A0A077ZD17_TRITR Loading...

Kelch protein 20 like

AlphaFold DB , UniProt , Accession A0A077ZD17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 609 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	35.2	Very low	32	Very low	248 Å²	248	149.8 Å²	149.8	100%	1.222	85%	0.851	S	S	*	*				0	93.8	0	-72.3	175.6	-167.3	0	0	106.9
2	A	27.4	Very low	31.9	Very low	91 Å²	91	152.8 Å²	152.8	75%	0.752	85%	0.852	S	S	*	*			trans	-80.9	142.6	161.6	0	0	0	0	0	107
3	D	31.6	Very low	31.9	Very low	159 Å²	159	159.4 Å²	159.4	85%	0.85	86%	0.856	S	S	*	*			trans	-177.4	135.7	139.4	-95.7	-25.1	0	0	0	113.2
4	S	31.6	Very low	31.9	Very low	110 Å²	110	158.8 Å²	158.8	77%	0.769	85%	0.852	S	S	*	*			trans	68.9	133.1	158	75.7	0	0	0	0	116.7
5	V	35.9	Very low	32	Very low	113 Å²	113	158.5 Å²	158.5	69%	0.685	85%	0.851	S	S	*	*				-156.9	120.9	51.7	173.1	0	0	0	0	109.3
6	S	32.4	Very low	32.1	Very low	120 Å²	120	158.8 Å²	158.8	84%	0.839	85%	0.85	S	S	*	*			trans	-102.6	105.7	166.9	64.9	0	0	0	0	109.4
7	N	34.1	Very low	32	Very low	152 Å²	152	157.8 Å²	157.8	81%	0.813	85%	0.85	S	S	*	*			trans	-84.1	131.9	177.5	-92.7	-24.8	0	0	0	111.7
8	R	32.2	Very low	31.9	Very low	222 Å²	222	152.8 Å²	152.8	84%	0.838	84%	0.842	S	S	*	*			trans	-70.6	133.4	178.3	-72.5	171	168.6	175.9	-3.8	111.5
9	C	28.5	Very low	31.7	Very low	136 Å²	136	155 Å²	155	92%	0.919	85%	0.846	S	S	*	*			trans	-108.8	108.7	156	-81.9	0	0	0	0	108.3
10	Q	30.3	Very low	31.6	Very low	175 Å²	175	153.2 Å²	153.2	82%	0.818	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-97	117.7	166.5	-79.1	179.6	-24.6	0	0	107.7
11	S	32.9	Very low	31.9	Very low	122 Å²	122	151.8 Å²	151.8	85%	0.853	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-94.2	126.7	173.8	48.9	0	0	0	0	110.6
12	E	30.4	Very low	31.7	Very low	186 Å²	186	149.3 Å²	149.3	87%	0.869	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-71.5	126.8	-178.8	-65.9	171	147.2	0	0	111
13	R	32.4	Very low	32.1	Very low	238 Å²	238	150.5 Å²	150.5	90%	0.898	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-92.4	116.7	169.5	-84.6	-178.2	174.5	174.4	-0.5	109
14	N	31.7	Very low	32	Very low	151 Å²	151	148.9 Å²	148.9	81%	0.807	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78.4	116.8	173.3	-78.7	-35.6	0	0	0	110.7
15	D	33.5	Very low	32.2	Very low	155 Å²	155	149 Å²	149	83%	0.829	83%	0.833	S	S	*	*			trans	-78.3	114.9	172.2	-74.4	-38.5	0	0	0	110.6
16	I	32.9	Very low	32	Very low	163 Å²	163	149.7 Å²	149.7	84%	0.836	84%	0.843	S	S	*	*			trans	-85.6	111.1	173.8	-64.9	174.8	0	0	0	108.5	G18	I16-G18 PolarHBondContact O-N 3.23Å
17	V	30.3	Very low	32.1	Very low	141 Å²	141	148 Å²	148	86%	0.855	84%	0.837	S	S	*	*			trans	-74.2	100.4	176.8	177.5	0	0	0	0	109.6
18	G	30.7	Very low	32.2	Very low	69 Å²	69	146.4 Å²	146.4	71%	0.711	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-97.7	132.2	173.2	0	0	0	0	0	112.2	I16	I16-G18 PolarHBondContact O-N 3.23Å
19	Q	28.6	Very low	32.4	Very low	194 Å²	194	144.4 Å²	144.4	91%	0.907	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-62.1	140.7	-169.4	-68	166.6	-12.4	0	0	115
20	S	29.8	Very low	33	Very low	118 Å²	118	141.5 Å²	141.5	83%	0.825	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-86.5	125.9	175.2	40.3	0	0	0	0	111.9
21	P	37.4	Very low	33.7	Very low	124 Å²	124	142.3 Å²	142.3	81%	0.805	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-87.3	139	170.7	29.5	-23.5	0	0	0	111.4
22	Q	30.5	Very low	34.2	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-62.4	128.5	172.9	-65.8	170.1	-18.9	0	0	111
23	S	36.2	Very low	35.1	Very low	117 Å²	117	141.6 Å²	141.6	82%	0.818	82%	0.824	S	S	*	*			trans	-155.9	121.2	144.6	56.4	0	0	0	0	110.3
24	S	30.2	Very low	36.3	Very low	124 Å²	124	136.7 Å²	136.7	87%	0.867	82%	0.815	S	S	*	*			trans	-84.5	115.4	175.1	40	0	0	0	0	109.8
25	S	35.1	Very low	37.9	Very low	112 Å²	112	137.2 Å²	137.2	78%	0.783	82%	0.818	S	S	*	*			trans	-157.1	108.4	144.6	56.3	0	0	0	0	109.5	A27	S25-A27 PolarHBondContact O-N 3.33Å
26	S	32.1	Very low	39.8	Very low	129 Å²	129	140.4 Å²	140.4	90%	0.902	82%	0.818	S	S	*	*			trans	-71.9	106.3	173.4	49.6	0	0	0	0	109.6
27	A	35	Very low	42.1	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	82%	0.821	S	S	*	*			trans	-141.8	117.6	164.1	0	0	0	0	0	110.5	S25	S25-A27 PolarHBondContact O-N 3.33Å
28	S	36.4	Very low	44.7	Very low	117 Å²	117	144 Å²	144	82%	0.818	82%	0.816	S	S	*	*			trans	56.9	102.4	165.6	62	0	0	0	0	118.2	G30	S28-G30 VanDerWaalsContact C-N 3.34Å; S28-G30 PolarHBondContact O-N 3.37Å
29	L	35.8	Very low	47.5	Very low	180 Å²	180	148.8 Å²	148.8	94%	0.942	82%	0.817	S	S	*	*			trans	-43.4	88.2	154.9	-75.7	133.8	0	0	0	112.5	K31	L29-K31 PolarHBondContact O-N 3.14Å; L29-K31 VanDerWaalsContact O-N 3.1Å
30	G	41.3	Very low	50.5	Low	75 Å²	75	146.4 Å²	146.4	77%	0.773	80%	0.804	S	S	*	*			trans	-69.4	96.5	159.6	0	0	0	0	0	109	S28 Y32	S28-G30 VanDerWaalsContact C-N 3.34Å; S28-G30 PolarHBondContact O-N 3.37Å; G30-Y32 PolarHBondContact O-N 3.41Å; G30-Y32 VanDerWaalsContact O-N 3.1Å
31	K	43.7	Very low	53.4	Low	192 Å²	192	143 Å²	143	84%	0.835	78%	0.78	S	S	*	*			trans	-49.8	113.7	172.8	-76.7	172	172.9	175.1	0	110.7	L29	L29-K31 PolarHBondContact O-N 3.14Å; L29-K31 VanDerWaalsContact O-N 3.1Å
32	Y	43.4	Very low	56	Low	189 Å²	189	145.6 Å²	145.6	74%	0.741	78%	0.782	S	S	*	*			trans	34.4	92	144.9	-60.4	-85.2	0	0	0	117.7	G30 L34	G30-Y32 PolarHBondContact O-N 3.41Å; G30-Y32 VanDerWaalsContact O-N 3.1Å; Y32-L34 HydrophobicContact CD1-CD1 3.49Å; Y32-L34 VanDerWaalsContact CD1-CD1 3.49Å; Y32-L34 HydrophobicContact CD1-CG 3.85Å; Y32-L34 HydrophobicContact CE1-CD1 4.29Å; Y32-L34 HydrophobicContact CG-CD1 3.91Å; Y32-L34 HydrophobicContact CG-CG 4.37Å; Y32-L34 PolarHBondContact O-N 2.95Å
33	S	50.1	Low	58.9	Low	104 Å²	104	144.3 Å²	144.3	73%	0.727	77%	0.773	S	S	*	*			trans	-78.3	72.1	148.5	-174.6	0	0	0	0	108.7	N35	S33-N35 PolarHBondContact O-N 3.39Å
34	L	57.6	Low	61.7	Low	136 Å²	136	144.4 Å²	144.4	71%	0.712	76%	0.76	S	S	*	*			trans	-74.9	1.4	173.9	-91	162.5	0	0	0	112.8	Y32	Y32-L34 HydrophobicContact CD1-CD1 3.49Å; Y32-L34 VanDerWaalsContact CD1-CD1 3.49Å; Y32-L34 HydrophobicContact CD1-CG 3.85Å; Y32-L34 HydrophobicContact CE1-CD1 4.29Å; Y32-L34 HydrophobicContact CG-CD1 3.91Å; Y32-L34 HydrophobicContact CG-CG 4.37Å; Y32-L34 PolarHBondContact O-N 2.95Å
35	N	65.5	Low	64.6	Low	162 Å²	162	142.5 Å²	142.5	87%	0.866	75%	0.745	S	S	*	*			trans	-109.4	41.5	-178	-75.8	-5.2	0	0	0	112.8	S33	S33-N35 PolarHBondContact O-N 3.39Å
36	R	73.9	Confident	67.2	Low	222 Å²	222	142.7 Å²	142.7	84%	0.838	74%	0.737	S	S	*	*			trans	-107.8	96.5	174.6	-159.2	179.7	-173.9	-168.1	2.6	110.8
37	M	80.6	Confident	70.1	Confident	180 Å²	180	138.4 Å²	138.4	89%	0.887	71%	0.709	S	S	*	*			trans	-86.9	119.7	168.7	-169.8	177.3	-72.7	0	0	109.1
38	R	85.3	Confident	72.9	Confident	199 Å²	199	137.6 Å²	137.6	75%	0.751	70%	0.695	S	S	*	*			trans	-99.4	110.5	174	-170.1	177.1	-174.2	-177.6	-0	108.4	F40	R38-F40 HydrophobicContact CG-CD2 4.19Å; R38-F40 HydrophobicContact CG-CE2 3.65Å; R38-F40 HydrophobicContact CG-CZ 4.16Å; R38-F40 VanDerWaalsContact NE-CE2 3.32Å; R38-F40 VanDerWaalsContact NH2-CZ 3.34Å
39	F	89.5	Confident	75.6	Confident	169 Å²	169	134 Å²	134	74%	0.741	67%	0.666	S	S	*	*			trans	-100.2	135.1	176.7	174	-108.5	0	0	0	110.3
40	F	90.3	Very high	78.3	Confident	144 Å²	144	131.3 Å²	131.3	63%	0.632	65%	0.649	S	S	*	*			trans	-123.8	121.5	172.3	-69.8	-85.6	0	0	0	108.5	R38	R38-F40 HydrophobicContact CG-CD2 4.19Å; R38-F40 HydrophobicContact CG-CE2 3.65Å; R38-F40 HydrophobicContact CG-CZ 4.16Å; R38-F40 VanDerWaalsContact NE-CE2 3.32Å; R38-F40 VanDerWaalsContact NH2-CZ 3.34Å
41	S	91.6	Very high	80.9	Confident	47 Å²	47	131.9 Å²	131.9	33%	0.329	64%	0.635	S	S	.	*			trans	-96.9	116.5	175.6	179.9	0	0	0	0	109.8	K43 H44 P45	S41-K43 PolarHBondContact O-N 2.94Å; S41-K43 PolarHBondContact OG-N 2.78Å; S41-H44 PolarHBondContact OG-N 3.03Å; S41-H44 VanDerWaalsContact OG-N 3.14Å; S41-P45 WeakPolarHBondContact O-CD 3.14Å
42	E	92	Very high	83.3	Confident	178 Å²	178	124.2 Å²	124.2	83%	0.832	60%	0.604	S	S	*	*	S	Bend	trans	-69.9	-22.3	171.2	-63.2	-178.7	170.8	0	0	111.9
43	K	92.4	Very high	85.7	Confident	169 Å²	169	117.8 Å²	117.8	74%	0.735	58%	0.579	S	S	*	*	H	α-helix	trans	-83.4	-26	-179.5	-62.8	-175.8	179.9	-177.1	0	113.4	S41 L46 A47	S41-K43 PolarHBondContact O-N 2.94Å; S41-K43 PolarHBondContact OG-N 2.78Å; K43-L46 PolarHBondContact O-N 3.32Å; K43-A47 WeakPolarHBondContact O-CB 3.33Å; K43-A47 PolarHBondContact O-N 2.9Å
44	H	93.2	Very high	87.9	Confident	119 Å²	119	115.9 Å²	115.9	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-63	-46.5	-172.7	-178.4	67.5	0	0	0	113.2	S41 L46 A47 V48	S41-H44 PolarHBondContact OG-N 3.03Å; S41-H44 VanDerWaalsContact OG-N 3.14Å; H44-L46 VanDerWaalsContact C-N 3.35Å; H44-L46 PolarHBondContact O-N 3.17Å; H44-A47 PolarHBondContact O-N 3.29Å; H44-V48 WeakPolarHBondContact O-CG2 3.41Å; H44-V48 PolarHBondContact O-N 2.93Å
45	P	91.3	Very high	89.6	Confident	84 Å²	84	112.5 Å²	112.5	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-59.7	-43.5	177.1	-23.9	35	0	0	0	112.9	S41 V48 L49	S41-P45 WeakPolarHBondContact O-CD 3.14Å; P45-V48 PolarHBondContact O-N 3.46Å; P45-L49 WeakPolarHBondContact O-CB 3.36Å; P45-L49 PolarHBondContact O-N 3.22Å
46	L	91.1	Very high	91	Very high	117 Å²	117	105.9 Å²	105.9	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-63	-45.1	178	-67	170.2	0	0	0	111.6	K43 H44 L49 E50	K43-L46 PolarHBondContact O-N 3.32Å; H44-L46 VanDerWaalsContact C-N 3.35Å; H44-L46 PolarHBondContact O-N 3.17Å; L46-L49 PolarHBondContact O-N 3.44Å; L46-E50 WeakPolarHBondContact O-CB 3.34Å; L46-E50 PolarHBondContact O-N 3.07Å
47	A	92.7	Very high	91.9	Very high	38 Å²	38	101.4 Å²	101.4	31%	0.314	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-38	178.4	0	0	0	0	0	112.5	K43 H44 N51	K43-A47 WeakPolarHBondContact O-CB 3.33Å; K43-A47 PolarHBondContact O-N 2.9Å; H44-A47 PolarHBondContact O-N 3.29Å; A47-N51 WeakPolarHBondContact O-CB 3.38Å; A47-N51 PolarHBondContact O-N 3.38Å; A47-N51 PolarHBondContact O-ND2 3.26Å
48	V	93.6	Very high	92.6	Very high	69 Å²	69	101.3 Å²	101.3	42%	0.418	48%	0.481	S	S	.	.	H	α-helix	trans	-63.2	-46.2	174.2	170.8	0	0	0	0	109.8	H44 P45 N51 T52	H44-V48 WeakPolarHBondContact O-CG2 3.41Å; H44-V48 PolarHBondContact O-N 2.93Å; P45-V48 PolarHBondContact O-N 3.46Å; V48-N51 PolarHBondContact O-N 3.24Å; V48-T52 HydrophobicContact CG1-CG2 4.47Å; V48-T52 WeakPolarHBondContact O-CG2 3.41Å; V48-T52 PolarHBondContact O-N 3.22Å; V48-T52 PolarHBondContact O-OG1 2.93Å
49	L	93.5	Very high	93	Very high	41 Å²	41	96.8 Å²	96.8	22%	0.215	47%	0.468	C	S	.	.	H	α-helix	trans	-61.7	-47.4	179.9	-162	71.3	0	0	0	111.6	P45 L46 N51 T52 Y53 C120 Y121 S123	P45-L49 WeakPolarHBondContact O-CB 3.36Å; P45-L49 PolarHBondContact O-N 3.22Å; L46-L49 PolarHBondContact O-N 3.44Å; L49-N51 VanDerWaalsContact C-N 3.34Å; L49-N51 PolarHBondContact O-N 3.03Å; L49-T52 WeakPolarHBondContact CA-OG1 3.05Å; L49-T52 PolarHBondContact O-N 3.31Å; L49-T52 VanDerWaalsContact O-N 3.17Å; L49-T52 PolarHBondContact O-OG1 3.03Å; L49-Y53 PolarHBondContact O-N 3.09Å; L49-C120 WeakPolarHBondContact CD1-O 3.47Å; L49-Y121 WeakPolarHBondContact CD2-O 3.42Å; L49-Y121 VanDerWaalsContact CG-O 3.31Å; L49-Y121 WeakPolarHBondContact CG-O 3.38Å; L49-S123 WeakPolarHBondContact CD2-OG 3.42Å
50	E	92.9	Very high	93.1	Very high	124 Å²	124	92.9 Å²	92.9	58%	0.579	45%	0.452	S	S	*	.	H	α-helix	trans	-58.8	-42.7	176.1	-175.8	178.3	-165	0	0	112.4	L46 Y53 N54	L46-E50 WeakPolarHBondContact O-CB 3.34Å; L46-E50 PolarHBondContact O-N 3.07Å; E50-Y53 WeakPolarHBondContact O-CB 3.4Å; E50-Y53 PolarHBondContact O-N 3.07Å; E50-N54 PolarHBondContact O-N 2.92Å; E50-N54 PolarHBondContact O-ND2 3.34Å
51	N	94.4	Very high	93.2	Very high	87 Å²	87	92.8 Å²	92.8	47%	0.465	46%	0.457	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.2	-75.8	-53.1	0	0	0	112.1	A47 V48 L49 Y53 N54 M55	A47-N51 WeakPolarHBondContact O-CB 3.38Å; A47-N51 PolarHBondContact O-N 3.38Å; A47-N51 PolarHBondContact O-ND2 3.26Å; V48-N51 PolarHBondContact O-N 3.24Å; L49-N51 VanDerWaalsContact C-N 3.34Å; L49-N51 PolarHBondContact O-N 3.03Å; N51-Y53 VanDerWaalsContact C-N 3.3Å; N51-Y53 PolarHBondContact O-N 3.31Å; N51-N54 PolarHBondContact O-N 2.9Å; N51-M55 HydrophobicContact CB-CE 4.5Å; N51-M55 WeakPolarHBondContact O-CG 3.35Å; N51-M55 PolarHBondContact O-N 3.31Å
52	T	94.1	Very high	93.3	Very high	30 Å²	30	92 Å²	92	18%	0.184	45%	0.451	C	S	.	.	H	α-helix	trans	-65	-32.9	174.3	55.5	0	0	0	0	112.8	V48 L49 M55 R56	V48-T52 HydrophobicContact CG1-CG2 4.47Å; V48-T52 WeakPolarHBondContact O-CG2 3.41Å; V48-T52 PolarHBondContact O-N 3.22Å; V48-T52 PolarHBondContact O-OG1 2.93Å; L49-T52 WeakPolarHBondContact CA-OG1 3.05Å; L49-T52 PolarHBondContact O-N 3.31Å; L49-T52 VanDerWaalsContact O-N 3.17Å; L49-T52 PolarHBondContact O-OG1 3.03Å; T52-M55 PolarHBondContact O-N 2.96Å; T52-R56 WeakPolarHBondContact O-CB 3.35Å; T52-R56 PolarHBondContact O-N 2.88Å
53	Y	94.9	Very high	93.4	Very high	55 Å²	55	86.9 Å²	86.9	22%	0.216	43%	0.43	C	S	.	.	H	α-helix	trans	-64.6	-43.3	172.4	-178.3	-123	0	0	0	111.6	L49 E50 N51 R56 K57 Y121 T122	L49-Y53 PolarHBondContact O-N 3.09Å; E50-Y53 WeakPolarHBondContact O-CB 3.4Å; E50-Y53 PolarHBondContact O-N 3.07Å; N51-Y53 VanDerWaalsContact C-N 3.3Å; N51-Y53 PolarHBondContact O-N 3.31Å; Y53-R56 PolarHBondContact O-N 3.05Å; Y53-K57 HydrophobicContact CE1-CD 4.16Å; Y53-K57 VanDerWaalsContact CE1-CE 3.44Å; Y53-K57 VanDerWaalsContact CE1-NZ 3.25Å; Y53-K57 PolarHBondContact O-N 3.25Å; Y53-K57 WeakPolarHBondContact OH-CE 3.45Å; Y53-K57 PolarHBondContact OH-NZ 2.99Å; Y53-Y121 VanDerWaalsContact CD2-CB 3.48Å; Y53-Y121 HydrophobicContact CD2-CG 4.19Å; Y53-T122 HydrophobicContact CD2-CG2 4.21Å; Y53-T122 HydrophobicContact CE1-CG2 4.36Å; Y53-T122 HydrophobicContact CE2-CG2 3.86Å
54	N	95.3	Very high	93.4	Very high	64 Å²	64	78.9 Å²	78.9	34%	0.342	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-40.9	175.8	-71.4	-35.2	0	0	0	112.4	E50 N51 K57 R58	E50-N54 PolarHBondContact O-N 2.92Å; E50-N54 PolarHBondContact O-ND2 3.34Å; N51-N54 PolarHBondContact O-N 2.9Å; N54-K57 PolarHBondContact O-N 3.1Å; N54-R58 PolarHBondContact O-N 3.39Å
55	M	94.5	Very high	93.5	Very high	64 Å²	64	73.7 Å²	73.7	32%	0.315	37%	0.371	S	S	.	.	H	α-helix	trans	-60.6	-45.8	173.1	-69.3	173.9	-161.9	0	0	110.9	N51 T52 K57 R58 H59 E60 L61	N51-M55 HydrophobicContact CB-CE 4.5Å; N51-M55 WeakPolarHBondContact O-CG 3.35Å; N51-M55 PolarHBondContact O-N 3.31Å; T52-M55 PolarHBondContact O-N 2.96Å; M55-K57 VanDerWaalsContact C-N 3.35Å; M55-K57 PolarHBondContact O-N 3.21Å; M55-R58 CarbonylContact O-C 3.35Å; M55-R58 PolarHBondContact O-N 3.29Å; M55-R58 VanDerWaalsContact O-N 3.1Å; M55-H59 PolarHBondContact O-N 2.7Å; M55-H59 VanDerWaalsContact O-N 3.09Å; M55-E60 HydrophobicContact CB-CB 4.2Å; M55-E60 PolarHBondContact O-N 2.89Å; M55-L61 HydrophobicContact SD-CD1 4.42Å
56	R	94.9	Very high	93.7	Very high	23 Å²	23	69.7 Å²	69.7	9%	0.087	35%	0.346	C	S	.	.	H	α-helix	trans	-57.6	-45.6	175.5	175.2	173.2	165.8	-123.3	-9.3	111.5	T52 Y53 R58 H59 Y74 D118 Y121	T52-R56 WeakPolarHBondContact O-CB 3.35Å; T52-R56 PolarHBondContact O-N 2.88Å; Y53-R56 PolarHBondContact O-N 3.05Å; R56-R58 PolarHBondContact O-N 3.42Å; R56-H59 PolarHBondContact O-CD2 3.06Å; R56-H59 PolarHBondContact O-N 3.17Å; R56-Y74 WeakPolarHBondContact CD-O 3.44Å; R56-Y74 WeakPolarHBondContact CG-O 3.38Å; R56-Y74 PolarHBondContact NE-O 3.45Å; R56-D118 IonicContact CZ-OD1 3.89Å; R56-D118 IonicContact NH1-OD1 2.64Å; R56-D118 PolarHBondContact NH1-OD1 3.45Å; R56-D118 IonicContact NH2-OD1 2.68Å; R56-D118 PolarHBondContact NH2-OD1 3.16Å; R56-Y121 HydrophobicContact CB-CD1 4.38Å; R56-Y121 HydrophobicContact CB-CE1 4.01Å; R56-Y121 VanDerWaalsContact CD-CZ 3.4Å
57	K	92.7	Very high	93.8	Very high	128 Å²	128	65.8 Å²	65.8	56%	0.557	33%	0.325	S	S	*	.	H	α-helix	trans	-59.9	-30.5	177.9	-81.1	-172.8	170.5	170	0	113.9	Y53 N54 M55	Y53-K57 HydrophobicContact CE1-CD 4.16Å; Y53-K57 VanDerWaalsContact CE1-CE 3.44Å; Y53-K57 VanDerWaalsContact CE1-NZ 3.25Å; Y53-K57 PolarHBondContact O-N 3.25Å; Y53-K57 WeakPolarHBondContact OH-CE 3.45Å; Y53-K57 PolarHBondContact OH-NZ 2.99Å; N54-K57 PolarHBondContact O-N 3.1Å; M55-K57 VanDerWaalsContact C-N 3.35Å; M55-K57 PolarHBondContact O-N 3.21Å
58	R	94.5	Very high	93.9	Very high	178 Å²	178	64 Å²	64	67%	0.672	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	2.2	178.2	-63.8	179.6	-175.1	173.8	1.7	113.2	N54 M55 R56 E60	N54-R58 PolarHBondContact O-N 3.39Å; M55-R58 CarbonylContact O-C 3.35Å; M55-R58 PolarHBondContact O-N 3.29Å; M55-R58 VanDerWaalsContact O-N 3.1Å; R56-R58 PolarHBondContact O-N 3.42Å; R58-E60 HydrophobicContact CB-CG 3.76Å; R58-E60 WeakPolarHBondContact CD-OE1 3.46Å; R58-E60 IonicContact NH1-OE1 2.93Å; R58-E60 PolarHBondContact O-N 3.29Å
59	H	93	Very high	93.7	Very high	104 Å²	104	64 Å²	64	48%	0.481	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	29.7	-171.5	-53.3	171.9	0	0	0	112.8	M55 R56 Y74	M55-H59 PolarHBondContact O-N 2.7Å; M55-H59 VanDerWaalsContact O-N 3.09Å; R56-H59 PolarHBondContact O-CD2 3.06Å; R56-H59 PolarHBondContact O-N 3.17Å; H59-Y74 AromaticContact CD2-CD2 3.86Å; H59-Y74 AromaticContact CD2-CG 3.8Å; H59-Y74 AromaticContact CE1-CD2 3.35Å; H59-Y74 WeakPolarHBondContact CE1-CD2 3.37Å; H59-Y74 AromaticContact CE1-CE2 3.4Å; H59-Y74 WeakPolarHBondContact CE1-CE2 3.49Å; H59-Y74 AromaticContact CE1-CG 3.92Å; H59-Y74 AromaticContact CE1-CZ 3.98Å; H59-Y74 AromaticContact CG-CG 3.96Å; H59-Y74 AromaticContact ND1-CD2 3.87Å; H59-Y74 AromaticContact ND1-CE2 3.87Å; H59-Y74 AromaticContact NE2-CD2 3.34Å; H59-Y74 VanDerWaalsContact NE2-CD2 3.34Å; H59-Y74 WeakPolarHBondContact NE2-CD2 3.41Å; H59-Y74 AromaticContact NE2-CE2 3.88Å; H59-Y74 AromaticContact NE2-CG 3.79Å
60	E	92.5	Very high	93.6	Very high	88 Å²	88	66.9 Å²	66.9	41%	0.411	35%	0.348	S	S	.	.			trans	-82.8	127.6	177.5	-70.8	170.9	-169.1	0	0	109.1	M55 R58 C62 H76	M55-E60 HydrophobicContact CB-CB 4.2Å; M55-E60 PolarHBondContact O-N 2.89Å; R58-E60 HydrophobicContact CB-CG 3.76Å; R58-E60 WeakPolarHBondContact CD-OE1 3.46Å; R58-E60 IonicContact NH1-OE1 2.93Å; R58-E60 PolarHBondContact O-N 3.29Å; E60-C62 PolarHBondContact O-N 3.31Å; E60-H76 PolarHBondContact O-NE2 2.89Å; E60-H76 VanDerWaalsContact O-NE2 3.07Å
61	L	92.3	Very high	93.6	Very high	142 Å²	142	63.3 Å²	63.3	74%	0.743	33%	0.331	S	S	*	.	S	Bend	trans	61	10.1	177.8	-55	175.3	0	0	0	116	M55 D63 H76	M55-L61 HydrophobicContact SD-CD1 4.42Å; L61-D63 PolarHBondContact O-N 2.64Å; L61-H76 PolarHBondContact O-CD2 3.1Å
62	C	93.1	Very high	93.6	Very high	30 Å²	30	65.6 Å²	65.6	20%	0.203	33%	0.333	C	S	.	.			trans	-61.3	119.5	171.6	-65.8	0	0	0	0	110.3	E60 A75	E60-C62 PolarHBondContact O-N 3.31Å; C62-A75 WeakPolarHBondContact CA-O 3.24Å
63	D	93.5	Very high	93.7	Very high	71 Å²	71	64.5 Å²	64.5	38%	0.38	33%	0.326	S	S	.	.			trans	-107.7	4.6	-177.5	62	-7.6	0	0	0	112.7	L61 A75 H76 R77	L61-D63 PolarHBondContact O-N 2.64Å; D63-A75 PolarHBondContact N-O 3.49Å; D63-H76 VanDerWaalsContact OD1-CA 3.22Å; D63-H76 WeakPolarHBondContact OD1-CA 3.21Å; D63-R77 PolarHBondContact O-NE 2.78Å; D63-R77 WeakPolarHBondContact OD1-CG 3.36Å; D63-R77 PolarHBondContact OD1-N 2.68Å; D63-R77 WeakPolarHBondContact OD2-CD 3.22Å
64	V	93.7	Very high	93.8	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	147.3	172.4	65.7	0	0	0	0	112.1	I66 A75 R77 L80 F91 M101 V103	V64-I66 HydrophobicContact CG2-CD1 3.92Å; V64-A75 HydrophobicContact CG1-CB 4.19Å; V64-A75 WeakPolarHBondContact CG1-O 3.45Å; V64-A75 PolarHBondContact N-O 3.14Å; V64-A75 PolarHBondContact O-N 2.79Å; V64-A75 VanDerWaalsContact O-O 3.06Å; V64-R77 HydrophobicContact CB-CG 3.77Å; V64-R77 HydrophobicContact CG1-CG 3.71Å; V64-L80 HydrophobicContact CG1-CD1 4.38Å; V64-F91 HydrophobicContact CB-CZ 4.49Å; V64-F91 HydrophobicContact CG1-CZ 4.11Å; V64-F91 HydrophobicContact CG2-CE1 3.97Å; V64-F91 HydrophobicContact CG2-CZ 4.08Å; V64-M101 CarbonylContact C-O 3.49Å; V64-M101 WeakPolarHBondContact CA-O 3.5Å; V64-V103 HydrophobicContact CG2-CG2 4.09Å
65	V	95.1	Very high	93.8	Very high	9 Å²	9	62.2 Å²	62.2	6%	0.055	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.8	169.3	-172.4	0	0	0	0	108.3	L67 R72 I73 Y74 M101 E102 V103	V65-L67 HydrophobicContact CG1-CD2 4.03Å; V65-R72 HydrophobicContact CG1-CB 4.03Å; V65-I73 WeakPolarHBondContact CA-O 3.33Å; V65-Y74 HydrophobicContact CG2-CD1 3.6Å; V65-Y74 HydrophobicContact CG2-CE1 3.63Å; V65-Y74 HydrophobicContact CG2-CG 4.39Å; V65-M101 PolarHBondContact N-O 3.1Å; V65-E102 HydrophobicContact CB-CG 4.27Å; V65-E102 CarbonylContact O-C 3.58Å; V65-E102 WeakPolarHBondContact O-CA 3.47Å; V65-V103 PolarHBondContact O-N 3.02Å
66	I	94.3	Very high	93.8	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	120.8	175.1	-54.3	-59.8	0	0	0	108.6	V64 I73 L80 F87 M90 F91 V103 I105 L113	V64-I66 HydrophobicContact CG2-CD1 3.92Å; I66-I73 HydrophobicContact CB-CB 4.32Å; I66-I73 PolarHBondContact N-O 3.1Å; I66-I73 PolarHBondContact O-N 2.85Å; I66-L80 HydrophobicContact CD1-CD1 4.47Å; I66-L80 HydrophobicContact CG1-CD1 4.26Å; I66-F87 HydrophobicContact CD1-CE1 4.44Å; I66-M90 HydrophobicContact CD1-CE 4.23Å; I66-F91 HydrophobicContact CD1-CZ 4.4Å; I66-V103 CarbonylContact C-O 3.53Å; I66-V103 WeakPolarHBondContact CA-O 3.31Å; I66-V103 HydrophobicContact CD1-CB 4.21Å; I66-I105 HydrophobicContact CG2-CD1 3.63Å; I66-I105 HydrophobicContact CG2-CG1 3.98Å; I66-L113 HydrophobicContact CG2-CD2 3.9Å
67	L	94.8	Very high	93.8	Very high	35 Å²	35	61.2 Å²	61.2	18%	0.183	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	116.5	175.7	-52.1	178.9	0	0	0	108.4	V65 R72 E102 V103 T104 I105	V65-L67 HydrophobicContact CG1-CD2 4.03Å; L67-R72 HydrophobicContact CD2-CB 4.15Å; L67-R72 HydrophobicContact CD2-CG 3.62Å; L67-E102 HydrophobicContact CD1-CB 4.02Å; L67-E102 HydrophobicContact CG-CB 4.37Å; L67-V103 PolarHBondContact N-O 3.26Å; L67-T104 HydrophobicContact CB-CG2 4.43Å; L67-T104 CarbonylContact O-C 3.53Å; L67-T104 WeakPolarHBondContact O-CA 3.34Å; L67-I105 PolarHBondContact O-N 3.1Å
68	V	93.9	Very high	93.8	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	110.3	177.6	60.9	0	0	0	0	108.4	S70 K71 I73 V108 E110 L113	V68-S70 PolarHBondContact O-N 3.01Å; V68-K71 HydrophobicContact CG1-CB 4.11Å; V68-K71 PolarHBondContact N-O 2.73Å; V68-K71 VanDerWaalsContact N-O 3.09Å; V68-K71 PolarHBondContact O-N 3.25Å; V68-I73 HydrophobicContact CG1-CD1 3.82Å; V68-V108 HydrophobicContact CG2-CG1 3.58Å; V68-E110 HydrophobicContact CG1-CB 4.24Å; V68-E110 HydrophobicContact CG1-CG 4.5Å; V68-E110 HydrophobicContact CG2-CB 4.47Å; V68-E110 HydrophobicContact CG2-CG 4.2Å; V68-E110 WeakPolarHBondContact O-CG 3.5Å; V68-L113 HydrophobicContact CB-CD2 3.81Å; V68-L113 HydrophobicContact CG1-CD2 3.96Å; V68-L113 HydrophobicContact CG2-CD2 3.93Å
69	G	90.2	Very high	93.9	Very high	70 Å²	70	52.8 Å²	52.8	72%	0.722	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	-112.1	-171.2	0	0	0	0	0	112.5	E110	G69-E110 WeakPolarHBondContact CA-OE1 3.4Å
70	S	91.4	Very high	94	Very high	101 Å²	101	47.9 Å²	47.9	71%	0.706	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-16.1	179.1	76.4	0	0	0	0	115.2	V68 E110	V68-S70 PolarHBondContact O-N 3.01Å; S70-E110 PolarHBondContact N-OE1 3.28Å; S70-E110 PolarHBondContact N-OE2 3.48Å; S70-E110 PolarHBondContact OG-OE2 2.82Å
71	K	92.9	Very high	94.1	Very high	48 Å²	48	44.2 Å²	44.2	21%	0.209	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	145	-174.7	-72.6	-172.9	-171.1	178.7	0	113	V68 E110 N111 E114	V68-K71 HydrophobicContact CG1-CB 4.11Å; V68-K71 PolarHBondContact N-O 2.73Å; V68-K71 VanDerWaalsContact N-O 3.09Å; V68-K71 PolarHBondContact O-N 3.25Å; K71-E110 HydrophobicContact CD-CB 4.03Å; K71-E110 HydrophobicContact CG-CB 4.31Å; K71-N111 PolarHBondContact NZ-OD1 2.74Å; K71-E114 IonicContact NZ-OE2 3.55Å; K71-E114 PolarHBondContact NZ-OE2 3.01Å
72	R	94.8	Very high	94.2	Very high	136 Å²	136	41.5 Å²	41.5	51%	0.513	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	108.7	172.7	-57.5	-176.6	67.4	-172.7	0.8	108.7	V65 L67 E102	V65-R72 HydrophobicContact CG1-CB 4.03Å; L67-R72 HydrophobicContact CD2-CB 4.15Å; L67-R72 HydrophobicContact CD2-CG 3.62Å; R72-E102 IonicContact CZ-OE1 3.2Å; R72-E102 IonicContact NH2-OE1 3.73Å; R72-E102 PolarHBondContact NH2-OE1 3.29Å
73	I	95.4	Very high	94.2	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	107.4	-174.4	-53.9	170.8	0	0	0	109	V65 I66 V68 E114 V117	V65-I73 WeakPolarHBondContact CA-O 3.33Å; I66-I73 HydrophobicContact CB-CB 4.32Å; I66-I73 PolarHBondContact N-O 3.1Å; I66-I73 PolarHBondContact O-N 2.85Å; V68-I73 HydrophobicContact CG1-CD1 3.82Å; I73-E114 HydrophobicContact CD1-CB 3.97Å; I73-E114 HydrophobicContact CD1-CG 4.48Å; I73-V117 HydrophobicContact CG2-CB 4.25Å; I73-V117 HydrophobicContact CG2-CG1 3.78Å; I73-V117 HydrophobicContact CG2-CG2 4.42Å
74	Y	96.1	Very high	94.3	Very high	71 Å²	71	39.2 Å²	39.2	28%	0.278	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.2	174.1	-64.2	-94.6	0	0	0	110.2	R56 H59 V65	R56-Y74 WeakPolarHBondContact CD-O 3.44Å; R56-Y74 WeakPolarHBondContact CG-O 3.38Å; R56-Y74 PolarHBondContact NE-O 3.45Å; H59-Y74 AromaticContact CD2-CD2 3.86Å; H59-Y74 AromaticContact CD2-CG 3.8Å; H59-Y74 AromaticContact CE1-CD2 3.35Å; H59-Y74 WeakPolarHBondContact CE1-CD2 3.37Å; H59-Y74 AromaticContact CE1-CE2 3.4Å; H59-Y74 WeakPolarHBondContact CE1-CE2 3.49Å; H59-Y74 AromaticContact CE1-CG 3.92Å; H59-Y74 AromaticContact CE1-CZ 3.98Å; H59-Y74 AromaticContact CG-CG 3.96Å; H59-Y74 AromaticContact ND1-CD2 3.87Å; H59-Y74 AromaticContact ND1-CE2 3.87Å; H59-Y74 AromaticContact NE2-CD2 3.34Å; H59-Y74 VanDerWaalsContact NE2-CD2 3.34Å; H59-Y74 WeakPolarHBondContact NE2-CD2 3.41Å; H59-Y74 AromaticContact NE2-CE2 3.88Å; H59-Y74 AromaticContact NE2-CG 3.79Å; V65-Y74 HydrophobicContact CG2-CD1 3.6Å; V65-Y74 HydrophobicContact CG2-CE1 3.63Å; V65-Y74 HydrophobicContact CG2-CG 4.39Å
75	A	96.1	Very high	94.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	174.2	-178.3	0	0	0	0	0	112.3	C62 D63 V64 L80 V117	C62-A75 WeakPolarHBondContact CA-O 3.24Å; D63-A75 PolarHBondContact N-O 3.49Å; V64-A75 HydrophobicContact CG1-CB 4.19Å; V64-A75 WeakPolarHBondContact CG1-O 3.45Å; V64-A75 PolarHBondContact N-O 3.14Å; V64-A75 PolarHBondContact O-N 2.79Å; V64-A75 VanDerWaalsContact O-O 3.06Å; A75-L80 HydrophobicContact CB-CD1 3.71Å; A75-L80 HydrophobicContact CB-CD2 4.49Å; A75-L80 HydrophobicContact CB-CG 4.08Å; A75-V117 HydrophobicContact CB-CG1 4.48Å
76	H	95.4	Very high	94.3	Very high	15 Å²	15	45.1 Å²	45.1	7%	0.069	27%	0.266	C	S	.	.			trans	-107.2	125.4	173.1	-53.8	89.5	0	0	0	109.9	E60 L61 D63 V78 V79 L80 Y121	E60-H76 PolarHBondContact O-NE2 2.89Å; E60-H76 VanDerWaalsContact O-NE2 3.07Å; L61-H76 PolarHBondContact O-CD2 3.1Å; D63-H76 VanDerWaalsContact OD1-CA 3.22Å; D63-H76 WeakPolarHBondContact OD1-CA 3.21Å; H76-V78 HydrophobicContact CB-CG1 4.31Å; H76-V78 PolarHBondContact O-N 3.36Å; H76-V79 HydrophobicContact CB-CB 4.26Å; H76-V79 HydrophobicContact CB-CG2 3.92Å; H76-V79 PolarHBondContact O-N 3.09Å; H76-V79 VanDerWaalsContact O-N 3.12Å; H76-L80 PolarHBondContact O-N 3.09Å; H76-L80 VanDerWaalsContact O-N 3.1Å; H76-Y121 PolarHBondContact N-OH 2.61Å; H76-Y121 AromaticContact ND1-CE1 3.66Å; H76-Y121 AromaticContact ND1-CZ 3.83Å; H76-Y121 PolarHBondContact ND1-OH 3.49Å; H76-Y121 VanDerWaalsContact ND1-OH 3.17Å
77	R	93.8	Very high	94.2	Very high	52 Å²	52	45.2 Å²	45.2	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-54.9	-40.2	178.8	-68.7	169.8	168.4	-143.9	-9.6	112	D63 V64 G81 F91 S98 Q100	D63-R77 PolarHBondContact O-NE 2.78Å; D63-R77 WeakPolarHBondContact OD1-CG 3.36Å; D63-R77 PolarHBondContact OD1-N 2.68Å; D63-R77 WeakPolarHBondContact OD2-CD 3.22Å; V64-R77 HydrophobicContact CB-CG 3.77Å; V64-R77 HydrophobicContact CG1-CG 3.71Å; R77-G81 PolarHBondContact O-N 3.12Å; R77-F91 HydrophobicContact CB-CD2 3.84Å; R77-F91 HydrophobicContact CB-CE2 4.12Å; R77-F91 HydrophobicContact CB-CG 4.09Å; R77-F91 HydrophobicContact CG-CD1 3.99Å; R77-F91 HydrophobicContact CG-CD2 4.08Å; R77-F91 HydrophobicContact CG-CE1 4Å; R77-F91 HydrophobicContact CG-CE2 4.11Å; R77-F91 HydrophobicContact CG-CG 4.02Å; R77-F91 HydrophobicContact CG-CZ 4.07Å; R77-S98 VanDerWaalsContact CZ-O 3.29Å; R77-S98 PolarHBondContact NH1-O 2.91Å; R77-S98 PolarHBondContact NH2-O 2.89Å; R77-Q100 PolarHBondContact NH2-O 2.97Å
78	V	93.6	Very high	94.1	Very high	111 Å²	111	51.2 Å²	51.2	67%	0.673	29%	0.286	S	S	*	.	H	α-helix	trans	-64.7	-39.8	-179.8	68.7	0	0	0	0	112.3	H76 A82	H76-V78 HydrophobicContact CB-CG1 4.31Å; H76-V78 PolarHBondContact O-N 3.36Å; V78-A82 VanDerWaalsContact O-CB 3.24Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.89Å
79	V	95.1	Very high	93.9	Very high	18 Å²	18	53.4 Å²	53.4	11%	0.109	30%	0.304	C	S	.	.	H	α-helix	trans	-70.1	-49.3	179.5	177.7	0	0	0	0	109.5	H76 G81 A82 C83 C120 Y121	H76-V79 HydrophobicContact CB-CB 4.26Å; H76-V79 HydrophobicContact CB-CG2 3.92Å; H76-V79 PolarHBondContact O-N 3.09Å; H76-V79 VanDerWaalsContact O-N 3.12Å; V79-G81 PolarHBondContact O-N 2.91Å; V79-A82 PolarHBondContact O-N 2.9Å; V79-C83 PolarHBondContact O-N 3.27Å; V79-C83 VanDerWaalsContact O-N 3.14Å; V79-C83 PolarHBondContact O-SG 3.15Å; V79-C120 HydrophobicContact CG1-CB 4.17Å; V79-Y121 HydrophobicContact CB-CE1 4.05Å; V79-Y121 HydrophobicContact CG1-CD1 4.09Å; V79-Y121 HydrophobicContact CG1-CD2 4.41Å; V79-Y121 HydrophobicContact CG1-CE1 3.74Å; V79-Y121 HydrophobicContact CG1-CE2 4.04Å; V79-Y121 HydrophobicContact CG1-CG 4.4Å; V79-Y121 HydrophobicContact CG2-CE1 3.93Å
80	L	95.5	Very high	93.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-45.9	178	-68.6	-172.8	0	0	0	112.3	V64 I66 A75 H76 A82 C83 S84 F87 F91 V117 C120	V64-L80 HydrophobicContact CG1-CD1 4.38Å; I66-L80 HydrophobicContact CD1-CD1 4.47Å; I66-L80 HydrophobicContact CG1-CD1 4.26Å; A75-L80 HydrophobicContact CB-CD1 3.71Å; A75-L80 HydrophobicContact CB-CD2 4.49Å; A75-L80 HydrophobicContact CB-CG 4.08Å; H76-L80 PolarHBondContact O-N 3.09Å; H76-L80 VanDerWaalsContact O-N 3.1Å; L80-A82 VanDerWaalsContact C-N 3.27Å; L80-A82 PolarHBondContact O-N 3.42Å; L80-C83 PolarHBondContact O-N 2.84Å; L80-S84 WeakPolarHBondContact O-CB 3.33Å; L80-S84 PolarHBondContact O-N 2.84Å; L80-F87 HydrophobicContact CB-CB 3.88Å; L80-F87 HydrophobicContact CB-CD2 3.67Å; L80-F87 HydrophobicContact CB-CE2 4.39Å; L80-F87 HydrophobicContact CB-CG 3.85Å; L80-F87 HydrophobicContact CD1-CD2 4.26Å; L80-F87 HydrophobicContact CD1-CE1 4.49Å; L80-F87 HydrophobicContact CD1-CE2 4.29Å; L80-F87 HydrophobicContact CD1-CG 4.4Å; L80-F87 HydrophobicContact CD1-CZ 4.39Å; L80-F87 HydrophobicContact CD2-CD2 4.03Å; L80-F87 HydrophobicContact CD2-CE2 3.96Å; L80-F87 HydrophobicContact CG-CD2 4.2Å; L80-F87 HydrophobicContact CG-CE2 4.44Å; L80-F91 HydrophobicContact CB-CE2 3.94Å; L80-F91 HydrophobicContact CD1-CE2 4.17Å; L80-F91 HydrophobicContact CD1-CZ 4.3Å; L80-V117 HydrophobicContact CD2-CG1 4.1Å; L80-V117 HydrophobicContact CD2-CG2 4.17Å; L80-C120 HydrophobicContact CD2-CB 4.33Å
81	G	94.3	Very high	93.8	Very high	12 Å²	12	47.3 Å²	47.3	12%	0.124	25%	0.246	C	C	.	.	H	α-helix	trans	-70.4	-19.1	178	0	0	0	0	0	114.3	R77 V79 R88	R77-G81 PolarHBondContact O-N 3.12Å; V79-G81 PolarHBondContact O-N 2.91Å; G81-R88 WeakPolarHBondContact O-CB 3.44Å
82	A	94.4	Very high	93.5	Very high	84 Å²	84	49.9 Å²	49.9	69%	0.694	27%	0.266	S	S	*	.	H	α-helix	trans	-78.3	-36.8	171.5	0	0	0	0	0	112	V78 V79 L80	V78-A82 VanDerWaalsContact O-CB 3.24Å; V78-A82 WeakPolarHBondContact O-CB 3.36Å; V78-A82 PolarHBondContact O-N 2.89Å; V79-A82 PolarHBondContact O-N 2.9Å; L80-A82 VanDerWaalsContact C-N 3.27Å; L80-A82 PolarHBondContact O-N 3.42Å
83	C	94.1	Very high	92.9	Very high	53 Å²	53	46.4 Å²	46.4	36%	0.358	26%	0.259	S	S	.	.	H	α-helix	trans	-89.6	-26.2	-176	-64.6	0	0	0	0	114.2	V79 L80 C120 M144	V79-C83 PolarHBondContact O-N 3.27Å; V79-C83 VanDerWaalsContact O-N 3.14Å; V79-C83 PolarHBondContact O-SG 3.15Å; L80-C83 PolarHBondContact O-N 2.84Å; C83-C120 HydrophobicContact CB-CB 4.07Å; C83-M144 HydrophobicContact CB-CE 4.27Å
84	S	95.5	Very high	92	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.007	30%	0.299	C	S	.	.			trans	-129.6	122.5	-174	166.6	0	0	0	0	111.3	L80 Y86 F87 R88 M142	L80-S84 WeakPolarHBondContact O-CB 3.33Å; L80-S84 PolarHBondContact O-N 2.84Å; S84-Y86 PolarHBondContact O-N 2.86Å; S84-Y86 WeakPolarHBondContact OG-CB 3.21Å; S84-Y86 PolarHBondContact OG-N 3.38Å; S84-F87 VanDerWaalsContact CB-CD2 3.47Å; S84-F87 PolarHBondContact O-N 3.21Å; S84-F87 PolarHBondContact OG-N 3.05Å; S84-R88 WeakPolarHBondContact O-CB 3.37Å; S84-R88 PolarHBondContact O-N 3.46Å; S84-M142 PolarHBondContact OG-O 3.06Å
85	P	94.6	Very high	91.1	Very high	67 Å²	67	57.2 Å²	57.2	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-59	-33.3	171.4	-24.2	34.1	0	0	0	113.3	R88 A89 Q143	P85-R88 WeakPolarHBondContact O-CB 3.38Å; P85-R88 PolarHBondContact O-N 2.78Å; P85-A89 WeakPolarHBondContact O-CB 3.4Å; P85-A89 PolarHBondContact O-N 3.43Å; P85-Q143 HydrophobicContact CB-CB 4.21Å; P85-Q143 WeakPolarHBondContact CD-O 3.25Å; P85-Q143 HydrophobicContact CG-CB 4.19Å
86	Y	93.5	Very high	90	Very high	67 Å²	67	60.2 Å²	60.2	26%	0.263	34%	0.339	S	S	.	.	H	α-helix	trans	-61.7	-53.1	175.6	174.2	-92.1	0	0	0	111	S84 R88 A89 M90 I105 L141 M142	S84-Y86 PolarHBondContact O-N 2.86Å; S84-Y86 WeakPolarHBondContact OG-CB 3.21Å; S84-Y86 PolarHBondContact OG-N 3.38Å; Y86-R88 VanDerWaalsContact C-N 3.29Å; Y86-R88 PolarHBondContact O-N 3.28Å; Y86-A89 PolarHBondContact O-N 3.09Å; Y86-M90 HydrophobicContact CE1-SD 4.07Å; Y86-M90 WeakPolarHBondContact O-CB 3.36Å; Y86-M90 PolarHBondContact O-N 2.63Å; Y86-I105 HydrophobicContact CE1-CD1 4.33Å; Y86-L141 WeakPolarHBondContact CD2-O 3.44Å; Y86-M142 HydrophobicContact CD1-CE 3.54Å; Y86-M142 HydrophobicContact CD1-SD 3.73Å; Y86-M142 HydrophobicContact CE1-CE 3.51Å; Y86-M142 HydrophobicContact CE1-SD 4.08Å; Y86-M142 HydrophobicContact CG-CE 4.1Å
87	F	93.2	Very high	89	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-36.7	177.4	-70.8	-45	0	0	0	112.2	I66 L80 S84 A89 M90 F91 I105 L113 M142	I66-F87 HydrophobicContact CD1-CE1 4.44Å; L80-F87 HydrophobicContact CB-CB 3.88Å; L80-F87 HydrophobicContact CB-CD2 3.67Å; L80-F87 HydrophobicContact CB-CE2 4.39Å; L80-F87 HydrophobicContact CB-CG 3.85Å; L80-F87 HydrophobicContact CD1-CD2 4.26Å; L80-F87 HydrophobicContact CD1-CE1 4.49Å; L80-F87 HydrophobicContact CD1-CE2 4.29Å; L80-F87 HydrophobicContact CD1-CG 4.4Å; L80-F87 HydrophobicContact CD1-CZ 4.39Å; L80-F87 HydrophobicContact CD2-CD2 4.03Å; L80-F87 HydrophobicContact CD2-CE2 3.96Å; L80-F87 HydrophobicContact CG-CD2 4.2Å; L80-F87 HydrophobicContact CG-CE2 4.44Å; S84-F87 VanDerWaalsContact CB-CD2 3.47Å; S84-F87 PolarHBondContact O-N 3.21Å; S84-F87 PolarHBondContact OG-N 3.05Å; F87-A89 PolarHBondContact O-N 3.33Å; F87-M90 HydrophobicContact CD1-CE 3.5Å; F87-M90 VanDerWaalsContact CD1-CE 3.5Å; F87-M90 HydrophobicContact CE1-CE 3.95Å; F87-M90 PolarHBondContact O-N 2.7Å; F87-F91 HydrophobicContact CB-CD2 4.22Å; F87-F91 HydrophobicContact CB-CE2 3.88Å; F87-F91 HydrophobicContact CD1-CE2 4.3Å; F87-F91 HydrophobicContact CD1-CZ 4.42Å; F87-F91 HydrophobicContact CG-CE2 4.33Å; F87-F91 WeakPolarHBondContact O-CD2 3.36Å; F87-F91 WeakPolarHBondContact O-CG 3.14Å; F87-F91 PolarHBondContact O-N 3.33Å; F87-I105 HydrophobicContact CE1-CD1 3.79Å; F87-I105 HydrophobicContact CZ-CD1 4.34Å; F87-L113 HydrophobicContact CZ-CD1 4.31Å; F87-M142 HydrophobicContact CE1-SD 3.8Å; F87-M142 HydrophobicContact CE2-SD 3.74Å; F87-M142 HydrophobicContact CZ-SD 3.32Å; F87-M142 WeakPolarHBondContact CZ-SD 3.44Å
88	R	92.1	Very high	88.2	Confident	161 Å²	161	61.6 Å²	61.6	61%	0.608	35%	0.35	S	S	*	.	H	α-helix	trans	-58.3	-50	174	-168.3	173.4	174.1	166.5	-1.5	110.9	G81 S84 P85 Y86 M90 F91 T92	G81-R88 WeakPolarHBondContact O-CB 3.44Å; S84-R88 WeakPolarHBondContact O-CB 3.37Å; S84-R88 PolarHBondContact O-N 3.46Å; P85-R88 WeakPolarHBondContact O-CB 3.38Å; P85-R88 PolarHBondContact O-N 2.78Å; Y86-R88 VanDerWaalsContact C-N 3.29Å; Y86-R88 PolarHBondContact O-N 3.28Å; R88-M90 VanDerWaalsContact C-N 3.35Å; R88-M90 PolarHBondContact O-N 2.7Å; R88-F91 PolarHBondContact O-N 3.29Å; R88-T92 HydrophobicContact CG-CG2 4.39Å; R88-T92 WeakPolarHBondContact O-CB 3.34Å; R88-T92 WeakPolarHBondContact O-CG2 3.07Å; R88-T92 PolarHBondContact O-N 3.01Å; R88-T92 PolarHBondContact O-OG1 3.38Å
89	A	89.9	Confident	87.5	Confident	47 Å²	47	66 Å²	66	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-47.1	177.9	0	0	0	0	0	110.7	P85 Y86 F87 F91 T92 T93	P85-A89 WeakPolarHBondContact O-CB 3.4Å; P85-A89 PolarHBondContact O-N 3.43Å; Y86-A89 PolarHBondContact O-N 3.09Å; F87-A89 PolarHBondContact O-N 3.33Å; A89-F91 VanDerWaalsContact C-N 3.34Å; A89-F91 PolarHBondContact O-N 2.63Å; A89-T92 PolarHBondContact O-N 2.7Å; A89-T93 WeakPolarHBondContact O-CB 3.37Å; A89-T93 WeakPolarHBondContact O-CG2 3.47Å; A89-T93 PolarHBondContact O-N 3.18Å; A89-T93 PolarHBondContact O-OG1 2.91Å
90	M	89.8	Confident	86.9	Confident	19 Å²	19	69.2 Å²	69.2	9%	0.094	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-40	-179.8	-172.3	172.9	78	0	0	113.5	I66 Y86 F87 R88 E97 V103	I66-M90 HydrophobicContact CD1-CE 4.23Å; Y86-M90 HydrophobicContact CE1-SD 4.07Å; Y86-M90 WeakPolarHBondContact O-CB 3.36Å; Y86-M90 PolarHBondContact O-N 2.63Å; F87-M90 HydrophobicContact CD1-CE 3.5Å; F87-M90 VanDerWaalsContact CD1-CE 3.5Å; F87-M90 HydrophobicContact CE1-CE 3.95Å; F87-M90 PolarHBondContact O-N 2.7Å; R88-M90 VanDerWaalsContact C-N 3.35Å; R88-M90 PolarHBondContact O-N 2.7Å; M90-E97 HydrophobicContact CG-CB 3.94Å; M90-V103 HydrophobicContact CE-CG1 4.03Å; M90-V103 HydrophobicContact SD-CG1 3.76Å
91	F	89.6	Confident	86.5	Confident	24 Å²	24	75.3 Å²	75.3	11%	0.105	40%	0.398	C	S	.	.	H	α-helix	trans	-90.1	-17.5	-177.5	-58.5	-43.8	0	0	0	114.9	V64 I66 R77 L80 F87 R88 A89	V64-F91 HydrophobicContact CB-CZ 4.49Å; V64-F91 HydrophobicContact CG1-CZ 4.11Å; V64-F91 HydrophobicContact CG2-CE1 3.97Å; V64-F91 HydrophobicContact CG2-CZ 4.08Å; I66-F91 HydrophobicContact CD1-CZ 4.4Å; R77-F91 HydrophobicContact CB-CD2 3.84Å; R77-F91 HydrophobicContact CB-CE2 4.12Å; R77-F91 HydrophobicContact CB-CG 4.09Å; R77-F91 HydrophobicContact CG-CD1 3.99Å; R77-F91 HydrophobicContact CG-CD2 4.08Å; R77-F91 HydrophobicContact CG-CE1 4Å; R77-F91 HydrophobicContact CG-CE2 4.11Å; R77-F91 HydrophobicContact CG-CG 4.02Å; R77-F91 HydrophobicContact CG-CZ 4.07Å; L80-F91 HydrophobicContact CB-CE2 3.94Å; L80-F91 HydrophobicContact CD1-CE2 4.17Å; L80-F91 HydrophobicContact CD1-CZ 4.3Å; F87-F91 HydrophobicContact CB-CD2 4.22Å; F87-F91 HydrophobicContact CB-CE2 3.88Å; F87-F91 HydrophobicContact CD1-CE2 4.3Å; F87-F91 HydrophobicContact CD1-CZ 4.42Å; F87-F91 HydrophobicContact CG-CE2 4.33Å; F87-F91 WeakPolarHBondContact O-CD2 3.36Å; F87-F91 WeakPolarHBondContact O-CG 3.14Å; F87-F91 PolarHBondContact O-N 3.33Å; R88-F91 PolarHBondContact O-N 3.29Å; A89-F91 VanDerWaalsContact C-N 3.34Å; A89-F91 PolarHBondContact O-N 2.63Å
92	T	86.8	Confident	86.4	Confident	102 Å²	102	78.4 Å²	78.4	63%	0.626	41%	0.409	S	S	*	.	H	α-helix	trans	-107	-15.7	-177.4	61.4	0	0	0	0	114.6	R88 A89	R88-T92 HydrophobicContact CG-CG2 4.39Å; R88-T92 WeakPolarHBondContact O-CB 3.34Å; R88-T92 WeakPolarHBondContact O-CG2 3.07Å; R88-T92 PolarHBondContact O-N 3.01Å; R88-T92 PolarHBondContact O-OG1 3.38Å; A89-T92 PolarHBondContact O-N 2.7Å
93	T	82.7	Confident	86.2	Confident	63 Å²	63	74.6 Å²	74.6	39%	0.387	38%	0.377	S	S	.	.	S	Bend	trans	-79.5	154.8	172.4	49.4	0	0	0	0	111.3	A89 M95 S98	A89-T93 WeakPolarHBondContact O-CB 3.37Å; A89-T93 WeakPolarHBondContact O-CG2 3.47Å; A89-T93 PolarHBondContact O-N 3.18Å; A89-T93 PolarHBondContact O-OG1 2.91Å; T93-M95 PolarHBondContact O-N 3.25Å; T93-S98 WeakPolarHBondContact O-CB 3.36Å; T93-S98 PolarHBondContact O-OG 3.17Å
94	E	76.7	Confident	86.1	Confident	184 Å²	184	76 Å²	76	86%	0.86	39%	0.385	S	S	*	.	S	Bend	trans	-73.5	24.7	179.1	-62	-170.3	164.1	0	0	114
95	M	76.1	Confident	85.9	Confident	120 Å²	120	76.4 Å²	76.4	59%	0.591	39%	0.387	S	S	*	.	S	Bend	trans	-75.7	163.3	176.4	-63.6	-65.4	-157.5	0	0	111.5	T93 E97 S98	T93-M95 PolarHBondContact O-N 3.25Å; M95-E97 WeakPolarHBondContact CB-OE2 3.5Å; M95-E97 PolarHBondContact O-N 3.17Å; M95-S98 WeakPolarHBondContact O-CB 3.32Å; M95-S98 PolarHBondContact O-N 3.1Å; M95-S98 VanDerWaalsContact O-N 3.15Å; M95-S98 PolarHBondContact O-OG 2.81Å
96	A	74.2	Confident	85.7	Confident	63 Å²	63	80.7 Å²	80.7	52%	0.521	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-59.6	-36.7	-176.3	0	0	0	0	0	112.5	S98 R99 Q100	A96-S98 PolarHBondContact O-N 3.28Å; A96-R99 PolarHBondContact O-N 2.87Å; A96-Q100 WeakPolarHBondContact O-CG 3.35Å; A96-Q100 PolarHBondContact O-N 2.89Å
97	E	74.5	Confident	85.5	Confident	76 Å²	76	85.6 Å²	85.6	36%	0.355	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-60.2	-30.8	-179.8	-64.1	79.3	-178.7	0	0	111.8	M90 M95 R99 Q100 V103	M90-E97 HydrophobicContact CG-CB 3.94Å; M95-E97 WeakPolarHBondContact CB-OE2 3.5Å; M95-E97 PolarHBondContact O-N 3.17Å; E97-R99 PolarHBondContact O-N 3.41Å; E97-R99 VanDerWaalsContact O-N 3.1Å; E97-Q100 PolarHBondContact O-N 3.03Å; E97-V103 HydrophobicContact CB-CG1 4.4Å; E97-V103 HydrophobicContact CB-CG2 4.43Å; E97-V103 HydrophobicContact CG-CG1 4.18Å
98	S	75.7	Confident	85.5	Confident	20 Å²	20	86.7 Å²	86.7	14%	0.14	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-61.2	-21.3	176.2	72.6	0	0	0	0	112.9	R77 T93 M95 A96	R77-S98 VanDerWaalsContact CZ-O 3.29Å; R77-S98 PolarHBondContact NH1-O 2.91Å; R77-S98 PolarHBondContact NH2-O 2.89Å; T93-S98 WeakPolarHBondContact O-CB 3.36Å; T93-S98 PolarHBondContact O-OG 3.17Å; M95-S98 WeakPolarHBondContact O-CB 3.32Å; M95-S98 PolarHBondContact O-N 3.1Å; M95-S98 VanDerWaalsContact O-N 3.15Å; M95-S98 PolarHBondContact O-OG 2.81Å; A96-S98 PolarHBondContact O-N 3.28Å
99	R	78.7	Confident	85.6	Confident	205 Å²	205	82 Å²	82	77%	0.774	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-108.5	-6.8	-179.5	-58	-178.1	-171.4	178.2	3	113.2	A96 E97	A96-R99 PolarHBondContact O-N 2.87Å; E97-R99 PolarHBondContact O-N 3.41Å; E97-R99 VanDerWaalsContact O-N 3.1Å
100	Q	83.5	Confident	85.9	Confident	85 Å²	85	82.2 Å²	82.2	40%	0.397	42%	0.416	S	S	.	.			trans	-85.5	134.7	-178	-72.6	173.5	-11.6	0	0	111.4	R77 A96 E97 V103	R77-Q100 PolarHBondContact NH2-O 2.97Å; A96-Q100 WeakPolarHBondContact O-CG 3.35Å; A96-Q100 PolarHBondContact O-N 2.89Å; E97-Q100 PolarHBondContact O-N 3.03Å; Q100-V103 HydrophobicContact CB-CG2 4.24Å
101	M	86.8	Confident	86.2	Confident	128 Å²	128	85.6 Å²	85.6	63%	0.631	43%	0.434	S	S	*	.	S	Bend	trans	-76.2	-29.3	171.5	-168	176.3	70.6	0	0	111.3	V64 V65	V64-M101 CarbonylContact C-O 3.49Å; V64-M101 WeakPolarHBondContact CA-O 3.5Å; V65-M101 PolarHBondContact N-O 3.1Å
102	E	91.8	Very high	86.5	Confident	77 Å²	77	84.6 Å²	84.6	36%	0.36	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.1	176.3	-54.1	-166.7	151.4	0	0	109.8	V65 L67 R72	V65-E102 HydrophobicContact CB-CG 4.27Å; V65-E102 CarbonylContact O-C 3.58Å; V65-E102 WeakPolarHBondContact O-CA 3.47Å; L67-E102 HydrophobicContact CD1-CB 4.02Å; L67-E102 HydrophobicContact CG-CB 4.37Å; R72-E102 IonicContact CZ-OE1 3.2Å; R72-E102 IonicContact NH2-OE1 3.73Å; R72-E102 PolarHBondContact NH2-OE1 3.29Å
103	V	91.2	Very high	87	Confident	3 Å²	3	79.8 Å²	79.8	2%	0.018	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.3	-177.4	-179.6	0	0	0	0	109.4	V64 V65 I66 L67 M90 E97 Q100	V64-V103 HydrophobicContact CG2-CG2 4.09Å; V65-V103 PolarHBondContact O-N 3.02Å; I66-V103 CarbonylContact C-O 3.53Å; I66-V103 WeakPolarHBondContact CA-O 3.31Å; I66-V103 HydrophobicContact CD1-CB 4.21Å; L67-V103 PolarHBondContact N-O 3.26Å; M90-V103 HydrophobicContact CE-CG1 4.03Å; M90-V103 HydrophobicContact SD-CG1 3.76Å; E97-V103 HydrophobicContact CB-CG1 4.4Å; E97-V103 HydrophobicContact CB-CG2 4.43Å; E97-V103 HydrophobicContact CG-CG1 4.18Å; Q100-V103 HydrophobicContact CB-CG2 4.24Å
104	T	91.9	Very high	87.6	Confident	84 Å²	84	80 Å²	80	52%	0.515	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.7	-179.3	-54.8	0	0	0	0	111.2	L67 K106	L67-T104 HydrophobicContact CB-CG2 4.43Å; L67-T104 CarbonylContact O-C 3.53Å; L67-T104 WeakPolarHBondContact O-CA 3.34Å; T104-K106 HydrophobicContact CG2-CG 4.36Å
105	I	91.4	Very high	88.5	Confident	9 Å²	9	73.6 Å²	73.6	5%	0.046	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.1	173.5	-55.4	-178.1	0	0	0	108.2	I66 L67 Y86 F87 V108 L113	I66-I105 HydrophobicContact CG2-CD1 3.63Å; I66-I105 HydrophobicContact CG2-CG1 3.98Å; L67-I105 PolarHBondContact O-N 3.1Å; Y86-I105 HydrophobicContact CE1-CD1 4.33Å; F87-I105 HydrophobicContact CE1-CD1 3.79Å; F87-I105 HydrophobicContact CZ-CD1 4.34Å; I105-V108 HydrophobicContact CB-CG1 4.4Å; I105-V108 HydrophobicContact CG2-CG1 3.64Å; I105-L113 HydrophobicContact CB-CD2 4.46Å; I105-L113 HydrophobicContact CD1-CD2 4.15Å
106	K	90.2	Very high	89.5	Confident	157 Å²	157	68 Å²	68	68%	0.683	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-102.9	164	-179.8	-61.2	-178.2	-178.6	178.5	0	110.3	T104 V108	T104-K106 HydrophobicContact CG2-CG 4.36Å; K106-V108 VanDerWaalsContact C-N 3.26Å; K106-V108 PolarHBondContact O-N 3.28Å
107	D	88.9	Confident	90.5	Very high	170 Å²	170	65 Å²	65	91%	0.909	32%	0.316	S	S	*	.	S	Bend	trans	59.2	31.4	171.3	-49.2	-43.5	0	0	0	114.8
108	V	93	Very high	91.5	Very high	24 Å²	24	63.7 Å²	63.7	15%	0.145	31%	0.311	C	S	.	.	S	Bend	trans	-135.3	145	174	69.1	0	0	0	0	110.1	V68 I105 K106 L113 A138 L141	V68-V108 HydrophobicContact CG2-CG1 3.58Å; I105-V108 HydrophobicContact CB-CG1 4.4Å; I105-V108 HydrophobicContact CG2-CG1 3.64Å; K106-V108 VanDerWaalsContact C-N 3.26Å; K106-V108 PolarHBondContact O-N 3.28Å; V108-L113 HydrophobicContact CG1-CB 4.43Å; V108-L113 HydrophobicContact CG1-CD2 4.01Å; V108-L113 HydrophobicContact CG2-CB 4.39Å; V108-A138 HydrophobicContact CG2-CB 3.62Å; V108-L141 HydrophobicContact CB-CD2 4.07Å; V108-L141 HydrophobicContact CG2-CD2 4.36Å
109	D	95.2	Very high	92.5	Very high	62 Å²	62	64.4 Å²	64.4	33%	0.332	31%	0.312	S	S	.	.			trans	-67	134.4	177.7	179.2	84.8	0	0	0	111.6	N111 A112 L113 Q134	D109-N111 VanDerWaalsContact C-N 3.33Å; D109-N111 PolarHBondContact O-N 3.47Å; D109-N111 WeakPolarHBondContact OD2-CA 3.38Å; D109-N111 WeakPolarHBondContact OD2-CB 3.48Å; D109-N111 PolarHBondContact OD2-N 3.03Å; D109-A112 HydrophobicContact CB-CB 3.94Å; D109-A112 PolarHBondContact O-N 3.04Å; D109-A112 PolarHBondContact OD2-N 2.93Å; D109-L113 WeakPolarHBondContact O-CB 3.18Å; D109-L113 PolarHBondContact O-N 2.85Å; D109-Q134 HydrophobicContact CB-CB 3.9Å; D109-Q134 HydrophobicContact CB-CG 4.25Å
110	E	95.8	Very high	93.3	Very high	52 Å²	52	54.8 Å²	54.8	24%	0.243	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-34	-174.8	-50.9	-176.9	-168	0	0	112.4	V68 G69 S70 K71 E114	V68-E110 HydrophobicContact CG1-CB 4.24Å; V68-E110 HydrophobicContact CG1-CG 4.5Å; V68-E110 HydrophobicContact CG2-CB 4.47Å; V68-E110 HydrophobicContact CG2-CG 4.2Å; V68-E110 WeakPolarHBondContact O-CG 3.5Å; G69-E110 WeakPolarHBondContact CA-OE1 3.4Å; S70-E110 PolarHBondContact N-OE1 3.28Å; S70-E110 PolarHBondContact N-OE2 3.48Å; S70-E110 PolarHBondContact OG-OE2 2.82Å; K71-E110 HydrophobicContact CD-CB 4.03Å; K71-E110 HydrophobicContact CG-CB 4.31Å; E110-E114 WeakPolarHBondContact O-CB 3.31Å; E110-E114 PolarHBondContact O-N 3.41Å
111	N	95.6	Very high	93.9	Very high	90 Å²	90	50.9 Å²	50.9	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-79.6	-43.1	-179.9	-57	-57.7	0	0	0	110.8	K71 D109 L113 E114 M115	K71-N111 PolarHBondContact NZ-OD1 2.74Å; D109-N111 VanDerWaalsContact C-N 3.33Å; D109-N111 PolarHBondContact O-N 3.47Å; D109-N111 WeakPolarHBondContact OD2-CA 3.38Å; D109-N111 WeakPolarHBondContact OD2-CB 3.48Å; D109-N111 PolarHBondContact OD2-N 3.03Å; N111-L113 VanDerWaalsContact C-N 3.35Å; N111-L113 PolarHBondContact O-N 3.49Å; N111-E114 PolarHBondContact O-N 3.27Å; N111-M115 VanDerWaalsContact O-CG 3.31Å; N111-M115 WeakPolarHBondContact O-CG 3.33Å; N111-M115 PolarHBondContact O-N 2.88Å
112	A	96.1	Very high	94.2	Very high	3 Å²	3	47.3 Å²	47.3	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-45	176.9	0	0	0	0	0	111.6	D109 M115 L116 Q134 A138	D109-A112 HydrophobicContact CB-CB 3.94Å; D109-A112 PolarHBondContact O-N 3.04Å; D109-A112 PolarHBondContact OD2-N 2.93Å; A112-M115 PolarHBondContact O-N 2.99Å; A112-L116 WeakPolarHBondContact O-CG 3.35Å; A112-L116 PolarHBondContact O-N 2.6Å; A112-Q134 HydrophobicContact CB-CB 4.08Å; A112-Q134 VanDerWaalsContact CB-O 3.3Å; A112-Q134 WeakPolarHBondContact CB-O 3.35Å; A112-A138 HydrophobicContact CB-CB 3.75Å
113	L	96.4	Very high	94.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-40.7	177.6	-173.6	62.8	0	0	0	111.8	I66 V68 F87 I105 V108 D109 N111 M115 L116 V117 M142	I66-L113 HydrophobicContact CG2-CD2 3.9Å; V68-L113 HydrophobicContact CB-CD2 3.81Å; V68-L113 HydrophobicContact CG1-CD2 3.96Å; V68-L113 HydrophobicContact CG2-CD2 3.93Å; F87-L113 HydrophobicContact CZ-CD1 4.31Å; I105-L113 HydrophobicContact CB-CD2 4.46Å; I105-L113 HydrophobicContact CD1-CD2 4.15Å; V108-L113 HydrophobicContact CG1-CB 4.43Å; V108-L113 HydrophobicContact CG1-CD2 4.01Å; V108-L113 HydrophobicContact CG2-CB 4.39Å; D109-L113 WeakPolarHBondContact O-CB 3.18Å; D109-L113 PolarHBondContact O-N 2.85Å; N111-L113 VanDerWaalsContact C-N 3.35Å; N111-L113 PolarHBondContact O-N 3.49Å; L113-M115 VanDerWaalsContact C-N 3.34Å; L113-M115 PolarHBondContact O-N 2.89Å; L113-L116 PolarHBondContact O-N 3.4Å; L113-V117 WeakPolarHBondContact O-CG2 3.5Å; L113-V117 PolarHBondContact O-N 3.01Å; L113-M142 HydrophobicContact CD1-CG 3.92Å; L113-M142 HydrophobicContact CD1-SD 3.7Å
114	E	95.5	Very high	94.4	Very high	67 Å²	67	50.9 Å²	50.9	31%	0.313	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-43	175	-175	170.1	-140.3	0	0	111.7	K71 I73 E110 N111 L116 V117 D118	K71-E114 IonicContact NZ-OE2 3.55Å; K71-E114 PolarHBondContact NZ-OE2 3.01Å; I73-E114 HydrophobicContact CD1-CB 3.97Å; I73-E114 HydrophobicContact CD1-CG 4.48Å; E110-E114 WeakPolarHBondContact O-CB 3.31Å; E110-E114 PolarHBondContact O-N 3.41Å; N111-E114 PolarHBondContact O-N 3.27Å; E114-L116 VanDerWaalsContact C-N 3.35Å; E114-L116 PolarHBondContact O-N 2.85Å; E114-V117 PolarHBondContact O-N 2.87Å; E114-D118 WeakPolarHBondContact O-CB 3.45Å; E114-D118 PolarHBondContact O-N 3.28Å
115	M	96.4	Very high	94.6	Very high	51 Å²	51	48.5 Å²	48.5	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-40	175	-72.2	177.9	70.9	0	0	112.8	N111 A112 L113 D118 F119 I125 V126 N131	N111-M115 VanDerWaalsContact O-CG 3.31Å; N111-M115 WeakPolarHBondContact O-CG 3.33Å; N111-M115 PolarHBondContact O-N 2.88Å; A112-M115 PolarHBondContact O-N 2.99Å; L113-M115 VanDerWaalsContact C-N 3.34Å; L113-M115 PolarHBondContact O-N 2.89Å; M115-D118 PolarHBondContact O-N 3.15Å; M115-F119 WeakPolarHBondContact O-CB 3.39Å; M115-F119 PolarHBondContact O-N 3.42Å; M115-I125 HydrophobicContact CB-CD1 4.3Å; M115-I125 HydrophobicContact CE-CG1 3.99Å; M115-V126 WeakPolarHBondContact CE-O 3.22Å; M115-N131 WeakPolarHBondContact CE-ND2 3.34Å
116	L	97.1	Very high	94.8	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-39.9	176.4	-68.3	174.1	0	0	0	112	A112 L113 E114 F119 C120 I125 L135 A138 A139 M142 M144 I147	A112-L116 WeakPolarHBondContact O-CG 3.35Å; A112-L116 PolarHBondContact O-N 2.6Å; L113-L116 PolarHBondContact O-N 3.4Å; E114-L116 VanDerWaalsContact C-N 3.35Å; E114-L116 PolarHBondContact O-N 2.85Å; L116-F119 WeakPolarHBondContact O-CB 3.34Å; L116-F119 PolarHBondContact O-N 2.92Å; L116-C120 PolarHBondContact O-N 3.35Å; L116-C120 VanDerWaalsContact O-N 3.15Å; L116-C120 PolarHBondContact O-SG 3.5Å; L116-I125 HydrophobicContact CD2-CD1 4.12Å; L116-L135 HydrophobicContact CD1-CD1 4.43Å; L116-L135 HydrophobicContact CD2-CD1 3.7Å; L116-L135 HydrophobicContact CG-CD1 3.82Å; L116-A138 VanDerWaalsContact CD1-C 3.44Å; L116-A138 HydrophobicContact CD1-CB 3.57Å; L116-A139 HydrophobicContact CD1-CB 4.44Å; L116-A139 HydrophobicContact CD2-CB 4.21Å; L116-M142 HydrophobicContact CD1-CB 4.38Å; L116-M142 HydrophobicContact CD1-CG 3.97Å; L116-M144 HydrophobicContact CB-SD 4.19Å; L116-M144 HydrophobicContact CD2-SD 3.98Å; L116-I147 HydrophobicContact CD2-CB 4.43Å; L116-I147 HydrophobicContact CD2-CG1 4.3Å; L116-I147 HydrophobicContact CD2-CG2 3.95Å
117	V	95.9	Very high	95	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-44.5	174	173.3	0	0	0	0	109.7	I73 A75 L80 L113 E114 F119 C120 Y121	I73-V117 HydrophobicContact CG2-CB 4.25Å; I73-V117 HydrophobicContact CG2-CG1 3.78Å; I73-V117 HydrophobicContact CG2-CG2 4.42Å; A75-V117 HydrophobicContact CB-CG1 4.48Å; L80-V117 HydrophobicContact CD2-CG1 4.1Å; L80-V117 HydrophobicContact CD2-CG2 4.17Å; L113-V117 WeakPolarHBondContact O-CG2 3.5Å; L113-V117 PolarHBondContact O-N 3.01Å; E114-V117 PolarHBondContact O-N 2.87Å; V117-F119 VanDerWaalsContact C-N 3.32Å; V117-F119 PolarHBondContact O-N 2.9Å; V117-C120 VanDerWaalsContact O-CB 3.25Å; V117-C120 WeakPolarHBondContact O-CB 3.5Å; V117-C120 PolarHBondContact O-N 3.42Å; V117-C120 VanDerWaalsContact O-N 3.09Å; V117-Y121 HydrophobicContact CG1-CE2 4.13Å; V117-Y121 WeakPolarHBondContact O-CD2 3.23Å
118	D	95.4	Very high	95.3	Very high	49 Å²	49	42.8 Å²	42.8	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-58.9	-42.7	174.7	-77.2	-5.3	0	0	0	111.9	R56 E114 M115 C120 Y121 T122	R56-D118 IonicContact CZ-OD1 3.89Å; R56-D118 IonicContact NH1-OD1 2.64Å; R56-D118 PolarHBondContact NH1-OD1 3.45Å; R56-D118 IonicContact NH2-OD1 2.68Å; R56-D118 PolarHBondContact NH2-OD1 3.16Å; E114-D118 WeakPolarHBondContact O-CB 3.45Å; E114-D118 PolarHBondContact O-N 3.28Å; M115-D118 PolarHBondContact O-N 3.15Å; D118-C120 PolarHBondContact O-N 2.96Å; D118-Y121 CarbonylContact O-C 3.49Å; D118-Y121 WeakPolarHBondContact O-CA 3.46Å; D118-Y121 PolarHBondContact O-N 3.31Å; D118-T122 WeakPolarHBondContact O-CG2 3.35Å; D118-T122 PolarHBondContact O-N 3.22Å; D118-T122 PolarHBondContact O-OG1 3.33Å; D118-T122 VanDerWaalsContact O-OG1 3.06Å
119	F	96.6	Very high	95.2	Very high	35 Å²	35	47.9 Å²	47.9	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-36.9	174.2	173.7	-98.3	0	0	0	112.7	M115 L116 V117 Y121 T122 S123 I125 M144 I147	M115-F119 WeakPolarHBondContact O-CB 3.39Å; M115-F119 PolarHBondContact O-N 3.42Å; L116-F119 WeakPolarHBondContact O-CB 3.34Å; L116-F119 PolarHBondContact O-N 2.92Å; V117-F119 VanDerWaalsContact C-N 3.32Å; V117-F119 PolarHBondContact O-N 2.9Å; F119-Y121 PolarHBondContact O-N 2.93Å; F119-Y121 VanDerWaalsContact O-N 3.09Å; F119-T122 PolarHBondContact O-N 2.9Å; F119-S123 WeakPolarHBondContact O-CA 3.4Å; F119-S123 PolarHBondContact O-N 3.39Å; F119-I125 HydrophobicContact CB-CB 4.36Å; F119-I125 HydrophobicContact CB-CD1 4.37Å; F119-I125 HydrophobicContact CD2-CB 3.88Å; F119-I125 HydrophobicContact CD2-CG2 4.07Å; F119-I125 HydrophobicContact CE2-CG2 4.42Å; F119-I125 HydrophobicContact CG-CB 4.41Å; F119-M144 HydrophobicContact CD1-CE 3.59Å; F119-M144 HydrophobicContact CE1-CE 3.82Å; F119-I147 HydrophobicContact CD1-CD1 4.04Å; F119-I147 HydrophobicContact CD1-CG1 4.18Å; F119-I147 HydrophobicContact CD2-CD1 4.04Å; F119-I147 HydrophobicContact CE1-CD1 3.69Å; F119-I147 HydrophobicContact CE1-CG1 4Å; F119-I147 HydrophobicContact CE2-CD1 3.7Å; F119-I147 HydrophobicContact CG-CD1 4.2Å; F119-I147 HydrophobicContact CZ-CD1 3.51Å; F119-I147 HydrophobicContact CZ-CG1 4.32Å
120	C	95.7	Very high	95.1	Very high	3 Å²	3	49 Å²	49	2%	0.02	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-21.5	174.8	-59.1	0	0	0	0	113.2	L49 V79 L80 C83 L116 V117 D118	L49-C120 WeakPolarHBondContact CD1-O 3.47Å; V79-C120 HydrophobicContact CG1-CB 4.17Å; L80-C120 HydrophobicContact CD2-CB 4.33Å; C83-C120 HydrophobicContact CB-CB 4.07Å; L116-C120 PolarHBondContact O-N 3.35Å; L116-C120 VanDerWaalsContact O-N 3.15Å; L116-C120 PolarHBondContact O-SG 3.5Å; V117-C120 VanDerWaalsContact O-CB 3.25Å; V117-C120 WeakPolarHBondContact O-CB 3.5Å; V117-C120 PolarHBondContact O-N 3.42Å; V117-C120 VanDerWaalsContact O-N 3.09Å; D118-C120 PolarHBondContact O-N 2.96Å
121	Y	95.4	Very high	95	Very high	3 Å²	3	47.6 Å²	47.6	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-110.7	-20.2	-179.9	-67.1	-90.5	0	0	0	114.3	L49 Y53 R56 H76 V79 V117 D118 F119	L49-Y121 WeakPolarHBondContact CD2-O 3.42Å; L49-Y121 VanDerWaalsContact CG-O 3.31Å; L49-Y121 WeakPolarHBondContact CG-O 3.38Å; Y53-Y121 VanDerWaalsContact CD2-CB 3.48Å; Y53-Y121 HydrophobicContact CD2-CG 4.19Å; R56-Y121 HydrophobicContact CB-CD1 4.38Å; R56-Y121 HydrophobicContact CB-CE1 4.01Å; R56-Y121 VanDerWaalsContact CD-CZ 3.4Å; H76-Y121 PolarHBondContact N-OH 2.61Å; H76-Y121 AromaticContact ND1-CE1 3.66Å; H76-Y121 AromaticContact ND1-CZ 3.83Å; H76-Y121 PolarHBondContact ND1-OH 3.49Å; H76-Y121 VanDerWaalsContact ND1-OH 3.17Å; V79-Y121 HydrophobicContact CB-CE1 4.05Å; V79-Y121 HydrophobicContact CG1-CD1 4.09Å; V79-Y121 HydrophobicContact CG1-CD2 4.41Å; V79-Y121 HydrophobicContact CG1-CE1 3.74Å; V79-Y121 HydrophobicContact CG1-CE2 4.04Å; V79-Y121 HydrophobicContact CG1-CG 4.4Å; V79-Y121 HydrophobicContact CG2-CE1 3.93Å; V117-Y121 HydrophobicContact CG1-CE2 4.13Å; V117-Y121 WeakPolarHBondContact O-CD2 3.23Å; D118-Y121 CarbonylContact O-C 3.49Å; D118-Y121 WeakPolarHBondContact O-CA 3.46Å; D118-Y121 PolarHBondContact O-N 3.31Å; F119-Y121 PolarHBondContact O-N 2.93Å; F119-Y121 VanDerWaalsContact O-N 3.09Å
122	T	93.1	Very high	94.9	Very high	53 Å²	53	43.5 Å²	43.5	33%	0.325	24%	0.244	S	C	.	.	H	α-helix	trans	-109	-18.3	-175.9	63.5	0	0	0	0	113	Y53 D118 F119 S124	Y53-T122 HydrophobicContact CD2-CG2 4.21Å; Y53-T122 HydrophobicContact CE1-CG2 4.36Å; Y53-T122 HydrophobicContact CE2-CG2 3.86Å; D118-T122 WeakPolarHBondContact O-CG2 3.35Å; D118-T122 PolarHBondContact O-N 3.22Å; D118-T122 PolarHBondContact O-OG1 3.33Å; D118-T122 VanDerWaalsContact O-OG1 3.06Å; F119-T122 PolarHBondContact O-N 2.9Å; T122-S124 PolarHBondContact O-N 3.25Å; T122-S124 VanDerWaalsContact O-N 3.1Å; T122-S124 PolarHBondContact OG1-N 2.62Å; T122-S124 PolarHBondContact OG1-O 3.22Å; T122-S124 VanDerWaalsContact OG1-O 3.05Å
123	S	92.7	Very high	94.7	Very high	77 Å²	77	49.4 Å²	49.4	54%	0.538	27%	0.271	S	S	.	.	S	Bend	trans	54	21	-168.1	-54.1	0	0	0	0	113.7	L49 F119	L49-S123 WeakPolarHBondContact CD2-OG 3.42Å; F119-S123 WeakPolarHBondContact O-CA 3.4Å; F119-S123 PolarHBondContact O-N 3.39Å
124	S	93.9	Very high	94.6	Very high	78 Å²	78	52.9 Å²	52.9	55%	0.545	29%	0.288	S	S	.	.			trans	-134.7	127.9	-177	177.9	0	0	0	0	109.8	T122	T122-S124 PolarHBondContact O-N 3.25Å; T122-S124 VanDerWaalsContact O-N 3.1Å; T122-S124 PolarHBondContact OG1-N 2.62Å; T122-S124 PolarHBondContact OG1-O 3.22Å; T122-S124 VanDerWaalsContact OG1-O 3.05Å
125	I	95.8	Very high	94.7	Very high	34 Å²	34	49.7 Å²	49.7	17%	0.174	27%	0.273	C	S	.	.			trans	-135.3	138	175.2	-164.2	162	0	0	0	109.4	M115 L116 F119 I127 L135 I147	M115-I125 HydrophobicContact CB-CD1 4.3Å; M115-I125 HydrophobicContact CE-CG1 3.99Å; L116-I125 HydrophobicContact CD2-CD1 4.12Å; F119-I125 HydrophobicContact CB-CB 4.36Å; F119-I125 HydrophobicContact CB-CD1 4.37Å; F119-I125 HydrophobicContact CD2-CB 3.88Å; F119-I125 HydrophobicContact CD2-CG2 4.07Å; F119-I125 HydrophobicContact CE2-CG2 4.42Å; F119-I125 HydrophobicContact CG-CB 4.41Å; I125-I127 HydrophobicContact CG2-CD1 4.42Å; I125-I127 HydrophobicContact CG2-CG1 4.4Å; I125-L135 HydrophobicContact CD1-CD1 3.76Å; I125-L135 HydrophobicContact CD1-CD2 3.76Å; I125-L135 HydrophobicContact CD1-CG 4.34Å; I125-L135 HydrophobicContact CG1-CD2 4.23Å; I125-I147 HydrophobicContact CD1-CG2 4.28Å; I125-I147 HydrophobicContact CG2-CD1 3.76Å
126	V	95.7	Very high	94.6	Very high	87 Å²	87	47.3 Å²	47.3	53%	0.527	26%	0.261	S	S	.	.			trans	-104	118.3	179.3	179.8	0	0	0	0	107.8	M115 E128 N131	M115-V126 WeakPolarHBondContact CE-O 3.22Å; V126-E128 HydrophobicContact CG1-CG 3.98Å; V126-N131 PolarHBondContact O-ND2 3.31Å
127	I	95.1	Very high	94.4	Very high	27 Å²	27	48.9 Å²	48.9	14%	0.138	27%	0.271	C	S	.	.			trans	-106.8	124.7	-178.9	-58.8	166.2	0	0	0	108	I125 V132 L135 V150 F154	I125-I127 HydrophobicContact CG2-CD1 4.42Å; I125-I127 HydrophobicContact CG2-CG1 4.4Å; I127-V132 HydrophobicContact CG2-CB 4.02Å; I127-V132 HydrophobicContact CG2-CG2 3.98Å; I127-L135 HydrophobicContact CG1-CD2 3.81Å; I127-V150 HydrophobicContact CD1-CB 3.88Å; I127-V150 HydrophobicContact CD1-CG1 3.48Å; I127-V150 VanDerWaalsContact CD1-CG1 3.48Å; I127-F154 HydrophobicContact CG2-CB 4.1Å; I127-F154 HydrophobicContact CG2-CD1 4.16Å; I127-F154 HydrophobicContact CG2-CD2 4.26Å; I127-F154 HydrophobicContact CG2-CG 3.91Å
128	E	94.3	Very high	94.4	Very high	101 Å²	101	49 Å²	49	47%	0.472	27%	0.272	S	S	.	.			trans	-134.1	164.8	-176.5	-62	-177.9	154.1	0	0	109.8	V126 S130 N131 V132	V126-E128 HydrophobicContact CG1-CG 3.98Å; E128-S130 PolarHBondContact O-N 3.36Å; E128-N131 PolarHBondContact N-OD1 3.35Å; E128-N131 PolarHBondContact O-N 2.89Å; E128-N131 VanDerWaalsContact O-N 3.16Å; E128-N131 PolarHBondContact O-OD1 3.07Å; E128-V132 WeakPolarHBondContact O-CB 3.41Å; E128-V132 PolarHBondContact O-N 3.27Å
129	E	91	Very high	94.4	Very high	131 Å²	131	46.6 Å²	46.6	61%	0.612	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-31.1	176.9	-63.6	175.9	-170.5	0	0	112.3	N131 F154 Q158	E129-N131 VanDerWaalsContact C-N 3.35Å; E129-N131 PolarHBondContact O-N 3.44Å; E129-F154 HydrophobicContact CG-CE1 3.98Å; E129-F154 HydrophobicContact CG-CZ 3.82Å; E129-Q158 PolarHBondContact OE1-NE2 3.38Å; E129-Q158 VanDerWaalsContact OE1-NE2 3.17Å
130	S	92.9	Very high	94.2	Very high	85 Å²	85	46.3 Å²	46.3	59%	0.594	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-23.7	-179.6	59.6	0	0	0	0	114	E128 Q134	E128-S130 PolarHBondContact O-N 3.36Å; S130-Q134 PolarHBondContact O-OE1 3.25Å
131	N	94.4	Very high	94.1	Very high	23 Å²	23	49.6 Å²	49.6	12%	0.123	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-20.1	-170.4	74.2	17	0	0	0	114.4	M115 V126 E128 E129 Q133 Q134 L135	M115-N131 WeakPolarHBondContact CE-ND2 3.34Å; V126-N131 PolarHBondContact O-ND2 3.31Å; E128-N131 PolarHBondContact N-OD1 3.35Å; E128-N131 PolarHBondContact O-N 2.89Å; E128-N131 VanDerWaalsContact O-N 3.16Å; E128-N131 PolarHBondContact O-OD1 3.07Å; E129-N131 VanDerWaalsContact C-N 3.35Å; E129-N131 PolarHBondContact O-N 3.44Å; N131-Q133 PolarHBondContact O-N 3.11Å; N131-Q134 PolarHBondContact O-N 3.12Å; N131-Q134 VanDerWaalsContact O-N 3.14Å; N131-Q134 PolarHBondContact O-OE1 2.88Å; N131-L135 WeakPolarHBondContact O-CB 3.34Å; N131-L135 PolarHBondContact O-N 3.33Å
132	V	94.1	Very high	94	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.03	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-33	-171.5	66.2	0	0	0	0	113	I127 E128 L135 L136 C151 F154 L155	I127-V132 HydrophobicContact CG2-CB 4.02Å; I127-V132 HydrophobicContact CG2-CG2 3.98Å; E128-V132 WeakPolarHBondContact O-CB 3.41Å; E128-V132 PolarHBondContact O-N 3.27Å; V132-L135 PolarHBondContact O-N 3.16Å; V132-L136 PolarHBondContact O-N 2.86Å; V132-C151 HydrophobicContact CG2-CB 4.12Å; V132-F154 HydrophobicContact CB-CD1 4.23Å; V132-F154 HydrophobicContact CB-CE1 4.48Å; V132-F154 HydrophobicContact CG1-CD1 4.24Å; V132-F154 HydrophobicContact CG1-CE1 4.22Å; V132-F154 HydrophobicContact CG2-CD1 4.1Å; V132-L155 HydrophobicContact CG1-CD2 3.88Å; V132-L155 HydrophobicContact CG2-CD1 4.24Å; V132-L155 HydrophobicContact CG2-CD2 4.08Å; V132-L155 HydrophobicContact CG2-CG 3.92Å
133	Q	92	Very high	94.1	Very high	126 Å²	126	52 Å²	52	59%	0.589	29%	0.286	S	S	*	.	H	α-helix	trans	-70.1	-31.5	-179.9	-67.2	-172.6	-0.1	0	0	112.9	N131 P137 F170	N131-Q133 PolarHBondContact O-N 3.11Å; Q133-P137 WeakPolarHBondContact O-CD 3.43Å; Q133-P137 WeakPolarHBondContact O-CG 3.21Å; Q133-F170 WeakPolarHBondContact O-CZ 3.32Å
134	Q	94.7	Very high	94.2	Very high	74 Å²	74	48.8 Å²	48.8	35%	0.346	26%	0.262	S	S	.	.	H	α-helix	trans	-88.3	-30.3	174.7	-58.9	80.9	4.5	0	0	111.6	D109 A112 S130 N131 P137 A138	D109-Q134 HydrophobicContact CB-CB 3.9Å; D109-Q134 HydrophobicContact CB-CG 4.25Å; A112-Q134 HydrophobicContact CB-CB 4.08Å; A112-Q134 VanDerWaalsContact CB-O 3.3Å; A112-Q134 WeakPolarHBondContact CB-O 3.35Å; S130-Q134 PolarHBondContact O-OE1 3.25Å; N131-Q134 PolarHBondContact O-N 3.12Å; N131-Q134 VanDerWaalsContact O-N 3.14Å; N131-Q134 PolarHBondContact O-OE1 2.88Å; Q134-P137 WeakPolarHBondContact O-CD 3.48Å; Q134-A138 WeakPolarHBondContact O-CB 3.5Å; Q134-A138 PolarHBondContact O-N 3.48Å
135	L	96.1	Very high	94.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-75.6	-43	-176.3	-176.3	61.6	0	0	0	113.3	L116 I125 I127 N131 V132 A138 A139 I147	L116-L135 HydrophobicContact CD1-CD1 4.43Å; L116-L135 HydrophobicContact CD2-CD1 3.7Å; L116-L135 HydrophobicContact CG-CD1 3.82Å; I125-L135 HydrophobicContact CD1-CD1 3.76Å; I125-L135 HydrophobicContact CD1-CD2 3.76Å; I125-L135 HydrophobicContact CD1-CG 4.34Å; I125-L135 HydrophobicContact CG1-CD2 4.23Å; I127-L135 HydrophobicContact CG1-CD2 3.81Å; N131-L135 WeakPolarHBondContact O-CB 3.34Å; N131-L135 PolarHBondContact O-N 3.33Å; V132-L135 PolarHBondContact O-N 3.16Å; L135-A138 PolarHBondContact O-N 3.24Å; L135-A139 WeakPolarHBondContact O-CB 3.44Å; L135-A139 PolarHBondContact O-N 3.23Å; L135-I147 HydrophobicContact CD2-CG2 4.49Å; L135-I147 HydrophobicContact CG-CG2 4.41Å
136	L	94.5	Very high	94.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-47.8	179.6	-179.7	64.8	0	0	0	112.7	V132 A138 A139 C140 Q148 C151 L155 F170	V132-L136 PolarHBondContact O-N 2.86Å; L136-A138 VanDerWaalsContact C-N 3.32Å; L136-A138 PolarHBondContact O-N 3.31Å; L136-A139 PolarHBondContact O-N 3.47Å; L136-A139 VanDerWaalsContact O-N 3.16Å; L136-C140 PolarHBondContact O-N 2.88Å; L136-C140 PolarHBondContact O-SG 3.32Å; L136-Q148 HydrophobicContact CD1-CB 4.03Å; L136-Q148 HydrophobicContact CD1-CG 4.14Å; L136-C151 HydrophobicContact CB-CB 4.1Å; L136-C151 HydrophobicContact CD1-CB 3.77Å; L136-C151 HydrophobicContact CG-CB 4.43Å; L136-L155 HydrophobicContact CD2-CD1 4.13Å; L136-F170 HydrophobicContact CB-CE1 3.93Å; L136-F170 HydrophobicContact CB-CZ 4.01Å; L136-F170 HydrophobicContact CD2-CD1 3.97Å; L136-F170 HydrophobicContact CD2-CE1 3.35Å; L136-F170 HydrophobicContact CD2-CZ 4.11Å; L136-F170 HydrophobicContact CG-CE1 4.13Å; L136-F170 HydrophobicContact CG-CZ 4.46Å
137	P	93.7	Very high	94	Very high	36 Å²	36	51.9 Å²	51.9	23%	0.234	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-40.1	178.4	-21.5	34.5	0	0	0	111.9	Q133 Q134 C140 L141 F170 H174	Q133-P137 WeakPolarHBondContact O-CD 3.43Å; Q133-P137 WeakPolarHBondContact O-CG 3.21Å; Q134-P137 WeakPolarHBondContact O-CD 3.48Å; P137-C140 PolarHBondContact O-N 3.38Å; P137-L141 WeakPolarHBondContact O-CB 3.39Å; P137-L141 PolarHBondContact O-N 3.01Å; P137-F170 HydrophobicContact CG-CE2 3.84Å; P137-F170 HydrophobicContact CG-CZ 3.8Å; P137-H174 WeakPolarHBondContact CG-NE2 3.3Å
138	A	95.2	Very high	93.9	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-43	174.9	0	0	0	0	0	111.2	V108 A112 L116 Q134 L135 L136 C140 L141 M142	V108-A138 HydrophobicContact CG2-CB 3.62Å; A112-A138 HydrophobicContact CB-CB 3.75Å; L116-A138 VanDerWaalsContact CD1-C 3.44Å; L116-A138 HydrophobicContact CD1-CB 3.57Å; Q134-A138 WeakPolarHBondContact O-CB 3.5Å; Q134-A138 PolarHBondContact O-N 3.48Å; L135-A138 PolarHBondContact O-N 3.24Å; L136-A138 VanDerWaalsContact C-N 3.32Å; L136-A138 PolarHBondContact O-N 3.31Å; A138-C140 PolarHBondContact O-N 3.43Å; A138-L141 PolarHBondContact O-N 2.9Å; A138-M142 WeakPolarHBondContact O-CB 3.42Å; A138-M142 VanDerWaalsContact O-CG 3.23Å; A138-M142 WeakPolarHBondContact O-CG 3.49Å; A138-M142 PolarHBondContact O-N 3.46Å
139	A	95.1	Very high	93.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.2	-36.1	177.5	0	0	0	0	0	112.4	L116 L135 L136 Q143 M144 I147 Q148	L116-A139 HydrophobicContact CD1-CB 4.44Å; L116-A139 HydrophobicContact CD2-CB 4.21Å; L135-A139 WeakPolarHBondContact O-CB 3.44Å; L135-A139 PolarHBondContact O-N 3.23Å; L136-A139 PolarHBondContact O-N 3.47Å; L136-A139 VanDerWaalsContact O-N 3.16Å; A139-Q143 PolarHBondContact O-N 3.2Å; A139-M144 PolarHBondContact O-N 3.14Å; A139-I147 HydrophobicContact CB-CB 4.07Å; A139-I147 HydrophobicContact CB-CG2 3.87Å; A139-Q148 HydrophobicContact CB-CG 3.87Å; A139-Q148 PolarHBondContact O-NE2 3.32Å; A139-Q148 VanDerWaalsContact O-NE2 3.14Å
140	C	93	Very high	94.1	Very high	28 Å²	28	48.2 Å²	48.2	19%	0.189	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-49	171.6	-68.7	0	0	0	0	111.5	L136 P137 A138 M142 Q143 Q148	L136-C140 PolarHBondContact O-N 2.88Å; L136-C140 PolarHBondContact O-SG 3.32Å; P137-C140 PolarHBondContact O-N 3.38Å; A138-C140 PolarHBondContact O-N 3.43Å; C140-M142 VanDerWaalsContact C-N 3.34Å; C140-M142 PolarHBondContact O-N 2.86Å; C140-Q143 PolarHBondContact O-N 3.03Å; C140-Q148 VanDerWaalsContact SG-CD 3.6Å; C140-Q148 PolarHBondContact SG-OE1 2.8Å; C140-Q148 VanDerWaalsContact SG-OE1 3.39Å
141	L	93.4	Very high	94.2	Very high	72 Å²	72	44.2 Å²	44.2	38%	0.377	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-43	178.9	-175.1	64.8	0	0	0	111.6	Y86 V108 P137 A138 Q143	Y86-L141 WeakPolarHBondContact CD2-O 3.44Å; V108-L141 HydrophobicContact CB-CD2 4.07Å; V108-L141 HydrophobicContact CG2-CD2 4.36Å; P137-L141 WeakPolarHBondContact O-CB 3.39Å; P137-L141 PolarHBondContact O-N 3.01Å; A138-L141 PolarHBondContact O-N 2.9Å; L141-Q143 PolarHBondContact O-N 3.16Å
142	M	93.6	Very high	94.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	1.1	177	-60.3	-60.2	97.9	0	0	113.3	S84 Y86 F87 L113 L116 A138 C140 M144	S84-M142 PolarHBondContact OG-O 3.06Å; Y86-M142 HydrophobicContact CD1-CE 3.54Å; Y86-M142 HydrophobicContact CD1-SD 3.73Å; Y86-M142 HydrophobicContact CE1-CE 3.51Å; Y86-M142 HydrophobicContact CE1-SD 4.08Å; Y86-M142 HydrophobicContact CG-CE 4.1Å; F87-M142 HydrophobicContact CE1-SD 3.8Å; F87-M142 HydrophobicContact CE2-SD 3.74Å; F87-M142 HydrophobicContact CZ-SD 3.32Å; F87-M142 WeakPolarHBondContact CZ-SD 3.44Å; L113-M142 HydrophobicContact CD1-CG 3.92Å; L113-M142 HydrophobicContact CD1-SD 3.7Å; L116-M142 HydrophobicContact CD1-CB 4.38Å; L116-M142 HydrophobicContact CD1-CG 3.97Å; A138-M142 WeakPolarHBondContact O-CB 3.42Å; A138-M142 VanDerWaalsContact O-CG 3.23Å; A138-M142 WeakPolarHBondContact O-CG 3.49Å; A138-M142 PolarHBondContact O-N 3.46Å; C140-M142 VanDerWaalsContact C-N 3.34Å; C140-M142 PolarHBondContact O-N 2.86Å; M142-M144 VanDerWaalsContact C-N 3.27Å; M142-M144 HydrophobicContact CB-CG 4Å; M142-M144 HydrophobicContact CB-SD 4.32Å; M142-M144 PolarHBondContact O-N 3.2Å
143	Q	94.4	Very high	94.2	Very high	107 Å²	107	47 Å²	47	50%	0.5	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	37.8	-179.7	-57.9	-176.9	18.1	0	0	114.1	P85 A139 C140 L141 Q145	P85-Q143 HydrophobicContact CB-CB 4.21Å; P85-Q143 WeakPolarHBondContact CD-O 3.25Å; P85-Q143 HydrophobicContact CG-CB 4.19Å; A139-Q143 PolarHBondContact O-N 3.2Å; C140-Q143 PolarHBondContact O-N 3.03Å; L141-Q143 PolarHBondContact O-N 3.16Å; Q143-Q145 PolarHBondContact O-N 3.21Å
144	M	95.1	Very high	94.4	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.049	22%	0.221	C	C	.	.			trans	-93.9	85	178.6	-59.7	-171.1	84.6	0	0	110.6	C83 L116 F119 A139 M142 E146 I147 Q148	C83-M144 HydrophobicContact CB-CE 4.27Å; L116-M144 HydrophobicContact CB-SD 4.19Å; L116-M144 HydrophobicContact CD2-SD 3.98Å; F119-M144 HydrophobicContact CD1-CE 3.59Å; F119-M144 HydrophobicContact CE1-CE 3.82Å; A139-M144 PolarHBondContact O-N 3.14Å; M142-M144 VanDerWaalsContact C-N 3.27Å; M142-M144 HydrophobicContact CB-CG 4Å; M142-M144 HydrophobicContact CB-SD 4.32Å; M142-M144 PolarHBondContact O-N 3.2Å; M144-E146 PolarHBondContact O-N 3.5Å; M144-I147 HydrophobicContact CB-CB 4.37Å; M144-I147 HydrophobicContact CB-CG1 4.25Å; M144-I147 PolarHBondContact O-N 3.23Å; M144-Q148 WeakPolarHBondContact O-CG 3.41Å; M144-Q148 PolarHBondContact O-N 3.4Å; M144-Q148 VanDerWaalsContact O-N 3.11Å
145	Q	93.2	Very high	94.3	Very high	109 Å²	109	40.2 Å²	40.2	51%	0.509	21%	0.207	S	C	.	.	H	α-helix	trans	-59.5	-41.3	-171.8	-170.4	61.9	50.8	0	0	113.4	Q143 I147 Q148 D149	Q143-Q145 PolarHBondContact O-N 3.21Å; Q145-I147 VanDerWaalsContact C-N 3.3Å; Q145-I147 PolarHBondContact O-N 3.14Å; Q145-Q148 WeakPolarHBondContact O-CB 3.45Å; Q145-Q148 PolarHBondContact O-N 3.04Å; Q145-Q148 VanDerWaalsContact O-N 3.12Å; Q145-D149 PolarHBondContact NE2-OD1 3.39Å; Q145-D149 VanDerWaalsContact O-CG 3.28Å; Q145-D149 PolarHBondContact O-N 2.89Å
146	E	94	Very high	94.2	Very high	149 Å²	149	42.9 Å²	42.9	70%	0.696	22%	0.219	S	C	*	.	H	α-helix	trans	-58.3	-43.9	180	-66.4	179.6	-150	0	0	111.4	M144 D149 V150	M144-E146 PolarHBondContact O-N 3.5Å; E146-D149 PolarHBondContact O-N 3.23Å; E146-V150 WeakPolarHBondContact O-CG2 3.47Å; E146-V150 PolarHBondContact O-N 3.17Å
147	I	94.9	Very high	94.1	Very high	6 Å²	6	51 Å²	51	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-69.1	-38.3	178.1	-54.6	-49	0	0	0	111.2	L116 F119 I125 L135 A139 M144 Q145 D149 V150 C151	L116-I147 HydrophobicContact CD2-CB 4.43Å; L116-I147 HydrophobicContact CD2-CG1 4.3Å; L116-I147 HydrophobicContact CD2-CG2 3.95Å; F119-I147 HydrophobicContact CD1-CD1 4.04Å; F119-I147 HydrophobicContact CD1-CG1 4.18Å; F119-I147 HydrophobicContact CD2-CD1 4.04Å; F119-I147 HydrophobicContact CE1-CD1 3.69Å; F119-I147 HydrophobicContact CE1-CG1 4Å; F119-I147 HydrophobicContact CE2-CD1 3.7Å; F119-I147 HydrophobicContact CG-CD1 4.2Å; F119-I147 HydrophobicContact CZ-CD1 3.51Å; F119-I147 HydrophobicContact CZ-CG1 4.32Å; I125-I147 HydrophobicContact CD1-CG2 4.28Å; I125-I147 HydrophobicContact CG2-CD1 3.76Å; L135-I147 HydrophobicContact CD2-CG2 4.49Å; L135-I147 HydrophobicContact CG-CG2 4.41Å; A139-I147 HydrophobicContact CB-CB 4.07Å; A139-I147 HydrophobicContact CB-CG2 3.87Å; M144-I147 HydrophobicContact CB-CB 4.37Å; M144-I147 HydrophobicContact CB-CG1 4.25Å; M144-I147 PolarHBondContact O-N 3.23Å; Q145-I147 VanDerWaalsContact C-N 3.3Å; Q145-I147 PolarHBondContact O-N 3.14Å; I147-D149 VanDerWaalsContact C-N 3.31Å; I147-D149 PolarHBondContact O-N 3.44Å; I147-V150 PolarHBondContact O-N 2.91Å; I147-C151 WeakPolarHBondContact O-CB 3.5Å; I147-C151 PolarHBondContact O-N 3.41Å; I147-C151 PolarHBondContact O-SG 3.36Å
148	Q	93.2	Very high	94	Very high	24 Å²	24	52.8 Å²	52.8	11%	0.112	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-44.3	174.5	-67.1	172.7	53.5	0	0	111.4	L136 A139 C140 M144 Q145 C151 C152	L136-Q148 HydrophobicContact CD1-CB 4.03Å; L136-Q148 HydrophobicContact CD1-CG 4.14Å; A139-Q148 HydrophobicContact CB-CG 3.87Å; A139-Q148 PolarHBondContact O-NE2 3.32Å; A139-Q148 VanDerWaalsContact O-NE2 3.14Å; C140-Q148 VanDerWaalsContact SG-CD 3.6Å; C140-Q148 PolarHBondContact SG-OE1 2.8Å; C140-Q148 VanDerWaalsContact SG-OE1 3.39Å; M144-Q148 WeakPolarHBondContact O-CG 3.41Å; M144-Q148 PolarHBondContact O-N 3.4Å; M144-Q148 VanDerWaalsContact O-N 3.11Å; Q145-Q148 WeakPolarHBondContact O-CB 3.45Å; Q145-Q148 PolarHBondContact O-N 3.04Å; Q145-Q148 VanDerWaalsContact O-N 3.12Å; Q148-C151 PolarHBondContact O-N 3.48Å; Q148-C152 WeakPolarHBondContact O-CB 3.37Å; Q148-C152 PolarHBondContact O-N 2.71Å; Q148-C152 PolarHBondContact O-SG 3.06Å
149	D	93.7	Very high	93.8	Very high	79 Å²	79	54 Å²	54	42%	0.422	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-45.3	179.7	-66.3	-19.4	0	0	0	111.1	Q145 E146 I147 C152 D153	Q145-D149 PolarHBondContact NE2-OD1 3.39Å; Q145-D149 VanDerWaalsContact O-CG 3.28Å; Q145-D149 PolarHBondContact O-N 2.89Å; E146-D149 PolarHBondContact O-N 3.23Å; I147-D149 VanDerWaalsContact C-N 3.31Å; I147-D149 PolarHBondContact O-N 3.44Å; D149-C152 WeakPolarHBondContact O-CB 3.05Å; D149-C152 PolarHBondContact O-N 2.87Å; D149-D153 WeakPolarHBondContact O-CB 3.16Å; D149-D153 PolarHBondContact O-N 3.49Å
150	V	95	Very high	93.8	Very high	79 Å²	79	57.4 Å²	57.4	48%	0.479	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-41.6	177.6	-173	0	0	0	0	111.8	I127 E146 I147 C152 D153 F154	I127-V150 HydrophobicContact CD1-CB 3.88Å; I127-V150 HydrophobicContact CD1-CG1 3.48Å; I127-V150 VanDerWaalsContact CD1-CG1 3.48Å; E146-V150 WeakPolarHBondContact O-CG2 3.47Å; E146-V150 PolarHBondContact O-N 3.17Å; I147-V150 PolarHBondContact O-N 2.91Å; V150-C152 VanDerWaalsContact C-N 3.33Å; V150-C152 PolarHBondContact O-N 3.29Å; V150-D153 PolarHBondContact O-N 2.89Å; V150-F154 PolarHBondContact O-N 3.35Å
151	C	95	Very high	93.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-42.9	174	-75.7	0	0	0	0	111.4	V132 L136 I147 Q148 D153 F154 L155	V132-C151 HydrophobicContact CG2-CB 4.12Å; L136-C151 HydrophobicContact CB-CB 4.1Å; L136-C151 HydrophobicContact CD1-CB 3.77Å; L136-C151 HydrophobicContact CG-CB 4.43Å; I147-C151 WeakPolarHBondContact O-CB 3.5Å; I147-C151 PolarHBondContact O-N 3.41Å; I147-C151 PolarHBondContact O-SG 3.36Å; Q148-C151 PolarHBondContact O-N 3.48Å; C151-D153 VanDerWaalsContact C-N 3.35Å; C151-D153 PolarHBondContact O-N 3.29Å; C151-F154 WeakPolarHBondContact O-CB 3.4Å; C151-F154 PolarHBondContact O-N 3.37Å; C151-L155 WeakPolarHBondContact O-CG 3.25Å; C151-L155 PolarHBondContact O-N 3.01Å
152	C	94.3	Very high	93.7	Very high	11 Å²	11	56.7 Å²	56.7	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-62.7	-41.7	174.9	-73.1	0	0	0	0	111.7	Q148 D149 V150 F154 L155 K156 C176 L179	Q148-C152 WeakPolarHBondContact O-CB 3.37Å; Q148-C152 PolarHBondContact O-N 2.71Å; Q148-C152 PolarHBondContact O-SG 3.06Å; D149-C152 WeakPolarHBondContact O-CB 3.05Å; D149-C152 PolarHBondContact O-N 2.87Å; V150-C152 VanDerWaalsContact C-N 3.33Å; V150-C152 PolarHBondContact O-N 3.29Å; C152-F154 VanDerWaalsContact C-N 3.33Å; C152-L155 PolarHBondContact O-N 3.31Å; C152-K156 VanDerWaalsContact O-CG 3.25Å; C152-K156 WeakPolarHBondContact O-CG 3.47Å; C152-K156 PolarHBondContact O-N 3.33Å; C152-C176 VanDerWaalsContact SG-SG 3.69Å; C152-L179 HydrophobicContact CB-CB 4.42Å
153	D	94.1	Very high	93.6	Very high	75 Å²	75	58.9 Å²	58.9	40%	0.401	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-33.1	177.6	-78.5	-8.8	0	0	0	113	D149 V150 C151 K156 K157	D149-D153 WeakPolarHBondContact O-CB 3.16Å; D149-D153 PolarHBondContact O-N 3.49Å; V150-D153 PolarHBondContact O-N 2.89Å; C151-D153 VanDerWaalsContact C-N 3.35Å; C151-D153 PolarHBondContact O-N 3.29Å; D153-K156 IonicContact OD1-NZ 3.26Å; D153-K156 PolarHBondContact OD1-NZ 3.18Å; D153-K157 WeakPolarHBondContact O-CG 3.41Å; D153-K157 PolarHBondContact O-N 2.88Å
154	F	95.1	Very high	93.6	Very high	47 Å²	47	53.8 Å²	53.8	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-50.2	170.3	-175.6	-92.9	0	0	0	111	I127 E129 V132 V150 C151 C152 K156 K157 Q158	I127-F154 HydrophobicContact CG2-CB 4.1Å; I127-F154 HydrophobicContact CG2-CD1 4.16Å; I127-F154 HydrophobicContact CG2-CD2 4.26Å; I127-F154 HydrophobicContact CG2-CG 3.91Å; E129-F154 HydrophobicContact CG-CE1 3.98Å; E129-F154 HydrophobicContact CG-CZ 3.82Å; V132-F154 HydrophobicContact CB-CD1 4.23Å; V132-F154 HydrophobicContact CB-CE1 4.48Å; V132-F154 HydrophobicContact CG1-CD1 4.24Å; V132-F154 HydrophobicContact CG1-CE1 4.22Å; V132-F154 HydrophobicContact CG2-CD1 4.1Å; V150-F154 PolarHBondContact O-N 3.35Å; C151-F154 WeakPolarHBondContact O-CB 3.4Å; C151-F154 PolarHBondContact O-N 3.37Å; C152-F154 VanDerWaalsContact C-N 3.33Å; F154-K156 VanDerWaalsContact C-N 3.32Å; F154-K156 PolarHBondContact O-N 3.38Å; F154-K157 WeakPolarHBondContact O-CB 3.49Å; F154-K157 PolarHBondContact O-N 2.91Å; F154-Q158 HydrophobicContact CD1-CG 4.33Å; F154-Q158 HydrophobicContact CE1-CG 3.95Å; F154-Q158 HydrophobicContact CZ-CG 4.2Å; F154-Q158 PolarHBondContact O-N 3.32Å
155	L	94.6	Very high	93.6	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-37	178.6	-69.6	171.9	0	0	0	112.6	V132 L136 C151 C152 K157 Q158 L159 I167 F170 L179	V132-L155 HydrophobicContact CG1-CD2 3.88Å; V132-L155 HydrophobicContact CG2-CD1 4.24Å; V132-L155 HydrophobicContact CG2-CD2 4.08Å; V132-L155 HydrophobicContact CG2-CG 3.92Å; L136-L155 HydrophobicContact CD2-CD1 4.13Å; C151-L155 WeakPolarHBondContact O-CG 3.25Å; C151-L155 PolarHBondContact O-N 3.01Å; C152-L155 PolarHBondContact O-N 3.31Å; L155-K157 PolarHBondContact O-N 3.28Å; L155-Q158 PolarHBondContact O-N 3.43Å; L155-Q158 VanDerWaalsContact O-N 3.14Å; L155-L159 PolarHBondContact O-N 3.07Å; L155-I167 HydrophobicContact CB-CG2 4.34Å; L155-I167 HydrophobicContact CD2-CD1 4.47Å; L155-I167 HydrophobicContact CD2-CG1 4.44Å; L155-F170 HydrophobicContact CD1-CD1 3.96Å; L155-F170 HydrophobicContact CD1-CE1 3.91Å; L155-L179 HydrophobicContact CB-CD1 3.93Å; L155-L179 HydrophobicContact CB-CD2 3.97Å; L155-L179 HydrophobicContact CD1-CD2 3.65Å; L155-L179 HydrophobicContact CG-CD2 4.47Å
156	K	92.5	Very high	93.6	Very high	56 Å²	56	49.7 Å²	49.7	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-36.7	174	-73.5	168.3	-158.4	165.4	0	112.3	C152 D153 F154 Q158 L179 I182	C152-K156 VanDerWaalsContact O-CG 3.25Å; C152-K156 WeakPolarHBondContact O-CG 3.47Å; C152-K156 PolarHBondContact O-N 3.33Å; D153-K156 IonicContact OD1-NZ 3.26Å; D153-K156 PolarHBondContact OD1-NZ 3.18Å; F154-K156 VanDerWaalsContact C-N 3.32Å; F154-K156 PolarHBondContact O-N 3.38Å; K156-Q158 VanDerWaalsContact C-N 3.31Å; K156-L179 HydrophobicContact CG-CD1 3.73Å; K156-I182 HydrophobicContact CD-CD1 3.55Å; K156-I182 HydrophobicContact CG-CD1 3.9Å
157	K	92	Very high	93.6	Very high	171 Å²	171	43.3 Å²	43.3	74%	0.743	23%	0.232	S	C	*	.	H	α-helix	trans	-76.7	-19.5	-179.7	-69	170.7	-175.3	172.5	0	112.9	D153 F154 L155	D153-K157 WeakPolarHBondContact O-CG 3.41Å; D153-K157 PolarHBondContact O-N 2.88Å; F154-K157 WeakPolarHBondContact O-CB 3.49Å; F154-K157 PolarHBondContact O-N 2.91Å; L155-K157 PolarHBondContact O-N 3.28Å
158	Q	92.2	Very high	93.5	Very high	74 Å²	74	43.1 Å²	43.1	35%	0.346	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	13.2	-177.3	-63.2	-65.6	-0.2	0	0	113.5	E129 F154 L155 K156 D160 N163	E129-Q158 PolarHBondContact OE1-NE2 3.38Å; E129-Q158 VanDerWaalsContact OE1-NE2 3.17Å; F154-Q158 HydrophobicContact CD1-CG 4.33Å; F154-Q158 HydrophobicContact CE1-CG 3.95Å; F154-Q158 HydrophobicContact CZ-CG 4.2Å; F154-Q158 PolarHBondContact O-N 3.32Å; L155-Q158 PolarHBondContact O-N 3.43Å; L155-Q158 VanDerWaalsContact O-N 3.14Å; K156-Q158 VanDerWaalsContact C-N 3.31Å; Q158-D160 PolarHBondContact O-N 2.85Å; Q158-N163 PolarHBondContact O-ND2 3.14Å; Q158-N163 PolarHBondContact O-OD1 3.32Å
159	L	91.9	Very high	93.5	Very high	25 Å²	25	43.1 Å²	43.1	13%	0.131	24%	0.235	C	C	.	.			trans	-66	120.9	176.3	-79.4	167.4	0	0	0	110.8	L155 C164 I167 I182 A183 F186	L155-L159 PolarHBondContact O-N 3.07Å; L159-C164 HydrophobicContact CD2-CB 4.03Å; L159-I167 HydrophobicContact CD2-CB 4.18Å; L159-I167 HydrophobicContact CD2-CD1 3.95Å; L159-I167 HydrophobicContact CD2-CG2 3.97Å; L159-I182 HydrophobicContact CD1-CG2 3.65Å; L159-A183 HydrophobicContact CD2-CB 4.17Å; L159-F186 HydrophobicContact CB-CD1 4.47Å; L159-F186 HydrophobicContact CB-CD2 4.11Å; L159-F186 HydrophobicContact CB-CE2 4.14Å; L159-F186 HydrophobicContact CB-CG 4.26Å; L159-F186 HydrophobicContact CB-CZ 4.34Å; L159-F186 HydrophobicContact CD1-CB 4.36Å; L159-F186 HydrophobicContact CD1-CG 4.5Å; L159-F186 WeakPolarHBondContact O-CZ 3.37Å
160	D	93.7	Very high	93.4	Very high	73 Å²	73	41.2 Å²	41.2	39%	0.39	22%	0.223	S	C	.	.			trans	-132.9	150.7	177.7	-177.2	-92.7	0	0	0	109.4	Q158 S162 N163 C164	Q158-D160 PolarHBondContact O-N 2.85Å; D160-S162 PolarHBondContact O-N 3.04Å; D160-S162 VanDerWaalsContact O-N 3.09Å; D160-S162 VanDerWaalsContact OD1-CB 3.26Å; D160-S162 WeakPolarHBondContact OD1-CB 3.4Å; D160-S162 PolarHBondContact OD1-N 3.43Å; D160-S162 PolarHBondContact OD1-OG 3.16Å; D160-N163 PolarHBondContact N-OD1 2.83Å; D160-N163 PolarHBondContact O-N 3.23Å; D160-N163 VanDerWaalsContact O-N 3.1Å; D160-N163 PolarHBondContact O-OD1 3.44Å; D160-C164 VanDerWaalsContact O-CB 3.26Å; D160-C164 WeakPolarHBondContact O-CB 3.46Å; D160-C164 PolarHBondContact O-N 3.43Å
161	P	91.3	Very high	93.3	Very high	16 Å²	16	37.5 Å²	37.5	10%	0.104	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-31.1	177.9	-28.6	38.1	0	0	0	113.7	F186 N190 E193 V194	P161-F186 HydrophobicContact CG-CE1 4.23Å; P161-F186 HydrophobicContact CG-CZ 4.37Å; P161-N190 HydrophobicContact CG-CB 4.29Å; P161-E193 HydrophobicContact CB-CB 3.82Å; P161-E193 HydrophobicContact CG-CB 4.23Å; P161-V194 HydrophobicContact CB-CG2 4.2Å
162	S	93.2	Very high	93.1	Very high	68 Å²	68	41.3 Å²	41.3	48%	0.476	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-20.3	180	66.9	0	0	0	0	115.5	D160 E199	D160-S162 PolarHBondContact O-N 3.04Å; D160-S162 VanDerWaalsContact O-N 3.09Å; D160-S162 VanDerWaalsContact OD1-CB 3.26Å; D160-S162 WeakPolarHBondContact OD1-CB 3.4Å; D160-S162 PolarHBondContact OD1-N 3.43Å; D160-S162 PolarHBondContact OD1-OG 3.16Å; S162-E199 WeakPolarHBondContact O-CG 3.25Å
163	N	93.1	Very high	92.9	Very high	46 Å²	46	45.8 Å²	45.8	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-7.6	-174.6	73.3	13.3	0	0	0	114.3	Q158 D160 L165 G166 I167 E199	Q158-N163 PolarHBondContact O-ND2 3.14Å; Q158-N163 PolarHBondContact O-OD1 3.32Å; D160-N163 PolarHBondContact N-OD1 2.83Å; D160-N163 PolarHBondContact O-N 3.23Å; D160-N163 VanDerWaalsContact O-N 3.1Å; D160-N163 PolarHBondContact O-OD1 3.44Å; N163-L165 PolarHBondContact O-N 3.12Å; N163-G166 PolarHBondContact O-N 3.22Å; N163-I167 WeakPolarHBondContact O-CG1 3.4Å; N163-I167 PolarHBondContact O-N 3.39Å; N163-E199 WeakPolarHBondContact CA-OE2 3.49Å
164	C	94.4	Very high	92.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-27.8	-169	66.2	0	0	0	0	113.1	L159 D160 R168 F186 T187 V194	L159-C164 HydrophobicContact CD2-CB 4.03Å; D160-C164 VanDerWaalsContact O-CB 3.26Å; D160-C164 WeakPolarHBondContact O-CB 3.46Å; D160-C164 PolarHBondContact O-N 3.43Å; C164-R168 WeakPolarHBondContact O-CB 3.26Å; C164-R168 PolarHBondContact O-N 2.99Å; C164-F186 HydrophobicContact CB-CD1 3.66Å; C164-F186 HydrophobicContact CB-CE1 4.02Å; C164-T187 PolarHBondContact SG-OG1 3.08Å; C164-V194 VanDerWaalsContact SG-CG2 3.59Å
165	L	94.7	Very high	92.3	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-76.3	-39	178.6	-64.2	174.7	0	0	0	110.8	N163 R168 A169 T187 V194 E199 F200 L203 I211	N163-L165 PolarHBondContact O-N 3.12Å; L165-R168 WeakPolarHBondContact O-CB 3.29Å; L165-R168 PolarHBondContact O-N 2.84Å; L165-A169 WeakPolarHBondContact O-CB 3.33Å; L165-A169 PolarHBondContact O-N 3.1Å; L165-T187 HydrophobicContact CD2-CG2 3.56Å; L165-V194 HydrophobicContact CD1-CG1 3.48Å; L165-V194 VanDerWaalsContact CD1-CG1 3.48Å; L165-V194 HydrophobicContact CD2-CG1 4.14Å; L165-V194 HydrophobicContact CG-CG1 3.75Å; L165-E199 HydrophobicContact CB-CB 4.06Å; L165-E199 WeakPolarHBondContact CB-OE2 3.32Å; L165-E199 HydrophobicContact CD1-CB 4.04Å; L165-E199 PolarHBondContact N-OE2 2.87Å; L165-F200 VanDerWaalsContact CD1-CA 3.47Å; L165-F200 HydrophobicContact CD1-CB 3.85Å; L165-F200 HydrophobicContact CD1-CD2 4.31Å; L165-L203 HydrophobicContact CB-CD2 4.33Å; L165-L203 HydrophobicContact CD1-CD1 3.83Å; L165-L203 HydrophobicContact CD1-CD2 4.25Å; L165-L203 HydrophobicContact CD1-CG 4.07Å; L165-L203 HydrophobicContact CD2-CD1 4.29Å; L165-L203 HydrophobicContact CD2-CD2 4.41Å; L165-I211 HydrophobicContact CD2-CD1 3.58Å
166	G	92.8	Very high	92	Very high	30 Å²	30	47 Å²	47	31%	0.309	26%	0.264	S	S	.	.	H	α-helix	trans	-59.6	-49.8	170.6	0	0	0	0	0	111.4	N163 R168 A169 F170 E199	N163-G166 PolarHBondContact O-N 3.22Å; G166-R168 VanDerWaalsContact C-N 3.3Å; G166-R168 PolarHBondContact O-N 2.9Å; G166-A169 PolarHBondContact O-N 3.3Å; G166-F170 VanDerWaalsContact O-CB 3.25Å; G166-F170 WeakPolarHBondContact O-CB 3.47Å; G166-F170 PolarHBondContact O-N 3.38Å; G166-E199 PolarHBondContact N-OE2 3.28Å
167	I	93.5	Very high	92	Very high	16 Å²	16	54 Å²	54	8%	0.082	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-40.2	176.7	-66.6	173.7	0	0	0	111.2	L155 L159 N163 F170 A171 L179	L155-I167 HydrophobicContact CB-CG2 4.34Å; L155-I167 HydrophobicContact CD2-CD1 4.47Å; L155-I167 HydrophobicContact CD2-CG1 4.44Å; L159-I167 HydrophobicContact CD2-CB 4.18Å; L159-I167 HydrophobicContact CD2-CD1 3.95Å; L159-I167 HydrophobicContact CD2-CG2 3.97Å; N163-I167 WeakPolarHBondContact O-CG1 3.4Å; N163-I167 PolarHBondContact O-N 3.39Å; I167-F170 PolarHBondContact O-N 3.23Å; I167-A171 WeakPolarHBondContact O-CB 3.5Å; I167-A171 PolarHBondContact O-N 3.22Å; I167-L179 HydrophobicContact CG2-CD1 3.89Å; I167-L179 HydrophobicContact CG2-CD2 4.11Å; I167-L179 HydrophobicContact CG2-CG 4.09Å
168	R	94.2	Very high	91.8	Very high	2 Å²	2	50 Å²	50	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-60.9	-51.3	176.1	-178.6	-167.1	176.5	-78.4	-12	111.6	C164 L165 G166 F170 A171 D172 L180 A183 N184 E210	C164-R168 WeakPolarHBondContact O-CB 3.26Å; C164-R168 PolarHBondContact O-N 2.99Å; L165-R168 WeakPolarHBondContact O-CB 3.29Å; L165-R168 PolarHBondContact O-N 2.84Å; G166-R168 VanDerWaalsContact C-N 3.3Å; G166-R168 PolarHBondContact O-N 2.9Å; R168-F170 VanDerWaalsContact C-N 3.28Å; R168-F170 PolarHBondContact O-N 3.09Å; R168-A171 PolarHBondContact O-N 2.64Å; R168-D172 PolarHBondContact O-N 2.96Å; R168-L180 HydrophobicContact CG-CD1 3.7Å; R168-L180 WeakPolarHBondContact O-CD1 3.46Å; R168-A183 HydrophobicContact CB-CB 3.86Å; R168-A183 HydrophobicContact CG-CB 4.38Å; R168-N184 PolarHBondContact NE-OD1 3.13Å; R168-N184 PolarHBondContact NH2-OD1 3.48Å; R168-E210 IonicContact CZ-OE2 3.69Å; R168-E210 IonicContact NH1-OE2 2.84Å; R168-E210 IonicContact NH2-OE1 3.44Å; R168-E210 PolarHBondContact NH2-OE1 2.95Å; R168-E210 IonicContact NH2-OE2 3.13Å; R168-E210 PolarHBondContact NH2-OE2 2.99Å
169	A	92.5	Very high	91.8	Very high	24 Å²	24	46.6 Å²	46.6	20%	0.198	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-37.1	179.1	0	0	0	0	0	111.8	L165 G166 D172 T173	L165-A169 WeakPolarHBondContact O-CB 3.33Å; L165-A169 PolarHBondContact O-N 3.1Å; G166-A169 PolarHBondContact O-N 3.3Å; A169-D172 PolarHBondContact O-N 3.01Å; A169-T173 WeakPolarHBondContact O-CB 3.45Å; A169-T173 PolarHBondContact O-N 3.09Å; A169-T173 PolarHBondContact O-OG1 3.49Å
170	F	91.1	Very high	91.8	Very high	39 Å²	39	46.8 Å²	46.8	17%	0.171	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-44.4	175.4	-172.5	-114.6	0	0	0	111.9	Q133 L136 P137 L155 G166 I167 R168 D172 T173 H174	Q133-F170 WeakPolarHBondContact O-CZ 3.32Å; L136-F170 HydrophobicContact CB-CE1 3.93Å; L136-F170 HydrophobicContact CB-CZ 4.01Å; L136-F170 HydrophobicContact CD2-CD1 3.97Å; L136-F170 HydrophobicContact CD2-CE1 3.35Å; L136-F170 HydrophobicContact CD2-CZ 4.11Å; L136-F170 HydrophobicContact CG-CE1 4.13Å; L136-F170 HydrophobicContact CG-CZ 4.46Å; P137-F170 HydrophobicContact CG-CE2 3.84Å; P137-F170 HydrophobicContact CG-CZ 3.8Å; L155-F170 HydrophobicContact CD1-CD1 3.96Å; L155-F170 HydrophobicContact CD1-CE1 3.91Å; G166-F170 VanDerWaalsContact O-CB 3.25Å; G166-F170 WeakPolarHBondContact O-CB 3.47Å; G166-F170 PolarHBondContact O-N 3.38Å; I167-F170 PolarHBondContact O-N 3.23Å; R168-F170 VanDerWaalsContact C-N 3.28Å; R168-F170 PolarHBondContact O-N 3.09Å; F170-D172 VanDerWaalsContact C-N 3.33Å; F170-D172 PolarHBondContact O-N 2.88Å; F170-T173 PolarHBondContact O-N 2.56Å; F170-H174 AromaticContact CD2-CD2 3.67Å; F170-H174 AromaticContact CD2-NE2 3.75Å; F170-H174 AromaticContact CE2-CD2 3.52Å; F170-H174 AromaticContact CE2-NE2 3.4Å; F170-H174 WeakPolarHBondContact CE2-NE2 3.28Å; F170-H174 AromaticContact CZ-CD2 3.86Å; F170-H174 PolarHBondContact O-CD2 3.13Å; F170-H174 VanDerWaalsContact O-CD2 3.23Å; F170-H174 PolarHBondContact O-N 2.99Å; F170-H174 VanDerWaalsContact O-N 3.12Å
171	A	93.2	Very high	91.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-38	176.8	0	0	0	0	0	112.6	I167 R168 H174 S175 C176 L179 L180	I167-A171 WeakPolarHBondContact O-CB 3.5Å; I167-A171 PolarHBondContact O-N 3.22Å; R168-A171 PolarHBondContact O-N 2.64Å; A171-H174 CarbonylContact O-C 3.54Å; A171-S175 PolarHBondContact O-N 3.16Å; A171-S175 VanDerWaalsContact O-N 3.09Å; A171-C176 HydrophobicContact CB-CB 4.24Å; A171-C176 PolarHBondContact O-N 3.44Å; A171-L179 HydrophobicContact CB-CB 3.96Å; A171-L179 HydrophobicContact CB-CD2 3.77Å; A171-L179 HydrophobicContact CB-CG 3.73Å; A171-L180 HydrophobicContact CB-CB 3.93Å
172	D	91.7	Very high	91.6	Very high	81 Å²	81	52.6 Å²	52.6	43%	0.433	28%	0.279	S	S	.	.	H	α-helix	trans	-65.8	-48.3	176.3	-167.5	42.6	0	0	0	111.4	R168 A169 F170 H174 S175 L180	R168-D172 PolarHBondContact O-N 2.96Å; A169-D172 PolarHBondContact O-N 3.01Å; F170-D172 VanDerWaalsContact C-N 3.33Å; F170-D172 PolarHBondContact O-N 2.88Å; D172-H174 VanDerWaalsContact C-N 3.25Å; D172-H174 PolarHBondContact O-N 3.38Å; D172-S175 PolarHBondContact O-N 3.02Å; D172-L180 HydrophobicContact CB-CD1 4.07Å; D172-L180 HydrophobicContact CB-CD2 4.28Å
173	T	89.7	Confident	91.6	Very high	105 Å²	105	49.3 Å²	49.3	64%	0.644	26%	0.256	S	S	*	.	H	α-helix	trans	-55.7	-39.3	177.6	-56.6	0	0	0	0	112.3	A169 F170	A169-T173 WeakPolarHBondContact O-CB 3.45Å; A169-T173 PolarHBondContact O-N 3.09Å; A169-T173 PolarHBondContact O-OG1 3.49Å; F170-T173 PolarHBondContact O-N 2.56Å
174	H	87.7	Confident	91.4	Very high	48 Å²	48	48.6 Å²	48.6	22%	0.222	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	15.1	179.8	-60.5	-59.2	0	0	0	113.8	P137 F170 A171 D172 C176	P137-H174 WeakPolarHBondContact CG-NE2 3.3Å; F170-H174 AromaticContact CD2-CD2 3.67Å; F170-H174 AromaticContact CD2-NE2 3.75Å; F170-H174 AromaticContact CE2-CD2 3.52Å; F170-H174 AromaticContact CE2-NE2 3.4Å; F170-H174 WeakPolarHBondContact CE2-NE2 3.28Å; F170-H174 AromaticContact CZ-CD2 3.86Å; F170-H174 PolarHBondContact O-CD2 3.13Å; F170-H174 VanDerWaalsContact O-CD2 3.23Å; F170-H174 PolarHBondContact O-N 2.99Å; F170-H174 VanDerWaalsContact O-N 3.12Å; A171-H174 CarbonylContact O-C 3.54Å; D172-H174 VanDerWaalsContact C-N 3.25Å; D172-H174 PolarHBondContact O-N 3.38Å; H174-C176 PolarHBondContact O-N 3.03Å; H174-C176 PolarHBondContact O-SG 2.92Å
175	S	87.3	Confident	91.1	Very high	97 Å²	97	55.5 Å²	55.5	68%	0.678	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	27.5	177.4	-64.5	0	0	0	0	114.8	A171 D172 R177	A171-S175 PolarHBondContact O-N 3.16Å; A171-S175 VanDerWaalsContact O-N 3.09Å; D172-S175 PolarHBondContact O-N 3.02Å; S175-R177 VanDerWaalsContact C-N 3.31Å; S175-R177 PolarHBondContact O-N 2.82Å
176	C	90.1	Very high	90.8	Very high	14 Å²	14	57.8 Å²	57.8	10%	0.095	29%	0.288	C	S	.	.			trans	-80.1	75.3	178.7	-67.1	0	0	0	0	110.2	C152 A171 H174 D178 L179 L180	C152-C176 VanDerWaalsContact SG-SG 3.69Å; A171-C176 HydrophobicContact CB-CB 4.24Å; A171-C176 PolarHBondContact O-N 3.44Å; H174-C176 PolarHBondContact O-N 3.03Å; H174-C176 PolarHBondContact O-SG 2.92Å; C176-D178 VanDerWaalsContact C-N 3.27Å; C176-D178 PolarHBondContact O-N 2.89Å; C176-D178 VanDerWaalsContact O-N 3.16Å; C176-L179 HydrophobicContact CB-CB 4.17Å; C176-L179 PolarHBondContact O-N 3.47Å; C176-L179 VanDerWaalsContact O-N 3.16Å; C176-L180 WeakPolarHBondContact O-CB 3.18Å; C176-L180 PolarHBondContact O-N 2.86Å
177	R	90.7	Very high	90.8	Very high	203 Å²	203	56.4 Å²	56.4	77%	0.766	27%	0.273	S	S	*	.	H	α-helix	trans	-54.6	-37.9	-170.6	-65.5	-176.8	178.6	-177.4	-0.8	114.3	S175 R181	S175-R177 VanDerWaalsContact C-N 3.31Å; S175-R177 PolarHBondContact O-N 2.82Å; R177-R181 VanDerWaalsContact O-CB 3.29Å; R177-R181 WeakPolarHBondContact O-CB 3.38Å; R177-R181 PolarHBondContact O-N 2.84Å
178	D	89	Confident	90.5	Very high	87 Å²	87	57.2 Å²	57.2	47%	0.465	28%	0.277	S	S	.	.	H	α-helix	trans	-71.4	-43.6	-178.6	-76.3	-6.8	0	0	0	112.2	C176 R181 I182	C176-D178 VanDerWaalsContact C-N 3.27Å; C176-D178 PolarHBondContact O-N 2.89Å; C176-D178 VanDerWaalsContact O-N 3.16Å; D178-R181 PolarHBondContact O-N 3.22Å; D178-R181 IonicContact OD1-CZ 2.72Å; D178-R181 IonicContact OD1-NH2 2.79Å; D178-R181 PolarHBondContact OD1-NH2 3.49Å; D178-I182 WeakPolarHBondContact O-CG1 3.35Å; D178-I182 PolarHBondContact O-N 3.45Å; D178-I182 VanDerWaalsContact O-N 3.13Å
179	L	91.8	Very high	89.9	Confident	1 Å²	1	61 Å²	61	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-45.2	174.3	-179.9	62.7	0	0	0	110.6	C152 L155 K156 I167 A171 C176 R181 I182 A183	C152-L179 HydrophobicContact CB-CB 4.42Å; L155-L179 HydrophobicContact CB-CD1 3.93Å; L155-L179 HydrophobicContact CB-CD2 3.97Å; L155-L179 HydrophobicContact CD1-CD2 3.65Å; L155-L179 HydrophobicContact CG-CD2 4.47Å; K156-L179 HydrophobicContact CG-CD1 3.73Å; I167-L179 HydrophobicContact CG2-CD1 3.89Å; I167-L179 HydrophobicContact CG2-CD2 4.11Å; I167-L179 HydrophobicContact CG2-CG 4.09Å; A171-L179 HydrophobicContact CB-CB 3.96Å; A171-L179 HydrophobicContact CB-CD2 3.77Å; A171-L179 HydrophobicContact CB-CG 3.73Å; C176-L179 HydrophobicContact CB-CB 4.17Å; C176-L179 PolarHBondContact O-N 3.47Å; C176-L179 VanDerWaalsContact O-N 3.16Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 2.9Å; L179-I182 PolarHBondContact O-N 3.2Å; L179-A183 WeakPolarHBondContact O-CB 3.49Å; L179-A183 PolarHBondContact O-N 3.43Å
180	L	93.2	Very high	89.6	Confident	29 Å²	29	61.3 Å²	61.3	15%	0.152	29%	0.293	C	S	.	.	H	α-helix	trans	-57.3	-45.7	177.6	178.5	61	0	0	0	111.8	R168 A171 D172 C176 I182 A183 N184	R168-L180 HydrophobicContact CG-CD1 3.7Å; R168-L180 WeakPolarHBondContact O-CD1 3.46Å; A171-L180 HydrophobicContact CB-CB 3.93Å; D172-L180 HydrophobicContact CB-CD1 4.07Å; D172-L180 HydrophobicContact CB-CD2 4.28Å; C176-L180 WeakPolarHBondContact O-CB 3.18Å; C176-L180 PolarHBondContact O-N 2.86Å; L180-I182 PolarHBondContact O-N 3.35Å; L180-A183 PolarHBondContact O-N 2.91Å; L180-N184 VanDerWaalsContact O-CB 3.28Å; L180-N184 WeakPolarHBondContact O-CB 3.44Å; L180-N184 PolarHBondContact O-N 2.55Å; L180-N184 PolarHBondContact O-ND2 3.47Å
181	R	90.1	Very high	89.6	Confident	146 Å²	146	59.5 Å²	59.5	55%	0.551	29%	0.285	S	S	*	.	H	α-helix	trans	-63.1	-40.7	178.1	174.5	171.4	47.6	157.7	-2.9	112.6	R177 D178 L179 R185	R177-R181 VanDerWaalsContact O-CB 3.29Å; R177-R181 WeakPolarHBondContact O-CB 3.38Å; R177-R181 PolarHBondContact O-N 2.84Å; D178-R181 PolarHBondContact O-N 3.22Å; D178-R181 IonicContact OD1-CZ 2.72Å; D178-R181 IonicContact OD1-NH2 2.79Å; D178-R181 PolarHBondContact OD1-NH2 3.49Å; L179-R181 VanDerWaalsContact C-N 3.34Å; L179-R181 PolarHBondContact O-N 2.9Å; R181-R185 PolarHBondContact O-N 2.83Å; R181-R185 VanDerWaalsContact O-N 3.17Å
182	I	89.7	Confident	89.4	Confident	65 Å²	65	61.3 Å²	61.3	33%	0.333	29%	0.293	S	S	.	.	H	α-helix	trans	-70.9	-45.1	178.7	-67.4	168.5	0	0	0	110.3	K156 L159 D178 L179 L180 N184 R185 F186	K156-I182 HydrophobicContact CD-CD1 3.55Å; K156-I182 HydrophobicContact CG-CD1 3.9Å; L159-I182 HydrophobicContact CD1-CG2 3.65Å; D178-I182 WeakPolarHBondContact O-CG1 3.35Å; D178-I182 PolarHBondContact O-N 3.45Å; D178-I182 VanDerWaalsContact O-N 3.13Å; L179-I182 PolarHBondContact O-N 3.2Å; L180-I182 PolarHBondContact O-N 3.35Å; I182-N184 PolarHBondContact O-N 2.84Å; I182-R185 PolarHBondContact O-N 2.93Å; I182-F186 WeakPolarHBondContact O-CB 3.48Å; I182-F186 PolarHBondContact O-N 3.34Å
183	A	92.4	Very high	89.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-45.5	175.9	0	0	0	0	0	111.2	L159 R168 L179 L180 R185 F186 T187	L159-A183 HydrophobicContact CD2-CB 4.17Å; R168-A183 HydrophobicContact CB-CB 3.86Å; R168-A183 HydrophobicContact CG-CB 4.38Å; L179-A183 WeakPolarHBondContact O-CB 3.49Å; L179-A183 PolarHBondContact O-N 3.43Å; L180-A183 PolarHBondContact O-N 2.91Å; A183-R185 VanDerWaalsContact C-N 3.35Å; A183-R185 PolarHBondContact O-N 3.06Å; A183-F186 WeakPolarHBondContact O-CB 3.32Å; A183-F186 PolarHBondContact O-N 3.36Å; A183-F186 VanDerWaalsContact O-N 3.13Å; A183-T187 PolarHBondContact O-N 3.44Å; A183-T187 PolarHBondContact O-OG1 3.14Å; A183-T187 VanDerWaalsContact O-OG1 3.06Å
184	N	90.4	Very high	89.5	Confident	30 Å²	30	57.8 Å²	57.8	16%	0.16	27%	0.267	C	S	.	.	H	α-helix	trans	-53.7	-48.9	173.5	-90.5	-34.1	0	0	0	112.5	R168 L180 I182 F186 T187 Q188	R168-N184 PolarHBondContact NE-OD1 3.13Å; R168-N184 PolarHBondContact NH2-OD1 3.48Å; L180-N184 VanDerWaalsContact O-CB 3.28Å; L180-N184 WeakPolarHBondContact O-CB 3.44Å; L180-N184 PolarHBondContact O-N 2.55Å; L180-N184 PolarHBondContact O-ND2 3.47Å; I182-N184 PolarHBondContact O-N 2.84Å; N184-F186 VanDerWaalsContact C-N 3.32Å; N184-F186 PolarHBondContact O-N 3.25Å; N184-T187 PolarHBondContact O-N 3.26Å; N184-Q188 WeakPolarHBondContact O-CB 3.3Å; N184-Q188 WeakPolarHBondContact O-CG 3.26Å; N184-Q188 PolarHBondContact O-N 3.02Å
185	R	86.8	Confident	89.7	Confident	146 Å²	146	56.9 Å²	56.9	55%	0.551	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-39.6	179	-173.4	-177.6	-68.5	168.5	-2.2	111.4	R181 I182 A183 Q188 H189	R181-R185 PolarHBondContact O-N 2.83Å; R181-R185 VanDerWaalsContact O-N 3.17Å; I182-R185 PolarHBondContact O-N 2.93Å; A183-R185 VanDerWaalsContact C-N 3.35Å; A183-R185 PolarHBondContact O-N 3.06Å; R185-Q188 PolarHBondContact O-N 3.17Å; R185-H189 VanDerWaalsContact O-CB 3.3Å; R185-H189 WeakPolarHBondContact O-CB 3.39Å; R185-H189 PolarHBondContact O-N 2.81Å
186	F	89.1	Confident	90	Very high	51 Å²	51	59.7 Å²	59.7	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-49	178.1	-172.4	-83.9	0	0	0	111.4	L159 P161 C164 I182 A183 N184 Q188 H189 N190	L159-F186 HydrophobicContact CB-CD1 4.47Å; L159-F186 HydrophobicContact CB-CD2 4.11Å; L159-F186 HydrophobicContact CB-CE2 4.14Å; L159-F186 HydrophobicContact CB-CG 4.26Å; L159-F186 HydrophobicContact CB-CZ 4.34Å; L159-F186 HydrophobicContact CD1-CB 4.36Å; L159-F186 HydrophobicContact CD1-CG 4.5Å; L159-F186 WeakPolarHBondContact O-CZ 3.37Å; P161-F186 HydrophobicContact CG-CE1 4.23Å; P161-F186 HydrophobicContact CG-CZ 4.37Å; C164-F186 HydrophobicContact CB-CD1 3.66Å; C164-F186 HydrophobicContact CB-CE1 4.02Å; I182-F186 WeakPolarHBondContact O-CB 3.48Å; I182-F186 PolarHBondContact O-N 3.34Å; A183-F186 WeakPolarHBondContact O-CB 3.32Å; A183-F186 PolarHBondContact O-N 3.36Å; A183-F186 VanDerWaalsContact O-N 3.13Å; N184-F186 VanDerWaalsContact C-N 3.32Å; N184-F186 PolarHBondContact O-N 3.25Å; F186-Q188 VanDerWaalsContact C-N 3.33Å; F186-Q188 PolarHBondContact O-N 3.25Å; F186-H189 PolarHBondContact O-N 3.43Å; F186-N190 HydrophobicContact CE1-CB 4.38Å; F186-N190 VanDerWaalsContact CE1-ND2 3.3Å; F186-N190 WeakPolarHBondContact CE1-ND2 3.5Å; F186-N190 VanDerWaalsContact CE2-ND2 3.32Å; F186-N190 WeakPolarHBondContact CE2-ND2 3.5Å; F186-N190 WeakPolarHBondContact CZ-ND2 3.39Å; F186-N190 PolarHBondContact O-N 3.26Å; F186-N190 PolarHBondContact O-ND2 3.29Å
187	T	92.1	Very high	90.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.2	-45.2	175	-59.2	0	0	0	0	111.4	C164 L165 A183 N184 H189 F191 V194 I211	C164-T187 PolarHBondContact SG-OG1 3.08Å; L165-T187 HydrophobicContact CD2-CG2 3.56Å; A183-T187 PolarHBondContact O-N 3.44Å; A183-T187 PolarHBondContact O-OG1 3.14Å; A183-T187 VanDerWaalsContact O-OG1 3.06Å; N184-T187 PolarHBondContact O-N 3.26Å; T187-H189 VanDerWaalsContact C-N 3.33Å; T187-H189 PolarHBondContact O-N 2.89Å; T187-F191 VanDerWaalsContact O-CA 3.29Å; T187-F191 WeakPolarHBondContact O-CA 3.35Å; T187-F191 WeakPolarHBondContact O-CB 3.19Å; T187-F191 PolarHBondContact O-N 2.7Å; T187-V194 HydrophobicContact CG2-CG1 4.38Å; T187-I211 HydrophobicContact CG2-CD1 4.27Å; T187-I211 HydrophobicContact CG2-CG1 4.46Å; T187-I211 HydrophobicContact CG2-CG2 4.19Å
188	Q	87.5	Confident	90.2	Very high	33 Å²	33	57.5 Å²	57.5	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-40.7	178	-73.5	166.5	0.7	0	0	111.9	N184 R185 F186 S214 L217 N218	N184-Q188 WeakPolarHBondContact O-CB 3.3Å; N184-Q188 WeakPolarHBondContact O-CG 3.26Å; N184-Q188 PolarHBondContact O-N 3.02Å; R185-Q188 PolarHBondContact O-N 3.17Å; F186-Q188 VanDerWaalsContact C-N 3.33Å; F186-Q188 PolarHBondContact O-N 3.25Å; Q188-S214 PolarHBondContact NE2-OG 3.03Å; Q188-L217 HydrophobicContact CG-CD1 4.45Å; Q188-N218 WeakPolarHBondContact O-CB 3.41Å; Q188-N218 PolarHBondContact O-N 2.65Å
189	H	82.8	Confident	90.4	Very high	82 Å²	82	56.2 Å²	56.2	38%	0.38	26%	0.255	S	S	.	.	H	α-helix	trans	-71	-38.7	-179.2	-168.1	62.8	0	0	0	113.1	R185 F186 T187 N218	R185-H189 VanDerWaalsContact O-CB 3.3Å; R185-H189 WeakPolarHBondContact O-CB 3.39Å; R185-H189 PolarHBondContact O-N 2.81Å; F186-H189 PolarHBondContact O-N 3.43Å; T187-H189 VanDerWaalsContact C-N 3.33Å; T187-H189 PolarHBondContact O-N 2.89Å; H189-N218 VanDerWaalsContact O-CB 3.31Å; H189-N218 WeakPolarHBondContact O-CB 3.48Å; H189-N218 PolarHBondContact O-ND2 2.95Å
190	N	85.9	Confident	90.6	Very high	31 Å²	31	56.2 Å²	56.2	17%	0.166	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	19.8	-175.7	-60.4	-47.6	0	0	0	112.9	P161 F186 Q192 E193 V194	P161-N190 HydrophobicContact CG-CB 4.29Å; F186-N190 HydrophobicContact CE1-CB 4.38Å; F186-N190 VanDerWaalsContact CE1-ND2 3.3Å; F186-N190 WeakPolarHBondContact CE1-ND2 3.5Å; F186-N190 VanDerWaalsContact CE2-ND2 3.32Å; F186-N190 WeakPolarHBondContact CE2-ND2 3.5Å; F186-N190 WeakPolarHBondContact CZ-ND2 3.39Å; F186-N190 PolarHBondContact O-N 3.26Å; F186-N190 PolarHBondContact O-ND2 3.29Å; N190-Q192 PolarHBondContact O-N 2.93Å; N190-E193 PolarHBondContact O-N 3.17Å; N190-V194 HydrophobicContact CB-CG2 4.46Å; N190-V194 WeakPolarHBondContact O-CG2 3.4Å; N190-V194 PolarHBondContact O-N 3.36Å; N190-V194 VanDerWaalsContact O-N 3.09Å
191	F	91.1	Very high	90.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-31.7	-171.3	-174.4	-101.4	0	0	0	114.4	T187 E193 V194 M195 F200 I211 I212 L217 V219 A228	T187-F191 VanDerWaalsContact O-CA 3.29Å; T187-F191 WeakPolarHBondContact O-CA 3.35Å; T187-F191 WeakPolarHBondContact O-CB 3.19Å; T187-F191 PolarHBondContact O-N 2.7Å; F191-E193 VanDerWaalsContact C-N 3.28Å; F191-E193 PolarHBondContact O-N 2.99Å; F191-V194 PolarHBondContact O-N 2.7Å; F191-M195 HydrophobicContact CE1-CB 4.4Å; F191-M195 WeakPolarHBondContact O-CB 3.3Å; F191-M195 PolarHBondContact O-N 2.86Å; F191-F200 HydrophobicContact CE2-CD2 4.41Å; F191-F200 AromaticContact CE2-CE2 3.73Å; F191-F200 HydrophobicContact CE2-CE2 3.73Å; F191-F200 HydrophobicContact CE2-CZ 4.48Å; F191-F200 AromaticContact CZ-CE2 3.94Å; F191-F200 HydrophobicContact CZ-CE2 3.94Å; F191-F200 HydrophobicContact CZ-CZ 4.23Å; F191-I211 HydrophobicContact CD2-CG2 3.9Å; F191-I211 HydrophobicContact CE2-CG2 3.67Å; F191-I212 HydrophobicContact CZ-CG2 4.25Å; F191-L217 HydrophobicContact CB-CD1 3.92Å; F191-L217 HydrophobicContact CB-CG 4.15Å; F191-L217 HydrophobicContact CD1-CD1 4.15Å; F191-L217 HydrophobicContact CD1-CD2 3.86Å; F191-L217 HydrophobicContact CD1-CG 3.91Å; F191-L217 HydrophobicContact CD2-CD1 3.49Å; F191-L217 VanDerWaalsContact CD2-CD1 3.49Å; F191-L217 HydrophobicContact CD2-CD2 4.41Å; F191-L217 HydrophobicContact CD2-CG 4.18Å; F191-L217 HydrophobicContact CE1-CD2 3.78Å; F191-L217 HydrophobicContact CE1-CG 4.33Å; F191-L217 HydrophobicContact CE2-CD1 3.96Å; F191-L217 HydrophobicContact CE2-CD2 4.34Å; F191-L217 HydrophobicContact CG-CD1 3.56Å; F191-L217 HydrophobicContact CG-CD2 4.16Å; F191-L217 HydrophobicContact CG-CG 3.8Å; F191-L217 HydrophobicContact CZ-CD1 4.47Å; F191-L217 HydrophobicContact CZ-CD2 4.02Å; F191-V219 HydrophobicContact CD1-CG1 3.4Å; F191-V219 VanDerWaalsContact CD1-CG1 3.4Å; F191-V219 HydrophobicContact CE1-CG1 3.89Å; F191-V219 HydrophobicContact CG-CG1 4.44Å; F191-A228 HydrophobicContact CZ-CB 4.47Å
192	Q	87.4	Confident	90.8	Very high	38 Å²	38	53.7 Å²	53.7	18%	0.178	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-34	177	-73	172.1	60.8	0	0	113.2	N190 M195 N218	N190-Q192 PolarHBondContact O-N 2.93Å; Q192-M195 WeakPolarHBondContact O-CE 3.26Å; Q192-M195 VanDerWaalsContact O-CG 3.31Å; Q192-M195 WeakPolarHBondContact O-CG 3.47Å; Q192-N218 PolarHBondContact NE2-O 2.96Å
193	E	90.2	Very high	91	Very high	113 Å²	113	51 Å²	51	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-84.5	-41.5	175.4	-67.2	173	-123.2	0	0	109.9	P161 N190 F191 M195 E196	P161-E193 HydrophobicContact CB-CB 3.82Å; P161-E193 HydrophobicContact CG-CB 4.23Å; N190-E193 PolarHBondContact O-N 3.17Å; F191-E193 VanDerWaalsContact C-N 3.28Å; F191-E193 PolarHBondContact O-N 2.99Å; E193-M195 VanDerWaalsContact C-N 3.29Å; E193-M195 PolarHBondContact O-N 2.82Å; E193-E196 PolarHBondContact O-N 2.96Å; E193-E196 VanDerWaalsContact O-N 3.12Å
194	V	93.9	Very high	91.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-38.9	-179.8	-179.9	0	0	0	0	111.9	P161 C164 L165 T187 N190 F191 E196 T197 F200	P161-V194 HydrophobicContact CB-CG2 4.2Å; C164-V194 VanDerWaalsContact SG-CG2 3.59Å; L165-V194 HydrophobicContact CD1-CG1 3.48Å; L165-V194 VanDerWaalsContact CD1-CG1 3.48Å; L165-V194 HydrophobicContact CD2-CG1 4.14Å; L165-V194 HydrophobicContact CG-CG1 3.75Å; T187-V194 HydrophobicContact CG2-CG1 4.38Å; N190-V194 HydrophobicContact CB-CG2 4.46Å; N190-V194 WeakPolarHBondContact O-CG2 3.4Å; N190-V194 PolarHBondContact O-N 3.36Å; N190-V194 VanDerWaalsContact O-N 3.09Å; F191-V194 PolarHBondContact O-N 2.7Å; V194-E196 PolarHBondContact O-N 3.49Å; V194-E196 VanDerWaalsContact O-N 3.1Å; V194-T197 WeakPolarHBondContact O-CB 3.4Å; V194-T197 WeakPolarHBondContact O-CG2 3.19Å; V194-T197 PolarHBondContact O-N 2.96Å; V194-T197 PolarHBondContact O-OG1 3.4Å; V194-F200 HydrophobicContact CG1-CB 4.47Å; V194-F200 HydrophobicContact CG1-CD2 4.48Å; V194-F200 WeakPolarHBondContact O-CB 3.42Å
195	M	93.1	Very high	91.4	Very high	29 Å²	29	54.4 Å²	54.4	14%	0.143	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.7	-178.7	69.2	175.3	-170.1	0	0	114.2	F191 Q192 E193 F200 A228	F191-M195 HydrophobicContact CE1-CB 4.4Å; F191-M195 WeakPolarHBondContact O-CB 3.3Å; F191-M195 PolarHBondContact O-N 2.86Å; Q192-M195 WeakPolarHBondContact O-CE 3.26Å; Q192-M195 VanDerWaalsContact O-CG 3.31Å; Q192-M195 WeakPolarHBondContact O-CG 3.47Å; E193-M195 VanDerWaalsContact C-N 3.29Å; E193-M195 PolarHBondContact O-N 2.82Å; M195-F200 HydrophobicContact CB-CD1 4.5Å; M195-F200 HydrophobicContact CB-CE1 4.46Å; M195-A228 HydrophobicContact CB-CB 3.95Å; M195-A228 HydrophobicContact SD-CB 4.2Å
196	E	91.7	Very high	91.7	Very high	155 Å²	155	53.5 Å²	53.5	72%	0.724	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-7.3	178.4	-58.8	-174.1	170.8	0	0	112.5	E193 V194	E193-E196 PolarHBondContact O-N 2.96Å; E193-E196 VanDerWaalsContact O-N 3.12Å; V194-E196 PolarHBondContact O-N 3.49Å; V194-E196 VanDerWaalsContact O-N 3.1Å
197	T	93.8	Very high	91.9	Very high	23 Å²	23	52.9 Å²	52.9	14%	0.141	27%	0.265	C	S	.	.	S	Bend	trans	-83.2	157.2	-175.6	68.9	0	0	0	0	112.8	V194 F200 M201	V194-T197 WeakPolarHBondContact O-CB 3.4Å; V194-T197 WeakPolarHBondContact O-CG2 3.19Å; V194-T197 PolarHBondContact O-N 2.96Å; V194-T197 PolarHBondContact O-OG1 3.4Å; T197-F200 PolarHBondContact O-N 2.84Å; T197-F200 PolarHBondContact OG1-N 2.86Å; T197-M201 PolarHBondContact O-N 2.79Å
198	E	93	Very high	92.1	Very high	149 Å²	149	52.9 Å²	52.9	70%	0.696	27%	0.265	S	S	*	.	H	α-helix	trans	-65.5	-39	173.8	-172.1	176.5	-177.9	0	0	112	F200 M201 L202	E198-F200 PolarHBondContact O-N 3.49Å; E198-M201 WeakPolarHBondContact O-CB 3.48Å; E198-M201 PolarHBondContact O-N 3.42Å; E198-L202 HydrophobicContact CG-CD1 4.04Å; E198-L202 HydrophobicContact CG-CG 4.4Å; E198-L202 WeakPolarHBondContact O-CG 3.24Å; E198-L202 PolarHBondContact O-N 2.94Å; E198-L202 VanDerWaalsContact O-N 3.08Å
199	E	92.6	Very high	92.4	Very high	59 Å²	59	51.9 Å²	51.9	28%	0.276	26%	0.262	S	S	.	.	H	α-helix	trans	-57.2	-38.8	178.2	-68.4	-161.3	155.4	0	0	111.8	S162 N163 L165 G166 L202 L203	S162-E199 WeakPolarHBondContact O-CG 3.25Å; N163-E199 WeakPolarHBondContact CA-OE2 3.49Å; L165-E199 HydrophobicContact CB-CB 4.06Å; L165-E199 WeakPolarHBondContact CB-OE2 3.32Å; L165-E199 HydrophobicContact CD1-CB 4.04Å; L165-E199 PolarHBondContact N-OE2 2.87Å; G166-E199 PolarHBondContact N-OE2 3.28Å; E199-L202 PolarHBondContact O-N 3.1Å; E199-L203 PolarHBondContact O-N 2.82Å
200	F	95.3	Very high	92.9	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-44.5	175.5	-178.8	-95.3	0	0	0	111.8	L165 F191 V194 M195 T197 E198 L202 L203 L208 A228 W232	L165-F200 VanDerWaalsContact CD1-CA 3.47Å; L165-F200 HydrophobicContact CD1-CB 3.85Å; L165-F200 HydrophobicContact CD1-CD2 4.31Å; F191-F200 HydrophobicContact CE2-CD2 4.41Å; F191-F200 AromaticContact CE2-CE2 3.73Å; F191-F200 HydrophobicContact CE2-CE2 3.73Å; F191-F200 HydrophobicContact CE2-CZ 4.48Å; F191-F200 AromaticContact CZ-CE2 3.94Å; F191-F200 HydrophobicContact CZ-CE2 3.94Å; F191-F200 HydrophobicContact CZ-CZ 4.23Å; V194-F200 HydrophobicContact CG1-CB 4.47Å; V194-F200 HydrophobicContact CG1-CD2 4.48Å; V194-F200 WeakPolarHBondContact O-CB 3.42Å; M195-F200 HydrophobicContact CB-CD1 4.5Å; M195-F200 HydrophobicContact CB-CE1 4.46Å; T197-F200 PolarHBondContact O-N 2.84Å; T197-F200 PolarHBondContact OG1-N 2.86Å; E198-F200 PolarHBondContact O-N 3.49Å; F200-L202 PolarHBondContact O-N 2.82Å; F200-L203 HydrophobicContact CD2-CD1 3.81Å; F200-L203 HydrophobicContact CE2-CD1 4.24Å; F200-L203 HydrophobicContact CG-CD1 4.47Å; F200-L203 WeakPolarHBondContact O-CB 3.32Å; F200-L203 PolarHBondContact O-N 3.24Å; F200-L208 HydrophobicContact CE2-CD1 3.58Å; F200-L208 HydrophobicContact CZ-CD1 3.55Å; F200-A228 HydrophobicContact CE1-CB 4.01Å; F200-A228 HydrophobicContact CZ-CB 3.92Å; F200-W232 HydrophobicContact CE1-CB 4.22Å; F200-W232 VanDerWaalsContact O-CD1 3.25Å
201	M	93.9	Very high	93.2	Very high	37 Å²	37	51.3 Å²	51.3	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-26.3	178.9	-61.9	-60.8	171.4	0	0	112.6	T197 E198 A231 H235 R240	T197-M201 PolarHBondContact O-N 2.79Å; E198-M201 WeakPolarHBondContact O-CB 3.48Å; E198-M201 PolarHBondContact O-N 3.42Å; M201-A231 HydrophobicContact CE-CB 3.84Å; M201-A231 HydrophobicContact SD-CB 4.34Å; M201-H235 HydrophobicContact SD-CB 4.43Å; M201-R240 VanDerWaalsContact O-CZ 3.26Å; M201-R240 PolarHBondContact O-NH1 3.47Å; M201-R240 PolarHBondContact O-NH2 3.27Å
202	L	94.3	Very high	93.4	Very high	86 Å²	86	51.3 Å²	51.3	45%	0.45	26%	0.258	S	S	.	.	H	α-helix	trans	-89	-6.3	179.6	-65.6	176.9	0	0	0	114.3	E198 E199 F200	E198-L202 HydrophobicContact CG-CD1 4.04Å; E198-L202 HydrophobicContact CG-CG 4.4Å; E198-L202 WeakPolarHBondContact O-CG 3.24Å; E198-L202 PolarHBondContact O-N 2.94Å; E198-L202 VanDerWaalsContact O-N 3.08Å; E199-L202 PolarHBondContact O-N 3.1Å; F200-L202 PolarHBondContact O-N 2.82Å
203	L	94.4	Very high	93.6	Very high	7 Å²	7	51.9 Å²	51.9	4%	0.037	27%	0.267	C	S	.	.			trans	-54.8	140.8	-179.1	-77.3	174.1	0	0	0	113.1	L165 E199 F200 Q207 I211 W232 R240	L165-L203 HydrophobicContact CB-CD2 4.33Å; L165-L203 HydrophobicContact CD1-CD1 3.83Å; L165-L203 HydrophobicContact CD1-CD2 4.25Å; L165-L203 HydrophobicContact CD1-CG 4.07Å; L165-L203 HydrophobicContact CD2-CD1 4.29Å; L165-L203 HydrophobicContact CD2-CD2 4.41Å; E199-L203 PolarHBondContact O-N 2.82Å; F200-L203 HydrophobicContact CD2-CD1 3.81Å; F200-L203 HydrophobicContact CE2-CD1 4.24Å; F200-L203 HydrophobicContact CG-CD1 4.47Å; F200-L203 WeakPolarHBondContact O-CB 3.32Å; F200-L203 PolarHBondContact O-N 3.24Å; L203-Q207 HydrophobicContact CD2-CB 4.13Å; L203-I211 HydrophobicContact CD1-CD1 3.77Å; L203-W232 VanDerWaalsContact O-CZ2 3.24Å; L203-W232 WeakPolarHBondContact O-CZ2 3.26Å; L203-W232 PolarHBondContact O-NE1 3.17Å; L203-R240 PolarHBondContact O-NH2 3.01Å; L203-R240 VanDerWaalsContact O-NH2 3.1Å
204	P	94.8	Very high	93.6	Very high	69 Å²	69	47.5 Å²	47.5	45%	0.448	25%	0.248	S	C	.	.			trans	-64.4	154.2	162.5	-19.8	32.8	0	0	0	111.9	D206 Q207 L208	P204-D206 VanDerWaalsContact C-N 3.31Å; P204-D206 PolarHBondContact O-N 3.03Å; P204-Q207 HydrophobicContact CG-CG 4.48Å; P204-Q207 PolarHBondContact O-N 2.9Å; P204-L208 PolarHBondContact O-N 3.5Å
205	V	95.1	Very high	93.1	Very high	33 Å²	33	49.4 Å²	49.4	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-57.1	-42.5	-178.3	63.5	0	0	0	0	112.3	Q207 L208 C209 W232 D243 V247	V205-Q207 PolarHBondContact O-N 2.84Å; V205-L208 PolarHBondContact O-N 3.23Å; V205-C209 WeakPolarHBondContact O-CB 3.31Å; V205-C209 PolarHBondContact O-N 3.28Å; V205-C209 PolarHBondContact O-SG 2.94Å; V205-W232 HydrophobicContact CB-CH2 3.91Å; V205-W232 HydrophobicContact CB-CZ2 4.37Å; V205-W232 HydrophobicContact CG2-CH2 4.24Å; V205-D243 HydrophobicContact CG2-CB 3.94Å; V205-V247 HydrophobicContact CG2-CG2 4.04Å
206	D	94.3	Very high	92.6	Very high	128 Å²	128	50.5 Å²	50.5	68%	0.684	26%	0.263	S	S	*	.	H	α-helix	trans	-64.2	-42.5	-177	-60.1	-41.6	0	0	0	111.8	P204 C209 E210	P204-D206 VanDerWaalsContact C-N 3.31Å; P204-D206 PolarHBondContact O-N 3.03Å; D206-C209 PolarHBondContact O-N 3.09Å; D206-E210 PolarHBondContact O-N 3.35Å
207	Q	92.9	Very high	92.3	Very high	37 Å²	37	43.2 Å²	43.2	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-69.7	-39.4	178.3	-64.4	-166.5	18.3	0	0	111.8	L203 P204 V205 E210 I211	L203-Q207 HydrophobicContact CD2-CB 4.13Å; P204-Q207 HydrophobicContact CG-CG 4.48Å; P204-Q207 PolarHBondContact O-N 2.9Å; V205-Q207 PolarHBondContact O-N 2.84Å; Q207-E210 PolarHBondContact O-N 3.44Å; Q207-I211 WeakPolarHBondContact O-CD1 3.42Å; Q207-I211 VanDerWaalsContact O-CG1 3.31Å; Q207-I211 WeakPolarHBondContact O-CG1 3.15Å; Q207-I211 PolarHBondContact O-N 2.85Å
208	L	95.2	Very high	91.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-50.5	174.1	175.4	63.9	0	0	0	110.3	F200 P204 V205 E210 I211 I212 W232 V247	F200-L208 HydrophobicContact CE2-CD1 3.58Å; F200-L208 HydrophobicContact CZ-CD1 3.55Å; P204-L208 PolarHBondContact O-N 3.5Å; V205-L208 PolarHBondContact O-N 3.23Å; L208-E210 VanDerWaalsContact C-N 3.3Å; L208-E210 PolarHBondContact O-N 2.82Å; L208-I211 PolarHBondContact O-N 3.16Å; L208-I211 VanDerWaalsContact O-N 3.14Å; L208-I212 HydrophobicContact CD1-CG2 3.9Å; L208-I212 HydrophobicContact CG-CD1 4.44Å; L208-I212 WeakPolarHBondContact O-CG1 3.29Å; L208-I212 PolarHBondContact O-N 3.1Å; L208-W232 HydrophobicContact CD2-CB 4.23Å; L208-W232 HydrophobicContact CD2-CD2 3.4Å; L208-W232 VanDerWaalsContact CD2-CD2 3.4Å; L208-W232 HydrophobicContact CD2-CE3 3.66Å; L208-W232 HydrophobicContact CD2-CG 3.66Å; L208-W232 HydrophobicContact CD2-CZ2 4.26Å; L208-W232 HydrophobicContact CD2-CZ3 4.22Å; L208-V247 HydrophobicContact CD2-CG1 3.83Å; L208-V247 HydrophobicContact CD2-CG2 4.06Å; L208-V247 HydrophobicContact CG-CG1 4.49Å
209	C	95.4	Very high	91	Very high	13 Å²	13	36.3 Å²	36.3	9%	0.088	20%	0.196	C	C	.	.	H	α-helix	trans	-56.3	-43	177.4	-75.2	0	0	0	0	111.9	V205 D206 I211 S213 Y250	V205-C209 WeakPolarHBondContact O-CB 3.31Å; V205-C209 PolarHBondContact O-N 3.28Å; V205-C209 PolarHBondContact O-SG 2.94Å; D206-C209 PolarHBondContact O-N 3.09Å; C209-I211 PolarHBondContact O-N 3.34Å; C209-S213 WeakPolarHBondContact O-CB 3.46Å; C209-S213 PolarHBondContact O-N 3.27Å; C209-S213 PolarHBondContact O-OG 2.92Å; C209-S213 VanDerWaalsContact O-OG 3.06Å; C209-Y250 HydrophobicContact CB-CD2 3.99Å; C209-Y250 HydrophobicContact CB-CE2 3.63Å
210	E	92.6	Very high	89.9	Confident	96 Å²	96	41 Å²	41	45%	0.449	21%	0.212	S	C	.	.	H	α-helix	trans	-60.9	-43.7	176.7	-161.5	-170.2	153.8	0	0	111.8	R168 D206 Q207 L208 S213	R168-E210 IonicContact CZ-OE2 3.69Å; R168-E210 IonicContact NH1-OE2 2.84Å; R168-E210 IonicContact NH2-OE1 3.44Å; R168-E210 PolarHBondContact NH2-OE1 2.95Å; R168-E210 IonicContact NH2-OE2 3.13Å; R168-E210 PolarHBondContact NH2-OE2 2.99Å; D206-E210 PolarHBondContact O-N 3.35Å; Q207-E210 PolarHBondContact O-N 3.44Å; L208-E210 VanDerWaalsContact C-N 3.3Å; L208-E210 PolarHBondContact O-N 2.82Å; E210-S213 PolarHBondContact O-OG 2.77Å
211	I	92.8	Very high	89.1	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-65.7	-52.3	178.3	-65.2	162.2	0	0	0	110.9	L165 T187 F191 L203 Q207 L208 C209 S213 S214 L217	L165-I211 HydrophobicContact CD2-CD1 3.58Å; T187-I211 HydrophobicContact CG2-CD1 4.27Å; T187-I211 HydrophobicContact CG2-CG1 4.46Å; T187-I211 HydrophobicContact CG2-CG2 4.19Å; F191-I211 HydrophobicContact CD2-CG2 3.9Å; F191-I211 HydrophobicContact CE2-CG2 3.67Å; L203-I211 HydrophobicContact CD1-CD1 3.77Å; Q207-I211 WeakPolarHBondContact O-CD1 3.42Å; Q207-I211 VanDerWaalsContact O-CG1 3.31Å; Q207-I211 WeakPolarHBondContact O-CG1 3.15Å; Q207-I211 PolarHBondContact O-N 2.85Å; L208-I211 PolarHBondContact O-N 3.16Å; L208-I211 VanDerWaalsContact O-N 3.14Å; C209-I211 PolarHBondContact O-N 3.34Å; I211-S213 VanDerWaalsContact C-N 3.33Å; I211-S213 PolarHBondContact O-N 2.74Å; I211-S214 VanDerWaalsContact O-CB 3.28Å; I211-S214 WeakPolarHBondContact O-CB 3.31Å; I211-S214 PolarHBondContact O-N 3.39Å; I211-L217 HydrophobicContact CG2-CD1 3.79Å
212	I	93.9	Very high	88.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-76.5	-17.7	-174.8	68.6	176.6	0	0	0	113.5	F191 L208 S214 V225 V247 Y250 R305	F191-I212 HydrophobicContact CZ-CG2 4.25Å; L208-I212 HydrophobicContact CD1-CG2 3.9Å; L208-I212 HydrophobicContact CG-CD1 4.44Å; L208-I212 WeakPolarHBondContact O-CG1 3.29Å; L208-I212 PolarHBondContact O-N 3.1Å; I212-S214 PolarHBondContact O-N 3.35Å; I212-V225 HydrophobicContact CB-CG1 4.24Å; I212-V225 HydrophobicContact CG2-CG1 4.16Å; I212-V247 HydrophobicContact CD1-CG1 3.62Å; I212-V247 WeakPolarHBondContact CD1-O 3.2Å; I212-Y250 HydrophobicContact CD1-CD2 4.46Å; I212-Y250 HydrophobicContact CG1-CD2 4.46Å; I212-Y250 HydrophobicContact CG1-CG 4.4Å; I212-R305 PolarHBondContact O-NH1 3.02Å; I212-R305 PolarHBondContact O-NH2 3.12Å
213	S	93.2	Very high	88.6	Confident	51 Å²	51	39.8 Å²	39.8	36%	0.357	21%	0.209	S	C	.	.	H	α-helix	trans	-71.8	-21.9	172.9	69.6	0	0	0	0	112.3	C209 E210 I211 D215	C209-S213 WeakPolarHBondContact O-CB 3.46Å; C209-S213 PolarHBondContact O-N 3.27Å; C209-S213 PolarHBondContact O-OG 2.92Å; C209-S213 VanDerWaalsContact O-OG 3.06Å; E210-S213 PolarHBondContact O-OG 2.77Å; I211-S213 VanDerWaalsContact C-N 3.33Å; I211-S213 PolarHBondContact O-N 2.74Å; S213-D215 PolarHBondContact O-N 2.84Å
214	S	89.6	Confident	88.3	Confident	20 Å²	20	41.2 Å²	41.2	14%	0.14	22%	0.215	C	C	.	.			trans	-61.3	128.4	-176	-174.4	0	0	0	0	112.9	Q188 I211 I212 E216 R305	Q188-S214 PolarHBondContact NE2-OG 3.03Å; I211-S214 VanDerWaalsContact O-CB 3.28Å; I211-S214 WeakPolarHBondContact O-CB 3.31Å; I211-S214 PolarHBondContact O-N 3.39Å; I212-S214 PolarHBondContact O-N 3.35Å; S214-E216 PolarHBondContact O-N 2.85Å; S214-E216 PolarHBondContact OG-N 3.31Å; S214-E216 VanDerWaalsContact OG-N 3.11Å; S214-R305 PolarHBondContact O-NH1 2.91Å
215	D	83.7	Confident	88.2	Confident	40 Å²	40	37.9 Å²	37.9	21%	0.214	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-21.5	167.5	-85.6	-15.7	0	0	0	112.4	S213 R252 R303 R305 K306	S213-D215 PolarHBondContact O-N 2.84Å; D215-R252 IonicContact OD1-CZ 3.28Å; D215-R252 VanDerWaalsContact OD1-CZ 3.24Å; D215-R252 IonicContact OD1-NH1 2.65Å; D215-R252 PolarHBondContact OD1-NH1 3.33Å; D215-R252 IonicContact OD1-NH2 3.8Å; D215-R252 PolarHBondContact OD1-NH2 3.45Å; D215-R303 IonicContact OD1-NE 3.84Å; D215-R303 IonicContact OD2-CZ 2.83Å; D215-R303 IonicContact OD2-NE 2.81Å; D215-R303 PolarHBondContact OD2-NE 3.34Å; D215-R303 VanDerWaalsContact OD2-NE 3.13Å; D215-R303 IonicContact OD2-NH1 3.29Å; D215-R303 IonicContact OD2-NH2 3.38Å; D215-R303 PolarHBondContact OD2-NH2 2.66Å; D215-R305 CarbonylContact O-C 3.38Å; D215-R305 VanDerWaalsContact O-CA 3.28Å; D215-R305 WeakPolarHBondContact O-CA 3.47Å; D215-R305 WeakPolarHBondContact O-CB 3.48Å; D215-K306 PolarHBondContact O-N 2.85Å
216	E	81.4	Confident	88.3	Confident	53 Å²	53	36.5 Å²	36.5	25%	0.248	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	4.1	-170	-59.5	-59.3	146.4	0	0	113.8	S214 N218 I308	S214-E216 PolarHBondContact O-N 2.85Å; S214-E216 PolarHBondContact OG-N 3.31Å; S214-E216 VanDerWaalsContact OG-N 3.11Å; E216-N218 PolarHBondContact O-N 3.05Å; E216-I308 HydrophobicContact CB-CD1 4.31Å; E216-I308 HydrophobicContact CG-CD1 3.98Å; E216-I308 VanDerWaalsContact OE2-CD1 3.27Å; E216-I308 WeakPolarHBondContact OE2-CD1 3.45Å; E216-I308 WeakPolarHBondContact OE2-CG1 3.42Å; E216-I308 PolarHBondContact OE2-N 3.28Å
217	L	86.6	Confident	88.3	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.177	C	C	.	.			trans	-63.9	121.9	-177.6	-157.4	73.4	0	0	0	111.2	Q188 F191 I211 V219 V225	Q188-L217 HydrophobicContact CG-CD1 4.45Å; F191-L217 HydrophobicContact CB-CD1 3.92Å; F191-L217 HydrophobicContact CB-CG 4.15Å; F191-L217 HydrophobicContact CD1-CD1 4.15Å; F191-L217 HydrophobicContact CD1-CD2 3.86Å; F191-L217 HydrophobicContact CD1-CG 3.91Å; F191-L217 HydrophobicContact CD2-CD1 3.49Å; F191-L217 VanDerWaalsContact CD2-CD1 3.49Å; F191-L217 HydrophobicContact CD2-CD2 4.41Å; F191-L217 HydrophobicContact CD2-CG 4.18Å; F191-L217 HydrophobicContact CE1-CD2 3.78Å; F191-L217 HydrophobicContact CE1-CG 4.33Å; F191-L217 HydrophobicContact CE2-CD1 3.96Å; F191-L217 HydrophobicContact CE2-CD2 4.34Å; F191-L217 HydrophobicContact CG-CD1 3.56Å; F191-L217 HydrophobicContact CG-CD2 4.16Å; F191-L217 HydrophobicContact CG-CG 3.8Å; F191-L217 HydrophobicContact CZ-CD1 4.47Å; F191-L217 HydrophobicContact CZ-CD2 4.02Å; I211-L217 HydrophobicContact CG2-CD1 3.79Å; L217-V219 HydrophobicContact CD2-CG1 4.07Å; L217-V219 HydrophobicContact CG-CG1 4.24Å; L217-V219 PolarHBondContact O-N 2.95Å; L217-V219 VanDerWaalsContact O-N 3.11Å; L217-V225 HydrophobicContact CD2-CG2 3.94Å
218	N	78.8	Confident	88.4	Confident	18 Å²	18	34.7 Å²	34.7	10%	0.096	17%	0.171	C	C	.	.			trans	-84.5	84.7	-178.9	-174.8	21.4	0	0	0	111.8	Q188 H189 Q192 E216 P307	Q188-N218 WeakPolarHBondContact O-CB 3.41Å; Q188-N218 PolarHBondContact O-N 2.65Å; H189-N218 VanDerWaalsContact O-CB 3.31Å; H189-N218 WeakPolarHBondContact O-CB 3.48Å; H189-N218 PolarHBondContact O-ND2 2.95Å; Q192-N218 PolarHBondContact NE2-O 2.96Å; E216-N218 PolarHBondContact O-N 3.05Å; N218-P307 HydrophobicContact CB-CB 4.38Å
219	V	79.5	Confident	88.4	Confident	9 Å²	9	34.8 Å²	34.8	6%	0.055	17%	0.172	C	C	.	.			trans	-118.9	152.6	174.7	-70.9	0	0	0	0	111.4	F191 L217 V225 N604	F191-V219 HydrophobicContact CD1-CG1 3.4Å; F191-V219 VanDerWaalsContact CD1-CG1 3.4Å; F191-V219 HydrophobicContact CE1-CG1 3.89Å; F191-V219 HydrophobicContact CG-CG1 4.44Å; L217-V219 HydrophobicContact CD2-CG1 4.07Å; L217-V219 HydrophobicContact CG-CG1 4.24Å; L217-V219 PolarHBondContact O-N 2.95Å; L217-V219 VanDerWaalsContact O-N 3.11Å; V219-V225 HydrophobicContact CB-CG2 4.17Å; V219-V225 HydrophobicContact CG1-CG2 3.79Å; V219-V225 HydrophobicContact CG2-CG2 3.78Å; V219-N604 PolarHBondContact O-ND2 3.4Å
220	R	69.9	Low	88.4	Confident	158 Å²	158	34.2 Å²	34.2	60%	0.596	17%	0.168	S	C	*	.	S	Bend	trans	-75.2	-35.9	174	-55.3	-175.3	-170.3	-170.8	2.1	111
221	S	79.3	Confident	88.5	Confident	46 Å²	46	31.3 Å²	31.3	32%	0.322	16%	0.16	S	C	.	.			trans	-152.5	156.6	178.1	66.3	0	0	0	0	111.5	E223 Q224	S221-E223 PolarHBondContact O-N 3.38Å; S221-E223 WeakPolarHBondContact OG-CB 3.5Å; S221-E223 PolarHBondContact OG-N 3.29Å; S221-Q224 WeakPolarHBondContact O-CB 3.27Å; S221-Q224 PolarHBondContact O-N 3.34Å
222	E	88.3	Confident	88.7	Confident	11 Å²	11	31.2 Å²	31.2	5%	0.051	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-19.8	170.1	-70.5	-68	147.5	0	0	112.3	Q224 V225 F226 R252 L255 R305	E222-Q224 PolarHBondContact O-N 3.39Å; E222-V225 PolarHBondContact O-N 2.86Å; E222-F226 WeakPolarHBondContact O-CB 3.07Å; E222-F226 PolarHBondContact O-N 3.14Å; E222-R252 VanDerWaalsContact CD-CB 3.49Å; E222-R252 HydrophobicContact CG-CB 3.78Å; E222-R252 WeakPolarHBondContact OE1-CD 3.29Å; E222-R252 IonicContact OE1-NE 3.77Å; E222-R252 PolarHBondContact OE2-N 3.44Å; E222-L255 HydrophobicContact CG-CB 4.08Å; E222-L255 HydrophobicContact CG-CD1 4.44Å; E222-R305 WeakPolarHBondContact OE1-CD 3.2Å; E222-R305 WeakPolarHBondContact OE1-CG 3.41Å; E222-R305 IonicContact OE1-CZ 3.74Å; E222-R305 IonicContact OE1-NE 3.07Å; E222-R305 PolarHBondContact OE1-NE 2.93Å; E222-R305 IonicContact OE1-NH2 2.7Å; E222-R305 PolarHBondContact OE1-NH2 3.31Å; E222-R305 IonicContact OE2-CZ 3.79Å; E222-R305 IonicContact OE2-NE 3.92Å; E222-R305 IonicContact OE2-NH2 2.99Å; E222-R305 PolarHBondContact OE2-NH2 2.82Å
223	E	88.2	Confident	88.8	Confident	42 Å²	42	31.2 Å²	31.2	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-31.9	172.2	-53.9	-173.4	178.2	0	0	111.6	S221 K227 C256 S257 F260	S221-E223 PolarHBondContact O-N 3.38Å; S221-E223 WeakPolarHBondContact OG-CB 3.5Å; S221-E223 PolarHBondContact OG-N 3.29Å; E223-K227 WeakPolarHBondContact O-CB 3.27Å; E223-K227 WeakPolarHBondContact O-CG 3.38Å; E223-K227 PolarHBondContact O-N 3.06Å; E223-C256 HydrophobicContact CG-CB 4.19Å; E223-S257 WeakPolarHBondContact OE1-CB 3.49Å; E223-S257 PolarHBondContact OE1-N 3.44Å; E223-S257 PolarHBondContact OE1-OG 3.32Å; E223-F260 HydrophobicContact CB-CD1 4.33Å; E223-F260 HydrophobicContact CB-CD2 4.09Å; E223-F260 HydrophobicContact CB-CE1 4.08Å; E223-F260 HydrophobicContact CB-CE2 3.84Å; E223-F260 HydrophobicContact CB-CG 4.32Å; E223-F260 HydrophobicContact CB-CZ 3.81Å; E223-F260 VanDerWaalsContact CD-CD2 3.5Å; E223-F260 VanDerWaalsContact CD-CG 3.45Å; E223-F260 HydrophobicContact CG-CB 4.22Å; E223-F260 HydrophobicContact CG-CD1 3.78Å; E223-F260 HydrophobicContact CG-CD2 3.88Å; E223-F260 HydrophobicContact CG-CE1 4.01Å; E223-F260 HydrophobicContact CG-CE2 4.13Å; E223-F260 HydrophobicContact CG-CG 3.69Å; E223-F260 HydrophobicContact CG-CZ 4.17Å; E223-F260 WeakPolarHBondContact OE1-CB 3.31Å; E223-F260 WeakPolarHBondContact OE2-CD2 3.39Å
224	Q	88.8	Confident	88.8	Confident	36 Å²	36	35 Å²	35	17%	0.168	17%	0.166	C	C	.	.	H	α-helix	trans	-69.3	-43.7	172.8	-67.4	-174.9	-55.2	0	0	111.3	S221 E222 F226 K227 A228	S221-Q224 WeakPolarHBondContact O-CB 3.27Å; S221-Q224 PolarHBondContact O-N 3.34Å; E222-Q224 PolarHBondContact O-N 3.39Å; Q224-F226 VanDerWaalsContact C-N 3.3Å; Q224-F226 PolarHBondContact O-N 2.8Å; Q224-K227 PolarHBondContact O-N 2.87Å; Q224-A228 WeakPolarHBondContact O-CB 3.38Å; Q224-A228 PolarHBondContact O-N 2.84Å
225	V	93.7	Very high	89	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-45.6	176	-173.2	0	0	0	0	109.9	I212 L217 V219 E222 K227 A228 C229 V251	I212-V225 HydrophobicContact CB-CG1 4.24Å; I212-V225 HydrophobicContact CG2-CG1 4.16Å; L217-V225 HydrophobicContact CD2-CG2 3.94Å; V219-V225 HydrophobicContact CB-CG2 4.17Å; V219-V225 HydrophobicContact CG1-CG2 3.79Å; V219-V225 HydrophobicContact CG2-CG2 3.78Å; E222-V225 PolarHBondContact O-N 2.86Å; V225-K227 PolarHBondContact O-N 3.22Å; V225-A228 PolarHBondContact O-N 3.41Å; V225-C229 WeakPolarHBondContact O-CB 3.44Å; V225-C229 PolarHBondContact O-N 2.94Å; V225-C229 PolarHBondContact O-SG 3.46Å; V225-V251 HydrophobicContact CG1-CG2 4.09Å
226	F	95.4	Very high	89.5	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-57.5	-50.7	174.7	-179.8	-86.5	0	0	0	111.5	E222 Q224 A228 C229 M230 L248 V251 L253 F260 A265 I271	E222-F226 WeakPolarHBondContact O-CB 3.07Å; E222-F226 PolarHBondContact O-N 3.14Å; Q224-F226 VanDerWaalsContact C-N 3.3Å; Q224-F226 PolarHBondContact O-N 2.8Å; F226-A228 VanDerWaalsContact C-N 3.31Å; F226-A228 PolarHBondContact O-N 3.29Å; F226-C229 PolarHBondContact O-N 3.28Å; F226-M230 HydrophobicContact CD1-CG 3.85Å; F226-M230 HydrophobicContact CE1-CG 3.49Å; F226-M230 VanDerWaalsContact CE1-CG 3.49Å; F226-M230 HydrophobicContact CE1-SD 4.47Å; F226-M230 HydrophobicContact CE2-CG 4.28Å; F226-M230 HydrophobicContact CE2-SD 4.49Å; F226-M230 HydrophobicContact CG-CG 4.42Å; F226-M230 HydrophobicContact CZ-CG 3.73Å; F226-M230 HydrophobicContact CZ-SD 4.13Å; F226-M230 WeakPolarHBondContact O-CB 3.41Å; F226-M230 VanDerWaalsContact O-CG 3.28Å; F226-M230 WeakPolarHBondContact O-CG 3.35Å; F226-M230 PolarHBondContact O-N 3.14Å; F226-L248 HydrophobicContact CD2-CD1 3.73Å; F226-L248 HydrophobicContact CE2-CD1 3.77Å; F226-V251 HydrophobicContact CB-CG1 3.99Å; F226-V251 HydrophobicContact CD2-CG1 4.45Å; F226-L253 HydrophobicContact CD2-CD2 3.77Å; F226-L253 HydrophobicContact CE2-CD2 4.2Å; F226-F260 HydrophobicContact CB-CE1 4.07Å; F226-F260 HydrophobicContact CB-CZ 4.17Å; F226-F260 AromaticContact CD1-CE1 3.68Å; F226-F260 HydrophobicContact CD1-CE1 3.68Å; F226-F260 AromaticContact CD1-CZ 3.42Å; F226-F260 HydrophobicContact CD1-CZ 3.42Å; F226-F260 VanDerWaalsContact CD1-CZ 3.42Å; F226-F260 HydrophobicContact CD2-CE1 4.43Å; F226-F260 HydrophobicContact CE1-CE1 4.17Å; F226-F260 AromaticContact CE1-CZ 3.99Å; F226-F260 HydrophobicContact CE1-CZ 3.99Å; F226-F260 AromaticContact CG-CE1 3.8Å; F226-F260 HydrophobicContact CG-CE1 3.8Å; F226-F260 AromaticContact CG-CZ 3.95Å; F226-F260 HydrophobicContact CG-CZ 3.95Å; F226-A265 HydrophobicContact CE2-CB 3.87Å; F226-A265 HydrophobicContact CZ-CB 3.72Å; F226-I271 HydrophobicContact CE2-CD1 3.6Å; F226-I271 HydrophobicContact CZ-CD1 3.44Å; F226-I271 VanDerWaalsContact CZ-CD1 3.44Å
227	K	94.2	Very high	90.1	Very high	121 Å²	121	41.4 Å²	41.4	53%	0.526	20%	0.195	S	C	.	.	H	α-helix	trans	-59.8	-42.1	179.3	-75.6	171.3	-171.9	177.1	0	111.7	E223 Q224 V225 M230 A231	E223-K227 WeakPolarHBondContact O-CB 3.27Å; E223-K227 WeakPolarHBondContact O-CG 3.38Å; E223-K227 PolarHBondContact O-N 3.06Å; Q224-K227 PolarHBondContact O-N 2.87Å; V225-K227 PolarHBondContact O-N 3.22Å; K227-M230 PolarHBondContact O-N 3.07Å; K227-A231 WeakPolarHBondContact O-CB 3.47Å; K227-A231 PolarHBondContact O-N 2.92Å
228	A	95.1	Very high	90.3	Very high	5 Å²	5	50.6 Å²	50.6	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-46.7	176.6	0	0	0	0	0	111.4	F191 M195 F200 Q224 V225 F226 M230 A231 W232	F191-A228 HydrophobicContact CZ-CB 4.47Å; M195-A228 HydrophobicContact CB-CB 3.95Å; M195-A228 HydrophobicContact SD-CB 4.2Å; F200-A228 HydrophobicContact CE1-CB 4.01Å; F200-A228 HydrophobicContact CZ-CB 3.92Å; Q224-A228 WeakPolarHBondContact O-CB 3.38Å; Q224-A228 PolarHBondContact O-N 2.84Å; V225-A228 PolarHBondContact O-N 3.41Å; F226-A228 VanDerWaalsContact C-N 3.31Å; F226-A228 PolarHBondContact O-N 3.29Å; A228-M230 PolarHBondContact O-N 3.11Å; A228-A231 PolarHBondContact O-N 2.93Å; A228-W232 WeakPolarHBondContact O-CB 3.24Å; A228-W232 PolarHBondContact O-N 3.44Å
229	C	95.8	Very high	91	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.02	25%	0.254	C	S	.	.	H	α-helix	trans	-60.5	-44.5	175.7	-65.1	0	0	0	0	111.6	V225 F226 W232 V233 V247 V251	V225-C229 WeakPolarHBondContact O-CB 3.44Å; V225-C229 PolarHBondContact O-N 2.94Å; V225-C229 PolarHBondContact O-SG 3.46Å; F226-C229 PolarHBondContact O-N 3.28Å; C229-W232 WeakPolarHBondContact O-CB 3.35Å; C229-W232 PolarHBondContact O-N 3.05Å; C229-V233 WeakPolarHBondContact O-CG2 3.49Å; C229-V233 PolarHBondContact O-N 2.82Å; C229-V247 HydrophobicContact CB-CG1 3.66Å; C229-V247 VanDerWaalsContact SG-CG1 3.53Å; C229-V251 HydrophobicContact CB-CG2 4.44Å
230	M	95.2	Very high	91.7	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-66.8	-37.2	178	-67.8	-55.7	-66	0	0	112.3	F226 K227 A228 V233 R234 L244 D268 L270 I271	F226-M230 HydrophobicContact CD1-CG 3.85Å; F226-M230 HydrophobicContact CE1-CG 3.49Å; F226-M230 VanDerWaalsContact CE1-CG 3.49Å; F226-M230 HydrophobicContact CE1-SD 4.47Å; F226-M230 HydrophobicContact CE2-CG 4.28Å; F226-M230 HydrophobicContact CE2-SD 4.49Å; F226-M230 HydrophobicContact CG-CG 4.42Å; F226-M230 HydrophobicContact CZ-CG 3.73Å; F226-M230 HydrophobicContact CZ-SD 4.13Å; F226-M230 WeakPolarHBondContact O-CB 3.41Å; F226-M230 VanDerWaalsContact O-CG 3.28Å; F226-M230 WeakPolarHBondContact O-CG 3.35Å; F226-M230 PolarHBondContact O-N 3.14Å; K227-M230 PolarHBondContact O-N 3.07Å; A228-M230 PolarHBondContact O-N 3.11Å; M230-V233 PolarHBondContact O-N 3.07Å; M230-R234 VanDerWaalsContact O-CB 3.3Å; M230-R234 WeakPolarHBondContact O-CB 3.28Å; M230-R234 WeakPolarHBondContact O-CG 3.31Å; M230-R234 PolarHBondContact O-N 2.73Å; M230-L244 HydrophobicContact SD-CD1 3.82Å; M230-D268 WeakPolarHBondContact CE-OD1 3.37Å; M230-L270 HydrophobicContact CE-CB 4.21Å; M230-L270 HydrophobicContact CE-CD1 3.9Å; M230-I271 HydrophobicContact SD-CD1 4.44Å
231	A	95.1	Very high	92.7	Very high	35 Å²	35	52.7 Å²	52.7	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-63.5	-43.1	173.7	0	0	0	0	0	111.1	M201 K227 A228 R234 H235	M201-A231 HydrophobicContact CE-CB 3.84Å; M201-A231 HydrophobicContact SD-CB 4.34Å; K227-A231 WeakPolarHBondContact O-CB 3.47Å; K227-A231 PolarHBondContact O-N 2.92Å; A228-A231 PolarHBondContact O-N 2.93Å; A231-R234 PolarHBondContact O-N 3.07Å; A231-H235 PolarHBondContact O-N 3.31Å
232	W	96.8	Very high	93.4	Very high	2 Å²	2	58 Å²	58	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-45.3	175.3	-178.2	94.9	0	0	0	112.6	F200 L203 V205 L208 A228 C229 R234 H235 R240 V247	F200-W232 HydrophobicContact CE1-CB 4.22Å; F200-W232 VanDerWaalsContact O-CD1 3.25Å; L203-W232 VanDerWaalsContact O-CZ2 3.24Å; L203-W232 WeakPolarHBondContact O-CZ2 3.26Å; L203-W232 PolarHBondContact O-NE1 3.17Å; V205-W232 HydrophobicContact CB-CH2 3.91Å; V205-W232 HydrophobicContact CB-CZ2 4.37Å; V205-W232 HydrophobicContact CG2-CH2 4.24Å; L208-W232 HydrophobicContact CD2-CB 4.23Å; L208-W232 HydrophobicContact CD2-CD2 3.4Å; L208-W232 VanDerWaalsContact CD2-CD2 3.4Å; L208-W232 HydrophobicContact CD2-CE3 3.66Å; L208-W232 HydrophobicContact CD2-CG 3.66Å; L208-W232 HydrophobicContact CD2-CZ2 4.26Å; L208-W232 HydrophobicContact CD2-CZ3 4.22Å; A228-W232 WeakPolarHBondContact O-CB 3.24Å; A228-W232 PolarHBondContact O-N 3.44Å; C229-W232 WeakPolarHBondContact O-CB 3.35Å; C229-W232 PolarHBondContact O-N 3.05Å; W232-R234 PolarHBondContact O-N 2.78Å; W232-H235 WeakPolarHBondContact O-CB 3.47Å; W232-H235 PolarHBondContact O-N 3.28Å; W232-R240 HydrophobicContact CE3-CB 4.46Å; W232-R240 HydrophobicContact CE3-CG 4.36Å; W232-R240 HydrophobicContact CH2-CB 4.26Å; W232-R240 HydrophobicContact CH2-CG 3.68Å; W232-R240 HydrophobicContact CZ2-CG 4.29Å; W232-R240 HydrophobicContact CZ3-CB 3.85Å; W232-R240 VanDerWaalsContact CZ3-CD 3.47Å; W232-R240 HydrophobicContact CZ3-CG 3.73Å; W232-R240 VanDerWaalsContact O-CD 3.3Å; W232-R240 WeakPolarHBondContact O-CD 3.19Å; W232-R240 PolarHBondContact O-NH1 2.88Å; W232-V247 HydrophobicContact CE3-CG2 4.49Å; W232-V247 HydrophobicContact CZ3-CG2 4.08Å
233	V	95.3	Very high	93.7	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.6	-42.9	175.9	174.6	0	0	0	0	110.6	C229 M230 H235 K236 V237 R240 L244 L270	C229-V233 WeakPolarHBondContact O-CG2 3.49Å; C229-V233 PolarHBondContact O-N 2.82Å; M230-V233 PolarHBondContact O-N 3.07Å; V233-H235 VanDerWaalsContact C-N 3.26Å; V233-H235 PolarHBondContact O-N 3.03Å; V233-K236 CarbonylContact O-C 3.44Å; V233-K236 PolarHBondContact O-N 3.32Å; V233-V237 WeakPolarHBondContact O-CA 3.39Å; V233-V237 PolarHBondContact O-N 3.26Å; V233-R240 HydrophobicContact CG1-CB 4.38Å; V233-L244 HydrophobicContact CG2-CD1 4.07Å; V233-L270 HydrophobicContact CG1-CD1 4.1Å
234	R	94.8	Very high	94	Very high	130 Å²	130	57.2 Å²	57.2	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-23.6	-179.9	-73.3	177.9	-167.6	134.2	-4	114	M230 A231 W232 K236 V237 D268 L270	M230-R234 VanDerWaalsContact O-CB 3.3Å; M230-R234 WeakPolarHBondContact O-CB 3.28Å; M230-R234 WeakPolarHBondContact O-CG 3.31Å; M230-R234 PolarHBondContact O-N 2.73Å; A231-R234 PolarHBondContact O-N 3.07Å; W232-R234 PolarHBondContact O-N 2.78Å; R234-K236 VanDerWaalsContact C-N 3.32Å; R234-K236 PolarHBondContact O-N 3.48Å; R234-V237 WeakPolarHBondContact O-CG2 3.3Å; R234-D268 IonicContact CZ-OD2 3.33Å; R234-D268 IonicContact NH2-OD2 2.73Å; R234-D268 PolarHBondContact NH2-OD2 2.92Å; R234-L270 HydrophobicContact CG-CD1 4.09Å
235	H	93.6	Very high	94.3	Very high	96 Å²	96	56.4 Å²	56.4	44%	0.444	26%	0.261	S	S	.	.	H	α-helix	trans	-64.7	-34.9	176.6	-173.2	73.2	0	0	0	112.5	M201 A231 W232 V233	M201-H235 HydrophobicContact SD-CB 4.43Å; A231-H235 PolarHBondContact O-N 3.31Å; W232-H235 WeakPolarHBondContact O-CB 3.47Å; W232-H235 PolarHBondContact O-N 3.28Å; V233-H235 VanDerWaalsContact C-N 3.26Å; V233-H235 PolarHBondContact O-N 3.03Å
236	K	93.5	Very high	94.3	Very high	88 Å²	88	61 Å²	61	38%	0.383	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	64.9	174.7	-62.2	-178.4	-179.6	178.4	0	111.2	V233 R234 F238 D239 R240	V233-K236 CarbonylContact O-C 3.44Å; V233-K236 PolarHBondContact O-N 3.32Å; R234-K236 VanDerWaalsContact C-N 3.32Å; R234-K236 PolarHBondContact O-N 3.48Å; K236-F238 VanDerWaalsContact C-N 3.27Å; K236-F238 PolarHBondContact O-N 3.11Å; K236-D239 PolarHBondContact O-N 2.78Å; K236-R240 HydrophobicContact CB-CG 4.09Å; K236-R240 VanDerWaalsContact O-CB 3.31Å; K236-R240 WeakPolarHBondContact O-CB 3.31Å; K236-R240 PolarHBondContact O-N 3.21Å
237	V	93.2	Very high	94.3	Very high	64 Å²	64	60.8 Å²	60.8	39%	0.388	28%	0.281	S	S	.	.	H	α-helix	trans	-52.3	-44	-172.9	179.4	0	0	0	0	112.6	V233 R234 D239 R241 L270	V233-V237 WeakPolarHBondContact O-CA 3.39Å; V233-V237 PolarHBondContact O-N 3.26Å; R234-V237 WeakPolarHBondContact O-CG2 3.3Å; V237-D239 VanDerWaalsContact C-N 3.34Å; V237-D239 PolarHBondContact O-N 3.41Å; V237-R241 WeakPolarHBondContact O-CB 3.37Å; V237-R241 PolarHBondContact O-N 3.42Å; V237-R241 VanDerWaalsContact O-N 3.08Å; V237-L270 HydrophobicContact CG1-CD2 4.23Å
238	F	92	Very high	94.4	Very high	193 Å²	193	55.1 Å²	55.1	85%	0.846	26%	0.257	S	S	*	.	H	α-helix	trans	-60.5	-43.5	-175.2	-173.7	-96.6	0	0	0	112.2	K236	K236-F238 VanDerWaalsContact C-N 3.27Å; K236-F238 PolarHBondContact O-N 3.11Å
239	D	93.2	Very high	94.3	Very high	92 Å²	92	57.8 Å²	57.8	49%	0.492	27%	0.267	S	S	.	.	H	α-helix	trans	-86.2	-36.6	-177.1	-59.2	-40.8	0	0	0	112.6	K236 V237 K242	K236-D239 PolarHBondContact O-N 2.78Å; V237-D239 VanDerWaalsContact C-N 3.34Å; V237-D239 PolarHBondContact O-N 3.41Å; D239-K242 VanDerWaalsContact O-CE 3.27Å; D239-K242 WeakPolarHBondContact O-CE 3.37Å
240	R	94.2	Very high	94.3	Very high	17 Å²	17	61.6 Å²	61.6	6%	0.064	28%	0.282	C	S	.	.	H	α-helix	trans	-94.1	-10.5	-168.9	-65.6	177.5	170.6	171	-4.8	114.6	M201 L203 W232 V233 K236 K242 D243 L244	M201-R240 VanDerWaalsContact O-CZ 3.26Å; M201-R240 PolarHBondContact O-NH1 3.47Å; M201-R240 PolarHBondContact O-NH2 3.27Å; L203-R240 PolarHBondContact O-NH2 3.01Å; L203-R240 VanDerWaalsContact O-NH2 3.1Å; W232-R240 HydrophobicContact CE3-CB 4.46Å; W232-R240 HydrophobicContact CE3-CG 4.36Å; W232-R240 HydrophobicContact CH2-CB 4.26Å; W232-R240 HydrophobicContact CH2-CG 3.68Å; W232-R240 HydrophobicContact CZ2-CG 4.29Å; W232-R240 HydrophobicContact CZ3-CB 3.85Å; W232-R240 VanDerWaalsContact CZ3-CD 3.47Å; W232-R240 HydrophobicContact CZ3-CG 3.73Å; W232-R240 VanDerWaalsContact O-CD 3.3Å; W232-R240 WeakPolarHBondContact O-CD 3.19Å; W232-R240 PolarHBondContact O-NH1 2.88Å; V233-R240 HydrophobicContact CG1-CB 4.38Å; K236-R240 HydrophobicContact CB-CG 4.09Å; K236-R240 VanDerWaalsContact O-CB 3.31Å; K236-R240 WeakPolarHBondContact O-CB 3.31Å; K236-R240 PolarHBondContact O-N 3.21Å; R240-K242 PolarHBondContact O-N 2.82Å; R240-D243 PolarHBondContact O-N 3.27Å; R240-L244 PolarHBondContact O-N 2.87Å
241	R	92	Very high	94.3	Very high	120 Å²	120	61.6 Å²	61.6	45%	0.453	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-56.8	-38.7	179.7	178.8	178.1	-179.5	-156.5	-3	112.3	V237 D243 L244 L270 S273	V237-R241 WeakPolarHBondContact O-CB 3.37Å; V237-R241 PolarHBondContact O-N 3.42Å; V237-R241 VanDerWaalsContact O-N 3.08Å; R241-D243 PolarHBondContact O-N 2.85Å; R241-L244 VanDerWaalsContact O-CB 3.31Å; R241-L244 WeakPolarHBondContact O-CB 3.39Å; R241-L244 PolarHBondContact O-N 3.27Å; R241-L270 HydrophobicContact CG-CD2 4.45Å; R241-S273 PolarHBondContact NH2-OG 2.95Å
242	K	93.3	Very high	94.1	Very high	157 Å²	157	60.4 Å²	60.4	68%	0.683	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.3	-25	177.4	67.1	-176.4	-178.2	179.6	0	113.4	D239 R240	D239-K242 VanDerWaalsContact O-CE 3.27Å; D239-K242 WeakPolarHBondContact O-CE 3.37Å; R240-K242 PolarHBondContact O-N 2.82Å
243	D	94.8	Very high	93.9	Very high	35 Å²	35	60.4 Å²	60.4	19%	0.187	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-90.9	-7.3	-177.1	-54.8	-48.5	0	0	0	112	V205 R240 R241 E246 V247	V205-D243 HydrophobicContact CG2-CB 3.94Å; R240-D243 PolarHBondContact O-N 3.27Å; R241-D243 PolarHBondContact O-N 2.85Å; D243-E246 WeakPolarHBondContact O-CB 3.39Å; D243-E246 PolarHBondContact O-N 3.45Å; D243-E246 VanDerWaalsContact O-N 3.1Å; D243-V247 WeakPolarHBondContact O-CG2 3.28Å; D243-V247 PolarHBondContact O-N 2.92Å
244	L	94.8	Very high	93.6	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-50.1	-52.7	179.4	175.8	64.8	0	0	0	113.6	M230 V233 R240 R241 E246 V247 L248 L270 I271 A277	M230-L244 HydrophobicContact SD-CD1 3.82Å; V233-L244 HydrophobicContact CG2-CD1 4.07Å; R240-L244 PolarHBondContact O-N 2.87Å; R241-L244 VanDerWaalsContact O-CB 3.31Å; R241-L244 WeakPolarHBondContact O-CB 3.39Å; R241-L244 PolarHBondContact O-N 3.27Å; L244-E246 VanDerWaalsContact C-N 3.27Å; L244-E246 PolarHBondContact O-N 3.28Å; L244-V247 PolarHBondContact O-N 2.94Å; L244-L248 WeakPolarHBondContact O-CB 3.48Å; L244-L248 PolarHBondContact O-N 2.93Å; L244-L270 HydrophobicContact CD2-CB 3.95Å; L244-I271 HydrophobicContact CD2-CG1 4.38Å; L244-A277 HydrophobicContact CD2-CB 4.14Å; L244-A277 HydrophobicContact CG-CB 4.32Å
245	P	94.3	Very high	93.1	Very high	20 Å²	20	56.4 Å²	56.4	13%	0.13	26%	0.258	C	S	.	.	H	α-helix	trans	-63	-34.8	179.6	23.6	-33.8	0	0	0	112.4	V247 L248 K249 A276	P245-V247 PolarHBondContact O-N 3.48Å; P245-L248 PolarHBondContact O-N 3.49Å; P245-K249 PolarHBondContact O-N 3.35Å; P245-A276 HydrophobicContact CB-CB 3.79Å; P245-A276 HydrophobicContact CG-CB 4.43Å
246	E	94.5	Very high	92.6	Very high	95 Å²	95	52.1 Å²	52.1	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-69	-33	179.5	-70.6	-61.5	107.7	0	0	112.9	D243 L244 K249 Y250	D243-E246 WeakPolarHBondContact O-CB 3.39Å; D243-E246 PolarHBondContact O-N 3.45Å; D243-E246 VanDerWaalsContact O-N 3.1Å; L244-E246 VanDerWaalsContact C-N 3.27Å; L244-E246 PolarHBondContact O-N 3.28Å; E246-K249 WeakPolarHBondContact O-CD 3.34Å; E246-K249 VanDerWaalsContact O-CE 3.23Å; E246-K249 WeakPolarHBondContact O-CE 3.28Å; E246-K249 VanDerWaalsContact O-CG 3.28Å; E246-K249 WeakPolarHBondContact O-CG 3.41Å; E246-K249 IonicContact OE1-NZ 3.33Å; E246-K249 IonicContact OE2-NZ 3.02Å; E246-K249 PolarHBondContact OE2-NZ 2.97Å; E246-Y250 WeakPolarHBondContact O-CD2 3.45Å; E246-Y250 WeakPolarHBondContact O-CE2 3.47Å
247	V	95.6	Very high	92	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-77.5	-44.8	172.7	177.3	0	0	0	0	110.1	V205 L208 I212 C229 W232 D243 L244 P245 K249 Y250	V205-V247 HydrophobicContact CG2-CG2 4.04Å; L208-V247 HydrophobicContact CD2-CG1 3.83Å; L208-V247 HydrophobicContact CD2-CG2 4.06Å; L208-V247 HydrophobicContact CG-CG1 4.49Å; I212-V247 HydrophobicContact CD1-CG1 3.62Å; I212-V247 WeakPolarHBondContact CD1-O 3.2Å; C229-V247 HydrophobicContact CB-CG1 3.66Å; C229-V247 VanDerWaalsContact SG-CG1 3.53Å; W232-V247 HydrophobicContact CE3-CG2 4.49Å; W232-V247 HydrophobicContact CZ3-CG2 4.08Å; D243-V247 WeakPolarHBondContact O-CG2 3.28Å; D243-V247 PolarHBondContact O-N 2.92Å; L244-V247 PolarHBondContact O-N 2.94Å; P245-V247 PolarHBondContact O-N 3.48Å; V247-K249 VanDerWaalsContact C-N 3.28Å; V247-K249 PolarHBondContact O-N 3.29Å; V247-Y250 PolarHBondContact O-N 2.85Å
248	L	94.9	Very high	91.6	Very high	3 Å²	3	50.3 Å²	50.3	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-28.3	-173.6	-166.6	65.8	0	0	0	112.8	F226 L244 P245 Y250 V251 L253 A277 L280	F226-L248 HydrophobicContact CD2-CD1 3.73Å; F226-L248 HydrophobicContact CE2-CD1 3.77Å; L244-L248 WeakPolarHBondContact O-CB 3.48Å; L244-L248 PolarHBondContact O-N 2.93Å; P245-L248 PolarHBondContact O-N 3.49Å; L248-Y250 PolarHBondContact O-N 3.2Å; L248-Y250 VanDerWaalsContact O-N 3.12Å; L248-V251 HydrophobicContact CD1-CB 4.18Å; L248-V251 HydrophobicContact CD1-CG2 4.11Å; L248-V251 WeakPolarHBondContact O-CB 3.48Å; L248-V251 PolarHBondContact O-N 3.33Å; L248-L253 HydrophobicContact CD1-CD1 4.22Å; L248-L253 HydrophobicContact CD1-CD2 4.25Å; L248-L253 HydrophobicContact CD1-CG 4.5Å; L248-L253 HydrophobicContact CD2-CD1 4.22Å; L248-L253 HydrophobicContact CG-CD1 4.03Å; L248-A277 HydrophobicContact CD2-CB 3.92Å; L248-L280 HydrophobicContact CB-CD1 4.02Å; L248-L280 HydrophobicContact CD2-CB 4.41Å; L248-L280 HydrophobicContact CD2-CD1 4.18Å; L248-L280 HydrophobicContact CG-CD1 4.1Å
249	K	94	Very high	91.2	Very high	60 Å²	60	49.9 Å²	49.9	26%	0.261	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.4	177.3	79.1	-168.1	178.1	179.3	0	114	P245 E246 V247 L280	P245-K249 PolarHBondContact O-N 3.35Å; E246-K249 WeakPolarHBondContact O-CD 3.34Å; E246-K249 VanDerWaalsContact O-CE 3.23Å; E246-K249 WeakPolarHBondContact O-CE 3.28Å; E246-K249 VanDerWaalsContact O-CG 3.28Å; E246-K249 WeakPolarHBondContact O-CG 3.41Å; E246-K249 IonicContact OE1-NZ 3.33Å; E246-K249 IonicContact OE2-NZ 3.02Å; E246-K249 PolarHBondContact OE2-NZ 2.97Å; V247-K249 VanDerWaalsContact C-N 3.28Å; V247-K249 PolarHBondContact O-N 3.29Å; K249-L280 HydrophobicContact CB-CD1 4.26Å
250	Y	95.2	Very high	90.9	Very high	84 Å²	84	46 Å²	46	33%	0.329	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.5	177.7	-62.6	-65.1	0	0	0	113.5	C209 I212 E246 V247 L248 R305	C209-Y250 HydrophobicContact CB-CD2 3.99Å; C209-Y250 HydrophobicContact CB-CE2 3.63Å; I212-Y250 HydrophobicContact CD1-CD2 4.46Å; I212-Y250 HydrophobicContact CG1-CD2 4.46Å; I212-Y250 HydrophobicContact CG1-CG 4.4Å; E246-Y250 WeakPolarHBondContact O-CD2 3.45Å; E246-Y250 WeakPolarHBondContact O-CE2 3.47Å; V247-Y250 PolarHBondContact O-N 2.85Å; L248-Y250 PolarHBondContact O-N 3.2Å; L248-Y250 VanDerWaalsContact O-N 3.12Å; Y250-R305 PolarHBondContact O-NH2 3.19Å
251	V	94.7	Very high	90.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-79.3	128	168.3	-175.1	0	0	0	0	107.9	V225 F226 C229 L248 L253	V225-V251 HydrophobicContact CG1-CG2 4.09Å; F226-V251 HydrophobicContact CB-CG1 3.99Å; F226-V251 HydrophobicContact CD2-CG1 4.45Å; C229-V251 HydrophobicContact CB-CG2 4.44Å; L248-V251 HydrophobicContact CD1-CB 4.18Å; L248-V251 HydrophobicContact CD1-CG2 4.11Å; L248-V251 WeakPolarHBondContact O-CB 3.48Å; L248-V251 PolarHBondContact O-N 3.33Å; V251-L253 HydrophobicContact CB-CG 4.47Å; V251-L253 HydrophobicContact CG1-CD2 3.97Å; V251-L253 HydrophobicContact CG1-CG 4.27Å; V251-L253 PolarHBondContact O-N 3.46Å
252	R	92.1	Very high	90.5	Very high	11 Å²	11	43.9 Å²	43.9	4%	0.042	22%	0.222	C	C	.	.			trans	-85.9	63.6	-174.7	-50.6	177.7	-168.6	-156.8	-5.9	109.4	D215 E222 P254 L255 R301 R303 H304 R305	D215-R252 IonicContact OD1-CZ 3.28Å; D215-R252 VanDerWaalsContact OD1-CZ 3.24Å; D215-R252 IonicContact OD1-NH1 2.65Å; D215-R252 PolarHBondContact OD1-NH1 3.33Å; D215-R252 IonicContact OD1-NH2 3.8Å; D215-R252 PolarHBondContact OD1-NH2 3.45Å; E222-R252 VanDerWaalsContact CD-CB 3.49Å; E222-R252 HydrophobicContact CG-CB 3.78Å; E222-R252 WeakPolarHBondContact OE1-CD 3.29Å; E222-R252 IonicContact OE1-NE 3.77Å; E222-R252 PolarHBondContact OE2-N 3.44Å; R252-P254 VanDerWaalsContact C-N 3.29Å; R252-P254 VanDerWaalsContact O-N 3.17Å; R252-L255 HydrophobicContact CB-CD1 3.82Å; R252-L255 HydrophobicContact CB-CG 4.14Å; R252-L255 VanDerWaalsContact O-CB 3.32Å; R252-L255 WeakPolarHBondContact O-CB 3.33Å; R252-L255 PolarHBondContact O-N 3.33Å; R252-R301 VanDerWaalsContact CB-O 3.29Å; R252-R301 WeakPolarHBondContact CB-O 3.39Å; R252-R303 WeakPolarHBondContact CD-O 3.45Å; R252-R303 PolarHBondContact NH1-O 3.1Å; R252-H304 PolarHBondContact NH1-O 3.49Å; R252-R305 VanDerWaalsContact CZ-CG 3.43Å; R252-R305 VanDerWaalsContact NH1-N 3.16Å
253	L	92.7	Very high	90.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-49.1	-37.7	-175.7	-67.9	173.2	0	0	0	114.8	F226 L248 V251 L255 C256 L261 L280 V281 A284	F226-L253 HydrophobicContact CD2-CD2 3.77Å; F226-L253 HydrophobicContact CE2-CD2 4.2Å; L248-L253 HydrophobicContact CD1-CD1 4.22Å; L248-L253 HydrophobicContact CD1-CD2 4.25Å; L248-L253 HydrophobicContact CD1-CG 4.5Å; L248-L253 HydrophobicContact CD2-CD1 4.22Å; L248-L253 HydrophobicContact CG-CD1 4.03Å; V251-L253 HydrophobicContact CB-CG 4.47Å; V251-L253 HydrophobicContact CG1-CD2 3.97Å; V251-L253 HydrophobicContact CG1-CG 4.27Å; V251-L253 PolarHBondContact O-N 3.46Å; L253-L255 PolarHBondContact O-N 2.87Å; L253-C256 WeakPolarHBondContact O-CB 3.11Å; L253-C256 PolarHBondContact O-N 2.84Å; L253-L261 HydrophobicContact CB-CD2 4.18Å; L253-L261 HydrophobicContact CD2-CD2 4.08Å; L253-L280 HydrophobicContact CD1-CB 3.9Å; L253-V281 HydrophobicContact CD1-CG2 3.97Å; L253-A284 HydrophobicContact CB-CB 3.58Å
254	P	87.8	Confident	90.1	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.026	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-58.5	-18.3	175.3	-26	35.5	0	0	0	114.7	R252 A284 Y287 R301 T302	R252-P254 VanDerWaalsContact C-N 3.29Å; R252-P254 VanDerWaalsContact O-N 3.17Å; P254-A284 HydrophobicContact CB-CB 4.49Å; P254-A284 HydrophobicContact CG-CB 4.1Å; P254-Y287 HydrophobicContact CB-CD1 3.6Å; P254-Y287 HydrophobicContact CB-CE1 4.12Å; P254-Y287 HydrophobicContact CB-CG 3.89Å; P254-R301 HydrophobicContact CG-CB 4.23Å; P254-T302 HydrophobicContact CB-CG2 4.03Å; P254-T302 HydrophobicContact CG-CG2 4.14Å
255	L	83.9	Confident	89.8	Confident	42 Å²	42	39.7 Å²	39.7	22%	0.22	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-93.8	-1.5	177.7	-51.6	-178.5	0	0	0	113.2	E222 R252 L253 H304	E222-L255 HydrophobicContact CG-CB 4.08Å; E222-L255 HydrophobicContact CG-CD1 4.44Å; R252-L255 HydrophobicContact CB-CD1 3.82Å; R252-L255 HydrophobicContact CB-CG 4.14Å; R252-L255 VanDerWaalsContact O-CB 3.32Å; R252-L255 WeakPolarHBondContact O-CB 3.33Å; R252-L255 PolarHBondContact O-N 3.33Å; L253-L255 PolarHBondContact O-N 2.87Å; L255-H304 HydrophobicContact CD1-CB 4.4Å
256	C	83.3	Confident	89.5	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.041	22%	0.223	C	C	.	.	S	Bend	trans	-79.5	157.3	170.9	-65.9	0	0	0	0	110.9	E223 L253 F260 L261	E223-C256 HydrophobicContact CG-CB 4.19Å; L253-C256 WeakPolarHBondContact O-CB 3.11Å; L253-C256 PolarHBondContact O-N 2.84Å; C256-F260 HydrophobicContact CB-CD1 3.96Å; C256-L261 HydrophobicContact CB-CD2 3.98Å; C256-L261 HydrophobicContact CB-CG 3.98Å
257	S	82.7	Confident	89.3	Confident	55 Å²	55	38.5 Å²	38.5	39%	0.385	22%	0.222	S	C	.	.			trans	-66.8	147.6	176.4	68.3	0	0	0	0	111.9	E223 K259 F260 L261	E223-S257 WeakPolarHBondContact OE1-CB 3.49Å; E223-S257 PolarHBondContact OE1-N 3.44Å; E223-S257 PolarHBondContact OE1-OG 3.32Å; S257-K259 PolarHBondContact O-N 2.95Å; S257-F260 WeakPolarHBondContact O-CB 3.32Å; S257-F260 PolarHBondContact O-N 3.17Å; S257-F260 WeakPolarHBondContact OG-CB 3.38Å; S257-F260 PolarHBondContact OG-N 3.23Å; S257-L261 PolarHBondContact O-N 2.8Å
258	A	83.5	Confident	89.2	Confident	59 Å²	59	39.5 Å²	39.5	49%	0.488	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-38	175.6	0	0	0	0	0	111.9	F260 L261 V262 L288	A258-F260 VanDerWaalsContact C-N 3.35Å; A258-F260 PolarHBondContact O-N 2.85Å; A258-L261 PolarHBondContact O-N 2.87Å; A258-V262 WeakPolarHBondContact O-CB 3.28Å; A258-V262 WeakPolarHBondContact O-CG2 3.49Å; A258-V262 PolarHBondContact O-N 3.41Å; A258-L288 HydrophobicContact CB-CD1 3.91Å
259	K	82.9	Confident	89	Confident	185 Å²	185	46.1 Å²	46.1	80%	0.804	26%	0.262	S	S	*	.	H	α-helix	trans	-60.6	-42.9	175.3	-177.3	179.5	176.8	-177.6	0	111.6	S257 G263	S257-K259 PolarHBondContact O-N 2.95Å; K259-G263 WeakPolarHBondContact O-CA 3.5Å; K259-G263 PolarHBondContact O-N 2.83Å
260	F	87	Confident	88.9	Confident	11 Å²	11	44.5 Å²	44.5	5%	0.048	26%	0.257	C	S	.	.	H	α-helix	trans	-69.3	-44.4	178.7	-176	-94.6	0	0	0	112.4	E223 F226 C256 S257 A258 V262 T264 A265	E223-F260 HydrophobicContact CB-CD1 4.33Å; E223-F260 HydrophobicContact CB-CD2 4.09Å; E223-F260 HydrophobicContact CB-CE1 4.08Å; E223-F260 HydrophobicContact CB-CE2 3.84Å; E223-F260 HydrophobicContact CB-CG 4.32Å; E223-F260 HydrophobicContact CB-CZ 3.81Å; E223-F260 VanDerWaalsContact CD-CD2 3.5Å; E223-F260 VanDerWaalsContact CD-CG 3.45Å; E223-F260 HydrophobicContact CG-CB 4.22Å; E223-F260 HydrophobicContact CG-CD1 3.78Å; E223-F260 HydrophobicContact CG-CD2 3.88Å; E223-F260 HydrophobicContact CG-CE1 4.01Å; E223-F260 HydrophobicContact CG-CE2 4.13Å; E223-F260 HydrophobicContact CG-CG 3.69Å; E223-F260 HydrophobicContact CG-CZ 4.17Å; E223-F260 WeakPolarHBondContact OE1-CB 3.31Å; E223-F260 WeakPolarHBondContact OE2-CD2 3.39Å; F226-F260 HydrophobicContact CB-CE1 4.07Å; F226-F260 HydrophobicContact CB-CZ 4.17Å; F226-F260 AromaticContact CD1-CE1 3.68Å; F226-F260 HydrophobicContact CD1-CE1 3.68Å; F226-F260 AromaticContact CD1-CZ 3.42Å; F226-F260 HydrophobicContact CD1-CZ 3.42Å; F226-F260 VanDerWaalsContact CD1-CZ 3.42Å; F226-F260 HydrophobicContact CD2-CE1 4.43Å; F226-F260 HydrophobicContact CE1-CE1 4.17Å; F226-F260 AromaticContact CE1-CZ 3.99Å; F226-F260 HydrophobicContact CE1-CZ 3.99Å; F226-F260 AromaticContact CG-CE1 3.8Å; F226-F260 HydrophobicContact CG-CE1 3.8Å; F226-F260 AromaticContact CG-CZ 3.95Å; F226-F260 HydrophobicContact CG-CZ 3.95Å; C256-F260 HydrophobicContact CB-CD1 3.96Å; S257-F260 WeakPolarHBondContact O-CB 3.32Å; S257-F260 PolarHBondContact O-N 3.17Å; S257-F260 WeakPolarHBondContact OG-CB 3.38Å; S257-F260 PolarHBondContact OG-N 3.23Å; A258-F260 VanDerWaalsContact C-N 3.35Å; A258-F260 PolarHBondContact O-N 2.85Å; F260-V262 PolarHBondContact O-N 2.94Å; F260-T264 HydrophobicContact CD2-CG2 4.45Å; F260-T264 HydrophobicContact CE2-CG2 3.97Å; F260-T264 HydrophobicContact CZ-CG2 4.26Å; F260-T264 WeakPolarHBondContact O-CA 3.1Å; F260-T264 WeakPolarHBondContact O-CB 3.28Å; F260-T264 PolarHBondContact O-N 3.38Å; F260-A265 PolarHBondContact O-N 2.91Å
261	L	90.1	Very high	88.8	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	24%	0.242	C	C	.	.	I	π-helix	trans	-62.4	-41.8	178.9	-70.3	175	0	0	0	112.3	L253 C256 S257 A258 A265 G266 A284 K285 L288	L253-L261 HydrophobicContact CB-CD2 4.18Å; L253-L261 HydrophobicContact CD2-CD2 4.08Å; C256-L261 HydrophobicContact CB-CD2 3.98Å; C256-L261 HydrophobicContact CB-CG 3.98Å; S257-L261 PolarHBondContact O-N 2.8Å; A258-L261 PolarHBondContact O-N 2.87Å; L261-A265 HydrophobicContact CD2-CB 4.4Å; L261-G266 WeakPolarHBondContact O-CA 3.34Å; L261-G266 PolarHBondContact O-N 2.8Å; L261-A284 HydrophobicContact CD1-CB 3.73Å; L261-A284 HydrophobicContact CD2-CB 4.14Å; L261-K285 HydrophobicContact CB-CG 4.48Å; L261-L288 HydrophobicContact CD1-CD1 3.68Å
262	V	89.3	Confident	88.7	Confident	90 Å²	90	46.4 Å²	46.4	55%	0.545	27%	0.267	S	S	.	.	I	π-helix	trans	-80.1	-46.7	179.7	176.9	0	0	0	0	111.4	A258 F260	A258-V262 WeakPolarHBondContact O-CB 3.28Å; A258-V262 WeakPolarHBondContact O-CG2 3.49Å; A258-V262 PolarHBondContact O-N 3.41Å; F260-V262 PolarHBondContact O-N 2.94Å
263	G	87.4	Confident	88.6	Confident	43 Å²	43	48.6 Å²	48.6	44%	0.443	28%	0.284	S	S	.	.	I	π-helix	trans	-82.9	-23.7	-170.8	0	0	0	0	0	115	K259 T267	K259-G263 WeakPolarHBondContact O-CA 3.5Å; K259-G263 PolarHBondContact O-N 2.83Å; G263-T267 PolarHBondContact O-OG1 3.16Å
264	T	90.4	Very high	88.6	Confident	64 Å²	64	50.3 Å²	50.3	39%	0.393	29%	0.293	S	S	.	.	I	π-helix	trans	-121.5	-58.9	-176.3	-52.9	0	0	0	0	111.9	F260 T267 D268	F260-T264 HydrophobicContact CD2-CG2 4.45Å; F260-T264 HydrophobicContact CE2-CG2 3.97Å; F260-T264 HydrophobicContact CZ-CG2 4.26Å; F260-T264 WeakPolarHBondContact O-CA 3.1Å; F260-T264 WeakPolarHBondContact O-CB 3.28Å; F260-T264 PolarHBondContact O-N 3.38Å; T264-T267 PolarHBondContact O-N 2.89Å; T264-T267 PolarHBondContact O-OG1 3.3Å; T264-D268 PolarHBondContact O-N 3.45Å
265	A	89.1	Confident	88.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.321	C	S	.	.	I	π-helix	trans	-67.6	-45.2	-176.3	0	0	0	0	0	112	F226 F260 L261 T267 I271 V281	F226-A265 HydrophobicContact CE2-CB 3.87Å; F226-A265 HydrophobicContact CZ-CB 3.72Å; F260-A265 PolarHBondContact O-N 2.91Å; L261-A265 HydrophobicContact CD2-CB 4.4Å; A265-T267 VanDerWaalsContact C-N 3.32Å; A265-T267 PolarHBondContact O-N 2.79Å; A265-I271 HydrophobicContact CB-CD1 4.29Å; A265-I271 WeakPolarHBondContact O-CD1 3.34Å; A265-V281 HydrophobicContact CB-CG1 4.31Å; A265-V281 HydrophobicContact CB-CG2 4.12Å
266	G	87.9	Confident	89.4	Confident	18 Å²	18	56.4 Å²	56.4	19%	0.186	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-14.4	-178.8	0	0	0	0	0	114.9	L261 K272	L261-G266 WeakPolarHBondContact O-CA 3.34Å; L261-G266 PolarHBondContact O-N 2.8Å; G266-K272 WeakPolarHBondContact O-CE 3.42Å
267	T	91.3	Very high	89.9	Confident	71 Å²	71	56.1 Å²	56.1	44%	0.436	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-19.6	176.8	52	0	0	0	0	113	G263 T264 A265 L269	G263-T267 PolarHBondContact O-OG1 3.16Å; T264-T267 PolarHBondContact O-N 2.89Å; T264-T267 PolarHBondContact O-OG1 3.3Å; A265-T267 VanDerWaalsContact C-N 3.32Å; A265-T267 PolarHBondContact O-N 2.79Å; T267-L269 PolarHBondContact O-N 2.93Å
268	D	92.2	Very high	90.4	Very high	22 Å²	22	58 Å²	58	12%	0.118	32%	0.324	C	S	.	.			trans	-60.4	131.2	-178.1	-166.7	-77.7	0	0	0	112.3	M230 R234 T264 L270 I271 K272	M230-D268 WeakPolarHBondContact CE-OD1 3.37Å; R234-D268 IonicContact CZ-OD2 3.33Å; R234-D268 IonicContact NH2-OD2 2.73Å; R234-D268 PolarHBondContact NH2-OD2 2.92Å; T264-D268 PolarHBondContact O-N 3.45Å; D268-L270 VanDerWaalsContact C-N 3.34Å; D268-L270 PolarHBondContact O-N 2.87Å; D268-L270 WeakPolarHBondContact OD1-CB 3.28Å; D268-L270 PolarHBondContact OD1-N 2.9Å; D268-I271 HydrophobicContact CB-CB 4.31Å; D268-I271 HydrophobicContact CB-CD1 4.2Å; D268-I271 HydrophobicContact CB-CG1 4.34Å; D268-I271 PolarHBondContact O-N 2.96Å; D268-K272 WeakPolarHBondContact O-CB 3.24Å; D268-K272 WeakPolarHBondContact O-CG 3.39Å; D268-K272 PolarHBondContact O-N 2.8Å
269	L	91.6	Very high	91	Very high	141 Å²	141	60.5 Å²	60.5	74%	0.738	33%	0.325	S	S	*	.	H	α-helix	trans	-66.3	-34.1	-176.2	-68.9	174.9	0	0	0	112.9	T267 S273	T267-L269 PolarHBondContact O-N 2.93Å; L269-S273 WeakPolarHBondContact O-CB 3.46Å; L269-S273 PolarHBondContact O-N 2.81Å; L269-S273 PolarHBondContact O-OG 2.77Å
270	L	91.6	Very high	91.5	Very high	26 Å²	26	52.7 Å²	52.7	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-67.1	-44.1	179.1	-66.9	170.4	0	0	0	110	M230 V233 R234 V237 R241 L244 D268 S273 D274	M230-L270 HydrophobicContact CE-CB 4.21Å; M230-L270 HydrophobicContact CE-CD1 3.9Å; V233-L270 HydrophobicContact CG1-CD1 4.1Å; R234-L270 HydrophobicContact CG-CD1 4.09Å; V237-L270 HydrophobicContact CG1-CD2 4.23Å; R241-L270 HydrophobicContact CG-CD2 4.45Å; L244-L270 HydrophobicContact CD2-CB 3.95Å; D268-L270 VanDerWaalsContact C-N 3.34Å; D268-L270 PolarHBondContact O-N 2.87Å; D268-L270 WeakPolarHBondContact OD1-CB 3.28Å; D268-L270 PolarHBondContact OD1-N 2.9Å; L270-S273 PolarHBondContact O-N 3.06Å; L270-S273 PolarHBondContact O-OG 2.8Å; L270-D274 PolarHBondContact O-N 2.93Å
271	I	92.8	Very high	91.9	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-44.4	177.6	-66.9	175.3	0	0	0	111.4	F226 M230 L244 A265 D268 S273 D274 A277 V281	F226-I271 HydrophobicContact CE2-CD1 3.6Å; F226-I271 HydrophobicContact CZ-CD1 3.44Å; F226-I271 VanDerWaalsContact CZ-CD1 3.44Å; M230-I271 HydrophobicContact SD-CD1 4.44Å; L244-I271 HydrophobicContact CD2-CG1 4.38Å; A265-I271 HydrophobicContact CB-CD1 4.29Å; A265-I271 WeakPolarHBondContact O-CD1 3.34Å; D268-I271 HydrophobicContact CB-CB 4.31Å; D268-I271 HydrophobicContact CB-CD1 4.2Å; D268-I271 HydrophobicContact CB-CG1 4.34Å; D268-I271 PolarHBondContact O-N 2.96Å; I271-S273 PolarHBondContact O-N 2.91Å; I271-D274 PolarHBondContact O-N 2.81Å; I271-A277 HydrophobicContact CG1-CB 4.49Å; I271-A277 HydrophobicContact CG2-CB 4.32Å; I271-V281 HydrophobicContact CD1-CG2 4.45Å; I271-V281 HydrophobicContact CG2-CG2 3.96Å
272	K	92.4	Very high	92	Very high	122 Å²	122	54.5 Å²	54.5	53%	0.53	30%	0.302	S	S	.	.	H	α-helix	trans	-61.8	-30.4	177.2	-79.8	-176.3	175	177.3	0	113.2	G266 D268 D274	G266-K272 WeakPolarHBondContact O-CE 3.42Å; D268-K272 WeakPolarHBondContact O-CB 3.24Å; D268-K272 WeakPolarHBondContact O-CG 3.39Å; D268-K272 PolarHBondContact O-N 2.8Å; K272-D274 VanDerWaalsContact C-N 3.33Å
273	S	90.4	Very high	92.2	Very high	56 Å²	56	53.8 Å²	53.8	39%	0.392	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-11.7	-177.2	78.2	0	0	0	0	114.1	R241 L269 L270 I271	R241-S273 PolarHBondContact NH2-OG 2.95Å; L269-S273 WeakPolarHBondContact O-CB 3.46Å; L269-S273 PolarHBondContact O-N 2.81Å; L269-S273 PolarHBondContact O-OG 2.77Å; L270-S273 PolarHBondContact O-N 3.06Å; L270-S273 PolarHBondContact O-OG 2.8Å; I271-S273 PolarHBondContact O-N 2.91Å
274	D	92.7	Very high	92.3	Very high	37 Å²	37	51.8 Å²	51.8	20%	0.198	27%	0.272	C	S	.	.			trans	-118.1	123.9	-177	-172.8	-82.9	0	0	0	110.2	L270 I271 K272 A276 A277 R278	L270-D274 PolarHBondContact O-N 2.93Å; I271-D274 PolarHBondContact O-N 2.81Å; K272-D274 VanDerWaalsContact C-N 3.33Å; D274-A276 PolarHBondContact OD1-N 3.23Å; D274-A277 HydrophobicContact CB-CB 3.98Å; D274-A277 PolarHBondContact OD1-N 3.48Å; D274-R278 WeakPolarHBondContact O-CB 3.34Å; D274-R278 PolarHBondContact O-N 3Å
275	E	93.7	Very high	92.3	Very high	132 Å²	132	51.3 Å²	51.3	62%	0.617	27%	0.265	S	S	*	.	H	α-helix	trans	-65.5	-45.9	-174.4	179.4	163.9	-152.7	0	0	112.4	R278 E279	E275-R278 WeakPolarHBondContact O-CB 3.39Å; E275-R278 PolarHBondContact O-N 2.7Å; E275-E279 WeakPolarHBondContact O-CG 3.46Å; E275-E279 PolarHBondContact O-N 3.1Å
276	A	94.7	Very high	92.3	Very high	42 Å²	42	55.6 Å²	55.6	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-68.2	-39.1	-177.8	0	0	0	0	0	111.8	P245 D274 R278 E279 L280	P245-A276 HydrophobicContact CB-CB 3.79Å; P245-A276 HydrophobicContact CG-CB 4.43Å; D274-A276 PolarHBondContact OD1-N 3.23Å; A276-R278 VanDerWaalsContact C-N 3.32Å; A276-R278 PolarHBondContact O-N 2.74Å; A276-E279 PolarHBondContact O-N 2.71Å; A276-L280 WeakPolarHBondContact O-CG 3.44Å; A276-L280 PolarHBondContact O-N 3.38Å
277	A	94.1	Very high	92.2	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-38.6	175	0	0	0	0	0	112.1	L244 L248 I271 D274 L280 V281	L244-A277 HydrophobicContact CD2-CB 4.14Å; L244-A277 HydrophobicContact CG-CB 4.32Å; L248-A277 HydrophobicContact CD2-CB 3.92Å; I271-A277 HydrophobicContact CG1-CB 4.49Å; I271-A277 HydrophobicContact CG2-CB 4.32Å; D274-A277 HydrophobicContact CB-CB 3.98Å; D274-A277 PolarHBondContact OD1-N 3.48Å; A277-L280 PolarHBondContact O-N 2.86Å; A277-V281 PolarHBondContact O-N 3.24Å
278	R	94	Very high	91.6	Very high	95 Å²	95	54.9 Å²	54.9	36%	0.358	28%	0.275	S	S	.	.	H	α-helix	trans	-65.9	-41.7	176.9	-176.7	-176.8	52.2	64.4	3.7	111.8	D274 E275 A276 L280 V281 D282	D274-R278 WeakPolarHBondContact O-CB 3.34Å; D274-R278 PolarHBondContact O-N 3Å; E275-R278 WeakPolarHBondContact O-CB 3.39Å; E275-R278 PolarHBondContact O-N 2.7Å; A276-R278 VanDerWaalsContact C-N 3.32Å; A276-R278 PolarHBondContact O-N 2.74Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 2.87Å; R278-V281 PolarHBondContact O-N 3.01Å; R278-V281 VanDerWaalsContact O-N 3.15Å; R278-D282 IonicContact NH1-OD2 2.92Å; R278-D282 PolarHBondContact NH1-OD2 3.1Å; R278-D282 PolarHBondContact O-N 3.02Å
279	E	95	Very high	91.1	Very high	111 Å²	111	60.2 Å²	60.2	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-42.3	175.8	-73.9	-179.3	174.2	0	0	112.4	E275 A276 V281 D282 E283	E275-E279 WeakPolarHBondContact O-CG 3.46Å; E275-E279 PolarHBondContact O-N 3.1Å; A276-E279 PolarHBondContact O-N 2.71Å; E279-V281 VanDerWaalsContact C-N 3.32Å; E279-V281 PolarHBondContact O-N 2.83Å; E279-D282 PolarHBondContact O-N 3.43Å; E279-E283 WeakPolarHBondContact O-CB 3.34Å; E279-E283 PolarHBondContact O-N 3Å
280	L	94.4	Very high	90.5	Very high	21 Å²	21	56.8 Å²	56.8	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-37.5	176.4	-69	171.8	0	0	0	112.7	L248 K249 L253 A276 A277 R278 A284	L248-L280 HydrophobicContact CB-CD1 4.02Å; L248-L280 HydrophobicContact CD2-CB 4.41Å; L248-L280 HydrophobicContact CD2-CD1 4.18Å; L248-L280 HydrophobicContact CG-CD1 4.1Å; K249-L280 HydrophobicContact CB-CD1 4.26Å; L253-L280 HydrophobicContact CD1-CB 3.9Å; A276-L280 WeakPolarHBondContact O-CG 3.44Å; A276-L280 PolarHBondContact O-N 3.38Å; A277-L280 PolarHBondContact O-N 2.86Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 2.87Å; L280-A284 PolarHBondContact O-N 3.35Å
281	V	94.5	Very high	89.5	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-71.8	-37.6	176.4	174.1	0	0	0	0	111.2	L253 A265 I271 A277 R278 E279 A284 K285	L253-V281 HydrophobicContact CD1-CG2 3.97Å; A265-V281 HydrophobicContact CB-CG1 4.31Å; A265-V281 HydrophobicContact CB-CG2 4.12Å; I271-V281 HydrophobicContact CD1-CG2 4.45Å; I271-V281 HydrophobicContact CG2-CG2 3.96Å; A277-V281 PolarHBondContact O-N 3.24Å; R278-V281 PolarHBondContact O-N 3.01Å; R278-V281 VanDerWaalsContact O-N 3.15Å; E279-V281 VanDerWaalsContact C-N 3.32Å; E279-V281 PolarHBondContact O-N 2.83Å; V281-A284 PolarHBondContact O-N 2.92Å; V281-K285 WeakPolarHBondContact O-CG 3.27Å; V281-K285 PolarHBondContact O-N 3.13Å
282	D	92.9	Very high	88.1	Confident	49 Å²	49	68.2 Å²	68.2	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-71.3	-37.2	178.5	-68.3	-23.7	0	0	0	111.8	R278 E279 A284 K285 N286	R278-D282 IonicContact NH1-OD2 2.92Å; R278-D282 PolarHBondContact NH1-OD2 3.1Å; R278-D282 PolarHBondContact O-N 3.02Å; E279-D282 PolarHBondContact O-N 3.43Å; D282-A284 VanDerWaalsContact C-N 3.31Å; D282-A284 PolarHBondContact O-N 2.76Å; D282-K285 PolarHBondContact O-N 2.8Å; D282-K285 IonicContact OD1-NZ 2.8Å; D282-K285 PolarHBondContact OD1-NZ 2.65Å; D282-N286 PolarHBondContact O-N 3.28Å; D282-N286 PolarHBondContact O-ND2 2.82Å
283	E	92.4	Very high	87.2	Confident	76 Å²	76	67 Å²	67	36%	0.355	34%	0.34	S	S	.	.	H	α-helix	trans	-53	-48.6	168.2	-178.7	-169	136.5	0	0	111	E279 K285 N286 Y287 R301	E279-E283 WeakPolarHBondContact O-CB 3.34Å; E279-E283 PolarHBondContact O-N 3Å; E283-K285 PolarHBondContact O-N 3.39Å; E283-N286 PolarHBondContact O-N 3.26Å; E283-Y287 PolarHBondContact O-N 3.08Å; E283-R301 IonicContact OE1-CZ 3.98Å; E283-R301 IonicContact OE1-NE 3.99Å; E283-R301 PolarHBondContact OE1-NE 2.83Å; E283-R301 IonicContact OE1-NH2 2.67Å; E283-R301 PolarHBondContact OE1-NH2 2.84Å; E283-R301 VanDerWaalsContact OE1-NH2 3.17Å; E283-R301 IonicContact OE2-CZ 3.13Å; E283-R301 IonicContact OE2-NE 3.67Å; E283-R301 PolarHBondContact OE2-NE 2.9Å; E283-R301 IonicContact OE2-NH2 2.96Å; E283-R301 PolarHBondContact OE2-NH2 2.82Å
284	A	91	Very high	86.6	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65	-38.5	179.5	0	0	0	0	0	113.1	L253 P254 L261 L280 V281 D282 Y287 L288	L253-A284 HydrophobicContact CB-CB 3.58Å; P254-A284 HydrophobicContact CB-CB 4.49Å; P254-A284 HydrophobicContact CG-CB 4.1Å; L261-A284 HydrophobicContact CD1-CB 3.73Å; L261-A284 HydrophobicContact CD2-CB 4.14Å; L280-A284 PolarHBondContact O-N 3.35Å; V281-A284 PolarHBondContact O-N 2.92Å; D282-A284 VanDerWaalsContact C-N 3.31Å; D282-A284 PolarHBondContact O-N 2.76Å; A284-Y287 PolarHBondContact O-N 2.71Å; A284-L288 PolarHBondContact O-N 3Å
285	K	90.1	Very high	85.3	Confident	55 Å²	55	69.8 Å²	69.8	24%	0.239	35%	0.35	C	S	.	.	H	α-helix	trans	-63.6	-44.6	174.2	-69.9	171.6	-166.1	151.1	0	111.4	L261 V281 D282 E283 Y287 L288 L289	L261-K285 HydrophobicContact CB-CG 4.48Å; V281-K285 WeakPolarHBondContact O-CG 3.27Å; V281-K285 PolarHBondContact O-N 3.13Å; D282-K285 PolarHBondContact O-N 2.8Å; D282-K285 IonicContact OD1-NZ 2.8Å; D282-K285 PolarHBondContact OD1-NZ 2.65Å; E283-K285 PolarHBondContact O-N 3.39Å; K285-Y287 VanDerWaalsContact C-N 3.33Å; K285-Y287 PolarHBondContact O-N 3.13Å; K285-L288 PolarHBondContact O-N 2.76Å; K285-L288 VanDerWaalsContact O-N 3.12Å; K285-L289 WeakPolarHBondContact O-CG 3.35Å; K285-L289 PolarHBondContact O-N 3.23Å
286	N	88.4	Confident	84.3	Confident	90 Å²	90	70.7 Å²	70.7	48%	0.481	36%	0.358	S	S	.	.	H	α-helix	trans	-61.3	-42.1	179.2	-71	-21.6	0	0	0	111.6	D282 E283 L288 L289 L290	D282-N286 PolarHBondContact O-N 3.28Å; D282-N286 PolarHBondContact O-ND2 2.82Å; E283-N286 PolarHBondContact O-N 3.26Å; N286-L288 VanDerWaalsContact C-N 3.27Å; N286-L288 PolarHBondContact O-N 3.01Å; N286-L289 PolarHBondContact O-N 3.05Å; N286-L290 PolarHBondContact O-N 3.5Å; N286-L290 VanDerWaalsContact O-N 3.15Å
287	Y	85.6	Confident	83.3	Confident	31 Å²	31	72.2 Å²	72.2	12%	0.122	36%	0.36	C	S	.	.	H	α-helix	trans	-56	-40.7	173.4	178.7	-97.3	0	0	0	112.7	P254 E283 A284 K285 R294 L297 T302	P254-Y287 HydrophobicContact CB-CD1 3.6Å; P254-Y287 HydrophobicContact CB-CE1 4.12Å; P254-Y287 HydrophobicContact CB-CG 3.89Å; E283-Y287 PolarHBondContact O-N 3.08Å; A284-Y287 PolarHBondContact O-N 2.71Å; K285-Y287 VanDerWaalsContact C-N 3.33Å; K285-Y287 PolarHBondContact O-N 3.13Å; Y287-R294 HydrophobicContact CD2-CG 4.06Å; Y287-R294 HydrophobicContact CE1-CG 4.39Å; Y287-R294 HydrophobicContact CE2-CB 3.87Å; Y287-R294 HydrophobicContact CE2-CG 3.71Å; Y287-R294 WeakPolarHBondContact O-CG 3.24Å; Y287-R294 PolarHBondContact O-NE 3.19Å; Y287-L297 HydrophobicContact CD2-CB 3.9Å; Y287-L297 HydrophobicContact CD2-CD1 4.29Å; Y287-L297 HydrophobicContact CE2-CB 4.37Å; Y287-T302 HydrophobicContact CD2-CG2 3.82Å; Y287-T302 HydrophobicContact CE2-CG2 3.61Å; Y287-T302 HydrophobicContact CG-CG2 4.44Å
288	L	78.2	Confident	82.5	Confident	43 Å²	43	77.3 Å²	77.3	23%	0.225	38%	0.384	C	S	.	.	H	α-helix	trans	-74.3	-35.8	178.5	-66.8	-178.9	0	0	0	113	A258 L261 A284 K285 N286 L290 R294	A258-L288 HydrophobicContact CB-CD1 3.91Å; L261-L288 HydrophobicContact CD1-CD1 3.68Å; A284-L288 PolarHBondContact O-N 3Å; K285-L288 PolarHBondContact O-N 2.76Å; K285-L288 VanDerWaalsContact O-N 3.12Å; N286-L288 VanDerWaalsContact C-N 3.27Å; N286-L288 PolarHBondContact O-N 3.01Å; L288-L290 VanDerWaalsContact C-N 3.32Å; L288-L290 PolarHBondContact O-N 3.21Å; L288-R294 PolarHBondContact O-NH2 2.84Å
289	L	82.9	Confident	81.7	Confident	133 Å²	133	74.3 Å²	74.3	70%	0.696	38%	0.382	S	S	*	.	H	α-helix	trans	-72.5	-19.3	-179.5	-71.6	171.3	0	0	0	114.1	K285 N286 P291	K285-L289 WeakPolarHBondContact O-CG 3.35Å; K285-L289 PolarHBondContact O-N 3.23Å; N286-L289 PolarHBondContact O-N 3.05Å; L289-P291 WeakPolarHBondContact O-CD 3.17Å
290	L	79.3	Confident	80.9	Confident	69 Å²	69	74.4 Å²	74.4	36%	0.361	39%	0.393	S	S	.	.			trans	-117.2	65.5	-175	-60.8	167.6	0	0	0	113.4	N286 L288 Q292 E293 R294	N286-L290 PolarHBondContact O-N 3.5Å; N286-L290 VanDerWaalsContact O-N 3.15Å; L288-L290 VanDerWaalsContact C-N 3.32Å; L288-L290 PolarHBondContact O-N 3.21Å; L290-Q292 VanDerWaalsContact C-N 3.27Å; L290-Q292 PolarHBondContact O-N 2.94Å; L290-Q292 VanDerWaalsContact O-N 3.15Å; L290-E293 HydrophobicContact CB-CB 4.16Å; L290-E293 PolarHBondContact O-N 3.44Å; L290-R294 WeakPolarHBondContact O-CG 3.4Å; L290-R294 PolarHBondContact O-N 2.89Å
291	P	69	Low	80.6	Confident	79 Å²	79	76.7 Å²	76.7	51%	0.513	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-37.2	-177.1	-25.8	32.5	0	0	0	115.2	L289 E293	L289-P291 WeakPolarHBondContact O-CD 3.17Å; P291-E293 VanDerWaalsContact C-N 3.3Å; P291-E293 PolarHBondContact O-N 2.84Å
292	Q	65	Low	79.8	Confident	190 Å²	190	77 Å²	77	89%	0.888	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.7	-178.5	-62.4	-174	11.4	0	0	112.8	L290	L290-Q292 VanDerWaalsContact C-N 3.27Å; L290-Q292 PolarHBondContact O-N 2.94Å; L290-Q292 VanDerWaalsContact O-N 3.15Å
293	E	72.6	Confident	78.9	Confident	98 Å²	98	80.4 Å²	80.4	46%	0.458	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-7.6	-178	-59	-174.7	179.6	0	0	113.1	L290 P291 P295 L296 L297	L290-E293 HydrophobicContact CB-CB 4.16Å; L290-E293 PolarHBondContact O-N 3.44Å; P291-E293 VanDerWaalsContact C-N 3.3Å; P291-E293 PolarHBondContact O-N 2.84Å; E293-P295 VanDerWaalsContact C-N 3.25Å; E293-P295 VanDerWaalsContact O-N 3.1Å; E293-L296 WeakPolarHBondContact O-CA 3.16Å; E293-L296 WeakPolarHBondContact O-CB 3.38Å; E293-L296 PolarHBondContact O-N 3.36Å; E293-L297 HydrophobicContact CB-CD1 4.46Å; E293-L297 PolarHBondContact O-N 2.87Å
294	R	77.7	Confident	77.7	Confident	69 Å²	69	79.5 Å²	79.5	26%	0.26	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-36	177.4	-70.5	-177.7	-174.3	158.7	4.6	114.8	Y287 L288 L290 L296 L297 Q298	Y287-R294 HydrophobicContact CD2-CG 4.06Å; Y287-R294 HydrophobicContact CE1-CG 4.39Å; Y287-R294 HydrophobicContact CE2-CB 3.87Å; Y287-R294 HydrophobicContact CE2-CG 3.71Å; Y287-R294 WeakPolarHBondContact O-CG 3.24Å; Y287-R294 PolarHBondContact O-NE 3.19Å; L288-R294 PolarHBondContact O-NH2 2.84Å; L290-R294 WeakPolarHBondContact O-CG 3.4Å; L290-R294 PolarHBondContact O-N 2.89Å; R294-L296 PolarHBondContact O-N 3.38Å; R294-L297 PolarHBondContact O-N 3.31Å; R294-Q298 PolarHBondContact O-NE2 3.39Å
295	P	66.6	Low	77	Confident	81 Å²	81	80.3 Å²	80.3	53%	0.526	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.3	174.5	-25.1	35.9	0	0	0	113.8	E293 Q298	E293-P295 VanDerWaalsContact C-N 3.25Å; E293-P295 VanDerWaalsContact O-N 3.1Å; P295-Q298 WeakPolarHBondContact O-CG 3.46Å
296	L	71.6	Confident	75.7	Confident	152 Å²	152	82.5 Å²	82.5	80%	0.796	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-22.7	178.2	-58.9	172.5	0	0	0	112.5	E293 R294 Q298	E293-L296 WeakPolarHBondContact O-CA 3.16Å; E293-L296 WeakPolarHBondContact O-CB 3.38Å; E293-L296 PolarHBondContact O-N 3.36Å; R294-L296 PolarHBondContact O-N 3.38Å; L296-Q298 VanDerWaalsContact C-N 3.29Å; L296-Q298 PolarHBondContact O-N 3.26Å
297	L	74.1	Confident	74.3	Confident	73 Å²	73	78.9 Å²	78.9	38%	0.382	40%	0.401	S	S	.	.	S	Bend	trans	-90.5	17.3	-178.2	-60.8	174.8	0	0	0	113.3	Y287 E293 R294 T302	Y287-L297 HydrophobicContact CD2-CB 3.9Å; Y287-L297 HydrophobicContact CD2-CD1 4.29Å; Y287-L297 HydrophobicContact CE2-CB 4.37Å; E293-L297 HydrophobicContact CB-CD1 4.46Å; E293-L297 PolarHBondContact O-N 2.87Å; R294-L297 PolarHBondContact O-N 3.31Å; L297-T302 WeakPolarHBondContact O-CG2 3.4Å
298	Q	76.2	Confident	72.6	Confident	107 Å²	107	81.3 Å²	81.3	50%	0.5	42%	0.415	S	S	.	.			trans	-71.1	136.8	-177.6	-66.4	-59.2	-46.1	0	0	112	R294 P295 L296 T302	R294-Q298 PolarHBondContact O-NE2 3.39Å; P295-Q298 WeakPolarHBondContact O-CG 3.46Å; L296-Q298 VanDerWaalsContact C-N 3.29Å; L296-Q298 PolarHBondContact O-N 3.26Å; Q298-T302 WeakPolarHBondContact CA-OG1 3.44Å; Q298-T302 PolarHBondContact OE1-OG1 3.48Å
299	G	77.7	Confident	71.1	Confident	32 Å²	32	87.6 Å²	87.6	33%	0.33	44%	0.436	S	S	.	.	S	Bend	trans	-163.8	-177.2	178.2	0	0	0	0	0	112.8	R301 T302 R303	G299-R301 PolarHBondContact O-N 3.29Å; G299-R301 VanDerWaalsContact O-N 3.14Å; G299-T302 PolarHBondContact N-OG1 2.79Å; G299-T302 PolarHBondContact O-N 2.6Å; G299-T302 PolarHBondContact O-OG1 3.13Å; G299-R303 PolarHBondContact O-N 3.32Å
300	P	79.3	Confident	69.5	Low	114 Å²	114	84.6 Å²	84.6	74%	0.74	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-33.1	-179.8	-25.8	34.6	0	0	0	113.6
301	R	87.8	Confident	68	Low	69 Å²	69	82.1 Å²	82.1	26%	0.26	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-13.7	178.9	-72.2	-177	-72.2	-91.1	8.3	114.9	R252 P254 E283 G299	R252-R301 VanDerWaalsContact CB-O 3.29Å; R252-R301 WeakPolarHBondContact CB-O 3.39Å; P254-R301 HydrophobicContact CG-CB 4.23Å; E283-R301 IonicContact OE1-CZ 3.98Å; E283-R301 IonicContact OE1-NE 3.99Å; E283-R301 PolarHBondContact OE1-NE 2.83Å; E283-R301 IonicContact OE1-NH2 2.67Å; E283-R301 PolarHBondContact OE1-NH2 2.84Å; E283-R301 VanDerWaalsContact OE1-NH2 3.17Å; E283-R301 IonicContact OE2-CZ 3.13Å; E283-R301 IonicContact OE2-NE 3.67Å; E283-R301 PolarHBondContact OE2-NE 2.9Å; E283-R301 IonicContact OE2-NH2 2.96Å; E283-R301 PolarHBondContact OE2-NH2 2.82Å; G299-R301 PolarHBondContact O-N 3.29Å; G299-R301 VanDerWaalsContact O-N 3.14Å
302	T	77.8	Confident	67.2	Low	7 Å²	7	79.9 Å²	79.9	4%	0.043	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-8.8	173.8	66	0	0	0	0	112	P254 Y287 L297 Q298 G299	P254-T302 HydrophobicContact CB-CG2 4.03Å; P254-T302 HydrophobicContact CG-CG2 4.14Å; Y287-T302 HydrophobicContact CD2-CG2 3.82Å; Y287-T302 HydrophobicContact CE2-CG2 3.61Å; Y287-T302 HydrophobicContact CG-CG2 4.44Å; L297-T302 WeakPolarHBondContact O-CG2 3.4Å; Q298-T302 WeakPolarHBondContact CA-OG1 3.44Å; Q298-T302 PolarHBondContact OE1-OG1 3.48Å; G299-T302 PolarHBondContact N-OG1 2.79Å; G299-T302 PolarHBondContact O-N 2.6Å; G299-T302 PolarHBondContact O-OG1 3.13Å
303	R	74.2	Confident	66.7	Low	120 Å²	120	71.8 Å²	71.8	45%	0.453	35%	0.353	S	S	.	.	S	Bend	trans	-78.2	123.7	178	179.7	175	164.8	166.7	-6.6	110	D215 R252 G299	D215-R303 IonicContact OD1-NE 3.84Å; D215-R303 IonicContact OD2-CZ 2.83Å; D215-R303 IonicContact OD2-NE 2.81Å; D215-R303 PolarHBondContact OD2-NE 3.34Å; D215-R303 VanDerWaalsContact OD2-NE 3.13Å; D215-R303 IonicContact OD2-NH1 3.29Å; D215-R303 IonicContact OD2-NH2 3.38Å; D215-R303 PolarHBondContact OD2-NH2 2.66Å; R252-R303 WeakPolarHBondContact CD-O 3.45Å; R252-R303 PolarHBondContact NH1-O 3.1Å; G299-R303 PolarHBondContact O-N 3.32Å
304	H	67.5	Low	66.4	Low	57 Å²	57	67.1 Å²	67.1	26%	0.264	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-65.6	152.2	176.8	-69	-96.7	0	0	0	113.4	R252 L255 A603	R252-H304 PolarHBondContact NH1-O 3.49Å; L255-H304 HydrophobicContact CD1-CB 4.4Å; H304-A603 HydrophobicContact CB-CB 4.27Å; H304-A603 WeakPolarHBondContact ND1-CB 3.13Å
305	R	74.5	Confident	65.8	Low	18 Å²	18	63.8 Å²	63.8	7%	0.068	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-67	146.4	168.6	-62.8	-163.1	-164.4	-92.3	-8.5	109.8	I212 S214 D215 E222 Y250 R252 P307	I212-R305 PolarHBondContact O-NH1 3.02Å; I212-R305 PolarHBondContact O-NH2 3.12Å; S214-R305 PolarHBondContact O-NH1 2.91Å; D215-R305 CarbonylContact O-C 3.38Å; D215-R305 VanDerWaalsContact O-CA 3.28Å; D215-R305 WeakPolarHBondContact O-CA 3.47Å; D215-R305 WeakPolarHBondContact O-CB 3.48Å; E222-R305 WeakPolarHBondContact OE1-CD 3.2Å; E222-R305 WeakPolarHBondContact OE1-CG 3.41Å; E222-R305 IonicContact OE1-CZ 3.74Å; E222-R305 IonicContact OE1-NE 3.07Å; E222-R305 PolarHBondContact OE1-NE 2.93Å; E222-R305 IonicContact OE1-NH2 2.7Å; E222-R305 PolarHBondContact OE1-NH2 3.31Å; E222-R305 IonicContact OE2-CZ 3.79Å; E222-R305 IonicContact OE2-NE 3.92Å; E222-R305 IonicContact OE2-NH2 2.99Å; E222-R305 PolarHBondContact OE2-NH2 2.82Å; Y250-R305 PolarHBondContact O-NH2 3.19Å; R252-R305 VanDerWaalsContact CZ-CG 3.43Å; R252-R305 VanDerWaalsContact NH1-N 3.16Å; R305-P307 VanDerWaalsContact C-CD 3.47Å; R305-P307 WeakPolarHBondContact O-CD 3.24Å
306	K	63.9	Low	65.3	Low	100 Å²	100	60 Å²	60	44%	0.435	30%	0.295	S	S	.	.			trans	-122.9	60.8	-175	-63.4	179.6	179	174	0	110.2	D215 I308	D215-K306 PolarHBondContact O-N 2.85Å; K306-I308 PolarHBondContact O-N 2.88Å
307	P	58.7	Low	64.5	Low	14 Å²	14	53 Å²	53	9%	0.091	26%	0.258	C	S	.	.			trans	-52.9	122.9	-177.6	22.5	-31.9	0	0	0	110.5	N218 R305 R309 Y310	N218-P307 HydrophobicContact CB-CB 4.38Å; R305-P307 VanDerWaalsContact C-CD 3.47Å; R305-P307 WeakPolarHBondContact O-CD 3.24Å; P307-R309 PolarHBondContact O-N 2.69Å; P307-Y310 PolarHBondContact O-N 2.99Å
308	I	49.3	Very low	63.6	Low	82 Å²	82	49.8 Å²	49.8	42%	0.421	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.7	104	172.2	-76	137.3	0	0	0	108.6	E216 K306	E216-I308 HydrophobicContact CB-CD1 4.31Å; E216-I308 HydrophobicContact CG-CD1 3.98Å; E216-I308 VanDerWaalsContact OE2-CD1 3.27Å; E216-I308 WeakPolarHBondContact OE2-CD1 3.45Å; E216-I308 WeakPolarHBondContact OE2-CG1 3.42Å; E216-I308 PolarHBondContact OE2-N 3.28Å; K306-I308 PolarHBondContact O-N 2.88Å
309	R	47.6	Very low	62	Low	176 Å²	176	45.8 Å²	45.8	66%	0.664	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	105.4	-4.5	170.6	-61.8	-174.4	-102.5	-149	0.1	120.9	P307 N554	P307-R309 PolarHBondContact O-N 2.69Å; R309-N554 VanDerWaalsContact O-CG 3.25Å; R309-N554 PolarHBondContact O-ND2 3.47Å; R309-N554 PolarHBondContact O-OD1 3.13Å
310	Y	48.9	Very low	60.1	Low	69 Å²	69	47.2 Å²	47.2	27%	0.271	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.2	8.3	-171.4	-58.1	-73.1	0	0	0	118.2	P307 R342	P307-Y310 PolarHBondContact O-N 2.99Å; Y310-R342 HydrophobicContact CD1-CG 3.44Å; Y310-R342 VanDerWaalsContact CD1-CG 3.44Å; Y310-R342 HydrophobicContact CE1-CG 3.98Å; Y310-R342 HydrophobicContact CG-CG 4.13Å
311	G	48	Very low	57.8	Low	18 Å²	18	42.9 Å²	42.9	19%	0.186	19%	0.191	C	C	.	.			trans	-92.8	-6.3	-172	0	0	0	0	0	117.3	R601 L602	G311-R601 CarbonylContact O-C 3.51Å; G311-R601 WeakPolarHBondContact O-CA 3.42Å; G311-L602 PolarHBondContact O-N 2.6Å; G311-L602 VanDerWaalsContact O-O 3.1Å
312	E	51.3	Low	54.8	Low	31 Å²	31	49.2 Å²	49.2	15%	0.145	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.1	-176.6	-56.1	-164.9	143.7	0	0	110.8	P341 V553 N554 V599 R601	E312-P341 WeakPolarHBondContact O-CG 3.38Å; E312-V553 HydrophobicContact CB-CG1 3.81Å; E312-V553 WeakPolarHBondContact O-CG1 3.21Å; E312-N554 PolarHBondContact N-OD1 3.04Å; E312-N554 PolarHBondContact OE2-N 3.22Å; E312-V599 HydrophobicContact CB-CG1 3.88Å; E312-R601 HydrophobicContact CG-CG 4.18Å; E312-R601 IonicContact OE1-CZ 2.99Å; E312-R601 VanDerWaalsContact OE1-CZ 3.29Å; E312-R601 IonicContact OE1-NE 3.51Å; E312-R601 PolarHBondContact OE1-NE 2.76Å; E312-R601 IonicContact OE1-NH2 3.54Å; E312-R601 PolarHBondContact OE1-NH2 3.4Å
313	V	56	Low	52.2	Low	20 Å²	20	52.5 Å²	52.5	12%	0.121	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.1	178.5	178	0	0	0	0	108.6	Y315 R338 L339 V600 L602	V313-Y315 HydrophobicContact CB-CE2 3.99Å; V313-Y315 HydrophobicContact CG1-CD2 4.15Å; V313-Y315 HydrophobicContact CG1-CE2 3.54Å; V313-R338 HydrophobicContact CG1-CB 4.16Å; V313-L339 WeakPolarHBondContact CG1-O 3.5Å; V313-V600 PolarHBondContact N-O 2.81Å; V313-V600 PolarHBondContact O-N 3.3Å; V313-L602 HydrophobicContact CB-CB 4.43Å; V313-L602 HydrophobicContact CB-CD1 4.15Å; V313-L602 HydrophobicContact CG1-CD1 4.35Å; V313-L602 HydrophobicContact CG2-CB 3.96Å; V313-L602 HydrophobicContact CG2-CD1 4.32Å
314	M	65.6	Low	49.9	Very low	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.7	180	-171.8	169.4	55.5	0	0	110.7	R338 L339 W346 A551 V553 Y558 V560 V597 V599	M314-R338 CarbonylContact O-C 3.58Å; M314-R338 WeakPolarHBondContact O-CA 3.41Å; M314-L339 HydrophobicContact CB-CB 4.19Å; M314-L339 HydrophobicContact CE-CB 4.3Å; M314-L339 HydrophobicContact CE-CD2 3.52Å; M314-L339 PolarHBondContact O-N 2.72Å; M314-W346 HydrophobicContact CE-CH2 3.74Å; M314-W346 HydrophobicContact CE-CZ2 3.8Å; M314-A551 HydrophobicContact CG-CB 4.4Å; M314-A551 HydrophobicContact SD-CB 3.77Å; M314-V553 HydrophobicContact CB-CG2 3.73Å; M314-V553 HydrophobicContact CG-CG2 4.1Å; M314-V553 HydrophobicContact SD-CG2 3.89Å; M314-Y558 HydrophobicContact CE-CD1 4.4Å; M314-Y558 HydrophobicContact CE-CG 4.25Å; M314-V560 HydrophobicContact CE-CG2 3.47Å; M314-V560 VanDerWaalsContact CE-CG2 3.47Å; M314-V560 HydrophobicContact SD-CG2 3.68Å; M314-V597 HydrophobicContact CG-CG1 3.36Å; M314-V597 HydrophobicContact SD-CG1 3.6Å; M314-V599 HydrophobicContact CG-CG2 4.35Å
315	Y	65.8	Low	47.9	Very low	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.2	-177	-83.6	-82.3	0	0	0	109.1	V313 M336 E337 R338 V349 Y386 P388 V597 G598 V600 L602	V313-Y315 HydrophobicContact CB-CE2 3.99Å; V313-Y315 HydrophobicContact CG1-CD2 4.15Å; V313-Y315 HydrophobicContact CG1-CE2 3.54Å; Y315-M336 HydrophobicContact CD1-CE 3.29Å; Y315-M336 HydrophobicContact CD1-SD 4.15Å; Y315-M336 HydrophobicContact CE1-CE 4.36Å; Y315-M336 HydrophobicContact CG-CE 3.7Å; Y315-E337 WeakPolarHBondContact CA-O 3.42Å; Y315-R338 HydrophobicContact CD1-CB 3.77Å; Y315-R338 HydrophobicContact CE1-CB 3.49Å; Y315-R338 VanDerWaalsContact CE1-CB 3.49Å; Y315-R338 HydrophobicContact CE1-CG 4.48Å; Y315-R338 HydrophobicContact CG-CB 4.47Å; Y315-V349 HydrophobicContact CE1-CG1 4.25Å; Y315-V349 HydrophobicContact CE1-CG2 4.39Å; Y315-Y386 HydrophobicContact CD1-CE1 4.24Å; Y315-Y386 HydrophobicContact CE1-CD1 4.37Å; Y315-Y386 AromaticContact CE1-CE1 3.57Å; Y315-Y386 HydrophobicContact CE1-CE1 3.57Å; Y315-P388 HydrophobicContact CE2-CG 4.46Å; Y315-V597 CarbonylContact O-C 3.54Å; Y315-V597 VanDerWaalsContact O-CA 3.25Å; Y315-V597 WeakPolarHBondContact O-CA 3.42Å; Y315-G598 WeakPolarHBondContact CA-O 3.27Å; Y315-G598 WeakPolarHBondContact CB-O 3.44Å; Y315-G598 PolarHBondContact N-O 3.26Å; Y315-G598 PolarHBondContact O-N 2.99Å; Y315-V600 HydrophobicContact CD2-CB 3.85Å; Y315-V600 HydrophobicContact CD2-CG2 3.63Å; Y315-V600 HydrophobicContact CE2-CB 3.8Å; Y315-V600 HydrophobicContact CE2-CG2 3.93Å; Y315-V600 HydrophobicContact CG-CG2 4.45Å; Y315-L602 HydrophobicContact CE2-CD1 3.52Å; Y315-L602 HydrophobicContact CE2-CG 4.46Å; Y315-L602 WeakPolarHBondContact OH-CD1 3.43Å
316	A	56.3	Low	45.7	Very low	2 Å²	2	55 Å²	55	2%	0.017	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	114.5	177.9	0	0	0	0	0	110.9	E337 W346 V560 M588 V597	A316-E337 PolarHBondContact N-O 3.45Å; A316-E337 PolarHBondContact O-N 2.93Å; A316-E337 VanDerWaalsContact O-N 3.14Å; A316-W346 HydrophobicContact CB-CH2 3.87Å; A316-W346 HydrophobicContact CB-CZ3 3.54Å; A316-V560 HydrophobicContact CB-CG1 4.35Å; A316-M588 HydrophobicContact CB-SD 3.97Å; A316-V597 HydrophobicContact CB-CG2 4.06Å
317	A	55	Low	43.8	Very low	4 Å²	4	61.4 Å²	61.4	3%	0.033	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137.8	164.9	0	0	0	0	0	109.3	V361 G596	A317-V361 HydrophobicContact CB-CG2 4.2Å; A317-G596 WeakPolarHBondContact CA-O 3.22Å; A317-G596 PolarHBondContact N-O 2.85Å; A317-G596 CarbonylContact O-C 3.58Å; A317-G596 WeakPolarHBondContact O-CA 3.47Å; A317-G596 PolarHBondContact O-N 2.95Å
318	G	53.7	Low	42.4	Very low	5 Å²	5	64.7 Å²	64.7	5%	0.052	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	174.3	-177.4	0	0	0	0	0	112.1	I333 R592	G318-I333 WeakPolarHBondContact O-CD1 3.28Å; G318-I333 WeakPolarHBondContact O-CG1 3.12Å; G318-R592 PolarHBondContact O-NH1 2.94Å; G318-R592 VanDerWaalsContact O-NH1 3.14Å
319	M	43	Very low	41.8	Very low	24 Å²	24	65.1 Å²	65.1	12%	0.118	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	150.7	-177.8	-76.4	-177.2	-82.8	0	0	113.5	F321 C357 R592 L593	M319-F321 HydrophobicContact CB-CD2 4.42Å; M319-F321 HydrophobicContact CB-CE2 3.96Å; M319-F321 HydrophobicContact SD-CE2 4.25Å; M319-C357 HydrophobicContact CE-CB 4.24Å; M319-C357 HydrophobicContact CG-CB 3.54Å; M319-C357 HydrophobicContact SD-CB 3.56Å; M319-C357 VanDerWaalsContact SD-CB 3.56Å; M319-R592 WeakPolarHBondContact O-CA 3.44Å; M319-L593 HydrophobicContact CB-CB 4.44Å; M319-L593 WeakPolarHBondContact CB-O 3.4Å; M319-L593 HydrophobicContact CE-CB 3.81Å; M319-L593 HydrophobicContact CE-CD2 3.34Å; M319-L593 HydrophobicContact CE-CG 3.56Å; M319-L593 WeakPolarHBondContact CE-O 3.2Å; M319-L593 PolarHBondContact N-O 3.03Å
320	F	37	Very low	41.9	Very low	62 Å²	62	58.8 Å²	58.8	27%	0.272	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.3	169.5	170	-113.7	0	0	0	109.3	R322 I333 Y590	F320-R322 HydrophobicContact CE1-CB 4.22Å; F320-I333 HydrophobicContact CB-CD1 3.33Å; F320-I333 HydrophobicContact CB-CG1 4.21Å; F320-I333 HydrophobicContact CB-CG2 3.89Å; F320-Y590 AromaticContact CD2-CD1 3.97Å; F320-Y590 HydrophobicContact CD2-CD1 3.97Å; F320-Y590 AromaticContact CD2-CG 3.94Å; F320-Y590 HydrophobicContact CD2-CG 3.94Å; F320-Y590 AromaticContact CE2-CD1 3.22Å; F320-Y590 HydrophobicContact CE2-CD1 3.22Å; F320-Y590 HydrophobicContact CE2-CE1 4.06Å; F320-Y590 AromaticContact CE2-CG 3.67Å; F320-Y590 HydrophobicContact CE2-CG 3.67Å; F320-Y590 AromaticContact CZ-CD1 3.68Å; F320-Y590 HydrophobicContact CZ-CD1 3.68Å; F320-Y590 HydrophobicContact CZ-CE1 4.06Å; F320-Y590 HydrophobicContact CZ-CG 4.4Å
321	F	31.4	Very low	42.5	Very low	22 Å²	22	60 Å²	60	10%	0.096	36%	0.361	C	S	.	.			trans	-117.8	119.1	178.1	-72.8	-113	0	0	0	109.7	M319 C328 S329 Y568	M319-F321 HydrophobicContact CB-CD2 4.42Å; M319-F321 HydrophobicContact CB-CE2 3.96Å; M319-F321 HydrophobicContact SD-CE2 4.25Å; F321-C328 HydrophobicContact CD1-CB 4.32Å; F321-S329 WeakPolarHBondContact CD1-O 3.48Å; F321-S329 VanDerWaalsContact CE1-C 3.45Å; F321-Y568 HydrophobicContact CD1-CD2 4.2Å; F321-Y568 AromaticContact CD1-CE2 3.79Å; F321-Y568 HydrophobicContact CD1-CE2 3.79Å; F321-Y568 HydrophobicContact CD2-CD2 4.02Å; F321-Y568 HydrophobicContact CD2-CE2 4.08Å; F321-Y568 HydrophobicContact CD2-CG 4.33Å; F321-Y568 HydrophobicContact CE1-CD2 4.2Å; F321-Y568 AromaticContact CE1-CE2 3.39Å; F321-Y568 HydrophobicContact CE1-CE2 3.39Å; F321-Y568 AromaticContact CE1-CZ 3.7Å; F321-Y568 HydrophobicContact CE2-CD1 4.33Å; F321-Y568 HydrophobicContact CE2-CD2 4.14Å; F321-Y568 HydrophobicContact CE2-CE1 4.04Å; F321-Y568 AromaticContact CE2-CE2 3.83Å; F321-Y568 HydrophobicContact CE2-CE2 3.83Å; F321-Y568 HydrophobicContact CE2-CG 4.37Å; F321-Y568 AromaticContact CE2-CZ 3.76Å; F321-Y568 HydrophobicContact CG-CD2 4.06Å; F321-Y568 HydrophobicContact CG-CE2 4.07Å; F321-Y568 HydrophobicContact CZ-CD2 4.21Å; F321-Y568 AromaticContact CZ-CE1 4Å; F321-Y568 HydrophobicContact CZ-CE1 4Å; F321-Y568 AromaticContact CZ-CE2 3.45Å; F321-Y568 HydrophobicContact CZ-CE2 3.45Å; F321-Y568 VanDerWaalsContact CZ-CE2 3.45Å; F321-Y568 AromaticContact CZ-CZ 3.31Å; F321-Y568 VanDerWaalsContact CZ-OH 3.31Å; F321-Y568 WeakPolarHBondContact CZ-OH 3.39Å
322	R	25.5	Very low	43.3	Very low	202 Å²	202	59.3 Å²	59.3	76%	0.762	35%	0.353	S	S	*	.			trans	-90.1	112.7	167.2	-161.2	179.8	-173	-170.3	2	107.7	F320 V324	F320-R322 HydrophobicContact CE1-CB 4.22Å; R322-V324 VanDerWaalsContact C-N 3.29Å; R322-V324 HydrophobicContact CB-CG2 4.3Å; R322-V324 HydrophobicContact CG-CG2 3.76Å; R322-V324 PolarHBondContact O-N 3.07Å
323	A	23.4	Very low	44.2	Very low	76 Å²	76	58.8 Å²	58.8	63%	0.628	35%	0.351	S	S	*	.			trans	-69.3	91.1	168	0	0	0	0	0	108.3
324	V	24.5	Very low	45.1	Very low	105 Å²	105	58.8 Å²	58.8	64%	0.636	35%	0.353	S	S	*	.	S	Bend	trans	-102.7	109.2	164	-171.7	0	0	0	0	106.1	R322 G326	R322-V324 VanDerWaalsContact C-N 3.29Å; R322-V324 HydrophobicContact CB-CG2 4.3Å; R322-V324 HydrophobicContact CG-CG2 3.76Å; R322-V324 PolarHBondContact O-N 3.07Å; V324-G326 PolarHBondContact O-N 2.9Å
325	G	26.8	Very low	45.6	Very low	76 Å²	76	60.7 Å²	60.7	78%	0.784	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	20.8	166.6	0	0	0	0	0	118.1
326	G	27.6	Very low	46.2	Very low	68 Å²	68	60.7 Å²	60.7	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	8.5	162.1	0	0	0	0	0	117.6	V324	V324-G326 PolarHBondContact O-N 2.9Å
327	W	24.4	Very low	47.2	Very low	233 Å²	233	60.6 Å²	60.6	88%	0.883	37%	0.366	S	S	*	.			trans	-123.9	111.5	171.9	-71.2	65.6	0	0	0	109.6	S329	W327-S329 PolarHBondContact O-N 2.83Å
328	C	28.4	Very low	48.5	Very low	84 Å²	84	61.9 Å²	61.9	57%	0.568	37%	0.37	S	S	*	.			trans	-88.3	80.7	-177.7	-65.8	0	0	0	0	111.6	F321	F321-C328 HydrophobicContact CD1-CB 4.32Å
329	S	38.2	Very low	49.4	Very low	91 Å²	91	61.7 Å²	61.7	64%	0.636	37%	0.368	S	S	*	.			trans	-85.7	135.7	164.9	56.5	0	0	0	0	110.4	F321 W327	F321-S329 WeakPolarHBondContact CD1-O 3.48Å; F321-S329 VanDerWaalsContact CE1-C 3.45Å; W327-S329 PolarHBondContact O-N 2.83Å
330	G	50.1	Low	50.6	Low	42 Å²	42	62.5 Å²	62.5	43%	0.433	37%	0.373	S	S	.	.			trans	-90.5	109.1	-173.5	0	0	0	0	0	114.8
331	D	60.7	Low	51.8	Low	95 Å²	95	60.8 Å²	60.8	51%	0.508	37%	0.368	S	S	.	.			trans	-88.2	139.9	175	-70.6	-18.8	0	0	0	111.2
332	A	64.3	Low	53	Low	3 Å²	3	67 Å²	67	3%	0.025	39%	0.391	C	S	.	.			trans	-60.3	145	164.5	0	0	0	0	0	109.6	R355 C357 H374	A332-R355 HydrophobicContact CB-CB 3.96Å; A332-R355 WeakPolarHBondContact O-CB 3.19Å; A332-R355 VanDerWaalsContact O-CD 3.31Å; A332-R355 WeakPolarHBondContact O-CD 3.3Å; A332-C357 HydrophobicContact CB-CB 4.05Å; A332-H374 WeakPolarHBondContact CB-O 3.35Å
333	I	69.5	Low	54.8	Low	20 Å²	20	60.5 Å²	60.5	10%	0.103	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-135.6	163.8	179	67.2	157	0	0	0	113.6	G318 F320 S335 R355 R356	G318-I333 WeakPolarHBondContact O-CD1 3.28Å; G318-I333 WeakPolarHBondContact O-CG1 3.12Å; F320-I333 HydrophobicContact CB-CD1 3.33Å; F320-I333 HydrophobicContact CB-CG1 4.21Å; F320-I333 HydrophobicContact CB-CG2 3.89Å; I333-S335 WeakPolarHBondContact CD1-OG 3.35Å; I333-R355 CarbonylContact O-C 3.54Å; I333-R355 WeakPolarHBondContact O-CA 3.42Å; I333-R356 PolarHBondContact O-N 2.75Å
334	A	76.9	Confident	57	Low	20 Å²	20	60.2 Å²	60.2	17%	0.165	36%	0.361	C	S	.	.			trans	-103.3	-16.8	178.2	0	0	0	0	0	113.6	P351 M352 R355	A334-P351 HydrophobicContact CB-CB 4.13Å; A334-P351 CarbonylContact O-C 3.57Å; A334-P351 WeakPolarHBondContact O-CA 3.3Å; A334-M352 HydrophobicContact CB-CB 4.17Å; A334-M352 WeakPolarHBondContact CB-O 3.42Å; A334-M352 PolarHBondContact O-N 2.94Å; A334-R355 HydrophobicContact CB-CG 4.24Å
335	S	75.5	Confident	59.2	Low	41 Å²	41	60.4 Å²	60.4	29%	0.287	36%	0.355	S	S	.	.			trans	-75.2	153.2	-171.1	73.3	0	0	0	0	112.6	I333 R592	I333-S335 WeakPolarHBondContact CD1-OG 3.35Å; S335-R592 PolarHBondContact O-NH1 3.37Å; S335-R592 PolarHBondContact OG-NH2 2.86Å
336	M	78.2	Confident	61.5	Low	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.7	-172.2	-173.8	-171.8	-169.3	0	0	110.2	Y315 C348 V349 L368 Y386 W393	Y315-M336 HydrophobicContact CD1-CE 3.29Å; Y315-M336 HydrophobicContact CD1-SD 4.15Å; Y315-M336 HydrophobicContact CE1-CE 4.36Å; Y315-M336 HydrophobicContact CG-CE 3.7Å; M336-C348 WeakPolarHBondContact O-CA 3.35Å; M336-V349 HydrophobicContact CB-CG2 3.69Å; M336-V349 HydrophobicContact CG-CG2 3.64Å; M336-V349 PolarHBondContact O-N 2.8Å; M336-V349 HydrophobicContact SD-CG2 3.52Å; M336-V349 VanDerWaalsContact SD-CG2 3.52Å; M336-L368 HydrophobicContact CE-CD2 3Å; M336-L368 HydrophobicContact CE-CG 4.46Å; M336-L368 HydrophobicContact SD-CD2 4.17Å; M336-Y386 HydrophobicContact SD-CD1 4.42Å; M336-W393 HydrophobicContact CE-CZ2 4.48Å; M336-W393 HydrophobicContact SD-CH2 4.34Å; M336-W393 HydrophobicContact SD-CZ2 3.48Å; M336-W393 WeakPolarHBondContact SD-CZ2 3.48Å
337	E	77.7	Confident	63.9	Low	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.7	175.6	-70.3	168.9	-101.9	0	0	111.7	Y315 A316 W346 K347 N589 R592	Y315-E337 WeakPolarHBondContact CA-O 3.42Å; A316-E337 PolarHBondContact N-O 3.45Å; A316-E337 PolarHBondContact O-N 2.93Å; A316-E337 VanDerWaalsContact O-N 3.14Å; E337-W346 HydrophobicContact CB-CE3 3.75Å; E337-W346 HydrophobicContact CB-CZ3 4.31Å; E337-K347 CarbonylContact C-O 3.5Å; E337-K347 VanDerWaalsContact CA-O 3.23Å; E337-K347 WeakPolarHBondContact CA-O 3.22Å; E337-N589 WeakPolarHBondContact OE2-CB 3.29Å; E337-N589 PolarHBondContact OE2-N 3.2Å; E337-N589 PolarHBondContact OE2-ND2 3.07Å; E337-R592 IonicContact OE1-CZ 2.6Å; E337-R592 VanDerWaalsContact OE1-CZ 3.24Å; E337-R592 IonicContact OE1-NE 2.88Å; E337-R592 PolarHBondContact OE1-NE 3.33Å; E337-R592 IonicContact OE1-NH2 3.06Å; E337-R592 PolarHBondContact OE1-NH2 2.97Å
338	R	80.9	Confident	66.3	Low	31 Å²	31	49 Å²	49	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136.6	171.7	71	177.1	176.3	-176.6	0.3	110.1	V313 M314 Y315 W346 K347 V349 E605	V313-R338 HydrophobicContact CG1-CB 4.16Å; M314-R338 CarbonylContact O-C 3.58Å; M314-R338 WeakPolarHBondContact O-CA 3.41Å; Y315-R338 HydrophobicContact CD1-CB 3.77Å; Y315-R338 HydrophobicContact CE1-CB 3.49Å; Y315-R338 VanDerWaalsContact CE1-CB 3.49Å; Y315-R338 HydrophobicContact CE1-CG 4.48Å; Y315-R338 HydrophobicContact CG-CB 4.47Å; R338-W346 CarbonylContact O-C 3.49Å; R338-W346 VanDerWaalsContact O-CA 3.29Å; R338-W346 WeakPolarHBondContact O-CA 3.36Å; R338-K347 HydrophobicContact CG-CB 3.99Å; R338-K347 PolarHBondContact N-O 3.31Å; R338-K347 PolarHBondContact O-N 3.5Å; R338-V349 HydrophobicContact CB-CG1 4.04Å; R338-V349 HydrophobicContact CG-CG1 3.72Å; R338-E605 IonicContact NH1-OE2 2.69Å; R338-E605 PolarHBondContact NH1-OE2 3.07Å
339	L	73.3	Confident	68.8	Low	1 Å²	1	45.8 Å²	45.8	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.2	168.6	174	65	0	0	0	108.8	V313 M314 P341 W346	V313-L339 WeakPolarHBondContact CG1-O 3.5Å; M314-L339 HydrophobicContact CB-CB 4.19Å; M314-L339 HydrophobicContact CE-CB 4.3Å; M314-L339 HydrophobicContact CE-CD2 3.52Å; M314-L339 PolarHBondContact O-N 2.72Å; L339-P341 WeakPolarHBondContact O-CD 3.21Å; L339-W346 HydrophobicContact CB-CD2 3.99Å; L339-W346 HydrophobicContact CB-CE3 4.03Å; L339-W346 HydrophobicContact CB-CH2 4.05Å; L339-W346 HydrophobicContact CB-CZ2 3.94Å; L339-W346 HydrophobicContact CB-CZ3 4.07Å; L339-W346 HydrophobicContact CD1-CD2 4.34Å; L339-W346 HydrophobicContact CD1-CG 4.35Å; L339-W346 HydrophobicContact CD2-CZ2 4.27Å; L339-W346 HydrophobicContact CG-CZ2 4.48Å
340	D	67.7	Low	70.8	Confident	40 Å²	40	42.5 Å²	42.5	21%	0.214	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	113.2	163.3	-178.6	-15.6	0	0	0	108.8	R342 T343 N344 E345	D340-R342 PolarHBondContact O-N 2.96Å; D340-R342 WeakPolarHBondContact OD1-CB 3.39Å; D340-R342 PolarHBondContact OD1-N 3.12Å; D340-T343 WeakPolarHBondContact CB-OG1 3.42Å; D340-N344 WeakPolarHBondContact O-CA 3.41Å; D340-N344 PolarHBondContact O-N 3.42Å; D340-E345 PolarHBondContact N-O 2.67Å
341	P	62.6	Low	72.3	Confident	27 Å²	27	44.3 Å²	44.3	18%	0.175	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.7	-178.7	31.6	-39.2	0	0	0	113.5	E312 L339	E312-P341 WeakPolarHBondContact O-CG 3.38Å; L339-P341 WeakPolarHBondContact O-CD 3.21Å
342	R	56	Low	73.5	Confident	153 Å²	153	40.2 Å²	40.2	58%	0.577	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-48.8	177.7	-83.3	-177	57.9	85.7	2.1	111.8	Y310 D340	Y310-R342 HydrophobicContact CD1-CG 3.44Å; Y310-R342 VanDerWaalsContact CD1-CG 3.44Å; Y310-R342 HydrophobicContact CE1-CG 3.98Å; Y310-R342 HydrophobicContact CG-CG 4.13Å; D340-R342 PolarHBondContact O-N 2.96Å; D340-R342 WeakPolarHBondContact OD1-CB 3.39Å; D340-R342 PolarHBondContact OD1-N 3.12Å
343	T	65	Low	74.5	Confident	64 Å²	64	44.9 Å²	44.9	39%	0.393	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-15	-178.1	63.3	0	0	0	0	111.9	D340 E345	D340-T343 WeakPolarHBondContact CB-OG1 3.42Å; T343-E345 PolarHBondContact O-N 3.22Å; T343-E345 WeakPolarHBondContact OG1-CB 3.1Å; T343-E345 PolarHBondContact OG1-N 3.03Å
344	N	68.7	Low	75.2	Confident	71 Å²	71	48.2 Å²	48.2	38%	0.38	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	28.6	-171.6	-162.8	35.9	0	0	0	112.6	D340 A585	D340-N344 WeakPolarHBondContact O-CA 3.41Å; D340-N344 PolarHBondContact O-N 3.42Å; N344-A585 VanDerWaalsContact CG-O 3.26Å; N344-A585 PolarHBondContact ND2-O 3.29Å; N344-A585 PolarHBondContact OD1-O 2.79Å
345	E	70.7	Confident	75.5	Confident	108 Å²	108	53.4 Å²	53.4	51%	0.505	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.4	-179.8	-65.6	-177.7	157.6	0	0	111.2	D340 T343	D340-E345 PolarHBondContact N-O 2.67Å; T343-E345 PolarHBondContact O-N 3.22Å; T343-E345 WeakPolarHBondContact OG1-CB 3.1Å; T343-E345 PolarHBondContact OG1-N 3.03Å
346	W	76.1	Confident	76	Confident	14 Å²	14	51.5 Å²	51.5	5%	0.053	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	126.3	172	-71.3	85.3	0	0	0	109.7	M314 A316 E337 R338 L339 V560 V572 S587 M588 N589	M314-W346 HydrophobicContact CE-CH2 3.74Å; M314-W346 HydrophobicContact CE-CZ2 3.8Å; A316-W346 HydrophobicContact CB-CH2 3.87Å; A316-W346 HydrophobicContact CB-CZ3 3.54Å; E337-W346 HydrophobicContact CB-CE3 3.75Å; E337-W346 HydrophobicContact CB-CZ3 4.31Å; R338-W346 CarbonylContact O-C 3.49Å; R338-W346 VanDerWaalsContact O-CA 3.29Å; R338-W346 WeakPolarHBondContact O-CA 3.36Å; L339-W346 HydrophobicContact CB-CD2 3.99Å; L339-W346 HydrophobicContact CB-CE3 4.03Å; L339-W346 HydrophobicContact CB-CH2 4.05Å; L339-W346 HydrophobicContact CB-CZ2 3.94Å; L339-W346 HydrophobicContact CB-CZ3 4.07Å; L339-W346 HydrophobicContact CD1-CD2 4.34Å; L339-W346 HydrophobicContact CD1-CG 4.35Å; L339-W346 HydrophobicContact CD2-CZ2 4.27Å; L339-W346 HydrophobicContact CG-CZ2 4.48Å; W346-V560 HydrophobicContact CH2-CG1 3.76Å; W346-V560 HydrophobicContact CH2-CG2 4.41Å; W346-V560 HydrophobicContact CZ2-CG1 4.04Å; W346-V572 HydrophobicContact CZ2-CG2 3.67Å; W346-S587 VanDerWaalsContact CD1-C 3.49Å; W346-M588 HydrophobicContact CD2-CB 4.25Å; W346-M588 HydrophobicContact CD2-CG 3.55Å; W346-M588 VanDerWaalsContact CE2-CG 3.49Å; W346-M588 HydrophobicContact CE3-CG 3.76Å; W346-M588 HydrophobicContact CG-CB 4.4Å; W346-M588 HydrophobicContact CG-CG 4.18Å; W346-M588 HydrophobicContact CH2-CG 3.79Å; W346-M588 HydrophobicContact CH2-SD 4.09Å; W346-M588 HydrophobicContact CZ2-CG 3.63Å; W346-M588 HydrophobicContact CZ2-SD 4.41Å; W346-M588 HydrophobicContact CZ3-CG 3.87Å; W346-M588 HydrophobicContact CZ3-SD 4.21Å; W346-N589 PolarHBondContact O-ND2 3.13Å
347	K	76.3	Confident	76.1	Confident	48 Å²	48	52.7 Å²	52.7	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.3	177.1	-68.6	-173.7	173.4	-170.7	0	110.9	E337 R338 P607	E337-K347 CarbonylContact C-O 3.5Å; E337-K347 VanDerWaalsContact CA-O 3.23Å; E337-K347 WeakPolarHBondContact CA-O 3.22Å; R338-K347 HydrophobicContact CG-CB 3.99Å; R338-K347 PolarHBondContact N-O 3.31Å; R338-K347 PolarHBondContact O-N 3.5Å; K347-P607 VanDerWaalsContact NZ-CA 3.35Å; K347-P607 PolarHBondContact NZ-O 3.37Å
348	C	75.9	Confident	76.2	Confident	77 Å²	77	53.4 Å²	53.4	52%	0.52	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	137.9	170.7	-67.6	0	0	0	0	110.2	M336	M336-C348 WeakPolarHBondContact O-CA 3.35Å
349	V	79.9	Confident	76.3	Confident	15 Å²	15	52.3 Å²	52.3	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	177.4	171.8	-62.4	0	0	0	0	110.4	Y315 M336 R338 Y386	Y315-V349 HydrophobicContact CE1-CG1 4.25Å; Y315-V349 HydrophobicContact CE1-CG2 4.39Å; M336-V349 HydrophobicContact CB-CG2 3.69Å; M336-V349 HydrophobicContact CG-CG2 3.64Å; M336-V349 PolarHBondContact O-N 2.8Å; M336-V349 HydrophobicContact SD-CG2 3.52Å; M336-V349 VanDerWaalsContact SD-CG2 3.52Å; R338-V349 HydrophobicContact CB-CG1 4.04Å; R338-V349 HydrophobicContact CG-CG1 3.72Å; V349-Y386 WeakPolarHBondContact CB-OH 3.47Å; V349-Y386 HydrophobicContact CG2-CE2 4.45Å
350	A	80	Confident	77	Confident	22 Å²	22	52.5 Å²	52.5	18%	0.182	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-53.4	135.6	-178.8	0	0	0	0	0	111.4	Y386 N391 W393	A350-Y386 HydrophobicContact CB-CE2 4.34Å; A350-N391 WeakPolarHBondContact CB-O 3.38Å; A350-N391 WeakPolarHBondContact CB-OD1 3.47Å; A350-N391 PolarHBondContact N-OD1 3.29Å; A350-W393 PolarHBondContact O-NE1 3.38Å
351	P	83.2	Confident	78.1	Confident	80 Å²	80	51.3 Å²	51.3	52%	0.519	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-75.4	152.7	179.3	32	-34.8	0	0	0	110.9	A334	A334-P351 HydrophobicContact CB-CB 4.13Å; A334-P351 CarbonylContact O-C 3.57Å; A334-P351 WeakPolarHBondContact O-CA 3.3Å
352	M	85.7	Confident	79.4	Confident	10 Å²	10	50.5 Å²	50.5	5%	0.049	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-58.8	157.5	165.1	-69.3	176.3	-72.4	0	0	110.6	A334 K354 R356 A370 W393	A334-M352 HydrophobicContact CB-CB 4.17Å; A334-M352 WeakPolarHBondContact CB-O 3.42Å; A334-M352 PolarHBondContact O-N 2.94Å; M352-K354 WeakPolarHBondContact CB-O 3.43Å; M352-R356 HydrophobicContact SD-CG 4.44Å; M352-A370 HydrophobicContact SD-CB 3.52Å; M352-A370 VanDerWaalsContact SD-CB 3.52Å; M352-W393 HydrophobicContact CB-CD2 4.43Å; M352-W393 HydrophobicContact CG-CD2 3.61Å; M352-W393 HydrophobicContact CG-CE3 3.86Å; M352-W393 HydrophobicContact CG-CG 4.31Å; M352-W393 HydrophobicContact CG-CH2 3.61Å; M352-W393 HydrophobicContact CG-CZ2 3.32Å; M352-W393 HydrophobicContact CG-CZ3 3.88Å; M352-W393 HydrophobicContact SD-CH2 3.83Å; M352-W393 HydrophobicContact SD-CZ2 4.02Å; M352-W393 HydrophobicContact SD-CZ3 4.2Å
353	S	85.3	Confident	80.9	Confident	101 Å²	101	44.8 Å²	44.8	71%	0.706	25%	0.251	S	S	*	.	S	Bend	trans	-74.6	-33.4	173.6	-62.4	0	0	0	0	111.4	E384	S353-E384 WeakPolarHBondContact CB-OE2 3.38Å; S353-E384 PolarHBondContact N-OE2 3.21Å
354	K	83.7	Confident	81.9	Confident	90 Å²	90	41.9 Å²	41.9	39%	0.391	23%	0.233	S	C	.	.	S	Bend	trans	-105.8	146.3	173.8	-65.5	-171.3	-179.1	-175.2	0	111.8	M352 L380 S382 E384	M352-K354 WeakPolarHBondContact CB-O 3.43Å; K354-L380 HydrophobicContact CD-CD1 4.4Å; K354-L380 HydrophobicContact CD-CD2 4.25Å; K354-S382 PolarHBondContact NZ-OG 3.35Å; K354-E384 PolarHBondContact N-OE1 3.31Å
355	R	82.6	Confident	82.4	Confident	129 Å²	129	43 Å²	43	49%	0.487	24%	0.24	S	C	.	.			trans	-74.7	137.8	167.4	-64.8	-174	-62.3	170.8	-5.7	109.1	A332 I333 A334 D375	A332-R355 HydrophobicContact CB-CB 3.96Å; A332-R355 WeakPolarHBondContact O-CB 3.19Å; A332-R355 VanDerWaalsContact O-CD 3.31Å; A332-R355 WeakPolarHBondContact O-CD 3.3Å; I333-R355 CarbonylContact O-C 3.54Å; I333-R355 WeakPolarHBondContact O-CA 3.42Å; A334-R355 HydrophobicContact CB-CG 4.24Å; R355-D375 WeakPolarHBondContact O-CA 3.46Å; R355-D375 WeakPolarHBondContact O-CB 3.28Å
356	R	86.5	Confident	82.8	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-140.5	129.9	-177.4	-53.9	179.8	175.7	-108.7	7	111.2	I333 M352 V359 G372 H374 L380 S382 E384	I333-R356 PolarHBondContact O-N 2.75Å; M352-R356 HydrophobicContact SD-CG 4.44Å; R356-V359 HydrophobicContact CB-CB 3.93Å; R356-V359 HydrophobicContact CB-CG2 4.25Å; R356-G372 WeakPolarHBondContact CD-O 3.44Å; R356-G372 PolarHBondContact NH1-O 3.39Å; R356-H374 CarbonylContact C-O 3.55Å; R356-H374 WeakPolarHBondContact CA-O 3.26Å; R356-L380 HydrophobicContact CG-CD1 3.85Å; R356-S382 PolarHBondContact NH1-O 2.83Å; R356-S382 PolarHBondContact NH2-O 3.45Å; R356-S382 PolarHBondContact NH2-OG 2.8Å; R356-E384 IonicContact CZ-OE1 3.91Å; R356-E384 VanDerWaalsContact CZ-OE1 3.3Å; R356-E384 IonicContact NE-OE1 3.24Å; R356-E384 PolarHBondContact NE-OE1 3.3Å; R356-E384 IonicContact NH2-OE1 2.94Å; R356-E384 PolarHBondContact NH2-OE1 2.9Å
357	C	79.7	Confident	83.2	Confident	24 Å²	24	42 Å²	42	16%	0.162	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-118.7	148.5	163.7	70.7	0	0	0	0	110.8	M319 A332 V359 G373 H374 T405	M319-C357 HydrophobicContact CE-CB 4.24Å; M319-C357 HydrophobicContact CG-CB 3.54Å; M319-C357 HydrophobicContact SD-CB 3.56Å; M319-C357 VanDerWaalsContact SD-CB 3.56Å; A332-C357 HydrophobicContact CB-CB 4.05Å; C357-V359 PolarHBondContact O-N 3.06Å; C357-G373 CarbonylContact O-C 3.49Å; C357-G373 WeakPolarHBondContact O-CA 3.46Å; C357-H374 PolarHBondContact N-O 3.1Å; C357-H374 PolarHBondContact O-N 2.94Å; C357-H374 PolarHBondContact SG-O 3.35Å; C357-T405 PolarHBondContact O-OG1 2.78Å; C357-T405 VanDerWaalsContact O-OG1 3.06Å
358	G	79.5	Confident	83.7	Confident	15 Å²	15	39.8 Å²	39.8	16%	0.155	23%	0.229	C	C	.	.	S	Bend	trans	59.8	31.2	-172.2	0	0	0	0	0	112.9	T405 S406	G358-T405 WeakPolarHBondContact CA-OG1 3.46Å; G358-S406 PolarHBondContact O-N 3.5Å
359	V	84.5	Confident	84.4	Confident	9 Å²	9	36.5 Å²	36.5	6%	0.055	21%	0.206	C	C	.	.			trans	-70.7	139.1	177	62.1	0	0	0	0	110.1	R356 C357 V361 A370	R356-V359 HydrophobicContact CB-CB 3.93Å; R356-V359 HydrophobicContact CB-CG2 4.25Å; C357-V359 PolarHBondContact O-N 3.06Å; V359-V361 HydrophobicContact CG1-CG2 4.17Å; V359-V361 HydrophobicContact CG2-CG2 4.29Å; V359-A370 HydrophobicContact CG2-CB 3.9Å
360	G	88.2	Confident	84.9	Confident	4 Å²	4	35.8 Å²	35.8	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.8	168	0	0	0	0	0	110.2	V371	G360-V371 PolarHBondContact N-O 3.36Å; G360-V371 PolarHBondContact O-N 2.96Å
361	V	89.8	Confident	85.5	Confident	15 Å²	15	34.8 Å²	34.8	9%	0.091	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	134	-175.6	177.7	0	0	0	0	110	A317 V359 L368 Y369 G596	A317-V361 HydrophobicContact CB-CG2 4.2Å; V359-V361 HydrophobicContact CG1-CG2 4.17Å; V359-V361 HydrophobicContact CG2-CG2 4.29Å; V361-L368 HydrophobicContact CG1-CD1 3.31Å; V361-L368 HydrophobicContact CG1-CD2 3.98Å; V361-L368 HydrophobicContact CG1-CG 3.75Å; V361-Y369 VanDerWaalsContact CA-O 3.32Å; V361-Y369 WeakPolarHBondContact CA-O 3.37Å; V361-G596 VanDerWaalsContact CG2-CA 3.42Å
362	A	90.4	Very high	85.8	Confident	10 Å²	10	31 Å²	31	8%	0.083	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	165	168.2	0	0	0	0	0	110.7	Y369 V409 V411 L416	A362-Y369 PolarHBondContact N-O 2.82Å; A362-Y369 PolarHBondContact O-N 2.77Å; A362-V409 HydrophobicContact CB-CB 4.43Å; A362-V409 HydrophobicContact CB-CG1 3.7Å; A362-V411 HydrophobicContact CB-CG2 4.2Å; A362-L416 HydrophobicContact CB-CD1 3.72Å
363	V	86.5	Confident	85.9	Confident	33 Å²	33	30.5 Å²	30.5	20%	0.2	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.7	179.9	178.6	0	0	0	0	109.5	L367 L368 V411 V599 V600	V363-L367 VanDerWaalsContact CA-O 3.32Å; V363-L367 WeakPolarHBondContact CA-O 3.26Å; V363-L368 HydrophobicContact CG2-CD1 3.42Å; V363-L368 VanDerWaalsContact CG2-CD1 3.42Å; V363-V411 VanDerWaalsContact O-CG2 3.29Å; V363-V411 WeakPolarHBondContact O-CG2 3.23Å; V363-V599 WeakPolarHBondContact CG2-O 3.19Å; V363-V600 HydrophobicContact CB-CG2 4.49Å; V363-V600 HydrophobicContact CG1-CB 4.49Å; V363-V600 HydrophobicContact CG1-CG1 4.36Å; V363-V600 HydrophobicContact CG1-CG2 4.08Å; V363-V600 HydrophobicContact CG2-CB 4.45Å; V363-V600 HydrophobicContact CG2-CG2 3.53Å
364	L	85.9	Confident	85.8	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.9	175.5	176	63.7	0	0	0	108.4	D366 L367 Y369 V411 G414 L416 Y434 P436	L364-D366 VanDerWaalsContact C-N 3.28Å; L364-D366 PolarHBondContact O-N 2.99Å; L364-L367 PolarHBondContact N-O 2.88Å; L364-L367 PolarHBondContact O-N 2.87Å; L364-L367 VanDerWaalsContact O-N 3.09Å; L364-Y369 HydrophobicContact CB-CD2 4.01Å; L364-Y369 HydrophobicContact CB-CE2 3.76Å; L364-Y369 HydrophobicContact CD2-CE2 4.49Å; L364-Y369 HydrophobicContact CG-CE2 4.46Å; L364-V411 HydrophobicContact CB-CG2 3.83Å; L364-V411 HydrophobicContact CD1-CG1 3.63Å; L364-V411 HydrophobicContact CD1-CG2 4.25Å; L364-G414 VanDerWaalsContact CD1-O 3.3Å; L364-G414 WeakPolarHBondContact CD1-O 3.42Å; L364-L416 HydrophobicContact CD2-CB 4.1Å; L364-Y434 HydrophobicContact CD2-CD1 4.4Å; L364-P436 HydrophobicContact CD2-CB 4.18Å; L364-P436 HydrophobicContact CD2-CG 3.97Å
365	N	81	Confident	85.9	Confident	96 Å²	96	25.1 Å²	25.1	51%	0.513	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	46.1	-179.1	-55.5	-17.8	0	0	0	112.4	L367	N365-L367 PolarHBondContact O-N 3.37Å
366	D	78.4	Confident	85.7	Confident	74 Å²	74	20.9 Å²	20.9	40%	0.396	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	12.4	-178.6	-54.7	-45	0	0	0	115.6	L364 V600	L364-D366 VanDerWaalsContact C-N 3.28Å; L364-D366 PolarHBondContact O-N 2.99Å; D366-V600 HydrophobicContact CB-CG1 4.34Å; D366-V600 VanDerWaalsContact O-CG1 3.24Å; D366-V600 WeakPolarHBondContact O-CG1 3.28Å
367	L	83.6	Confident	85.5	Confident	27 Å²	27	29 Å²	29	14%	0.141	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.8	172.6	-59.4	176.2	0	0	0	109.7	V363 L364 N365 Y369 R385 Y386 D387	V363-L367 VanDerWaalsContact CA-O 3.32Å; V363-L367 WeakPolarHBondContact CA-O 3.26Å; L364-L367 PolarHBondContact N-O 2.88Å; L364-L367 PolarHBondContact O-N 2.87Å; L364-L367 VanDerWaalsContact O-N 3.09Å; N365-L367 PolarHBondContact O-N 3.37Å; L367-Y369 HydrophobicContact CB-CD2 4.47Å; L367-Y369 HydrophobicContact CB-CE2 3.82Å; L367-Y369 WeakPolarHBondContact O-CD2 3.47Å; L367-R385 VanDerWaalsContact CD1-NH1 3.34Å; L367-Y386 WeakPolarHBondContact CA-O 3.23Å; L367-D387 HydrophobicContact CD2-CB 3.58Å
368	L	88.1	Confident	85.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.2	177.2	-172.5	81.5	0	0	0	110.2	M336 V361 V363 R385 Y386 W393 V600	M336-L368 HydrophobicContact CE-CD2 3Å; M336-L368 HydrophobicContact CE-CG 4.46Å; M336-L368 HydrophobicContact SD-CD2 4.17Å; V361-L368 HydrophobicContact CG1-CD1 3.31Å; V361-L368 HydrophobicContact CG1-CD2 3.98Å; V361-L368 HydrophobicContact CG1-CG 3.75Å; V363-L368 HydrophobicContact CG2-CD1 3.42Å; V363-L368 VanDerWaalsContact CG2-CD1 3.42Å; L368-R385 CarbonylContact O-C 3.53Å; L368-R385 WeakPolarHBondContact O-CA 3.46Å; L368-Y386 HydrophobicContact CB-CD1 4.49Å; L368-Y386 PolarHBondContact N-O 2.89Å; L368-Y386 PolarHBondContact O-N 3.43Å; L368-W393 HydrophobicContact CD2-CH2 4.23Å; L368-V600 HydrophobicContact CB-CG2 4.25Å; L368-V600 HydrophobicContact CD1-CG2 4.41Å
369	Y	90	Very high	86.3	Confident	9 Å²	9	33.1 Å²	33.1	4%	0.035	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.4	178.3	-72.3	-105.1	0	0	0	110.6	V361 A362 L364 L367 I383 E384 R385 V397 L416 Y434	V361-Y369 VanDerWaalsContact CA-O 3.32Å; V361-Y369 WeakPolarHBondContact CA-O 3.37Å; A362-Y369 PolarHBondContact N-O 2.82Å; A362-Y369 PolarHBondContact O-N 2.77Å; L364-Y369 HydrophobicContact CB-CD2 4.01Å; L364-Y369 HydrophobicContact CB-CE2 3.76Å; L364-Y369 HydrophobicContact CD2-CE2 4.49Å; L364-Y369 HydrophobicContact CG-CE2 4.46Å; L367-Y369 HydrophobicContact CB-CD2 4.47Å; L367-Y369 HydrophobicContact CB-CE2 3.82Å; L367-Y369 WeakPolarHBondContact O-CD2 3.47Å; Y369-I383 HydrophobicContact CD1-CG2 3.91Å; Y369-E384 WeakPolarHBondContact CA-O 3.46Å; Y369-R385 HydrophobicContact CD1-CB 3.95Å; Y369-R385 HydrophobicContact CD2-CB 4.49Å; Y369-R385 HydrophobicContact CE1-CB 3.79Å; Y369-R385 HydrophobicContact CE2-CB 4.32Å; Y369-R385 HydrophobicContact CG-CB 4.3Å; Y369-V397 HydrophobicContact CD1-CG1 4.38Å; Y369-V397 HydrophobicContact CD1-CG2 4.22Å; Y369-V397 HydrophobicContact CE1-CG1 4.18Å; Y369-V397 HydrophobicContact CE1-CG2 3.76Å; Y369-L416 HydrophobicContact CD1-CD2 4.01Å; Y369-L416 HydrophobicContact CG-CD2 3.96Å; Y369-Y434 HydrophobicContact CE1-CE1 4.13Å
370	A	91.3	Very high	86.6	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	104.5	172	0	0	0	0	0	109.7	M352 V359 I383 E384 W393	M352-A370 HydrophobicContact SD-CB 3.52Å; M352-A370 VanDerWaalsContact SD-CB 3.52Å; V359-A370 HydrophobicContact CG2-CB 3.9Å; A370-I383 WeakPolarHBondContact O-CA 3.42Å; A370-E384 PolarHBondContact N-O 3.36Å; A370-E384 PolarHBondContact O-N 2.73Å; A370-E384 VanDerWaalsContact O-N 3.12Å; A370-W393 HydrophobicContact CB-CH2 3.85Å; A370-W393 HydrophobicContact CB-CZ3 3.69Å
371	V	91.7	Very high	86.8	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122	-169.9	-175.5	0	0	0	0	110.9	G360 I383 I407 V409 L416 A418 W441	G360-V371 PolarHBondContact N-O 3.36Å; G360-V371 PolarHBondContact O-N 2.96Å; V371-I383 HydrophobicContact CB-CG1 4.17Å; V371-I383 HydrophobicContact CG1-CG1 3.86Å; V371-I383 HydrophobicContact CG2-CG1 4.16Å; V371-I383 HydrophobicContact CG2-CG2 4.11Å; V371-I407 HydrophobicContact CG1-CD1 4.31Å; V371-V409 HydrophobicContact CB-CG2 3.93Å; V371-V409 HydrophobicContact CG1-CG2 4.31Å; V371-V409 HydrophobicContact CG2-CG1 4.07Å; V371-V409 HydrophobicContact CG2-CG2 4.15Å; V371-L416 HydrophobicContact CG2-CD2 3.84Å; V371-A418 HydrophobicContact CG1-CB 4.31Å; V371-W441 HydrophobicContact CG1-CH2 4.39Å
372	G	90.2	Very high	87	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.199	C	C	.	.			trans	60.3	-142.8	175.3	0	0	0	0	0	113.4	R356 L380 S382	R356-G372 WeakPolarHBondContact CD-O 3.44Å; R356-G372 PolarHBondContact NH1-O 3.39Å; G372-L380 WeakPolarHBondContact CA-O 3.27Å; G372-S382 PolarHBondContact N-O 3.5Å
373	G	87.1	Confident	87.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.			trans	101.7	-167.9	-172.2	0	0	0	0	0	112.3	C357 L380 R404	C357-G373 CarbonylContact O-C 3.49Å; C357-G373 WeakPolarHBondContact O-CA 3.46Å; G373-L380 WeakPolarHBondContact O-CB 3.36Å; G373-L380 PolarHBondContact O-N 3.39Å; G373-R404 WeakPolarHBondContact CA-O 3.33Å; G373-R404 PolarHBondContact N-O 2.93Å
374	H	83.7	Confident	87.5	Confident	39 Å²	39	34 Å²	34	18%	0.181	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-129.9	137.9	174.9	179.4	-87.8	0	0	0	108.8	A332 R356 C357 G376 A378 Y379	A332-H374 WeakPolarHBondContact CB-O 3.35Å; R356-H374 CarbonylContact C-O 3.55Å; R356-H374 WeakPolarHBondContact CA-O 3.26Å; C357-H374 PolarHBondContact N-O 3.1Å; C357-H374 PolarHBondContact O-N 2.94Å; C357-H374 PolarHBondContact SG-O 3.35Å; H374-G376 VanDerWaalsContact CE1-CA 3.41Å; H374-G376 WeakPolarHBondContact CE1-CA 3.32Å; H374-G376 PolarHBondContact CE1-N 2.89Å; H374-G376 WeakPolarHBondContact ND1-CA 3.21Å; H374-G376 PolarHBondContact ND1-N 3.35Å; H374-A378 WeakPolarHBondContact CA-O 3.14Å; H374-A378 PolarHBondContact CD2-O 2.81Å; H374-A378 VanDerWaalsContact CD2-O 3.27Å; H374-Y379 AromaticContact CD2-CD1 3.99Å; H374-Y379 AromaticContact CD2-CD2 3.98Å; H374-Y379 AromaticContact CD2-CG 3.93Å
375	D	84.5	Confident	87.8	Confident	39 Å²	39	36.7 Å²	36.7	21%	0.209	20%	0.196	C	C	.	.			trans	-96.1	3.3	-173.6	64.8	8.7	0	0	0	114.6	R355 Q377 A378 L380	R355-D375 WeakPolarHBondContact O-CA 3.46Å; R355-D375 WeakPolarHBondContact O-CB 3.28Å; D375-Q377 WeakPolarHBondContact OD1-CA 3.48Å; D375-Q377 PolarHBondContact OD1-N 2.8Å; D375-A378 PolarHBondContact N-O 2.82Å; D375-A378 VanDerWaalsContact N-O 3.12Å; D375-A378 PolarHBondContact OD1-N 3.42Å; D375-L380 HydrophobicContact CB-CD1 4.21Å; D375-L380 HydrophobicContact CB-CD2 4.3Å; D375-L380 HydrophobicContact CB-CG 4.45Å
376	G	79.4	Confident	88	Confident	40 Å²	40	32.1 Å²	32.1	41%	0.412	17%	0.172	S	C	.	.	S	Bend	trans	100.5	-13.8	-173.5	0	0	0	0	0	113.1	H374	H374-G376 VanDerWaalsContact CE1-CA 3.41Å; H374-G376 WeakPolarHBondContact CE1-CA 3.32Å; H374-G376 PolarHBondContact CE1-N 2.89Å; H374-G376 WeakPolarHBondContact ND1-CA 3.21Å; H374-G376 PolarHBondContact ND1-N 3.35Å
377	Q	82.6	Confident	88.2	Confident	172 Å²	172	29.9 Å²	29.9	80%	0.804	16%	0.16	S	C	*	.	S	Bend	trans	-123.3	-42	178	-62.6	-62.6	-42.1	0	0	112	D375	D375-Q377 WeakPolarHBondContact OD1-CA 3.48Å; D375-Q377 PolarHBondContact OD1-N 2.8Å
378	A	86.7	Confident	87.8	Confident	46 Å²	46	28.6 Å²	28.6	38%	0.38	15%	0.153	S	C	.	.	S	Bend	trans	-138.4	152.2	-174.5	0	0	0	0	0	112.7	H374 D375	H374-A378 WeakPolarHBondContact CA-O 3.14Å; H374-A378 PolarHBondContact CD2-O 2.81Å; H374-A378 VanDerWaalsContact CD2-O 3.27Å; D375-A378 PolarHBondContact N-O 2.82Å; D375-A378 VanDerWaalsContact N-O 3.12Å; D375-A378 PolarHBondContact OD1-N 3.42Å
379	Y	89.1	Confident	87	Confident	78 Å²	78	32.8 Å²	32.8	31%	0.306	17%	0.173	S	C	.	.	B	Isolated β-bridge	trans	-72.5	135.5	166.2	-61.3	-92.5	0	0	0	109.2	H374 C403 T405 Q422 G424	H374-Y379 AromaticContact CD2-CD1 3.99Å; H374-Y379 AromaticContact CD2-CD2 3.98Å; H374-Y379 AromaticContact CD2-CG 3.93Å; Y379-C403 WeakPolarHBondContact O-CB 3.45Å; Y379-C403 PolarHBondContact O-SG 3.14Å; Y379-T405 HydrophobicContact CD1-CG2 3.67Å; Y379-T405 HydrophobicContact CE1-CG2 3.5Å; Y379-Q422 HydrophobicContact CE1-CG 4.42Å; Y379-G424 VanDerWaalsContact CE2-CA 3.42Å; Y379-G424 WeakPolarHBondContact OH-CA 3.5Å
380	L	90.7	Very high	86.3	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.042	19%	0.192	C	C	.	.			trans	-102.3	139.4	-174	-57.3	177	0	0	0	111.1	K354 R356 G372 G373 D375 R404	K354-L380 HydrophobicContact CD-CD1 4.4Å; K354-L380 HydrophobicContact CD-CD2 4.25Å; R356-L380 HydrophobicContact CG-CD1 3.85Å; G372-L380 WeakPolarHBondContact CA-O 3.27Å; G373-L380 WeakPolarHBondContact O-CB 3.36Å; G373-L380 PolarHBondContact O-N 3.39Å; D375-L380 HydrophobicContact CB-CD1 4.21Å; D375-L380 HydrophobicContact CB-CD2 4.3Å; D375-L380 HydrophobicContact CB-CG 4.45Å; L380-R404 PolarHBondContact O-N 3.04Å
381	N	92.4	Very high	85.8	Confident	56 Å²	56	39.2 Å²	39.2	30%	0.299	21%	0.21	S	C	.	.			trans	-107	-7.3	163.4	66.4	-22.7	0	0	0	112.6	I383 P399 T400 T402 C403	N381-I383 WeakPolarHBondContact O-CD1 3.38Å; N381-P399 WeakPolarHBondContact O-CA 3.02Å; N381-T400 WeakPolarHBondContact CA-OG1 3.5Å; N381-T400 WeakPolarHBondContact CB-O 3.45Å; N381-T400 WeakPolarHBondContact CB-OG1 3.32Å; N381-T400 PolarHBondContact ND2-O 3.1Å; N381-T400 PolarHBondContact O-N 2.81Å; N381-T400 PolarHBondContact O-OG1 2.83Å; N381-T400 VanDerWaalsContact O-OG1 3.05Å; N381-T402 WeakPolarHBondContact CB-O 2.87Å; N381-C403 HydrophobicContact CB-CB 4.5Å
382	S	93.5	Very high	85.3	Confident	22 Å²	22	45 Å²	45	15%	0.154	24%	0.238	C	C	.	.			trans	-72.1	154	-179.7	54.2	0	0	0	0	112.1	K354 R356 G372	K354-S382 PolarHBondContact NZ-OG 3.35Å; R356-S382 PolarHBondContact NH1-O 2.83Å; R356-S382 PolarHBondContact NH2-O 3.45Å; R356-S382 PolarHBondContact NH2-OG 2.8Å; G372-S382 PolarHBondContact N-O 3.5Å
383	I	94.1	Very high	85.2	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143	177.8	-61.4	94.8	0	0	0	108.4	Y369 A370 V371 N381 V397 A398 T400 W441	Y369-I383 HydrophobicContact CD1-CG2 3.91Å; A370-I383 WeakPolarHBondContact O-CA 3.42Å; V371-I383 HydrophobicContact CB-CG1 4.17Å; V371-I383 HydrophobicContact CG1-CG1 3.86Å; V371-I383 HydrophobicContact CG2-CG1 4.16Å; V371-I383 HydrophobicContact CG2-CG2 4.11Å; N381-I383 WeakPolarHBondContact O-CD1 3.38Å; I383-V397 HydrophobicContact CB-CB 4.02Å; I383-V397 HydrophobicContact CB-CG1 3.81Å; I383-V397 HydrophobicContact CG2-CB 4.04Å; I383-V397 HydrophobicContact CG2-CG1 3.73Å; I383-V397 HydrophobicContact CG2-CG2 4.4Å; I383-A398 WeakPolarHBondContact CD1-O 3.31Å; I383-T400 HydrophobicContact CD1-CG2 4.15Å; I383-W441 HydrophobicContact CD1-CZ2 3.92Å; I383-W441 HydrophobicContact CG1-CZ2 4.11Å
384	E	92.6	Very high	85.3	Confident	3 Å²	3	48.2 Å²	48.2	1%	0.014	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.6	170.2	-70.3	167.8	-101.9	0	0	108.4	S353 K354 R356 Y369 A370 W393 S394	S353-E384 WeakPolarHBondContact CB-OE2 3.38Å; S353-E384 PolarHBondContact N-OE2 3.21Å; K354-E384 PolarHBondContact N-OE1 3.31Å; R356-E384 IonicContact CZ-OE1 3.91Å; R356-E384 VanDerWaalsContact CZ-OE1 3.3Å; R356-E384 IonicContact NE-OE1 3.24Å; R356-E384 PolarHBondContact NE-OE1 3.3Å; R356-E384 IonicContact NH2-OE1 2.94Å; R356-E384 PolarHBondContact NH2-OE1 2.9Å; Y369-E384 WeakPolarHBondContact CA-O 3.46Å; A370-E384 PolarHBondContact N-O 3.36Å; A370-E384 PolarHBondContact O-N 2.73Å; A370-E384 VanDerWaalsContact O-N 3.12Å; E384-W393 HydrophobicContact CB-CE3 3.6Å; E384-W393 HydrophobicContact CB-CZ3 4.02Å; E384-S394 CarbonylContact C-O 3.59Å; E384-S394 WeakPolarHBondContact CA-O 3.2Å
385	R	92.7	Very high	85.7	Confident	58 Å²	58	50.8 Å²	50.8	22%	0.219	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.2	173.8	67.2	-175.8	179.7	97.1	-0.5	110.2	L367 L368 Y369 W393 S394 D396 V397	L367-R385 VanDerWaalsContact CD1-NH1 3.34Å; L368-R385 CarbonylContact O-C 3.53Å; L368-R385 WeakPolarHBondContact O-CA 3.46Å; Y369-R385 HydrophobicContact CD1-CB 3.95Å; Y369-R385 HydrophobicContact CD2-CB 4.49Å; Y369-R385 HydrophobicContact CE1-CB 3.79Å; Y369-R385 HydrophobicContact CE2-CB 4.32Å; Y369-R385 HydrophobicContact CG-CB 4.3Å; R385-W393 VanDerWaalsContact C-CE3 3.44Å; R385-W393 CarbonylContact O-C 3.51Å; R385-W393 WeakPolarHBondContact O-CA 3.46Å; R385-S394 PolarHBondContact N-O 2.75Å; R385-S394 PolarHBondContact O-N 3.5Å; R385-D396 IonicContact CZ-OD1 2.8Å; R385-D396 IonicContact CZ-OD2 2.82Å; R385-D396 IonicContact NE-OD1 2.93Å; R385-D396 PolarHBondContact NE-OD1 3.15Å; R385-D396 IonicContact NE-OD2 3.49Å; R385-D396 PolarHBondContact NE-OD2 2.85Å; R385-D396 IonicContact NH2-OD1 3.49Å; R385-D396 PolarHBondContact NH2-OD1 3.44Å; R385-D396 IonicContact NH2-OD2 3.35Å; R385-D396 PolarHBondContact NH2-OD2 3.48Å; R385-V397 HydrophobicContact CB-CG2 4.04Å; R385-V397 HydrophobicContact CG-CG2 3.88Å
386	Y	86.4	Confident	86	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.7	175.8	175.7	-110.1	0	0	0	109.3	Y315 M336 V349 A350 L367 L368 P388 N391 Q392 W393	Y315-Y386 HydrophobicContact CD1-CE1 4.24Å; Y315-Y386 HydrophobicContact CE1-CD1 4.37Å; Y315-Y386 AromaticContact CE1-CE1 3.57Å; Y315-Y386 HydrophobicContact CE1-CE1 3.57Å; M336-Y386 HydrophobicContact SD-CD1 4.42Å; V349-Y386 WeakPolarHBondContact CB-OH 3.47Å; V349-Y386 HydrophobicContact CG2-CE2 4.45Å; A350-Y386 HydrophobicContact CB-CE2 4.34Å; L367-Y386 WeakPolarHBondContact CA-O 3.23Å; L368-Y386 HydrophobicContact CB-CD1 4.49Å; L368-Y386 PolarHBondContact N-O 2.89Å; L368-Y386 PolarHBondContact O-N 3.43Å; Y386-P388 HydrophobicContact CD1-CB 4.48Å; Y386-P388 HydrophobicContact CD1-CG 3.81Å; Y386-P388 HydrophobicContact CE1-CB 3.85Å; Y386-P388 HydrophobicContact CE1-CG 3.64Å; Y386-N391 WeakPolarHBondContact CE2-OD1 3.29Å; Y386-N391 PolarHBondContact OH-OD1 3.02Å; Y386-Q392 WeakPolarHBondContact CA-O 3.25Å; Y386-W393 AromaticContact CD2-CD1 3.73Å; Y386-W393 HydrophobicContact CD2-CD2 4.1Å; Y386-W393 AromaticContact CD2-CE2 3.8Å; Y386-W393 HydrophobicContact CD2-CG 4.11Å; Y386-W393 HydrophobicContact CD2-CZ2 4.43Å; Y386-W393 AromaticContact CD2-NE1 3.51Å; Y386-W393 HydrophobicContact CG-CD2 4.29Å; Y386-W393 AromaticContact CG-CE2 3.97Å; Y386-W393 HydrophobicContact CG-CZ2 4.2Å
387	D	81.4	Confident	86.7	Confident	27 Å²	27	51.5 Å²	51.5	14%	0.144	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.8	168.6	178	7.9	0	0	0	108.9	L367 H389 T390 N391 Q392	L367-D387 HydrophobicContact CD2-CB 3.58Å; D387-H389 PolarHBondContact O-N 3.3Å; D387-H389 WeakPolarHBondContact OD1-CB 3.5Å; D387-H389 IonicContact OD1-CG 3.24Å; D387-H389 PolarHBondContact OD1-N 3.36Å; D387-H389 IonicContact OD1-ND1 2.6Å; D387-H389 PolarHBondContact OD1-ND1 2.99Å; D387-T390 WeakPolarHBondContact CB-OG1 3.38Å; D387-T390 VanDerWaalsContact CG-OG1 3.31Å; D387-T390 PolarHBondContact O-N 3.06Å; D387-T390 WeakPolarHBondContact OD2-CG2 3.41Å; D387-T390 PolarHBondContact OD2-OG1 3.14Å; D387-N391 WeakPolarHBondContact O-CA 3.19Å; D387-N391 PolarHBondContact O-N 3.48Å; D387-Q392 PolarHBondContact N-O 2.91Å; D387-Q392 PolarHBondContact O-N 2.84Å
388	P	75.8	Confident	87.3	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-29.4	179.6	-26.5	38.1	0	0	0	114.2	Y315 Y386 N391 V600 L602	Y315-P388 HydrophobicContact CE2-CG 4.46Å; Y386-P388 HydrophobicContact CD1-CB 4.48Å; Y386-P388 HydrophobicContact CD1-CG 3.81Å; Y386-P388 HydrophobicContact CE1-CB 3.85Å; Y386-P388 HydrophobicContact CE1-CG 3.64Å; P388-N391 PolarHBondContact O-N 2.82Å; P388-V600 HydrophobicContact CG-CB 4.49Å; P388-V600 HydrophobicContact CG-CG1 4.07Å; P388-V600 HydrophobicContact CG-CG2 4.37Å; P388-L602 HydrophobicContact CB-CD1 3.42Å; P388-L602 VanDerWaalsContact CB-CD1 3.42Å; P388-L602 HydrophobicContact CB-CD2 3.47Å; P388-L602 VanDerWaalsContact CB-CD2 3.47Å; P388-L602 HydrophobicContact CB-CG 4.07Å; P388-L602 HydrophobicContact CG-CD1 3.98Å; P388-L602 HydrophobicContact CG-CD2 3.78Å; P388-L602 HydrophobicContact CG-CG 4.39Å
389	H	70.8	Confident	87.7	Confident	87 Å²	87	45.7 Å²	45.7	40%	0.403	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-33.7	-176.5	-53.7	89.5	0	0	0	112.5	D387	D387-H389 PolarHBondContact O-N 3.3Å; D387-H389 WeakPolarHBondContact OD1-CB 3.5Å; D387-H389 IonicContact OD1-CG 3.24Å; D387-H389 PolarHBondContact OD1-N 3.36Å; D387-H389 IonicContact OD1-ND1 2.6Å; D387-H389 PolarHBondContact OD1-ND1 2.99Å
390	T	75.8	Confident	88	Confident	72 Å²	72	42 Å²	42	44%	0.442	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-6.8	175.9	54.4	0	0	0	0	111.9	D387 Q392	D387-T390 WeakPolarHBondContact CB-OG1 3.38Å; D387-T390 VanDerWaalsContact CG-OG1 3.31Å; D387-T390 PolarHBondContact O-N 3.06Å; D387-T390 WeakPolarHBondContact OD2-CG2 3.41Å; D387-T390 PolarHBondContact OD2-OG1 3.14Å; T390-Q392 WeakPolarHBondContact O-CG 3.43Å; T390-Q392 PolarHBondContact O-N 2.94Å
391	N	80.1	Confident	88	Confident	72 Å²	72	44.9 Å²	44.9	39%	0.385	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	47.7	-170.9	-171.6	26.6	0	0	0	111.5	A350 Y386 D387 P388	A350-N391 WeakPolarHBondContact CB-O 3.38Å; A350-N391 WeakPolarHBondContact CB-OD1 3.47Å; A350-N391 PolarHBondContact N-OD1 3.29Å; Y386-N391 WeakPolarHBondContact CE2-OD1 3.29Å; Y386-N391 PolarHBondContact OH-OD1 3.02Å; D387-N391 WeakPolarHBondContact O-CA 3.19Å; D387-N391 PolarHBondContact O-N 3.48Å; P388-N391 PolarHBondContact O-N 2.82Å
392	Q	82.6	Confident	87.8	Confident	124 Å²	124	43.8 Å²	43.8	58%	0.579	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135	145.9	-175.8	-76.9	177.8	22.8	0	0	112.1	Y386 D387 T390	Y386-Q392 WeakPolarHBondContact CA-O 3.25Å; D387-Q392 PolarHBondContact N-O 2.91Å; D387-Q392 PolarHBondContact O-N 2.84Å; T390-Q392 WeakPolarHBondContact O-CG 3.43Å; T390-Q392 PolarHBondContact O-N 2.94Å
393	W	87.4	Confident	87.6	Confident	26 Å²	26	44.8 Å²	44.8	10%	0.098	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.3	170.2	-71.9	90.1	0	0	0	110.5	M336 A350 M352 L368 A370 E384 R385 Y386	M336-W393 HydrophobicContact CE-CZ2 4.48Å; M336-W393 HydrophobicContact SD-CH2 4.34Å; M336-W393 HydrophobicContact SD-CZ2 3.48Å; M336-W393 WeakPolarHBondContact SD-CZ2 3.48Å; A350-W393 PolarHBondContact O-NE1 3.38Å; M352-W393 HydrophobicContact CB-CD2 4.43Å; M352-W393 HydrophobicContact CG-CD2 3.61Å; M352-W393 HydrophobicContact CG-CE3 3.86Å; M352-W393 HydrophobicContact CG-CG 4.31Å; M352-W393 HydrophobicContact CG-CH2 3.61Å; M352-W393 HydrophobicContact CG-CZ2 3.32Å; M352-W393 HydrophobicContact CG-CZ3 3.88Å; M352-W393 HydrophobicContact SD-CH2 3.83Å; M352-W393 HydrophobicContact SD-CZ2 4.02Å; M352-W393 HydrophobicContact SD-CZ3 4.2Å; L368-W393 HydrophobicContact CD2-CH2 4.23Å; A370-W393 HydrophobicContact CB-CH2 3.85Å; A370-W393 HydrophobicContact CB-CZ3 3.69Å; E384-W393 HydrophobicContact CB-CE3 3.6Å; E384-W393 HydrophobicContact CB-CZ3 4.02Å; R385-W393 VanDerWaalsContact C-CE3 3.44Å; R385-W393 CarbonylContact O-C 3.51Å; R385-W393 WeakPolarHBondContact O-CA 3.46Å; Y386-W393 AromaticContact CD2-CD1 3.73Å; Y386-W393 HydrophobicContact CD2-CD2 4.1Å; Y386-W393 AromaticContact CD2-CE2 3.8Å; Y386-W393 HydrophobicContact CD2-CG 4.11Å; Y386-W393 HydrophobicContact CD2-CZ2 4.43Å; Y386-W393 AromaticContact CD2-NE1 3.51Å; Y386-W393 HydrophobicContact CG-CD2 4.29Å; Y386-W393 AromaticContact CG-CE2 3.97Å; Y386-W393 HydrophobicContact CG-CZ2 4.2Å
394	S	89.5	Confident	87.4	Confident	41 Å²	41	44.8 Å²	44.8	29%	0.287	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.6	173	-63.6	0	0	0	0	110.4	E384 R385 D396	E384-S394 CarbonylContact C-O 3.59Å; E384-S394 WeakPolarHBondContact CA-O 3.2Å; R385-S394 PolarHBondContact N-O 2.75Å; R385-S394 PolarHBondContact O-N 3.5Å; S394-D396 VanDerWaalsContact CB-OD1 3.27Å; S394-D396 WeakPolarHBondContact CB-OD1 3.31Å
395	S	91.3	Very high	87.2	Confident	93 Å²	93	45 Å²	45	65%	0.65	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	24.3	177.8	65.2	0	0	0	0	112.5	V397	S395-V397 PolarHBondContact O-N 2.78Å
396	D	90.8	Very high	87	Confident	85 Å²	85	43.2 Å²	43.2	46%	0.455	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	9.3	-178.4	64.3	-23.9	0	0	0	113.3	R385 S394 N439	R385-D396 IonicContact CZ-OD1 2.8Å; R385-D396 IonicContact CZ-OD2 2.82Å; R385-D396 IonicContact NE-OD1 2.93Å; R385-D396 PolarHBondContact NE-OD1 3.15Å; R385-D396 IonicContact NE-OD2 3.49Å; R385-D396 PolarHBondContact NE-OD2 2.85Å; R385-D396 IonicContact NH2-OD1 3.49Å; R385-D396 PolarHBondContact NH2-OD1 3.44Å; R385-D396 IonicContact NH2-OD2 3.35Å; R385-D396 PolarHBondContact NH2-OD2 3.48Å; S394-D396 VanDerWaalsContact CB-OD1 3.27Å; S394-D396 WeakPolarHBondContact CB-OD1 3.31Å; D396-N439 PolarHBondContact O-ND2 3.18Å
397	V	94.4	Very high	87.1	Confident	9 Å²	9	43.8 Å²	43.8	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.3	177.9	-174.1	0	0	0	0	109.7	Y369 I383 R385 S395 Y434	Y369-V397 HydrophobicContact CD1-CG1 4.38Å; Y369-V397 HydrophobicContact CD1-CG2 4.22Å; Y369-V397 HydrophobicContact CE1-CG1 4.18Å; Y369-V397 HydrophobicContact CE1-CG2 3.76Å; I383-V397 HydrophobicContact CB-CB 4.02Å; I383-V397 HydrophobicContact CB-CG1 3.81Å; I383-V397 HydrophobicContact CG2-CB 4.04Å; I383-V397 HydrophobicContact CG2-CG1 3.73Å; I383-V397 HydrophobicContact CG2-CG2 4.4Å; R385-V397 HydrophobicContact CB-CG2 4.04Å; R385-V397 HydrophobicContact CG-CG2 3.88Å; S395-V397 PolarHBondContact O-N 2.78Å; V397-Y434 HydrophobicContact CG1-CE1 4.33Å; V397-Y434 HydrophobicContact CG1-CE2 3.86Å
398	A	95.2	Very high	87.6	Confident	21 Å²	21	42.7 Å²	42.7	17%	0.174	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-56.3	143.1	178.5	0	0	0	0	0	111.7	I383 N439 W441	I383-A398 WeakPolarHBondContact CD1-O 3.31Å; A398-N439 WeakPolarHBondContact CB-O 3.33Å; A398-N439 WeakPolarHBondContact CB-OD1 3.47Å; A398-N439 PolarHBondContact N-OD1 3.44Å; A398-W441 VanDerWaalsContact O-CD1 3.27Å; A398-W441 PolarHBondContact O-NE1 2.9Å
399	P	95.8	Very high	88.5	Confident	74 Å²	74	43.2 Å²	43.2	48%	0.481	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-73.5	155.1	178.8	31.2	-35.1	0	0	0	111.9	N381	N381-P399 WeakPolarHBondContact O-CA 3.02Å
400	T	94.5	Very high	89.6	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-68.3	157	166.2	47.4	0	0	0	0	110.8	N381 I383 T402 A418 W441	N381-T400 WeakPolarHBondContact CA-OG1 3.5Å; N381-T400 WeakPolarHBondContact CB-O 3.45Å; N381-T400 WeakPolarHBondContact CB-OG1 3.32Å; N381-T400 PolarHBondContact ND2-O 3.1Å; N381-T400 PolarHBondContact O-N 2.81Å; N381-T400 PolarHBondContact O-OG1 2.83Å; N381-T400 VanDerWaalsContact O-OG1 3.05Å; I383-T400 HydrophobicContact CD1-CG2 4.15Å; T400-T402 PolarHBondContact O-N 3.3Å; T400-T402 PolarHBondContact OG1-O 2.87Å; T400-A418 HydrophobicContact CG2-CB 4.29Å; T400-W441 HydrophobicContact CG2-CD2 3.74Å; T400-W441 HydrophobicContact CG2-CE3 4.02Å; T400-W441 HydrophobicContact CG2-CG 4.27Å; T400-W441 HydrophobicContact CG2-CH2 4.18Å; T400-W441 HydrophobicContact CG2-CZ2 3.91Å; T400-W441 HydrophobicContact CG2-CZ3 4.24Å
401	S	91.6	Very high	90.4	Very high	68 Å²	68	38.2 Å²	38.2	48%	0.476	23%	0.232	S	C	.	.	S	Bend	trans	-70.8	-9.6	-179	61.8	0	0	0	0	114.4	E432 K443	S401-E432 VanDerWaalsContact CB-OE2 3.28Å; S401-E432 WeakPolarHBondContact CB-OE2 3.35Å; S401-E432 PolarHBondContact N-OE2 3.26Å; S401-E432 PolarHBondContact OG-OE1 3.26Å; S401-E432 VanDerWaalsContact OG-OE1 3.13Å; S401-E432 PolarHBondContact OG-OE2 3.06Å; S401-K443 WeakPolarHBondContact OG-CE 2.91Å
402	T	87.2	Confident	91	Very high	32 Å²	32	34.9 Å²	34.9	20%	0.196	21%	0.214	C	C	.	.	S	Bend	trans	-142.6	144	-176.6	42.7	0	0	0	0	109.8	N381 T400 R404 I430 E432	N381-T402 WeakPolarHBondContact CB-O 2.87Å; T400-T402 PolarHBondContact O-N 3.3Å; T400-T402 PolarHBondContact OG1-O 2.87Å; T402-R404 VanDerWaalsContact OG1-CZ 3.25Å; T402-R404 PolarHBondContact OG1-NE 3.27Å; T402-R404 PolarHBondContact OG1-NH2 3.04Å; T402-I430 HydrophobicContact CG2-CD1 4.49Å; T402-E432 PolarHBondContact OG1-OE1 3.14Å
403	C	88.8	Confident	91.2	Very high	44 Å²	44	33.9 Å²	33.9	30%	0.297	21%	0.213	S	C	.	.			trans	-72.8	139	172.4	-63.3	0	0	0	0	110.6	Y379 N381 D423	Y379-C403 WeakPolarHBondContact O-CB 3.45Å; Y379-C403 PolarHBondContact O-SG 3.14Å; N381-C403 HydrophobicContact CB-CB 4.5Å; C403-D423 VanDerWaalsContact O-CA 3.31Å; C403-D423 WeakPolarHBondContact O-CA 3.37Å; C403-D423 VanDerWaalsContact O-CB 3.22Å; C403-D423 WeakPolarHBondContact O-CB 3.38Å
404	R	89.9	Confident	91.2	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	23%	0.225	C	C	.	.			trans	-147.2	137.2	-171.9	-58.5	178.5	-176.9	-134.2	5	112.3	G373 L380 T402 I407 G420 Q422 L428 I430 E432	G373-R404 WeakPolarHBondContact CA-O 3.33Å; G373-R404 PolarHBondContact N-O 2.93Å; L380-R404 PolarHBondContact O-N 3.04Å; T402-R404 VanDerWaalsContact OG1-CZ 3.25Å; T402-R404 PolarHBondContact OG1-NE 3.27Å; T402-R404 PolarHBondContact OG1-NH2 3.04Å; R404-I407 HydrophobicContact CB-CB 4.48Å; R404-I407 HydrophobicContact CB-CD1 4.11Å; R404-I407 HydrophobicContact CG-CD1 4.45Å; R404-G420 PolarHBondContact NH1-O 2.89Å; R404-Q422 CarbonylContact C-O 3.45Å; R404-Q422 VanDerWaalsContact CA-O 3.28Å; R404-Q422 WeakPolarHBondContact CA-O 3.35Å; R404-L428 HydrophobicContact CG-CD1 3.81Å; R404-I430 PolarHBondContact NH1-O 3.15Å; R404-I430 VanDerWaalsContact NH2-CB 3.33Å; R404-E432 IonicContact CZ-OE1 3.5Å; R404-E432 IonicContact NE-OE1 3.58Å; R404-E432 IonicContact NH2-OE1 2.69Å; R404-E432 PolarHBondContact NH2-OE1 3.27Å
405	T	89	Confident	91.4	Very high	9 Å²	9	35.6 Å²	35.6	6%	0.055	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-125.3	163.6	161.7	-171.5	0	0	0	0	111.1	C357 G358 Y379 I407 G421 Q422	C357-T405 PolarHBondContact O-OG1 2.78Å; C357-T405 VanDerWaalsContact O-OG1 3.06Å; G358-T405 WeakPolarHBondContact CA-OG1 3.46Å; Y379-T405 HydrophobicContact CD1-CG2 3.67Å; Y379-T405 HydrophobicContact CE1-CG2 3.5Å; T405-I407 PolarHBondContact O-N 2.71Å; T405-G421 CarbonylContact O-C 3.59Å; T405-G421 WeakPolarHBondContact O-CA 3.3Å; T405-Q422 HydrophobicContact CG2-CG 3.58Å; T405-Q422 PolarHBondContact N-O 2.93Å; T405-Q422 PolarHBondContact O-N 2.81Å
406	S	88.4	Confident	91.6	Very high	20 Å²	20	31.2 Å²	31.2	14%	0.14	19%	0.193	C	C	.	.	S	Bend	trans	55.3	41.1	-176.4	-58.1	0	0	0	0	112	G358 G453	G358-S406 PolarHBondContact O-N 3.5Å; S406-G453 PolarHBondContact O-N 2.83Å
407	I	89.3	Confident	91.9	Very high	11 Å²	11	27.3 Å²	27.3	6%	0.056	17%	0.172	C	C	.	.			trans	-86.8	143.8	-177.3	-169.5	174.3	0	0	0	110.7	V371 R404 T405 V409 A418 V419	V371-I407 HydrophobicContact CG1-CD1 4.31Å; R404-I407 HydrophobicContact CB-CB 4.48Å; R404-I407 HydrophobicContact CB-CD1 4.11Å; R404-I407 HydrophobicContact CG-CD1 4.45Å; T405-I407 PolarHBondContact O-N 2.71Å; I407-V409 HydrophobicContact CD1-CG2 4.49Å; I407-V409 HydrophobicContact CG1-CG2 4.35Å; I407-V409 HydrophobicContact CG2-CG2 4.13Å; I407-A418 HydrophobicContact CD1-CB 3.62Å; I407-V419 WeakPolarHBondContact CG1-O 3.38Å
408	G	92.1	Very high	92	Very high	4 Å²	4	26.9 Å²	26.9	4%	0.041	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.7	168.3	0	0	0	0	0	110.8	V419	G408-V419 PolarHBondContact N-O 3.33Å; G408-V419 WeakPolarHBondContact O-CB 3.49Å; G408-V419 PolarHBondContact O-N 2.83Å
409	V	93.9	Very high	92.1	Very high	13 Å²	13	25.9 Å²	25.9	8%	0.079	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.3	-178.3	-177.4	0	0	0	0	109.9	A362 V371 I407 L416 Y417	A362-V409 HydrophobicContact CB-CB 4.43Å; A362-V409 HydrophobicContact CB-CG1 3.7Å; V371-V409 HydrophobicContact CB-CG2 3.93Å; V371-V409 HydrophobicContact CG1-CG2 4.31Å; V371-V409 HydrophobicContact CG2-CG1 4.07Å; V371-V409 HydrophobicContact CG2-CG2 4.15Å; I407-V409 HydrophobicContact CD1-CG2 4.49Å; I407-V409 HydrophobicContact CG1-CG2 4.35Å; I407-V409 HydrophobicContact CG2-CG2 4.13Å; V409-L416 HydrophobicContact CG1-CD1 3.38Å; V409-L416 HydrophobicContact CG1-CG 3.95Å; V409-Y417 VanDerWaalsContact CA-O 3.26Å; V409-Y417 WeakPolarHBondContact CA-O 3.41Å; V409-Y417 WeakPolarHBondContact CG1-O 3.32Å
410	A	94.7	Very high	92.1	Very high	10 Å²	10	22.4 Å²	22.4	8%	0.083	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	168.8	172.7	0	0	0	0	0	110.7	Y417 V456 V458 L463	A410-Y417 PolarHBondContact N-O 2.92Å; A410-Y417 PolarHBondContact O-N 2.9Å; A410-V456 HydrophobicContact CB-CG1 3.77Å; A410-V458 HydrophobicContact CB-CG2 4.09Å; A410-L463 HydrophobicContact CB-CD1 3.75Å
411	V	93	Very high	92	Very high	43 Å²	43	22.3 Å²	22.3	26%	0.261	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.8	179.6	172.3	0	0	0	0	110.4	A362 V363 L364 Y415 L416 V458	A362-V411 HydrophobicContact CB-CG2 4.2Å; V363-V411 VanDerWaalsContact O-CG2 3.29Å; V363-V411 WeakPolarHBondContact O-CG2 3.23Å; L364-V411 HydrophobicContact CB-CG2 3.83Å; L364-V411 HydrophobicContact CD1-CG1 3.63Å; L364-V411 HydrophobicContact CD1-CG2 4.25Å; V411-Y415 CarbonylContact C-O 3.59Å; V411-Y415 VanDerWaalsContact CA-O 3.27Å; V411-Y415 WeakPolarHBondContact CA-O 3.17Å; V411-L416 HydrophobicContact CG2-CB 4.47Å; V411-L416 HydrophobicContact CG2-CD1 3.68Å; V411-V458 WeakPolarHBondContact O-CG2 3.48Å
412	L	92.2	Very high	92	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.016	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.2	175.7	172.7	64.1	0	0	0	108.7	G414 Y415 Y417 V458 G461 L463 A483	L412-G414 PolarHBondContact O-N 3.31Å; L412-Y415 PolarHBondContact N-O 3.44Å; L412-Y415 PolarHBondContact O-N 2.9Å; L412-Y417 HydrophobicContact CB-CD2 4.06Å; L412-Y417 HydrophobicContact CB-CE2 3.75Å; L412-Y417 HydrophobicContact CD2-CE2 4.44Å; L412-Y417 HydrophobicContact CG-CE2 4.41Å; L412-V458 HydrophobicContact CB-CG1 4.48Å; L412-V458 HydrophobicContact CB-CG2 3.99Å; L412-V458 HydrophobicContact CD1-CG1 3.68Å; L412-G461 WeakPolarHBondContact CD1-O 3.38Å; L412-L463 HydrophobicContact CD2-CB 4.24Å; L412-A483 HydrophobicContact CD2-CB 3.95Å
413	D	87	Confident	92.1	Very high	103 Å²	103	22.4 Å²	22.4	55%	0.551	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	37.6	176.1	-57.9	-24.9	0	0	0	114.3	Y415	D413-Y415 VanDerWaalsContact C-N 3.3Å; D413-Y415 HydrophobicContact CB-CD2 4.41Å; D413-Y415 WeakPolarHBondContact O-CD2 3.4Å; D413-Y415 VanDerWaalsContact O-CE2 3.29Å; D413-Y415 WeakPolarHBondContact O-CE2 3.17Å; D413-Y415 PolarHBondContact O-N 3.38Å
414	G	87	Confident	91.9	Very high	34 Å²	34	22.2 Å²	22.2	35%	0.351	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	8.2	-179.7	0	0	0	0	0	114.8	L364 L412	L364-G414 VanDerWaalsContact CD1-O 3.3Å; L364-G414 WeakPolarHBondContact CD1-O 3.42Å; L412-G414 PolarHBondContact O-N 3.31Å
415	Y	93.8	Very high	91.7	Very high	69 Å²	69	28.8 Å²	28.8	27%	0.271	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.8	177	-58.6	-81.9	0	0	0	111.3	V411 L412 D413 R433 Y434 D435	V411-Y415 CarbonylContact C-O 3.59Å; V411-Y415 VanDerWaalsContact CA-O 3.27Å; V411-Y415 WeakPolarHBondContact CA-O 3.17Å; L412-Y415 PolarHBondContact N-O 3.44Å; L412-Y415 PolarHBondContact O-N 2.9Å; D413-Y415 VanDerWaalsContact C-N 3.3Å; D413-Y415 HydrophobicContact CB-CD2 4.41Å; D413-Y415 WeakPolarHBondContact O-CD2 3.4Å; D413-Y415 VanDerWaalsContact O-CE2 3.29Å; D413-Y415 WeakPolarHBondContact O-CE2 3.17Å; D413-Y415 PolarHBondContact O-N 3.38Å; Y415-R433 HydrophobicContact CD1-CG 4.24Å; Y415-R433 HydrophobicContact CG-CG 4.02Å; Y415-Y434 WeakPolarHBondContact CB-O 3.24Å; Y415-Y434 WeakPolarHBondContact CD1-O 3.32Å; Y415-D435 HydrophobicContact CD1-CB 3.93Å; Y415-D435 HydrophobicContact CE1-CB 3.78Å
416	L	95.9	Very high	91.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.1	175.6	-178.4	76.9	0	0	0	109.7	A362 L364 Y369 V371 V409 V411 R433 Y434 W441	A362-L416 HydrophobicContact CB-CD1 3.72Å; L364-L416 HydrophobicContact CD2-CB 4.1Å; Y369-L416 HydrophobicContact CD1-CD2 4.01Å; Y369-L416 HydrophobicContact CG-CD2 3.96Å; V371-L416 HydrophobicContact CG2-CD2 3.84Å; V409-L416 HydrophobicContact CG1-CD1 3.38Å; V409-L416 HydrophobicContact CG1-CG 3.95Å; V411-L416 HydrophobicContact CG2-CB 4.47Å; V411-L416 HydrophobicContact CG2-CD1 3.68Å; L416-R433 CarbonylContact O-C 3.43Å; L416-R433 WeakPolarHBondContact O-CA 3.46Å; L416-Y434 HydrophobicContact CB-CD1 4.21Å; L416-Y434 PolarHBondContact N-O 2.85Å; L416-Y434 PolarHBondContact O-N 3.46Å; L416-W441 HydrophobicContact CD2-CH2 3.86Å; L416-W441 HydrophobicContact CD2-CZ2 4.17Å; L416-W441 HydrophobicContact CG-CH2 4.17Å
417	Y	97.3	Very high	92	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.016	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.6	-179.8	-74.2	-101.9	0	0	0	110.8	V409 A410 L412 V431 E432 R433 V444 L463 Y481	V409-Y417 VanDerWaalsContact CA-O 3.26Å; V409-Y417 WeakPolarHBondContact CA-O 3.41Å; V409-Y417 WeakPolarHBondContact CG1-O 3.32Å; A410-Y417 PolarHBondContact N-O 2.92Å; A410-Y417 PolarHBondContact O-N 2.9Å; L412-Y417 HydrophobicContact CB-CD2 4.06Å; L412-Y417 HydrophobicContact CB-CE2 3.75Å; L412-Y417 HydrophobicContact CD2-CE2 4.44Å; L412-Y417 HydrophobicContact CG-CE2 4.41Å; Y417-V431 HydrophobicContact CD1-CG1 4.15Å; Y417-E432 CarbonylContact C-O 3.56Å; Y417-E432 WeakPolarHBondContact CA-O 3.34Å; Y417-R433 HydrophobicContact CD1-CB 4.07Å; Y417-R433 HydrophobicContact CD1-CG 4.31Å; Y417-R433 HydrophobicContact CD2-CG 4.33Å; Y417-R433 HydrophobicContact CE1-CB 3.77Å; Y417-R433 HydrophobicContact CE1-CG 3.82Å; Y417-R433 HydrophobicContact CE2-CG 3.82Å; Y417-R433 VanDerWaalsContact OH-CD 3.26Å; Y417-R433 WeakPolarHBondContact OH-CD 3.18Å; Y417-V444 HydrophobicContact CE1-CG1 4.46Å; Y417-V444 HydrophobicContact CE1-CG2 4.33Å; Y417-L463 HydrophobicContact CD1-CD2 4.09Å; Y417-L463 HydrophobicContact CG-CD2 4.07Å; Y417-Y481 AromaticContact CE1-CE1 3.86Å; Y417-Y481 HydrophobicContact CE1-CE1 3.86Å
418	A	96.4	Very high	92.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	112.4	176.2	0	0	0	0	0	108.7	V371 T400 I407 V431 E432 W441	V371-A418 HydrophobicContact CG1-CB 4.31Å; T400-A418 HydrophobicContact CG2-CB 4.29Å; I407-A418 HydrophobicContact CD1-CB 3.62Å; A418-V431 WeakPolarHBondContact O-CA 3.3Å; A418-E432 PolarHBondContact N-O 3.18Å; A418-E432 PolarHBondContact O-N 3.24Å; A418-W441 HydrophobicContact CB-CE3 4.33Å; A418-W441 HydrophobicContact CB-CH2 3.76Å; A418-W441 HydrophobicContact CB-CZ3 3.46Å; A418-W441 VanDerWaalsContact CB-CZ3 3.46Å
419	V	96.6	Very high	92.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.8	-164.3	-175.4	0	0	0	0	111.1	I407 G408 V431 M447 V454 V456 L463 A465 W488	I407-V419 WeakPolarHBondContact CG1-O 3.38Å; G408-V419 PolarHBondContact N-O 3.33Å; G408-V419 WeakPolarHBondContact O-CB 3.49Å; G408-V419 PolarHBondContact O-N 2.83Å; V419-V431 HydrophobicContact CG1-CG2 4.11Å; V419-V431 HydrophobicContact CG2-CG1 4.01Å; V419-M447 HydrophobicContact CG1-CE 3.76Å; V419-M447 HydrophobicContact CG1-CG 4.37Å; V419-M447 HydrophobicContact CG1-SD 3.37Å; V419-M447 WeakPolarHBondContact CG1-SD 3.43Å; V419-V454 WeakPolarHBondContact O-CG1 3.31Å; V419-V456 HydrophobicContact CB-CG2 3.86Å; V419-V456 HydrophobicContact CG1-CG2 3.99Å; V419-V456 HydrophobicContact CG2-CG1 4.1Å; V419-V456 HydrophobicContact CG2-CG2 4.09Å; V419-L463 HydrophobicContact CG2-CD2 3.83Å; V419-A465 HydrophobicContact CG1-CB 4.4Å; V419-W488 HydrophobicContact CG1-CH2 4.36Å
420	G	94.9	Very high	92.5	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.198	C	C	.	.			trans	64.8	-140.1	174.1	0	0	0	0	0	113.3	R404 I430	R404-G420 PolarHBondContact NH1-O 2.89Å; G420-I430 PolarHBondContact N-O 3.18Å; G420-I430 VanDerWaalsContact N-O 3.08Å
421	G	92.6	Very high	92.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.195	C	C	.	.			trans	94.3	-164.8	-172.4	0	0	0	0	0	112.9	T405 L428 R451	T405-G421 CarbonylContact O-C 3.59Å; T405-G421 WeakPolarHBondContact O-CA 3.3Å; G421-L428 WeakPolarHBondContact O-CB 3.28Å; G421-L428 PolarHBondContact O-N 3.06Å; G421-R451 PolarHBondContact N-O 2.83Å
422	Q	91.6	Very high	92.9	Very high	54 Å²	54	30.7 Å²	30.7	25%	0.252	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-136.2	150.4	172	66	174.9	-18.9	0	0	111.1	Y379 R404 T405 S426 L452	Y379-Q422 HydrophobicContact CE1-CG 4.42Å; R404-Q422 CarbonylContact C-O 3.45Å; R404-Q422 VanDerWaalsContact CA-O 3.28Å; R404-Q422 WeakPolarHBondContact CA-O 3.35Å; T405-Q422 HydrophobicContact CG2-CG 3.58Å; T405-Q422 PolarHBondContact N-O 2.93Å; T405-Q422 PolarHBondContact O-N 2.81Å; Q422-S426 WeakPolarHBondContact CA-O 3.47Å; Q422-S426 WeakPolarHBondContact CB-O 3.26Å; Q422-L452 HydrophobicContact CB-CB 4.45Å; Q422-L452 HydrophobicContact CB-CD2 4.39Å
423	D	89.8	Confident	93.2	Very high	49 Å²	49	34 Å²	34	26%	0.262	20%	0.195	S	C	.	.			trans	-103.2	4.4	-179.6	60.7	6.7	0	0	0	113.9	C403 V425 S426 L428	C403-D423 VanDerWaalsContact O-CA 3.31Å; C403-D423 WeakPolarHBondContact O-CA 3.37Å; C403-D423 VanDerWaalsContact O-CB 3.22Å; C403-D423 WeakPolarHBondContact O-CB 3.38Å; D423-V425 WeakPolarHBondContact OD1-CA 3.14Å; D423-V425 PolarHBondContact OD1-N 3.02Å; D423-S426 PolarHBondContact N-O 2.96Å; D423-S426 PolarHBondContact OD1-N 3.3Å; D423-L428 HydrophobicContact CB-CD1 4.38Å
424	G	84.9	Confident	93.7	Very high	40 Å²	40	29.6 Å²	29.6	41%	0.412	17%	0.171	S	C	.	.	S	Bend	trans	93.3	-12.3	-174.3	0	0	0	0	0	114.5	Y379	Y379-G424 VanDerWaalsContact CE2-CA 3.42Å; Y379-G424 WeakPolarHBondContact OH-CA 3.5Å
425	V	86.1	Confident	94	Very high	138 Å²	138	29 Å²	29	84%	0.836	16%	0.16	S	C	*	.	S	Bend	trans	-110.8	-42.2	174.8	-178	0	0	0	0	110.6	D423	D423-V425 WeakPolarHBondContact OD1-CA 3.14Å; D423-V425 PolarHBondContact OD1-N 3.02Å
426	S	89.7	Confident	93.8	Very high	37 Å²	37	27.1 Å²	27.1	26%	0.259	16%	0.156	S	C	.	.			trans	-146.1	155.3	-174.2	74.9	0	0	0	0	113.8	Q422 D423	Q422-S426 WeakPolarHBondContact CA-O 3.47Å; Q422-S426 WeakPolarHBondContact CB-O 3.26Å; D423-S426 PolarHBondContact N-O 2.96Å; D423-S426 PolarHBondContact OD1-N 3.3Å
427	C	92.6	Very high	93.4	Very high	13 Å²	13	34 Å²	34	9%	0.088	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-71.5	137	164.7	-64.7	0	0	0	0	109.8	R450 L452 G471	C427-R450 HydrophobicContact CB-CB 3.88Å; C427-R450 VanDerWaalsContact O-CD 3.23Å; C427-R450 WeakPolarHBondContact O-CD 3.35Å; C427-R450 WeakPolarHBondContact O-CG 2.97Å; C427-R450 PolarHBondContact O-NH1 3.42Å; C427-L452 WeakPolarHBondContact SG-CD2 3.37Å; C427-G471 WeakPolarHBondContact SG-CA 3.27Å; C427-G471 PolarHBondContact SG-N 2.96Å; C427-G471 VanDerWaalsContact SG-N 3.44Å
428	L	94.7	Very high	93.1	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.042	21%	0.21	C	C	.	.			trans	-103.5	143.3	-173.2	-56.1	176.2	0	0	0	111.4	R404 G421 D423 I430 R450 R451	R404-L428 HydrophobicContact CG-CD1 3.81Å; G421-L428 WeakPolarHBondContact O-CB 3.28Å; G421-L428 PolarHBondContact O-N 3.06Å; D423-L428 HydrophobicContact CB-CD1 4.38Å; L428-I430 HydrophobicContact CD2-CD1 4.34Å; L428-R450 WeakPolarHBondContact O-CA 3.49Å; L428-R451 PolarHBondContact O-N 3.3Å
429	N	96.3	Very high	93	Very high	48 Å²	48	40.6 Å²	40.6	26%	0.257	23%	0.226	S	C	.	.			trans	-108.6	5.2	163.2	67.9	-26.8	0	0	0	112.2	P446 M447 S449 R450	N429-P446 CarbonylContact O-C 3.52Å; N429-P446 VanDerWaalsContact O-CA 3.31Å; N429-P446 WeakPolarHBondContact O-CA 3.41Å; N429-P446 WeakPolarHBondContact O-CB 3.48Å; N429-M447 HydrophobicContact CB-CB 4.17Å; N429-M447 WeakPolarHBondContact CB-O 3.37Å; N429-M447 PolarHBondContact ND2-O 2.78Å; N429-M447 PolarHBondContact O-N 3.23Å; N429-S449 WeakPolarHBondContact CB-O 3.48Å; N429-R450 HydrophobicContact CB-CG 4.04Å
430	I	96.3	Very high	93	Very high	41 Å²	41	49 Å²	49	21%	0.21	26%	0.258	C	S	.	.			trans	-71.7	140.5	-176.7	-55.1	173.2	0	0	0	109.3	T402 R404 G420 L428 E432 K443	T402-I430 HydrophobicContact CG2-CD1 4.49Å; R404-I430 PolarHBondContact NH1-O 3.15Å; R404-I430 VanDerWaalsContact NH2-CB 3.33Å; G420-I430 PolarHBondContact N-O 3.18Å; G420-I430 VanDerWaalsContact N-O 3.08Å; L428-I430 HydrophobicContact CD2-CD1 4.34Å; I430-E432 HydrophobicContact CG2-CG 4.33Å; I430-K443 HydrophobicContact CG2-CG 4.49Å
431	V	97.6	Very high	93.1	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.1	174.8	-173.9	0	0	0	0	109.1	Y417 A418 V419 V444 M447 W488	Y417-V431 HydrophobicContact CD1-CG1 4.15Å; A418-V431 WeakPolarHBondContact O-CA 3.3Å; V419-V431 HydrophobicContact CG1-CG2 4.11Å; V419-V431 HydrophobicContact CG2-CG1 4.01Å; V431-V444 HydrophobicContact CB-CG2 3.72Å; V431-V444 HydrophobicContact CG1-CG2 3.57Å; V431-V444 PolarHBondContact O-N 3.01Å; V431-M447 HydrophobicContact CG2-CG 3.89Å; V431-W488 HydrophobicContact CG1-CZ2 4.41Å; V431-W488 HydrophobicContact CG2-CZ2 3.82Å
432	E	97.9	Very high	93.3	Very high	3 Å²	3	54 Å²	54	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.1	178	-65.6	176.4	-107.1	0	0	109.7	S401 T402 R404 Y417 A418 I430 W441 T442 K443	S401-E432 VanDerWaalsContact CB-OE2 3.28Å; S401-E432 WeakPolarHBondContact CB-OE2 3.35Å; S401-E432 PolarHBondContact N-OE2 3.26Å; S401-E432 PolarHBondContact OG-OE1 3.26Å; S401-E432 VanDerWaalsContact OG-OE1 3.13Å; S401-E432 PolarHBondContact OG-OE2 3.06Å; T402-E432 PolarHBondContact OG1-OE1 3.14Å; R404-E432 IonicContact CZ-OE1 3.5Å; R404-E432 IonicContact NE-OE1 3.58Å; R404-E432 IonicContact NH2-OE1 2.69Å; R404-E432 PolarHBondContact NH2-OE1 3.27Å; Y417-E432 CarbonylContact C-O 3.56Å; Y417-E432 WeakPolarHBondContact CA-O 3.34Å; A418-E432 PolarHBondContact N-O 3.18Å; A418-E432 PolarHBondContact O-N 3.24Å; I430-E432 HydrophobicContact CG2-CG 4.33Å; E432-W441 HydrophobicContact CB-CE3 3.64Å; E432-W441 HydrophobicContact CB-CZ3 4.26Å; E432-W441 WeakPolarHBondContact O-CZ3 3.08Å; E432-T442 CarbonylContact C-O 3.58Å; E432-T442 WeakPolarHBondContact CA-O 2.99Å; E432-K443 HydrophobicContact CG-CG 3.98Å
433	R	97.5	Very high	93.6	Very high	73 Å²	73	57.4 Å²	57.4	28%	0.275	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.4	176.1	-176.6	-166.4	73.8	-176.7	0.1	109.4	Y415 L416 Y417 W441 T442 V444	Y415-R433 HydrophobicContact CD1-CG 4.24Å; Y415-R433 HydrophobicContact CG-CG 4.02Å; L416-R433 CarbonylContact O-C 3.43Å; L416-R433 WeakPolarHBondContact O-CA 3.46Å; Y417-R433 HydrophobicContact CD1-CB 4.07Å; Y417-R433 HydrophobicContact CD1-CG 4.31Å; Y417-R433 HydrophobicContact CD2-CG 4.33Å; Y417-R433 HydrophobicContact CE1-CB 3.77Å; Y417-R433 HydrophobicContact CE1-CG 3.82Å; Y417-R433 HydrophobicContact CE2-CG 3.82Å; Y417-R433 VanDerWaalsContact OH-CD 3.26Å; Y417-R433 WeakPolarHBondContact OH-CD 3.18Å; R433-W441 CarbonylContact O-C 3.5Å; R433-W441 WeakPolarHBondContact O-CA 3.32Å; R433-T442 PolarHBondContact N-O 3Å; R433-T442 PolarHBondContact O-N 3.14Å; R433-V444 HydrophobicContact CB-CG1 3.89Å
434	Y	97.9	Very high	94	Very high	9 Å²	9	56.1 Å²	56.1	4%	0.035	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.8	173.7	175.5	-109.1	0	0	0	111.2	L364 Y369 V397 Y415 L416 P436 N439 R440 W441	L364-Y434 HydrophobicContact CD2-CD1 4.4Å; Y369-Y434 HydrophobicContact CE1-CE1 4.13Å; V397-Y434 HydrophobicContact CG1-CE1 4.33Å; V397-Y434 HydrophobicContact CG1-CE2 3.86Å; Y415-Y434 WeakPolarHBondContact CB-O 3.24Å; Y415-Y434 WeakPolarHBondContact CD1-O 3.32Å; L416-Y434 HydrophobicContact CB-CD1 4.21Å; L416-Y434 PolarHBondContact N-O 2.85Å; L416-Y434 PolarHBondContact O-N 3.46Å; Y434-P436 HydrophobicContact CE1-CB 3.9Å; Y434-N439 WeakPolarHBondContact CE2-OD1 3.5Å; Y434-N439 PolarHBondContact OH-OD1 3.02Å; Y434-R440 WeakPolarHBondContact CA-O 3.21Å; Y434-W441 AromaticContact CD2-CD1 3.87Å; Y434-W441 HydrophobicContact CD2-CD2 4.16Å; Y434-W441 AromaticContact CD2-CE2 3.79Å; Y434-W441 HydrophobicContact CD2-CG 4.23Å; Y434-W441 HydrophobicContact CD2-CZ2 4.3Å; Y434-W441 AromaticContact CD2-NE1 3.56Å; Y434-W441 HydrophobicContact CG-CD2 4.33Å; Y434-W441 AromaticContact CG-CE2 3.96Å; Y434-W441 HydrophobicContact CG-CH2 4.5Å; Y434-W441 HydrophobicContact CG-CZ2 4.07Å
435	D	93.6	Very high	94.6	Very high	22 Å²	22	55.1 Å²	55.1	12%	0.118	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.9	169.6	177.2	8	0	0	0	110.3	Y415 H437 T438 N439 R440	Y415-D435 HydrophobicContact CD1-CB 3.93Å; Y415-D435 HydrophobicContact CE1-CB 3.78Å; D435-H437 PolarHBondContact O-N 3.31Å; D435-H437 WeakPolarHBondContact OD1-CB 3.49Å; D435-H437 IonicContact OD1-CG 3.41Å; D435-H437 PolarHBondContact OD1-N 2.69Å; D435-H437 IonicContact OD1-ND1 3.57Å; D435-H437 PolarHBondContact OD1-ND1 2.96Å; D435-T438 WeakPolarHBondContact CB-OG1 3.49Å; D435-T438 VanDerWaalsContact CG-OG1 3.28Å; D435-T438 WeakPolarHBondContact OD2-CG2 3.43Å; D435-T438 PolarHBondContact OD2-OG1 2.95Å; D435-N439 WeakPolarHBondContact O-CA 3.35Å; D435-N439 PolarHBondContact O-N 3.03Å; D435-R440 PolarHBondContact N-O 3.45Å; D435-R440 PolarHBondContact O-N 2.81Å
436	P	89.1	Confident	95.2	Very high	29 Å²	29	51.9 Å²	51.9	19%	0.188	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.9	-180	29.4	-37	0	0	0	113.3	L364 Y434	L364-P436 HydrophobicContact CD2-CB 4.18Å; L364-P436 HydrophobicContact CD2-CG 3.97Å; Y434-P436 HydrophobicContact CE1-CB 3.9Å
437	H	87	Confident	95.6	Very high	145 Å²	145	50.3 Å²	50.3	67%	0.671	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-37.8	-177.5	-52.8	87	0	0	0	111.8	D435	D435-H437 PolarHBondContact O-N 3.31Å; D435-H437 WeakPolarHBondContact OD1-CB 3.49Å; D435-H437 IonicContact OD1-CG 3.41Å; D435-H437 PolarHBondContact OD1-N 2.69Å; D435-H437 IonicContact OD1-ND1 3.57Å; D435-H437 PolarHBondContact OD1-ND1 2.96Å
438	T	92.4	Very high	95.8	Very high	79 Å²	79	54.5 Å²	54.5	49%	0.485	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-5.8	179.7	57.7	0	0	0	0	112.9	D435 R440	D435-T438 WeakPolarHBondContact CB-OG1 3.49Å; D435-T438 VanDerWaalsContact CG-OG1 3.28Å; D435-T438 WeakPolarHBondContact OD2-CG2 3.43Å; D435-T438 PolarHBondContact OD2-OG1 2.95Å; T438-R440 VanDerWaalsContact C-N 3.3Å; T438-R440 WeakPolarHBondContact O-CG 3.31Å; T438-R440 PolarHBondContact O-N 2.96Å
439	N	94.8	Very high	95.8	Very high	63 Å²	63	55.9 Å²	55.9	34%	0.337	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	50.7	-173.5	-168.2	13	0	0	0	111.7	D396 A398 Y434 D435	D396-N439 PolarHBondContact O-ND2 3.18Å; A398-N439 WeakPolarHBondContact CB-O 3.33Å; A398-N439 WeakPolarHBondContact CB-OD1 3.47Å; A398-N439 PolarHBondContact N-OD1 3.44Å; Y434-N439 WeakPolarHBondContact CE2-OD1 3.5Å; Y434-N439 PolarHBondContact OH-OD1 3.02Å; D435-N439 WeakPolarHBondContact O-CA 3.35Å; D435-N439 PolarHBondContact O-N 3.03Å
440	R	95.9	Very high	95.9	Very high	178 Å²	178	59.5 Å²	59.5	67%	0.672	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	141	-175.5	-77.4	178.8	-179.2	-152.8	-0.7	112.4	Y434 D435 T438	Y434-R440 WeakPolarHBondContact CA-O 3.21Å; D435-R440 PolarHBondContact N-O 3.45Å; D435-R440 PolarHBondContact O-N 2.81Å; T438-R440 VanDerWaalsContact C-N 3.3Å; T438-R440 WeakPolarHBondContact O-CG 3.31Å; T438-R440 PolarHBondContact O-N 2.96Å
441	W	97.3	Very high	95.9	Very high	30 Å²	30	57.6 Å²	57.6	11%	0.114	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.3	167.9	-68.3	89	0	0	0	110.7	V371 I383 A398 T400 L416 A418 E432 R433 Y434	V371-W441 HydrophobicContact CG1-CH2 4.39Å; I383-W441 HydrophobicContact CD1-CZ2 3.92Å; I383-W441 HydrophobicContact CG1-CZ2 4.11Å; A398-W441 VanDerWaalsContact O-CD1 3.27Å; A398-W441 PolarHBondContact O-NE1 2.9Å; T400-W441 HydrophobicContact CG2-CD2 3.74Å; T400-W441 HydrophobicContact CG2-CE3 4.02Å; T400-W441 HydrophobicContact CG2-CG 4.27Å; T400-W441 HydrophobicContact CG2-CH2 4.18Å; T400-W441 HydrophobicContact CG2-CZ2 3.91Å; T400-W441 HydrophobicContact CG2-CZ3 4.24Å; L416-W441 HydrophobicContact CD2-CH2 3.86Å; L416-W441 HydrophobicContact CD2-CZ2 4.17Å; L416-W441 HydrophobicContact CG-CH2 4.17Å; A418-W441 HydrophobicContact CB-CE3 4.33Å; A418-W441 HydrophobicContact CB-CH2 3.76Å; A418-W441 HydrophobicContact CB-CZ3 3.46Å; A418-W441 VanDerWaalsContact CB-CZ3 3.46Å; E432-W441 HydrophobicContact CB-CE3 3.64Å; E432-W441 HydrophobicContact CB-CZ3 4.26Å; E432-W441 WeakPolarHBondContact O-CZ3 3.08Å; R433-W441 CarbonylContact O-C 3.5Å; R433-W441 WeakPolarHBondContact O-CA 3.32Å; Y434-W441 AromaticContact CD2-CD1 3.87Å; Y434-W441 HydrophobicContact CD2-CD2 4.16Å; Y434-W441 AromaticContact CD2-CE2 3.79Å; Y434-W441 HydrophobicContact CD2-CG 4.23Å; Y434-W441 HydrophobicContact CD2-CZ2 4.3Å; Y434-W441 AromaticContact CD2-NE1 3.56Å; Y434-W441 HydrophobicContact CG-CD2 4.33Å; Y434-W441 AromaticContact CG-CE2 3.96Å; Y434-W441 HydrophobicContact CG-CH2 4.5Å; Y434-W441 HydrophobicContact CG-CZ2 4.07Å
442	T	97.1	Very high	95.6	Very high	73 Å²	73	58.4 Å²	58.4	45%	0.448	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135	174.3	-54.9	0	0	0	0	109.4	E432 R433	E432-T442 CarbonylContact C-O 3.58Å; E432-T442 WeakPolarHBondContact CA-O 2.99Å; R433-T442 PolarHBondContact N-O 3Å; R433-T442 PolarHBondContact O-N 3.14Å
443	K	97.4	Very high	95.3	Very high	127 Å²	127	58.6 Å²	58.6	55%	0.552	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	132.5	173.5	-71.2	179.6	-179.7	177.6	0	110	S401 I430 E432	S401-K443 WeakPolarHBondContact OG-CE 2.91Å; I430-K443 HydrophobicContact CG2-CG 4.49Å; E432-K443 HydrophobicContact CG-CG 3.98Å
444	V	97.8	Very high	95.1	Very high	22 Å²	22	55.5 Å²	55.5	13%	0.133	28%	0.279	C	S	.	.			trans	-109	-176.9	171.2	-60.3	0	0	0	0	109.4	Y417 V431 R433	Y417-V444 HydrophobicContact CE1-CG1 4.46Å; Y417-V444 HydrophobicContact CE1-CG2 4.33Å; V431-V444 HydrophobicContact CB-CG2 3.72Å; V431-V444 HydrophobicContact CG1-CG2 3.57Å; V431-V444 PolarHBondContact O-N 3.01Å; R433-V444 HydrophobicContact CB-CG1 3.89Å
445	A	98	Very high	95	Very high	19 Å²	19	55.6 Å²	55.6	16%	0.157	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-54.5	133	177.9	0	0	0	0	0	111.1	Y481 N486 W488	A445-Y481 HydrophobicContact CB-CE2 4.28Å; A445-N486 WeakPolarHBondContact CB-O 3.47Å; A445-N486 WeakPolarHBondContact CB-OD1 3.49Å; A445-N486 PolarHBondContact N-OD1 2.81Å; A445-W488 PolarHBondContact O-NE1 3.09Å
446	P	98	Very high	95.1	Very high	70 Å²	70	55.2 Å²	55.2	46%	0.455	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-72	154.9	178.5	31.7	-35.4	0	0	0	110.6	N429 W488	N429-P446 CarbonylContact O-C 3.52Å; N429-P446 VanDerWaalsContact O-CA 3.31Å; N429-P446 WeakPolarHBondContact O-CA 3.41Å; N429-P446 WeakPolarHBondContact O-CB 3.48Å; P446-W488 VanDerWaalsContact C-CD1 3.5Å
447	M	98	Very high	95.4	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.015	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-60.9	153.8	169	-65.9	179.6	-65.7	0	0	110.6	V419 N429 V431 S449 R451 A465 W488	V419-M447 HydrophobicContact CG1-CE 3.76Å; V419-M447 HydrophobicContact CG1-CG 4.37Å; V419-M447 HydrophobicContact CG1-SD 3.37Å; V419-M447 WeakPolarHBondContact CG1-SD 3.43Å; N429-M447 HydrophobicContact CB-CB 4.17Å; N429-M447 WeakPolarHBondContact CB-O 3.37Å; N429-M447 PolarHBondContact ND2-O 2.78Å; N429-M447 PolarHBondContact O-N 3.23Å; V431-M447 HydrophobicContact CG2-CG 3.89Å; M447-S449 WeakPolarHBondContact CB-O 3.45Å; M447-S449 PolarHBondContact O-N 2.94Å; M447-R451 HydrophobicContact CE-CB 4.13Å; M447-R451 HydrophobicContact CE-CG 4.21Å; M447-R451 HydrophobicContact SD-CG 4.33Å; M447-A465 HydrophobicContact SD-CB 3.64Å; M447-W488 HydrophobicContact CG-CD2 3.97Å; M447-W488 HydrophobicContact CG-CE3 4.25Å; M447-W488 HydrophobicContact CG-CH2 4.02Å; M447-W488 HydrophobicContact CG-CZ2 3.74Å; M447-W488 HydrophobicContact CG-CZ3 4.26Å; M447-W488 HydrophobicContact SD-CH2 4.43Å
448	L	97.4	Very high	95.7	Very high	102 Å²	102	49.6 Å²	49.6	53%	0.534	26%	0.256	S	S	.	.	S	Bend	trans	-69.8	-25.3	176.7	-55	172.5	0	0	0	111.5	E479 W488 Q490	L448-E479 WeakPolarHBondContact CA-OE2 3.38Å; L448-E479 VanDerWaalsContact CB-OE2 3.23Å; L448-E479 WeakPolarHBondContact CB-OE2 3.33Å; L448-E479 WeakPolarHBondContact CG-OE2 3.4Å; L448-E479 PolarHBondContact N-OE2 2.91Å; L448-W488 HydrophobicContact CG-CB 4.14Å; L448-Q490 HydrophobicContact CD1-CG 3.81Å
449	S	95.3	Very high	95.7	Very high	36 Å²	36	46.6 Å²	46.6	25%	0.252	24%	0.237	S	C	.	.	S	Bend	trans	-125.4	150.1	175.4	-60.1	0	0	0	0	111.4	N429 M447 E479	N429-S449 WeakPolarHBondContact CB-O 3.48Å; M447-S449 WeakPolarHBondContact CB-O 3.45Å; M447-S449 PolarHBondContact O-N 2.94Å; S449-E479 PolarHBondContact N-OE1 3.02Å
450	R	96.7	Very high	95.3	Very high	125 Å²	125	47.2 Å²	47.2	47%	0.472	26%	0.258	S	S	.	.			trans	-73.1	139.1	169.9	-64.5	166.5	-178.8	-121.2	11.3	108.8	C427 L428 N429 D470	C427-R450 HydrophobicContact CB-CB 3.88Å; C427-R450 VanDerWaalsContact O-CD 3.23Å; C427-R450 WeakPolarHBondContact O-CD 3.35Å; C427-R450 WeakPolarHBondContact O-CG 2.97Å; C427-R450 PolarHBondContact O-NH1 3.42Å; L428-R450 WeakPolarHBondContact O-CA 3.49Å; N429-R450 HydrophobicContact CB-CG 4.04Å; R450-D470 WeakPolarHBondContact O-CA 3.36Å
451	R	97	Very high	95	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.242	C	C	.	.			trans	-145.1	117.9	-176.8	-51.5	-179.8	175.8	-100.3	-4.9	111.7	G421 L428 M447 V454 G467 S469 L475 T477 E479	G421-R451 PolarHBondContact N-O 2.83Å; L428-R451 PolarHBondContact O-N 3.3Å; M447-R451 HydrophobicContact CE-CB 4.13Å; M447-R451 HydrophobicContact CE-CG 4.21Å; M447-R451 HydrophobicContact SD-CG 4.33Å; R451-V454 HydrophobicContact CB-CB 3.8Å; R451-V454 HydrophobicContact CB-CG1 4.32Å; R451-V454 HydrophobicContact CB-CG2 4.14Å; R451-G467 PolarHBondContact NH1-O 2.74Å; R451-S469 CarbonylContact C-O 3.52Å; R451-S469 VanDerWaalsContact CA-O 3.28Å; R451-S469 WeakPolarHBondContact CA-O 3.14Å; R451-L475 HydrophobicContact CG-CD1 4Å; R451-T477 PolarHBondContact NH1-O 3.43Å; R451-T477 PolarHBondContact NH2-O 2.8Å; R451-T477 PolarHBondContact NH2-OG1 3.21Å; R451-E479 IonicContact CZ-OE1 2.7Å; R451-E479 VanDerWaalsContact CZ-OE1 3.26Å; R451-E479 IonicContact NE-OE1 3.48Å; R451-E479 PolarHBondContact NE-OE1 3.31Å; R451-E479 IonicContact NH2-OE1 3.44Å; R451-E479 PolarHBondContact NH2-OE1 2.94Å
452	L	92.7	Very high	94.8	Very high	19 Å²	19	39.6 Å²	39.6	10%	0.099	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-103.6	151.2	160.4	73.4	78.6	0	0	0	110.5	Q422 C427 V454 G468 S469	Q422-L452 HydrophobicContact CB-CB 4.45Å; Q422-L452 HydrophobicContact CB-CD2 4.39Å; C427-L452 WeakPolarHBondContact SG-CD2 3.37Å; L452-V454 PolarHBondContact O-N 2.78Å; L452-G468 CarbonylContact O-C 3.52Å; L452-G468 WeakPolarHBondContact O-CA 3.39Å; L452-S469 PolarHBondContact N-O 3.4Å; L452-S469 PolarHBondContact O-N 2.93Å
453	G	90.5	Very high	94.8	Very high	6 Å²	6	36.1 Å²	36.1	6%	0.062	22%	0.22	C	C	.	.	S	Bend	trans	61.2	27.7	-177.6	0	0	0	0	0	112.3	S406 G468 H500	S406-G453 PolarHBondContact O-N 2.83Å; G453-G468 WeakPolarHBondContact O-CA 3.45Å; G453-H500 PolarHBondContact O-N 3.4Å
454	V	94.1	Very high	94.9	Very high	9 Å²	9	30.4 Å²	30.4	6%	0.055	20%	0.195	C	C	.	.			trans	-72.9	140	176.4	60.6	0	0	0	0	109.5	V419 R451 L452 V456 A465	V419-V454 WeakPolarHBondContact O-CG1 3.31Å; R451-V454 HydrophobicContact CB-CB 3.8Å; R451-V454 HydrophobicContact CB-CG1 4.32Å; R451-V454 HydrophobicContact CB-CG2 4.14Å; L452-V454 PolarHBondContact O-N 2.78Å; V454-V456 HydrophobicContact CG1-CG2 4.32Å; V454-V456 HydrophobicContact CG2-CG2 4.17Å; V454-A465 HydrophobicContact CG2-CB 3.97Å
455	A	94.4	Very high	94.9	Very high	10 Å²	10	29.4 Å²	29.4	8%	0.083	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	141.5	169.6	0	0	0	0	0	109.8	V466 L501 C503	A455-V466 PolarHBondContact N-O 2.82Å; A455-V466 VanDerWaalsContact N-O 3.1Å; A455-V466 PolarHBondContact O-N 2.72Å; A455-L501 HydrophobicContact CB-CD1 4.35Å; A455-L501 HydrophobicContact CB-CD2 3.46Å; A455-L501 VanDerWaalsContact CB-CD2 3.46Å; A455-L501 HydrophobicContact CB-CG 3.61Å; A455-C503 HydrophobicContact CB-CB 3.34Å
456	V	95.6	Very high	94.9	Very high	15 Å²	15	28.5 Å²	28.5	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.9	-171.9	-179.5	0	0	0	0	109.9	A410 V419 V454 L463 Y464	A410-V456 HydrophobicContact CB-CG1 3.77Å; V419-V456 HydrophobicContact CB-CG2 3.86Å; V419-V456 HydrophobicContact CG1-CG2 3.99Å; V419-V456 HydrophobicContact CG2-CG1 4.1Å; V419-V456 HydrophobicContact CG2-CG2 4.09Å; V454-V456 HydrophobicContact CG1-CG2 4.32Å; V454-V456 HydrophobicContact CG2-CG2 4.17Å; V456-L463 HydrophobicContact CG1-CD1 3.33Å; V456-L463 HydrophobicContact CG1-CD2 4.36Å; V456-L463 HydrophobicContact CG1-CG 3.8Å; V456-Y464 VanDerWaalsContact CA-O 3.26Å; V456-Y464 WeakPolarHBondContact CA-O 3.42Å
457	A	95.7	Very high	94.8	Very high	10 Å²	10	25.1 Å²	25.1	8%	0.083	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	167	173.6	0	0	0	0	0	110.7	Y464 V505 L510	A457-Y464 PolarHBondContact N-O 3.3Å; A457-Y464 PolarHBondContact O-N 2.97Å; A457-V505 HydrophobicContact CB-CG2 4.37Å; A457-L510 HydrophobicContact CB-CD1 3.66Å
458	V	94.6	Very high	94.6	Very high	45 Å²	45	25 Å²	25	27%	0.273	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.4	-177.4	173.4	0	0	0	0	110.2	A410 V411 L412 C462 L463 V505	A410-V458 HydrophobicContact CB-CG2 4.09Å; V411-V458 WeakPolarHBondContact O-CG2 3.48Å; L412-V458 HydrophobicContact CB-CG1 4.48Å; L412-V458 HydrophobicContact CB-CG2 3.99Å; L412-V458 HydrophobicContact CD1-CG1 3.68Å; V458-C462 CarbonylContact C-O 3.6Å; V458-C462 VanDerWaalsContact CA-O 3.28Å; V458-C462 WeakPolarHBondContact CA-O 3.37Å; V458-L463 HydrophobicContact CG2-CD1 3.57Å; V458-V505 VanDerWaalsContact O-CG2 3.26Å; V458-V505 WeakPolarHBondContact O-CG2 3.35Å
459	L	92.3	Very high	94.5	Very high	17 Å²	17	20.4 Å²	20.4	9%	0.089	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.6	179.6	178.2	59.4	0	0	0	109.8	G461 C462 Y464 V505 G508 L510 P530	L459-G461 VanDerWaalsContact C-N 3.32Å; L459-G461 PolarHBondContact O-N 2.76Å; L459-C462 PolarHBondContact N-O 2.72Å; L459-C462 PolarHBondContact O-N 3.07Å; L459-C462 VanDerWaalsContact O-N 3.14Å; L459-Y464 HydrophobicContact CB-CD2 4.12Å; L459-Y464 HydrophobicContact CB-CE2 3.82Å; L459-Y464 WeakPolarHBondContact O-CE2 3.41Å; L459-V505 HydrophobicContact CB-CG2 3.82Å; L459-V505 HydrophobicContact CD1-CG1 3.74Å; L459-V505 HydrophobicContact CD1-CG2 4.21Å; L459-V505 HydrophobicContact CG-CG2 4.46Å; L459-G508 WeakPolarHBondContact CD1-O 3.49Å; L459-L510 HydrophobicContact CD2-CB 4Å; L459-P530 HydrophobicContact CD2-CB 4.27Å; L459-P530 HydrophobicContact CD2-CG 3.84Å; L459-P530 HydrophobicContact CG-CG 4.38Å
460	G	86.7	Confident	94.4	Very high	75 Å²	75	22.2 Å²	22.2	77%	0.773	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	38.4	176.9	0	0	0	0	0	113.9	C462	G460-C462 PolarHBondContact O-N 3.09Å
461	G	88.8	Confident	94.1	Very high	33 Å²	33	18.7 Å²	18.7	34%	0.34	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.3	-178.5	0	0	0	0	0	114.5	L412 L459	L412-G461 WeakPolarHBondContact CD1-O 3.38Å; L459-G461 VanDerWaalsContact C-N 3.32Å; L459-G461 PolarHBondContact O-N 2.76Å
462	C	93.3	Very high	93.6	Very high	15 Å²	15	22.2 Å²	22.2	10%	0.101	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	148.3	177.5	-65.9	0	0	0	0	110.7	V458 L459 G460 Y464 R480 Y481	V458-C462 CarbonylContact C-O 3.6Å; V458-C462 VanDerWaalsContact CA-O 3.28Å; V458-C462 WeakPolarHBondContact CA-O 3.37Å; L459-C462 PolarHBondContact N-O 2.72Å; L459-C462 PolarHBondContact O-N 3.07Å; L459-C462 VanDerWaalsContact O-N 3.14Å; G460-C462 PolarHBondContact O-N 3.09Å; C462-Y464 HydrophobicContact CB-CE2 3.91Å; C462-R480 HydrophobicContact CB-CG 3.59Å; C462-Y481 WeakPolarHBondContact CA-O 3.39Å; C462-Y481 WeakPolarHBondContact CB-O 3.47Å
463	L	97.4	Very high	93.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.1	175.9	-175.5	78.2	0	0	0	109.5	A410 L412 Y417 V419 V456 V458 R480 Y481 W488	A410-L463 HydrophobicContact CB-CD1 3.75Å; L412-L463 HydrophobicContact CD2-CB 4.24Å; Y417-L463 HydrophobicContact CD1-CD2 4.09Å; Y417-L463 HydrophobicContact CG-CD2 4.07Å; V419-L463 HydrophobicContact CG2-CD2 3.83Å; V456-L463 HydrophobicContact CG1-CD1 3.33Å; V456-L463 HydrophobicContact CG1-CD2 4.36Å; V456-L463 HydrophobicContact CG1-CG 3.8Å; V458-L463 HydrophobicContact CG2-CD1 3.57Å; L463-R480 CarbonylContact O-C 3.56Å; L463-R480 WeakPolarHBondContact O-CA 3.45Å; L463-Y481 HydrophobicContact CB-CD1 4.27Å; L463-Y481 PolarHBondContact N-O 2.9Å; L463-Y481 VanDerWaalsContact N-O 3.09Å; L463-Y481 PolarHBondContact O-N 2.84Å; L463-W488 HydrophobicContact CD2-CH2 3.94Å; L463-W488 HydrophobicContact CD2-CZ2 4.23Å; L463-W488 HydrophobicContact CG-CH2 4.37Å
464	Y	98.2	Very high	93.9	Very high	8 Å²	8	22.6 Å²	22.6	3%	0.031	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.6	179.4	-72.9	-103.3	0	0	0	110.5	V456 A457 L459 C462 V478 E479 R480 V491 L510 Y528	V456-Y464 VanDerWaalsContact CA-O 3.26Å; V456-Y464 WeakPolarHBondContact CA-O 3.42Å; A457-Y464 PolarHBondContact N-O 3.3Å; A457-Y464 PolarHBondContact O-N 2.97Å; L459-Y464 HydrophobicContact CB-CD2 4.12Å; L459-Y464 HydrophobicContact CB-CE2 3.82Å; L459-Y464 WeakPolarHBondContact O-CE2 3.41Å; C462-Y464 HydrophobicContact CB-CE2 3.91Å; Y464-V478 HydrophobicContact CD1-CG1 4.2Å; Y464-E479 CarbonylContact C-O 3.58Å; Y464-E479 VanDerWaalsContact CA-O 3.3Å; Y464-E479 WeakPolarHBondContact CA-O 3.41Å; Y464-R480 HydrophobicContact CD1-CB 4.04Å; Y464-R480 HydrophobicContact CD1-CG 4.27Å; Y464-R480 HydrophobicContact CD2-CG 4.34Å; Y464-R480 HydrophobicContact CE1-CB 3.77Å; Y464-R480 HydrophobicContact CE1-CG 3.79Å; Y464-R480 HydrophobicContact CE2-CG 3.85Å; Y464-R480 VanDerWaalsContact OH-CD 3.3Å; Y464-R480 WeakPolarHBondContact OH-CD 3.46Å; Y464-V491 HydrophobicContact CD1-CG2 4.45Å; Y464-V491 HydrophobicContact CE1-CG1 4.4Å; Y464-V491 HydrophobicContact CE1-CG2 4.32Å; Y464-L510 HydrophobicContact CD1-CD2 3.92Å; Y464-L510 HydrophobicContact CG-CD2 3.9Å; Y464-Y528 HydrophobicContact CE1-CD1 4.39Å; Y464-Y528 AromaticContact CE1-CE1 3.77Å; Y464-Y528 HydrophobicContact CE1-CE1 3.77Å
465	A	98	Very high	94.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	110.8	170.5	0	0	0	0	0	109	V419 M447 V454 V478 E479 W488	V419-A465 HydrophobicContact CG1-CB 4.4Å; M447-A465 HydrophobicContact SD-CB 3.64Å; V454-A465 HydrophobicContact CG2-CB 3.97Å; A465-V478 WeakPolarHBondContact O-CA 3.29Å; A465-E479 PolarHBondContact N-O 2.82Å; A465-E479 PolarHBondContact O-N 2.94Å; A465-W488 HydrophobicContact CB-CH2 3.97Å; A465-W488 HydrophobicContact CB-CZ3 3.67Å
466	V	97.9	Very high	94.3	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.7	-169.4	-169.5	0	0	0	0	109.7	A455 V478 M494 L501 L510 A512 W535	A455-V466 PolarHBondContact N-O 2.82Å; A455-V466 VanDerWaalsContact N-O 3.1Å; A455-V466 PolarHBondContact O-N 2.72Å; V466-V478 HydrophobicContact CG1-CG2 3.99Å; V466-V478 HydrophobicContact CG2-CG1 4.03Å; V466-M494 HydrophobicContact CG1-CE 3.88Å; V466-M494 HydrophobicContact CG1-SD 3.53Å; V466-M494 VanDerWaalsContact CG1-SD 3.53Å; V466-L501 HydrophobicContact CG1-CD1 3.92Å; V466-L510 HydrophobicContact CG2-CD2 3.66Å; V466-L510 HydrophobicContact CG2-CG 4.4Å; V466-A512 HydrophobicContact CG1-CB 4.23Å; V466-W535 HydrophobicContact CG1-CH2 4.11Å; V466-W535 HydrophobicContact CG1-CZ2 4.37Å
467	G	96.8	Very high	94.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	21%	0.208	C	C	.	.			trans	58.3	-138	176	0	0	0	0	0	113.3	R451 L475 T477 R498	R451-G467 PolarHBondContact NH1-O 2.74Å; G467-L475 WeakPolarHBondContact CA-O 3.5Å; G467-T477 PolarHBondContact N-O 2.89Å; G467-R498 CarbonylContact C-O 3.56Å; G467-R498 WeakPolarHBondContact CA-O 3.19Å
468	G	94.5	Very high	94.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	20%	0.204	C	C	.	.			trans	90.1	-164.5	-169.2	0	0	0	0	0	111.9	L452 G453 P474 L475 R498	L452-G468 CarbonylContact O-C 3.52Å; L452-G468 WeakPolarHBondContact O-CA 3.39Å; G453-G468 WeakPolarHBondContact O-CA 3.45Å; G468-P474 CarbonylContact O-C 3.58Å; G468-P474 WeakPolarHBondContact O-CA 3.26Å; G468-L475 PolarHBondContact O-N 2.82Å; G468-R498 PolarHBondContact N-O 3.48Å
469	S	94.2	Very high	94.7	Very high	6 Å²	6	25 Å²	25	4%	0.042	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-133.6	140.8	178	175.8	0	0	0	0	109.7	R451 L452 G471 A473	R451-S469 CarbonylContact C-O 3.52Å; R451-S469 VanDerWaalsContact CA-O 3.28Å; R451-S469 WeakPolarHBondContact CA-O 3.14Å; L452-S469 PolarHBondContact N-O 3.4Å; L452-S469 PolarHBondContact O-N 2.93Å; S469-G471 PolarHBondContact O-N 3.28Å; S469-G471 PolarHBondContact OG-N 2.87Å; S469-A473 WeakPolarHBondContact CA-O 3.47Å; S469-A473 PolarHBondContact OG-O 2.97Å
470	D	94.1	Very high	95	Very high	73 Å²	73	27.8 Å²	27.8	39%	0.39	20%	0.201	S	C	.	.			trans	-81.5	0.6	174.1	59.9	8.7	0	0	0	113.5	R450 G472 A473 L475	R450-D470 WeakPolarHBondContact O-CA 3.36Å; D470-G472 WeakPolarHBondContact OD1-CA 3.28Å; D470-G472 PolarHBondContact OD1-N 2.84Å; D470-A473 PolarHBondContact N-O 3.21Å; D470-A473 PolarHBondContact OD1-N 3.18Å; D470-L475 HydrophobicContact CB-CD1 4.37Å; D470-L475 HydrophobicContact CB-CD2 4.3Å
471	G	88.8	Confident	95.5	Very high	51 Å²	51	24.4 Å²	24.4	53%	0.526	17%	0.165	S	C	.	.	S	Bend	trans	102.9	-22.2	-175.1	0	0	0	0	0	112.9	C427 S469	C427-G471 WeakPolarHBondContact SG-CA 3.27Å; C427-G471 PolarHBondContact SG-N 2.96Å; C427-G471 VanDerWaalsContact SG-N 3.44Å; S469-G471 PolarHBondContact O-N 3.28Å; S469-G471 PolarHBondContact OG-N 2.87Å
472	G	88.4	Confident	95.7	Very high	74 Å²	74	24.2 Å²	24.2	76%	0.763	16%	0.156	S	C	*	.	S	Bend	trans	-95.7	-52.1	172.4	0	0	0	0	0	112.1	D470	D470-G472 WeakPolarHBondContact OD1-CA 3.28Å; D470-G472 PolarHBondContact OD1-N 2.84Å
473	A	93.2	Very high	95.7	Very high	30 Å²	30	24.9 Å²	24.9	25%	0.248	16%	0.162	C	C	.	.	S	Bend	trans	-145.6	155.2	-175.1	0	0	0	0	0	113.4	S469 D470	S469-A473 WeakPolarHBondContact CA-O 3.47Å; S469-A473 PolarHBondContact OG-O 2.97Å; D470-A473 PolarHBondContact N-O 3.21Å; D470-A473 PolarHBondContact OD1-N 3.18Å
474	P	96.1	Very high	95.3	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.026	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-59.6	141.8	168.5	-21	35.7	0	0	0	112.4	G468 R497 K499 D518	G468-P474 CarbonylContact O-C 3.58Å; G468-P474 WeakPolarHBondContact O-CA 3.26Å; P474-R497 HydrophobicContact CB-CB 4.12Å; P474-R497 WeakPolarHBondContact O-CD 3.42Å; P474-R497 PolarHBondContact O-NH1 3.05Å; P474-K499 HydrophobicContact CB-CB 4.33Å; P474-K499 HydrophobicContact CB-CG 4.22Å; P474-K499 HydrophobicContact CG-CD 4.04Å; P474-K499 HydrophobicContact CG-CG 4.05Å; P474-D518 WeakPolarHBondContact CD-OD1 3.38Å
475	L	97.5	Very high	95.1	Very high	15 Å²	15	39.8 Å²	39.8	8%	0.079	23%	0.226	C	C	.	.			trans	-100.5	144.3	-175.8	-60	175.2	0	0	0	110.4	R451 G467 G468 D470 R498	R451-L475 HydrophobicContact CG-CD1 4Å; G467-L475 WeakPolarHBondContact CA-O 3.5Å; G468-L475 PolarHBondContact O-N 2.82Å; D470-L475 HydrophobicContact CB-CD1 4.37Å; D470-L475 HydrophobicContact CB-CD2 4.3Å; L475-R498 PolarHBondContact O-N 3.3Å
476	K	97.5	Very high	95.1	Very high	84 Å²	84	43.3 Å²	43.3	37%	0.365	25%	0.245	S	C	.	.			trans	-101.3	-9.5	164.7	65.1	176.8	-176.2	174.9	0	112.9	P493 M494 R497	K476-P493 HydrophobicContact CD-CB 4.48Å; K476-P493 HydrophobicContact CG-CB 4.18Å; K476-P493 CarbonylContact O-C 3.39Å; K476-P493 WeakPolarHBondContact O-CA 3.06Å; K476-P493 WeakPolarHBondContact O-CB 3.44Å; K476-M494 HydrophobicContact CB-CB 4.46Å; K476-M494 PolarHBondContact O-N 3.37Å; K476-R497 HydrophobicContact CB-CG 3.94Å; K476-R497 HydrophobicContact CG-CG 4.32Å
477	T	98.2	Very high	95.1	Very high	39 Å²	39	49.5 Å²	49.5	24%	0.239	27%	0.272	C	S	.	.			trans	-73.8	151.2	-175.8	57.4	0	0	0	0	110.9	R451 G467	R451-T477 PolarHBondContact NH1-O 3.43Å; R451-T477 PolarHBondContact NH2-O 2.8Å; R451-T477 PolarHBondContact NH2-OG1 3.21Å; G467-T477 PolarHBondContact N-O 2.89Å
478	V	98.5	Very high	95.2	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.7	-179.4	-176.1	0	0	0	0	108.3	Y464 A465 V466 V491 M494 W535	Y464-V478 HydrophobicContact CD1-CG1 4.2Å; A465-V478 WeakPolarHBondContact O-CA 3.29Å; V466-V478 HydrophobicContact CG1-CG2 3.99Å; V466-V478 HydrophobicContact CG2-CG1 4.03Å; V478-V491 HydrophobicContact CB-CG2 3.72Å; V478-V491 HydrophobicContact CG1-CG2 3.62Å; V478-V491 PolarHBondContact O-N 3.41Å; V478-M494 HydrophobicContact CG2-CE 4.32Å; V478-M494 HydrophobicContact CG2-CG 4.06Å; V478-W535 HydrophobicContact CG1-CZ2 4.47Å; V478-W535 HydrophobicContact CG2-CZ2 3.8Å
479	E	98.3	Very high	95.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.6	179.9	-61.4	172.4	-123.9	0	0	110.2	L448 S449 R451 Y464 A465 W488 H489 Q490	L448-E479 WeakPolarHBondContact CA-OE2 3.38Å; L448-E479 VanDerWaalsContact CB-OE2 3.23Å; L448-E479 WeakPolarHBondContact CB-OE2 3.33Å; L448-E479 WeakPolarHBondContact CG-OE2 3.4Å; L448-E479 PolarHBondContact N-OE2 2.91Å; S449-E479 PolarHBondContact N-OE1 3.02Å; R451-E479 IonicContact CZ-OE1 2.7Å; R451-E479 VanDerWaalsContact CZ-OE1 3.26Å; R451-E479 IonicContact NE-OE1 3.48Å; R451-E479 PolarHBondContact NE-OE1 3.31Å; R451-E479 IonicContact NH2-OE1 3.44Å; R451-E479 PolarHBondContact NH2-OE1 2.94Å; Y464-E479 CarbonylContact C-O 3.58Å; Y464-E479 VanDerWaalsContact CA-O 3.3Å; Y464-E479 WeakPolarHBondContact CA-O 3.41Å; A465-E479 PolarHBondContact N-O 2.82Å; A465-E479 PolarHBondContact O-N 2.94Å; E479-W488 HydrophobicContact CB-CE3 3.61Å; E479-W488 HydrophobicContact CB-CZ3 4.12Å; E479-H489 CarbonylContact C-O 3.32Å; E479-H489 VanDerWaalsContact CA-O 3.31Å; E479-H489 WeakPolarHBondContact CA-O 3.48Å; E479-Q490 HydrophobicContact CG-CG 4.31Å
480	R	97.9	Very high	95.5	Very high	76 Å²	76	59.2 Å²	59.2	29%	0.287	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.9	177.6	-176.2	-165.6	75.3	-167	1.7	110	C462 L463 Y464 W488 H489 V491	C462-R480 HydrophobicContact CB-CG 3.59Å; L463-R480 CarbonylContact O-C 3.56Å; L463-R480 WeakPolarHBondContact O-CA 3.45Å; Y464-R480 HydrophobicContact CD1-CB 4.04Å; Y464-R480 HydrophobicContact CD1-CG 4.27Å; Y464-R480 HydrophobicContact CD2-CG 4.34Å; Y464-R480 HydrophobicContact CE1-CB 3.77Å; Y464-R480 HydrophobicContact CE1-CG 3.79Å; Y464-R480 HydrophobicContact CE2-CG 3.85Å; Y464-R480 VanDerWaalsContact OH-CD 3.3Å; Y464-R480 WeakPolarHBondContact OH-CD 3.46Å; R480-W488 CarbonylContact O-C 3.53Å; R480-W488 WeakPolarHBondContact O-CA 3.42Å; R480-H489 PolarHBondContact N-O 3.35Å; R480-H489 PolarHBondContact O-N 3.01Å; R480-V491 HydrophobicContact CB-CG1 3.85Å
481	Y	98.4	Very high	95.7	Very high	4 Å²	4	56.6 Å²	56.6	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.5	172.3	177.2	-105.6	0	0	0	111.3	Y417 A445 C462 L463 A483 N486 K487 W488	Y417-Y481 AromaticContact CE1-CE1 3.86Å; Y417-Y481 HydrophobicContact CE1-CE1 3.86Å; A445-Y481 HydrophobicContact CB-CE2 4.28Å; C462-Y481 WeakPolarHBondContact CA-O 3.39Å; C462-Y481 WeakPolarHBondContact CB-O 3.47Å; L463-Y481 HydrophobicContact CB-CD1 4.27Å; L463-Y481 PolarHBondContact N-O 2.9Å; L463-Y481 VanDerWaalsContact N-O 3.09Å; L463-Y481 PolarHBondContact O-N 2.84Å; Y481-A483 HydrophobicContact CD1-CB 4.47Å; Y481-A483 VanDerWaalsContact CE1-CA 3.48Å; Y481-A483 HydrophobicContact CE1-CB 3.78Å; Y481-N486 PolarHBondContact OH-OD1 2.84Å; Y481-K487 WeakPolarHBondContact CA-O 3.32Å; Y481-W488 AromaticContact CD2-CD1 3.7Å; Y481-W488 HydrophobicContact CD2-CD2 4.1Å; Y481-W488 AromaticContact CD2-CE2 3.7Å; Y481-W488 HydrophobicContact CD2-CG 4.09Å; Y481-W488 HydrophobicContact CD2-CZ2 4.23Å; Y481-W488 AromaticContact CD2-NE1 3.44Å; Y481-W488 HydrophobicContact CG-CD2 4.27Å; Y481-W488 AromaticContact CG-CE2 3.88Å; Y481-W488 AromaticContact CG-CZ2 3.99Å; Y481-W488 HydrophobicContact CG-CZ2 3.99Å
482	D	92.5	Very high	96.1	Very high	28 Å²	28	55 Å²	55	15%	0.15	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.4	169.1	-174.5	-31.3	0	0	0	108.7	R484 L485 N486 K487	D482-R484 VanDerWaalsContact C-N 3.27Å; D482-R484 PolarHBondContact O-N 3.17Å; D482-R484 VanDerWaalsContact OD1-CB 3.28Å; D482-R484 WeakPolarHBondContact OD1-CB 3.46Å; D482-R484 PolarHBondContact OD1-N 2.75Å; D482-L485 HydrophobicContact CB-CB 4.31Å; D482-L485 HydrophobicContact CB-CD1 4.38Å; D482-L485 HydrophobicContact CB-CG 4.42Å; D482-L485 PolarHBondContact O-N 3.35Å; D482-L485 PolarHBondContact OD1-N 2.82Å; D482-N486 WeakPolarHBondContact O-CA 3.47Å; D482-N486 PolarHBondContact O-N 3.32Å; D482-K487 PolarHBondContact N-O 3.44Å; D482-K487 PolarHBondContact O-N 3.04Å
483	A	92.8	Very high	96.6	Very high	29 Å²	29	54.7 Å²	54.7	24%	0.24	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-26.1	-177.5	0	0	0	0	0	113.4	L412 Y481	L412-A483 HydrophobicContact CD2-CB 3.95Å; Y481-A483 HydrophobicContact CD1-CB 4.47Å; Y481-A483 VanDerWaalsContact CE1-CA 3.48Å; Y481-A483 HydrophobicContact CE1-CB 3.78Å
484	R	89.8	Confident	96.8	Very high	218 Å²	218	53.4 Å²	53.4	82%	0.823	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-37.6	-179.9	-54.6	170	-175	170.8	1.3	110.9	D482	D482-R484 VanDerWaalsContact C-N 3.27Å; D482-R484 PolarHBondContact O-N 3.17Å; D482-R484 VanDerWaalsContact OD1-CB 3.28Å; D482-R484 WeakPolarHBondContact OD1-CB 3.46Å; D482-R484 PolarHBondContact OD1-N 2.75Å
485	L	94.6	Very high	96.8	Very high	103 Å²	103	56.1 Å²	56.1	54%	0.539	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-14.8	177.9	-58.4	179.5	0	0	0	112.6	D482 K487	D482-L485 HydrophobicContact CB-CB 4.31Å; D482-L485 HydrophobicContact CB-CD1 4.38Å; D482-L485 HydrophobicContact CB-CG 4.42Å; D482-L485 PolarHBondContact O-N 3.35Å; D482-L485 PolarHBondContact OD1-N 2.82Å; L485-K487 VanDerWaalsContact C-N 3.29Å; L485-K487 HydrophobicContact CB-CB 4.32Å; L485-K487 WeakPolarHBondContact O-CG 3.5Å; L485-K487 PolarHBondContact O-N 3.04Å
486	N	97.1	Very high	96.8	Very high	75 Å²	75	57.3 Å²	57.3	40%	0.401	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	50.9	-169.9	-173.6	26.1	0	0	0	111.2	A445 Y481 D482	A445-N486 WeakPolarHBondContact CB-O 3.47Å; A445-N486 WeakPolarHBondContact CB-OD1 3.49Å; A445-N486 PolarHBondContact N-OD1 2.81Å; Y481-N486 PolarHBondContact OH-OD1 2.84Å; D482-N486 WeakPolarHBondContact O-CA 3.47Å; D482-N486 PolarHBondContact O-N 3.32Å
487	K	97.9	Very high	96.8	Very high	130 Å²	130	58.2 Å²	58.2	57%	0.565	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.1	142.3	-175.8	-76	-178.1	-175.3	-177.7	0	112.6	Y481 D482 L485	Y481-K487 WeakPolarHBondContact CA-O 3.32Å; D482-K487 PolarHBondContact N-O 3.44Å; D482-K487 PolarHBondContact O-N 3.04Å; L485-K487 VanDerWaalsContact C-N 3.29Å; L485-K487 HydrophobicContact CB-CB 4.32Å; L485-K487 WeakPolarHBondContact O-CG 3.5Å; L485-K487 PolarHBondContact O-N 3.04Å
488	W	98.5	Very high	96.7	Very high	15 Å²	15	56.3 Å²	56.3	6%	0.057	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	142.8	171.1	-69	88	0	0	0	111.2	V419 V431 A445 P446 M447 L448 L463 A465 E479 R480 Y481	V419-W488 HydrophobicContact CG1-CH2 4.36Å; V431-W488 HydrophobicContact CG1-CZ2 4.41Å; V431-W488 HydrophobicContact CG2-CZ2 3.82Å; A445-W488 PolarHBondContact O-NE1 3.09Å; P446-W488 VanDerWaalsContact C-CD1 3.5Å; M447-W488 HydrophobicContact CG-CD2 3.97Å; M447-W488 HydrophobicContact CG-CE3 4.25Å; M447-W488 HydrophobicContact CG-CH2 4.02Å; M447-W488 HydrophobicContact CG-CZ2 3.74Å; M447-W488 HydrophobicContact CG-CZ3 4.26Å; M447-W488 HydrophobicContact SD-CH2 4.43Å; L448-W488 HydrophobicContact CG-CB 4.14Å; L463-W488 HydrophobicContact CD2-CH2 3.94Å; L463-W488 HydrophobicContact CD2-CZ2 4.23Å; L463-W488 HydrophobicContact CG-CH2 4.37Å; A465-W488 HydrophobicContact CB-CH2 3.97Å; A465-W488 HydrophobicContact CB-CZ3 3.67Å; E479-W488 HydrophobicContact CB-CE3 3.61Å; E479-W488 HydrophobicContact CB-CZ3 4.12Å; R480-W488 CarbonylContact O-C 3.53Å; R480-W488 WeakPolarHBondContact O-CA 3.42Å; Y481-W488 AromaticContact CD2-CD1 3.7Å; Y481-W488 HydrophobicContact CD2-CD2 4.1Å; Y481-W488 AromaticContact CD2-CE2 3.7Å; Y481-W488 HydrophobicContact CD2-CG 4.09Å; Y481-W488 HydrophobicContact CD2-CZ2 4.23Å; Y481-W488 AromaticContact CD2-NE1 3.44Å; Y481-W488 HydrophobicContact CG-CD2 4.27Å; Y481-W488 AromaticContact CG-CE2 3.88Å; Y481-W488 AromaticContact CG-CZ2 3.99Å; Y481-W488 HydrophobicContact CG-CZ2 3.99Å
489	H	97.6	Very high	96.5	Very high	69 Å²	69	58.6 Å²	58.6	32%	0.319	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139	176.1	-57.9	81.1	0	0	0	109	E479 R480	E479-H489 CarbonylContact C-O 3.32Å; E479-H489 VanDerWaalsContact CA-O 3.31Å; E479-H489 WeakPolarHBondContact CA-O 3.48Å; R480-H489 PolarHBondContact N-O 3.35Å; R480-H489 PolarHBondContact O-N 3.01Å
490	Q	97.6	Very high	96.1	Very high	125 Å²	125	61.5 Å²	61.5	58%	0.584	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	138.3	168.7	-72.4	-169.9	-7.5	0	0	110.2	L448 E479	L448-Q490 HydrophobicContact CD1-CG 3.81Å; E479-Q490 HydrophobicContact CG-CG 4.31Å
491	V	98	Very high	95.9	Very high	19 Å²	19	58.4 Å²	58.4	12%	0.115	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	179.3	169.8	-60	0	0	0	0	109.3	Y464 V478 R480 Y528	Y464-V491 HydrophobicContact CD1-CG2 4.45Å; Y464-V491 HydrophobicContact CE1-CG1 4.4Å; Y464-V491 HydrophobicContact CE1-CG2 4.32Å; V478-V491 HydrophobicContact CB-CG2 3.72Å; V478-V491 HydrophobicContact CG1-CG2 3.62Å; V478-V491 PolarHBondContact O-N 3.41Å; R480-V491 HydrophobicContact CB-CG1 3.85Å; V491-Y528 HydrophobicContact CB-CE2 4.44Å; V491-Y528 HydrophobicContact CG2-CE2 4.43Å
492	A	98.1	Very high	95.6	Very high	18 Å²	18	58.3 Å²	58.3	15%	0.149	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-53.3	134.1	179.6	0	0	0	0	0	111.5	Y528 N533 W535	A492-Y528 HydrophobicContact CB-CE2 4.34Å; A492-N533 WeakPolarHBondContact CB-O 3.4Å; A492-N533 WeakPolarHBondContact CB-OD1 3.44Å; A492-N533 PolarHBondContact N-OD1 3.44Å; A492-W535 PolarHBondContact O-NE1 2.85Å
493	P	98.3	Very high	95.7	Very high	67 Å²	67	57.8 Å²	57.8	44%	0.435	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-73.7	154.8	177.6	31.8	-35.1	0	0	0	110.7	K476 W535	K476-P493 HydrophobicContact CD-CB 4.48Å; K476-P493 HydrophobicContact CG-CB 4.18Å; K476-P493 CarbonylContact O-C 3.39Å; K476-P493 WeakPolarHBondContact O-CA 3.06Å; K476-P493 WeakPolarHBondContact O-CB 3.44Å; P493-W535 VanDerWaalsContact C-CD1 3.46Å
494	M	98.1	Very high	95.7	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.01	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-62.3	158.5	167.5	-64.2	175.7	-67.6	0	0	110.6	V466 K476 V478 T496 R498 L501 A512 W535	V466-M494 HydrophobicContact CG1-CE 3.88Å; V466-M494 HydrophobicContact CG1-SD 3.53Å; V466-M494 VanDerWaalsContact CG1-SD 3.53Å; K476-M494 HydrophobicContact CB-CB 4.46Å; K476-M494 PolarHBondContact O-N 3.37Å; V478-M494 HydrophobicContact CG2-CE 4.32Å; V478-M494 HydrophobicContact CG2-CG 4.06Å; M494-T496 WeakPolarHBondContact CB-O 3.21Å; M494-R498 HydrophobicContact CE-CB 4.33Å; M494-L501 HydrophobicContact SD-CD1 4.26Å; M494-A512 HydrophobicContact SD-CB 3.7Å; M494-W535 HydrophobicContact CB-CD2 4.46Å; M494-W535 HydrophobicContact CG-CD2 3.79Å; M494-W535 HydrophobicContact CG-CE3 4.02Å; M494-W535 HydrophobicContact CG-CG 4.5Å; M494-W535 HydrophobicContact CG-CH2 3.9Å; M494-W535 HydrophobicContact CG-CZ2 3.67Å; M494-W535 HydrophobicContact CG-CZ3 4.07Å; M494-W535 HydrophobicContact SD-CH2 4.26Å; M494-W535 HydrophobicContact SD-CZ2 4.46Å
495	G	96.6	Very high	95.9	Very high	61 Å²	61	48.8 Å²	48.8	63%	0.629	26%	0.262	S	S	*	.	S	Bend	trans	-67.6	-39.3	170.1	0	0	0	0	0	111.6	E526	G495-E526 WeakPolarHBondContact CA-OE2 3.35Å; G495-E526 PolarHBondContact N-OE2 3.48Å
496	T	95.7	Very high	95.8	Very high	41 Å²	41	44.9 Å²	44.9	25%	0.252	24%	0.24	S	C	.	.	S	Bend	trans	-105.1	143.1	-177.1	-39.7	0	0	0	0	111.9	M494 L522 E526	M494-T496 WeakPolarHBondContact CB-O 3.21Å; T496-L522 HydrophobicContact CG2-CD1 3.84Å; T496-L522 HydrophobicContact CG2-CD2 4.41Å; T496-E526 WeakPolarHBondContact CB-OE1 3.46Å; T496-E526 PolarHBondContact N-OE1 3.29Å; T496-E526 PolarHBondContact OG1-OE1 3.29Å
497	R	97.5	Very high	95.3	Very high	102 Å²	102	45.7 Å²	45.7	39%	0.385	25%	0.245	S	C	.	.			trans	-75.2	134.9	168.8	-66.1	173.5	179.3	-86.4	2.1	109.6	P474 K476 D517	P474-R497 HydrophobicContact CB-CB 4.12Å; P474-R497 WeakPolarHBondContact O-CD 3.42Å; P474-R497 PolarHBondContact O-NH1 3.05Å; K476-R497 HydrophobicContact CB-CG 3.94Å; K476-R497 HydrophobicContact CG-CG 4.32Å; R497-D517 WeakPolarHBondContact O-CB 3.48Å
498	R	96.8	Very high	94.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.239	C	C	.	.			trans	-145.1	126.2	-174.8	-57.8	177.9	-175.9	-90.8	-1.2	111	G467 G468 L475 M494 L501 G514 L522 S524 E526	G467-R498 CarbonylContact C-O 3.56Å; G467-R498 WeakPolarHBondContact CA-O 3.19Å; G468-R498 PolarHBondContact N-O 3.48Å; L475-R498 PolarHBondContact O-N 3.3Å; M494-R498 HydrophobicContact CE-CB 4.33Å; R498-L501 HydrophobicContact CB-CB 4.09Å; R498-L501 HydrophobicContact CB-CD1 3.97Å; R498-L501 HydrophobicContact CB-CD2 4.42Å; R498-L501 HydrophobicContact CB-CG 4.39Å; R498-G514 WeakPolarHBondContact CD-O 3.45Å; R498-G514 PolarHBondContact NH1-O 2.85Å; R498-L522 HydrophobicContact CG-CD1 3.85Å; R498-S524 PolarHBondContact NH1-O 3.4Å; R498-S524 PolarHBondContact NH1-OG 3.31Å; R498-S524 PolarHBondContact NH2-O 3.23Å; R498-S524 PolarHBondContact NH2-OG 2.8Å; R498-E526 IonicContact CZ-OE1 3.35Å; R498-E526 IonicContact NE-OE1 2.76Å; R498-E526 PolarHBondContact NE-OE1 3.33Å; R498-E526 IonicContact NH2-OE1 3.3Å; R498-E526 PolarHBondContact NH2-OE1 3.43Å
499	K	93.8	Very high	94.7	Very high	48 Å²	48	44.2 Å²	44.2	21%	0.209	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-116.1	155.4	159.7	64.3	173.5	177.6	-175.1	0	110.5	P474 L501 G515 R516	P474-K499 HydrophobicContact CB-CB 4.33Å; P474-K499 HydrophobicContact CB-CG 4.22Å; P474-K499 HydrophobicContact CG-CD 4.04Å; P474-K499 HydrophobicContact CG-CG 4.05Å; K499-L501 PolarHBondContact O-N 3.05Å; K499-G515 CarbonylContact O-C 3.45Å; K499-G515 VanDerWaalsContact O-CA 3.27Å; K499-G515 WeakPolarHBondContact O-CA 3.37Å; K499-R516 HydrophobicContact CG-CB 4.25Å; K499-R516 WeakPolarHBondContact CG-O 3.41Å; K499-R516 PolarHBondContact N-O 3.32Å; K499-R516 PolarHBondContact O-N 2.98Å
500	H	91.5	Very high	94.6	Very high	62 Å²	62	40.9 Å²	40.9	29%	0.287	23%	0.234	S	C	.	.	S	Bend	trans	53.6	34.9	-177.4	-53.4	-70.9	0	0	0	113.1	G453 G547	G453-H500 PolarHBondContact O-N 3.4Å; H500-G547 WeakPolarHBondContact O-CA 3.41Å; H500-G547 PolarHBondContact O-N 3.24Å
501	L	93.5	Very high	94.6	Very high	11 Å²	11	35 Å²	35	6%	0.058	21%	0.207	C	C	.	.			trans	-79.3	162.3	174.6	73	168.8	0	0	0	111.8	A455 V466 M494 R498 K499 A512	A455-L501 HydrophobicContact CB-CD1 4.35Å; A455-L501 HydrophobicContact CB-CD2 3.46Å; A455-L501 VanDerWaalsContact CB-CD2 3.46Å; A455-L501 HydrophobicContact CB-CG 3.61Å; V466-L501 HydrophobicContact CG1-CD1 3.92Å; M494-L501 HydrophobicContact SD-CD1 4.26Å; R498-L501 HydrophobicContact CB-CB 4.09Å; R498-L501 HydrophobicContact CB-CD1 3.97Å; R498-L501 HydrophobicContact CB-CD2 4.42Å; R498-L501 HydrophobicContact CB-CG 4.39Å; K499-L501 PolarHBondContact O-N 3.05Å; L501-A512 HydrophobicContact CD1-CB 3.81Å
502	G	92.2	Very high	94.5	Very high	2 Å²	2	34.1 Å²	34.1	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	142.5	163.3	0	0	0	0	0	111.2	V513	G502-V513 PolarHBondContact N-O 2.98Å; G502-V513 PolarHBondContact O-N 2.94Å
503	C	93.2	Very high	94.4	Very high	16 Å²	16	33.3 Å²	33.3	11%	0.108	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	132.9	173.8	-170	0	0	0	0	111.7	A455 L510 C511	A455-C503 HydrophobicContact CB-CB 3.34Å; C503-L510 WeakPolarHBondContact SG-CD1 3.03Å; C503-C511 VanDerWaalsContact CA-O 3.26Å; C503-C511 WeakPolarHBondContact CA-O 3.4Å
504	A	93.8	Very high	94.3	Very high	10 Å²	10	30.1 Å²	30.1	8%	0.083	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	158.3	178.7	0	0	0	0	0	109.9	C511 L550 V552 L557	A504-C511 PolarHBondContact N-O 2.77Å; A504-C511 PolarHBondContact O-N 2.8Å; A504-L550 HydrophobicContact CB-CD2 3.94Å; A504-L550 HydrophobicContact CB-CG 4.09Å; A504-V552 HydrophobicContact CB-CG2 4.27Å; A504-L557 HydrophobicContact CB-CD1 3.93Å
505	V	92.9	Very high	94	Very high	48 Å²	48	30 Å²	30	29%	0.291	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.3	172.3	173	0	0	0	0	109.7	A457 V458 L459 Y509 L510 V552	A457-V505 HydrophobicContact CB-CG2 4.37Å; V458-V505 VanDerWaalsContact O-CG2 3.26Å; V458-V505 WeakPolarHBondContact O-CG2 3.35Å; L459-V505 HydrophobicContact CB-CG2 3.82Å; L459-V505 HydrophobicContact CD1-CG1 3.74Å; L459-V505 HydrophobicContact CD1-CG2 4.21Å; L459-V505 HydrophobicContact CG-CG2 4.46Å; V505-Y509 CarbonylContact C-O 3.6Å; V505-Y509 VanDerWaalsContact CA-O 3.28Å; V505-Y509 WeakPolarHBondContact CA-O 3.49Å; V505-L510 HydrophobicContact CG2-CD1 4.1Å; V505-V552 WeakPolarHBondContact O-CG2 3.35Å
506	Y	92.5	Very high	93.9	Very high	21 Å²	21	30.7 Å²	30.7	8%	0.082	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.3	-178.7	-176.2	-112.1	0	0	0	110.3	G508 Y509 V552 G555 L557 Y575 N577	Y506-G508 PolarHBondContact O-N 3.27Å; Y506-G508 VanDerWaalsContact O-N 3.16Å; Y506-Y509 PolarHBondContact N-O 3.3Å; Y506-Y509 PolarHBondContact O-N 3.06Å; Y506-V552 HydrophobicContact CD2-CG1 4.18Å; Y506-V552 HydrophobicContact CD2-CG2 3.85Å; Y506-V552 HydrophobicContact CG-CG2 4.45Å; Y506-G555 VanDerWaalsContact CE2-O 3.27Å; Y506-G555 WeakPolarHBondContact CE2-O 3.39Å; Y506-L557 HydrophobicContact CD1-CB 4.45Å; Y506-L557 HydrophobicContact CD1-CD2 4.49Å; Y506-L557 HydrophobicContact CD2-CB 3.9Å; Y506-L557 HydrophobicContact CE2-CB 4.16Å; Y506-L557 HydrophobicContact CG-CB 4.06Å; Y506-L557 HydrophobicContact CG-CD2 4.4Å; Y506-Y575 HydrophobicContact CD1-CD1 4.44Å; Y506-Y575 AromaticContact CE1-CD1 3.84Å; Y506-Y575 HydrophobicContact CE1-CD1 3.84Å; Y506-Y575 AromaticContact CE1-CE1 3.93Å; Y506-Y575 HydrophobicContact CE1-CE1 3.93Å; Y506-N577 HydrophobicContact CE1-CB 4.35Å
507	N	87.6	Confident	93.8	Very high	93 Å²	93	30.4 Å²	30.4	50%	0.497	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	37.3	-177.7	-65.5	-13.9	0	0	0	114.2	Y509	N507-Y509 VanDerWaalsContact C-N 3.27Å; N507-Y509 HydrophobicContact CB-CD2 4.42Å; N507-Y509 WeakPolarHBondContact O-CD2 3.31Å; N507-Y509 VanDerWaalsContact O-CE2 3.31Å; N507-Y509 WeakPolarHBondContact O-CE2 3.21Å; N507-Y509 PolarHBondContact O-N 2.86Å
508	G	88.5	Confident	93.5	Very high	44 Å²	44	30.2 Å²	30.2	45%	0.454	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	2.4	-179.3	0	0	0	0	0	115.2	L459 Y506	L459-G508 WeakPolarHBondContact CD1-O 3.49Å; Y506-G508 PolarHBondContact O-N 3.27Å; Y506-G508 VanDerWaalsContact O-N 3.16Å
509	Y	94.6	Very high	93.2	Very high	69 Å²	69	33.6 Å²	33.6	27%	0.271	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	150.7	175.5	-58.7	-88.1	0	0	0	110.9	V505 Y506 N507 Y528 N529	V505-Y509 CarbonylContact C-O 3.6Å; V505-Y509 VanDerWaalsContact CA-O 3.28Å; V505-Y509 WeakPolarHBondContact CA-O 3.49Å; Y506-Y509 PolarHBondContact N-O 3.3Å; Y506-Y509 PolarHBondContact O-N 3.06Å; N507-Y509 VanDerWaalsContact C-N 3.27Å; N507-Y509 HydrophobicContact CB-CD2 4.42Å; N507-Y509 WeakPolarHBondContact O-CD2 3.31Å; N507-Y509 VanDerWaalsContact O-CE2 3.31Å; N507-Y509 WeakPolarHBondContact O-CE2 3.21Å; N507-Y509 PolarHBondContact O-N 2.86Å; Y509-Y528 WeakPolarHBondContact CA-O 3.46Å; Y509-N529 HydrophobicContact CD1-CB 3.93Å; Y509-N529 HydrophobicContact CE1-CB 3.75Å
510	L	96.1	Very high	93.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.9	170.2	-177.6	75.3	0	0	0	108.8	A457 L459 Y464 V466 C503 V505 R527 Y528 W535	A457-L510 HydrophobicContact CB-CD1 3.66Å; L459-L510 HydrophobicContact CD2-CB 4Å; Y464-L510 HydrophobicContact CD1-CD2 3.92Å; Y464-L510 HydrophobicContact CG-CD2 3.9Å; V466-L510 HydrophobicContact CG2-CD2 3.66Å; V466-L510 HydrophobicContact CG2-CG 4.4Å; C503-L510 WeakPolarHBondContact SG-CD1 3.03Å; V505-L510 HydrophobicContact CG2-CD1 4.1Å; L510-R527 CarbonylContact O-C 3.53Å; L510-R527 VanDerWaalsContact O-CA 3.29Å; L510-R527 WeakPolarHBondContact O-CA 3.39Å; L510-Y528 HydrophobicContact CB-CD1 4.26Å; L510-Y528 HydrophobicContact CD2-CD1 4.45Å; L510-Y528 PolarHBondContact N-O 3.4Å; L510-Y528 PolarHBondContact O-N 3.44Å; L510-W535 HydrophobicContact CD2-CH2 4.22Å; L510-W535 HydrophobicContact CD2-CZ2 4.4Å; L510-W535 HydrophobicContact CG-CH2 4.48Å
511	C	96.8	Very high	93.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.014	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.2	-178.6	-69.7	0	0	0	0	110.7	C503 A504 V513 E526 L557	C503-C511 VanDerWaalsContact CA-O 3.26Å; C503-C511 WeakPolarHBondContact CA-O 3.4Å; A504-C511 PolarHBondContact N-O 2.77Å; A504-C511 PolarHBondContact O-N 2.8Å; C511-V513 HydrophobicContact CB-CG2 4.45Å; C511-E526 WeakPolarHBondContact CA-O 3.37Å; C511-L557 HydrophobicContact CB-CD2 4.27Å
512	A	96.9	Very high	93.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.9	173.3	0	0	0	0	0	109	V466 M494 L501 A525 E526 W535	V466-A512 HydrophobicContact CG1-CB 4.23Å; M494-A512 HydrophobicContact SD-CB 3.7Å; L501-A512 HydrophobicContact CD1-CB 3.81Å; A512-A525 CarbonylContact O-C 3.53Å; A512-A525 VanDerWaalsContact O-CA 3.32Å; A512-A525 WeakPolarHBondContact O-CA 3.34Å; A512-E526 PolarHBondContact N-O 2.86Å; A512-E526 PolarHBondContact O-N 2.85Å; A512-W535 HydrophobicContact CB-CH2 3.82Å; A512-W535 HydrophobicContact CB-CZ3 3.57Å
513	V	95.8	Very high	93.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	130	-169	-177.8	0	0	0	0	110.8	G502 C511 A525 M541 I548 L550 W582	G502-V513 PolarHBondContact N-O 2.98Å; G502-V513 PolarHBondContact O-N 2.94Å; C511-V513 HydrophobicContact CB-CG2 4.45Å; V513-A525 HydrophobicContact CB-CB 4.41Å; V513-A525 HydrophobicContact CG1-CB 4.28Å; V513-A525 HydrophobicContact CG2-CB 3.97Å; V513-M541 HydrophobicContact CG1-CE 3.59Å; V513-M541 HydrophobicContact CG1-CG 4.02Å; V513-M541 HydrophobicContact CG1-SD 3.34Å; V513-M541 WeakPolarHBondContact CG1-SD 3.23Å; V513-I548 HydrophobicContact CG1-CD1 4.31Å; V513-I548 WeakPolarHBondContact O-CD1 3.28Å; V513-L550 HydrophobicContact CB-CD1 4.02Å; V513-L550 HydrophobicContact CB-CD2 3.94Å; V513-L550 HydrophobicContact CG1-CD1 4.28Å; V513-L550 HydrophobicContact CG2-CD1 3.93Å; V513-L550 HydrophobicContact CG2-CD2 3.57Å; V513-L550 HydrophobicContact CG2-CG 4.46Å; V513-W582 HydrophobicContact CG1-CH2 4.13Å; V513-W582 HydrophobicContact CG1-CZ2 4.02Å; V513-W582 HydrophobicContact CG2-CH2 4.36Å; V513-W582 HydrophobicContact CG2-CZ2 4.25Å
514	G	95.2	Very high	93.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.202	C	C	.	.			trans	52.9	-134.7	178.9	0	0	0	0	0	114.1	R498 L522 S524	R498-G514 WeakPolarHBondContact CD-O 3.45Å; R498-G514 PolarHBondContact NH1-O 2.85Å; G514-L522 VanDerWaalsContact CA-O 3.28Å; G514-L522 WeakPolarHBondContact CA-O 3.37Å; G514-S524 PolarHBondContact N-O 3.35Å
515	G	93.4	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.199	C	C	.	.			trans	92.4	-160.7	-170.1	0	0	0	0	0	112.2	K499 L522 R545	K499-G515 CarbonylContact O-C 3.45Å; K499-G515 VanDerWaalsContact O-CA 3.27Å; K499-G515 WeakPolarHBondContact O-CA 3.37Å; G515-L522 WeakPolarHBondContact O-CB 3.48Å; G515-L522 PolarHBondContact O-N 2.8Å; G515-R545 PolarHBondContact N-O 2.92Å
516	R	92.9	Very high	94.1	Very high	76 Å²	76	32.5 Å²	32.5	29%	0.287	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-131	138.8	178.9	-163.6	-170.8	-169.4	-91.3	4.6	110.1	K499 T520 E521	K499-R516 HydrophobicContact CG-CB 4.25Å; K499-R516 WeakPolarHBondContact CG-O 3.41Å; K499-R516 PolarHBondContact N-O 3.32Å; K499-R516 PolarHBondContact O-N 2.98Å; R516-T520 WeakPolarHBondContact CA-O 3.49Å; R516-T520 WeakPolarHBondContact CG-O 3.46Å; R516-E521 VanDerWaalsContact CD-OE1 3.32Å; R516-E521 WeakPolarHBondContact CD-OE1 3.09Å; R516-E521 HydrophobicContact CG-CG 4.46Å; R516-E521 IonicContact NE-OE1 3.53Å; R516-E521 PolarHBondContact NE-OE1 3.49Å
517	D	94.6	Very high	94.3	Very high	35 Å²	35	35.1 Å²	35.1	19%	0.187	20%	0.198	C	C	.	.			trans	-98.8	-159	168.1	67.6	14.7	0	0	0	110.9	R497 A519 T520 L522	R497-D517 WeakPolarHBondContact O-CB 3.48Å; D517-A519 PolarHBondContact O-N 3.12Å; D517-A519 WeakPolarHBondContact OD1-CA 3.33Å; D517-A519 PolarHBondContact OD1-N 3.26Å; D517-T520 PolarHBondContact N-O 3.06Å; D517-T520 PolarHBondContact OD1-N 3.24Å; D517-T520 VanDerWaalsContact OD1-O 3.11Å; D517-L522 HydrophobicContact CB-CD1 4.32Å; D517-L522 HydrophobicContact CB-CD2 4.5Å
518	D	90.8	Very high	94.8	Very high	98 Å²	98	30.9 Å²	30.9	52%	0.524	18%	0.175	S	C	.	.	S	Bend	trans	-64.4	-30.9	178.2	-63.9	-62.6	0	0	0	112.2	P474	P474-D518 WeakPolarHBondContact CD-OD1 3.38Å
519	A	89.9	Confident	95.2	Very high	71 Å²	71	30 Å²	30	59%	0.587	16%	0.16	S	C	*	.	S	Bend	trans	-105.3	-51	-171.2	0	0	0	0	0	112.9	D517	D517-A519 PolarHBondContact O-N 3.12Å; D517-A519 WeakPolarHBondContact OD1-CA 3.33Å; D517-A519 PolarHBondContact OD1-N 3.26Å
520	T	93.8	Very high	95.1	Very high	58 Å²	58	29.1 Å²	29.1	36%	0.356	16%	0.163	S	C	.	.	S	Bend	trans	-147.2	165.8	-163.7	66.8	0	0	0	0	113.7	R516 D517	R516-T520 WeakPolarHBondContact CA-O 3.49Å; R516-T520 WeakPolarHBondContact CG-O 3.46Å; D517-T520 PolarHBondContact N-O 3.06Å; D517-T520 PolarHBondContact OD1-N 3.24Å; D517-T520 VanDerWaalsContact OD1-O 3.11Å
521	E	93.5	Very high	94.9	Very high	22 Å²	22	37.7 Å²	37.7	10%	0.103	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-71.2	141.8	167	-67.9	65.1	-146.4	0	0	110.5	R516 R544 S546 F563 G565	R516-E521 VanDerWaalsContact CD-OE1 3.32Å; R516-E521 WeakPolarHBondContact CD-OE1 3.09Å; R516-E521 HydrophobicContact CG-CG 4.46Å; R516-E521 IonicContact NE-OE1 3.53Å; R516-E521 PolarHBondContact NE-OE1 3.49Å; E521-R544 HydrophobicContact CB-CB 4.03Å; E521-R544 VanDerWaalsContact O-CD 3.24Å; E521-R544 WeakPolarHBondContact O-CD 3.41Å; E521-R544 WeakPolarHBondContact O-CG 3.49Å; E521-R544 PolarHBondContact O-NH1 2.83Å; E521-S546 WeakPolarHBondContact CG-OG 3.26Å; E521-F563 HydrophobicContact CG-CD1 4.15Å; E521-F563 WeakPolarHBondContact CG-O 3.29Å; E521-G565 WeakPolarHBondContact OE2-CA 3.38Å
522	L	96	Very high	94.9	Very high	12 Å²	12	41.1 Å²	41.1	6%	0.063	22%	0.224	C	C	.	.			trans	-106.3	140.4	-169.7	-61.3	173.1	0	0	0	111.2	T496 R498 G514 G515 D517 R545	T496-L522 HydrophobicContact CG2-CD1 3.84Å; T496-L522 HydrophobicContact CG2-CD2 4.41Å; R498-L522 HydrophobicContact CG-CD1 3.85Å; G514-L522 VanDerWaalsContact CA-O 3.28Å; G514-L522 WeakPolarHBondContact CA-O 3.37Å; G515-L522 WeakPolarHBondContact O-CB 3.48Å; G515-L522 PolarHBondContact O-N 2.8Å; D517-L522 HydrophobicContact CB-CD1 4.32Å; D517-L522 HydrophobicContact CB-CD2 4.5Å; L522-R545 PolarHBondContact O-N 2.98Å
523	S	95.8	Very high	94.9	Very high	30 Å²	30	44.7 Å²	44.7	21%	0.21	24%	0.243	C	C	.	.			trans	-100.2	-15.4	164.1	57.4	0	0	0	0	112.6	A540 M541 N543	S523-A540 CarbonylContact O-C 3.58Å; S523-A540 WeakPolarHBondContact O-CA 3.28Å; S523-M541 WeakPolarHBondContact CB-O 3.5Å; S523-M541 PolarHBondContact O-N 2.92Å; S523-N543 WeakPolarHBondContact CB-O 3.4Å
524	S	96.8	Very high	95	Very high	34 Å²	34	50.4 Å²	50.4	24%	0.238	27%	0.27	C	S	.	.			trans	-65.3	151.2	-176.2	61.7	0	0	0	0	112.2	R498 G514	R498-S524 PolarHBondContact NH1-O 3.4Å; R498-S524 PolarHBondContact NH1-OG 3.31Å; R498-S524 PolarHBondContact NH2-O 3.23Å; R498-S524 PolarHBondContact NH2-OG 2.8Å; G514-S524 PolarHBondContact N-O 3.35Å
525	A	97	Very high	95.2	Very high	2 Å²	2	52 Å²	52	2%	0.017	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151	176.4	0	0	0	0	0	110.1	A512 V513 L538	A512-A525 CarbonylContact O-C 3.53Å; A512-A525 VanDerWaalsContact O-CA 3.32Å; A512-A525 WeakPolarHBondContact O-CA 3.34Å; V513-A525 HydrophobicContact CB-CB 4.41Å; V513-A525 HydrophobicContact CG1-CB 4.28Å; V513-A525 HydrophobicContact CG2-CB 3.97Å; A525-L538 HydrophobicContact CB-CB 3.85Å; A525-L538 PolarHBondContact O-N 3.08Å
526	E	97.3	Very high	95.3	Very high	15 Å²	15	55 Å²	55	7%	0.07	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	150.9	178.7	-59.9	173	-108.7	0	0	108.6	G495 T496 R498 C511 A512 W535 T536	G495-E526 WeakPolarHBondContact CA-OE2 3.35Å; G495-E526 PolarHBondContact N-OE2 3.48Å; T496-E526 WeakPolarHBondContact CB-OE1 3.46Å; T496-E526 PolarHBondContact N-OE1 3.29Å; T496-E526 PolarHBondContact OG1-OE1 3.29Å; R498-E526 IonicContact CZ-OE1 3.35Å; R498-E526 IonicContact NE-OE1 2.76Å; R498-E526 PolarHBondContact NE-OE1 3.33Å; R498-E526 IonicContact NH2-OE1 3.3Å; R498-E526 PolarHBondContact NH2-OE1 3.43Å; C511-E526 WeakPolarHBondContact CA-O 3.37Å; A512-E526 PolarHBondContact N-O 2.86Å; A512-E526 PolarHBondContact O-N 2.85Å; E526-W535 HydrophobicContact CB-CE3 3.74Å; E526-W535 HydrophobicContact CB-CZ3 4.26Å; E526-T536 CarbonylContact C-O 3.6Å; E526-T536 WeakPolarHBondContact CA-O 3.45Å
527	R	96.8	Very high	95.5	Very high	76 Å²	76	56.2 Å²	56.2	29%	0.287	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	145	174	67.1	172.3	178.2	-160.1	0.2	111.7	L510 W535 T536 L538	L510-R527 CarbonylContact O-C 3.53Å; L510-R527 VanDerWaalsContact O-CA 3.29Å; L510-R527 WeakPolarHBondContact O-CA 3.39Å; R527-W535 VanDerWaalsContact C-CE3 3.42Å; R527-W535 CarbonylContact O-C 3.52Å; R527-W535 VanDerWaalsContact O-CA 3.28Å; R527-W535 WeakPolarHBondContact O-CA 3.37Å; R527-T536 PolarHBondContact N-O 2.96Å; R527-T536 PolarHBondContact O-N 3.46Å; R527-L538 HydrophobicContact CB-CD1 3.96Å; R527-L538 HydrophobicContact CB-CG 4.16Å; R527-L538 HydrophobicContact CG-CD1 4.4Å; R527-L538 HydrophobicContact CG-CD2 4.12Å; R527-L538 HydrophobicContact CG-CG 4.11Å
528	Y	98.3	Very high	95.4	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.016	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.7	177.3	170.2	-101.6	0	0	0	111.5	Y464 V491 A492 Y509 L510 P530 N533 Q534 W535	Y464-Y528 HydrophobicContact CE1-CD1 4.39Å; Y464-Y528 AromaticContact CE1-CE1 3.77Å; Y464-Y528 HydrophobicContact CE1-CE1 3.77Å; V491-Y528 HydrophobicContact CB-CE2 4.44Å; V491-Y528 HydrophobicContact CG2-CE2 4.43Å; A492-Y528 HydrophobicContact CB-CE2 4.34Å; Y509-Y528 WeakPolarHBondContact CA-O 3.46Å; L510-Y528 HydrophobicContact CB-CD1 4.26Å; L510-Y528 HydrophobicContact CD2-CD1 4.45Å; L510-Y528 PolarHBondContact N-O 3.4Å; L510-Y528 PolarHBondContact O-N 3.44Å; Y528-P530 HydrophobicContact CE1-CB 3.94Å; Y528-N533 WeakPolarHBondContact CE2-OD1 3.19Å; Y528-N533 PolarHBondContact OH-OD1 2.74Å; Y528-Q534 WeakPolarHBondContact CA-O 3.41Å; Y528-W535 AromaticContact CD2-CD1 3.83Å; Y528-W535 HydrophobicContact CD2-CD2 4.36Å; Y528-W535 AromaticContact CD2-CE2 3.9Å; Y528-W535 HydrophobicContact CD2-CG 4.33Å; Y528-W535 HydrophobicContact CD2-CZ2 4.39Å; Y528-W535 AromaticContact CD2-NE1 3.54Å; Y528-W535 HydrophobicContact CG-CD2 4.48Å; Y528-W535 HydrophobicContact CG-CZ2 4.11Å
529	N	96.1	Very high	95.6	Very high	25 Å²	25	53.1 Å²	53.1	13%	0.134	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	114	172.3	-174.9	-18.1	0	0	0	109.8	Y509 Q531 T532 N533 Q534	Y509-N529 HydrophobicContact CD1-CB 3.93Å; Y509-N529 HydrophobicContact CE1-CB 3.75Å; N529-Q531 PolarHBondContact O-N 2.89Å; N529-Q531 WeakPolarHBondContact OD1-CB 3.49Å; N529-Q531 PolarHBondContact OD1-N 3.35Å; N529-T532 WeakPolarHBondContact CB-OG1 3.3Å; N529-N533 WeakPolarHBondContact O-CA 3.32Å; N529-N533 PolarHBondContact O-N 3.38Å; N529-Q534 PolarHBondContact N-O 2.86Å; N529-Q534 PolarHBondContact O-N 3.03Å
530	P	92.5	Very high	95.9	Very high	51 Å²	51	51.9 Å²	51.9	33%	0.331	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.3	179.6	29.6	-36.7	0	0	0	113.8	L459 Y528	L459-P530 HydrophobicContact CD2-CB 4.27Å; L459-P530 HydrophobicContact CD2-CG 3.84Å; L459-P530 HydrophobicContact CG-CG 4.38Å; Y528-P530 HydrophobicContact CE1-CB 3.94Å
531	Q	92.8	Very high	96	Very high	180 Å²	180	49.4 Å²	49.4	84%	0.841	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-40.8	-179.7	-61.5	178.2	-21.2	0	0	112	N529	N529-Q531 PolarHBondContact O-N 2.89Å; N529-Q531 WeakPolarHBondContact OD1-CB 3.49Å; N529-Q531 PolarHBondContact OD1-N 3.35Å
532	T	96.7	Very high	96	Very high	75 Å²	75	53.4 Å²	53.4	46%	0.46	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-9.1	179.1	62.5	0	0	0	0	113.1	N529 Q534	N529-T532 WeakPolarHBondContact CB-OG1 3.3Å; T532-Q534 VanDerWaalsContact C-N 3.33Å; T532-Q534 PolarHBondContact O-N 2.86Å
533	N	97.2	Very high	95.7	Very high	75 Å²	75	56 Å²	56	40%	0.401	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	50.5	-173.7	-174.6	34	0	0	0	111.6	A492 Y528 N529	A492-N533 WeakPolarHBondContact CB-O 3.4Å; A492-N533 WeakPolarHBondContact CB-OD1 3.44Å; A492-N533 PolarHBondContact N-OD1 3.44Å; Y528-N533 WeakPolarHBondContact CE2-OD1 3.19Å; Y528-N533 PolarHBondContact OH-OD1 2.74Å; N529-N533 WeakPolarHBondContact O-CA 3.32Å; N529-N533 PolarHBondContact O-N 3.38Å
534	Q	97.9	Very high	95.6	Very high	119 Å²	119	60.1 Å²	60.1	56%	0.556	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.4	-178.3	-72.2	178.7	2.7	0	0	111.7	Y528 N529 T532	Y528-Q534 WeakPolarHBondContact CA-O 3.41Å; N529-Q534 PolarHBondContact N-O 2.86Å; N529-Q534 PolarHBondContact O-N 3.03Å; T532-Q534 VanDerWaalsContact C-N 3.33Å; T532-Q534 PolarHBondContact O-N 2.86Å
535	W	98.4	Very high	95.4	Very high	33 Å²	33	58.5 Å²	58.5	13%	0.125	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	141.6	170.1	-72	85.1	0	0	0	110.4	V466 V478 A492 P493 M494 L510 A512 E526 R527 Y528	V466-W535 HydrophobicContact CG1-CH2 4.11Å; V466-W535 HydrophobicContact CG1-CZ2 4.37Å; V478-W535 HydrophobicContact CG1-CZ2 4.47Å; V478-W535 HydrophobicContact CG2-CZ2 3.8Å; A492-W535 PolarHBondContact O-NE1 2.85Å; P493-W535 VanDerWaalsContact C-CD1 3.46Å; M494-W535 HydrophobicContact CB-CD2 4.46Å; M494-W535 HydrophobicContact CG-CD2 3.79Å; M494-W535 HydrophobicContact CG-CE3 4.02Å; M494-W535 HydrophobicContact CG-CG 4.5Å; M494-W535 HydrophobicContact CG-CH2 3.9Å; M494-W535 HydrophobicContact CG-CZ2 3.67Å; M494-W535 HydrophobicContact CG-CZ3 4.07Å; M494-W535 HydrophobicContact SD-CH2 4.26Å; M494-W535 HydrophobicContact SD-CZ2 4.46Å; L510-W535 HydrophobicContact CD2-CH2 4.22Å; L510-W535 HydrophobicContact CD2-CZ2 4.4Å; L510-W535 HydrophobicContact CG-CH2 4.48Å; A512-W535 HydrophobicContact CB-CH2 3.82Å; A512-W535 HydrophobicContact CB-CZ3 3.57Å; E526-W535 HydrophobicContact CB-CE3 3.74Å; E526-W535 HydrophobicContact CB-CZ3 4.26Å; R527-W535 VanDerWaalsContact C-CE3 3.42Å; R527-W535 CarbonylContact O-C 3.52Å; R527-W535 VanDerWaalsContact O-CA 3.28Å; R527-W535 WeakPolarHBondContact O-CA 3.37Å; Y528-W535 AromaticContact CD2-CD1 3.83Å; Y528-W535 HydrophobicContact CD2-CD2 4.36Å; Y528-W535 AromaticContact CD2-CE2 3.9Å; Y528-W535 HydrophobicContact CD2-CG 4.33Å; Y528-W535 HydrophobicContact CD2-CZ2 4.39Å; Y528-W535 AromaticContact CD2-NE1 3.54Å; Y528-W535 HydrophobicContact CG-CD2 4.48Å; Y528-W535 HydrophobicContact CG-CZ2 4.11Å
536	T	97	Very high	95.1	Very high	63 Å²	63	58.9 Å²	58.9	39%	0.387	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.6	175.1	-46.4	0	0	0	0	108.9	E526 R527	E526-T536 CarbonylContact C-O 3.6Å; E526-T536 WeakPolarHBondContact CA-O 3.45Å; R527-T536 PolarHBondContact N-O 2.96Å; R527-T536 PolarHBondContact O-N 3.46Å
537	P	96	Very high	94.6	Very high	103 Å²	103	58.5 Å²	58.5	67%	0.669	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.8	143.7	175.9	25.9	-34.4	0	0	0	111.4
538	L	93.5	Very high	94.1	Very high	23 Å²	23	55 Å²	55	12%	0.12	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	164.8	166.8	-72.3	178.6	0	0	0	109.4	A525 R527 A540	A525-L538 HydrophobicContact CB-CB 3.85Å; A525-L538 PolarHBondContact O-N 3.08Å; R527-L538 HydrophobicContact CB-CD1 3.96Å; R527-L538 HydrophobicContact CB-CG 4.16Å; R527-L538 HydrophobicContact CG-CD1 4.4Å; R527-L538 HydrophobicContact CG-CD2 4.12Å; R527-L538 HydrophobicContact CG-CG 4.11Å; L538-A540 PolarHBondContact O-N 2.83Å
539	V	95	Very high	93.5	Very high	45 Å²	45	55 Å²	55	27%	0.273	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-56.4	137.1	171.8	74.1	0	0	0	0	110.2	Y575 N580 W582	V539-Y575 HydrophobicContact CG1-CD2 3.99Å; V539-Y575 HydrophobicContact CG1-CE2 3.54Å; V539-N580 WeakPolarHBondContact CB-O 3.33Å; V539-N580 WeakPolarHBondContact CG1-O 3.36Å; V539-W582 PolarHBondContact O-NE1 3.01Å
540	A	95.7	Very high	93.3	Very high	44 Å²	44	54.5 Å²	54.5	36%	0.364	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-69.6	148	177.2	0	0	0	0	0	110.8	S523 L538 W582	S523-A540 CarbonylContact O-C 3.58Å; S523-A540 WeakPolarHBondContact O-CA 3.28Å; L538-A540 PolarHBondContact O-N 2.83Å; A540-W582 VanDerWaalsContact O-CD1 3.25Å
541	M	95.6	Very high	93.1	Very high	7 Å²	7	52.4 Å²	52.4	3%	0.034	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-60.9	159.8	168.3	-65.8	176.8	-63.6	0	0	110.7	V513 S523 N543 R545 I548 A559 W582	V513-M541 HydrophobicContact CG1-CE 3.59Å; V513-M541 HydrophobicContact CG1-CG 4.02Å; V513-M541 HydrophobicContact CG1-SD 3.34Å; V513-M541 WeakPolarHBondContact CG1-SD 3.23Å; S523-M541 WeakPolarHBondContact CB-O 3.5Å; S523-M541 PolarHBondContact O-N 2.92Å; M541-N543 WeakPolarHBondContact CB-O 3.47Å; M541-N543 PolarHBondContact O-N 2.77Å; M541-R545 HydrophobicContact CE-CB 4.16Å; M541-R545 HydrophobicContact CE-CG 4.08Å; M541-R545 HydrophobicContact SD-CG 4.31Å; M541-I548 HydrophobicContact CE-CD1 3.7Å; M541-I548 HydrophobicContact SD-CD1 4.17Å; M541-A559 HydrophobicContact SD-CB 3.81Å; M541-W582 HydrophobicContact CB-CG 4.39Å; M541-W582 HydrophobicContact CG-CD2 3.75Å; M541-W582 HydrophobicContact CG-CE3 4.24Å; M541-W582 HydrophobicContact CG-CG 4.06Å; M541-W582 HydrophobicContact CG-CH2 4.45Å; M541-W582 HydrophobicContact CG-CZ2 3.99Å
542	N	93.8	Very high	92.6	Very high	106 Å²	106	45.6 Å²	45.6	57%	0.567	25%	0.252	S	S	*	.	S	Bend	trans	-68.6	-28.3	177.1	-59.7	-68.4	0	0	0	111.8	E573 W582	N542-E573 WeakPolarHBondContact CB-OE2 3.46Å; N542-E573 PolarHBondContact N-OE2 3.24Å; N542-E573 PolarHBondContact ND2-OE2 3.44Å; N542-W582 PolarHBondContact ND2-O 3.04Å
543	N	90.7	Very high	91.7	Very high	65 Å²	65	42.1 Å²	42.1	35%	0.348	23%	0.23	S	C	.	.	S	Bend	trans	-122	150.9	179.4	-58.6	-82	0	0	0	111.2	S523 M541 R545 L569 E573	S523-N543 WeakPolarHBondContact CB-O 3.4Å; M541-N543 WeakPolarHBondContact CB-O 3.47Å; M541-N543 PolarHBondContact O-N 2.77Å; N543-R545 HydrophobicContact CB-CG 4.49Å; N543-L569 HydrophobicContact CB-CD1 4.41Å; N543-E573 PolarHBondContact ND2-OE1 3.15Å
544	R	93.4	Very high	90.5	Very high	118 Å²	118	40.8 Å²	40.8	45%	0.445	22%	0.223	S	C	.	.			trans	-69.3	139.3	166.3	-66	170.9	-176.3	-85	-1.1	108.5	E521 D564	E521-R544 HydrophobicContact CB-CB 4.03Å; E521-R544 VanDerWaalsContact O-CD 3.24Å; E521-R544 WeakPolarHBondContact O-CD 3.41Å; E521-R544 WeakPolarHBondContact O-CG 3.49Å; E521-R544 PolarHBondContact O-NH1 2.83Å; R544-D564 HydrophobicContact CB-CB 4.37Å; R544-D564 VanDerWaalsContact O-CA 3.24Å; R544-D564 WeakPolarHBondContact O-CA 3.36Å; R544-D564 WeakPolarHBondContact O-CB 3.42Å
545	R	92.6	Very high	89.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.218	C	C	.	.			trans	-148	129	179	-45.9	-179.7	169.6	-106.5	-3.4	110.7	G515 L522 M541 N543 I548 G561 F563 L569 T571 E573	G515-R545 PolarHBondContact N-O 2.92Å; L522-R545 PolarHBondContact O-N 2.98Å; M541-R545 HydrophobicContact CE-CB 4.16Å; M541-R545 HydrophobicContact CE-CG 4.08Å; M541-R545 HydrophobicContact SD-CG 4.31Å; N543-R545 HydrophobicContact CB-CG 4.49Å; R545-I548 HydrophobicContact CB-CD1 3.46Å; R545-I548 VanDerWaalsContact CB-CD1 3.46Å; R545-I548 HydrophobicContact CB-CG1 3.33Å; R545-I548 HydrophobicContact CG-CD1 4.4Å; R545-I548 HydrophobicContact CG-CG1 4.45Å; R545-I548 WeakPolarHBondContact O-CD1 3.33Å; R545-G561 PolarHBondContact NH1-O 3.39Å; R545-F563 CarbonylContact C-O 3.6Å; R545-F563 WeakPolarHBondContact CA-O 3.35Å; R545-L569 HydrophobicContact CB-CD1 4.42Å; R545-L569 HydrophobicContact CG-CD1 3.68Å; R545-T571 PolarHBondContact NH1-O 2.88Å; R545-T571 PolarHBondContact NH2-OG1 3.48Å; R545-E573 IonicContact CZ-OE1 2.75Å; R545-E573 IonicContact NE-OE1 3.17Å; R545-E573 PolarHBondContact NE-OE1 3.22Å; R545-E573 VanDerWaalsContact NE-OE1 3.07Å; R545-E573 IonicContact NH2-OE1 2.8Å; R545-E573 PolarHBondContact NH2-OE1 2.95Å
546	S	90.3	Very high	88.8	Confident	10 Å²	10	39.9 Å²	39.9	7%	0.07	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-118.3	154.4	164.6	65.8	0	0	0	0	110.6	E521 I548 G562 F563 L593	E521-S546 WeakPolarHBondContact CG-OG 3.26Å; S546-I548 VanDerWaalsContact C-N 3.27Å; S546-I548 PolarHBondContact O-N 3.3Å; S546-G562 CarbonylContact O-C 3.57Å; S546-G562 WeakPolarHBondContact O-CA 3.33Å; S546-F563 PolarHBondContact N-O 3.06Å; S546-F563 PolarHBondContact O-N 2.82Å; S546-F563 PolarHBondContact OG-O 3.21Å; S546-L593 WeakPolarHBondContact O-CD1 3.22Å
547	G	85.5	Confident	88.5	Confident	7 Å²	7	36.9 Å²	36.9	7%	0.072	21%	0.214	C	C	.	.	S	Bend	trans	62.7	35.4	-172	0	0	0	0	0	112.8	H500 G594 G595	H500-G547 WeakPolarHBondContact O-CA 3.41Å; H500-G547 PolarHBondContact O-N 3.24Å; G547-G594 PolarHBondContact O-N 2.91Å; G547-G594 VanDerWaalsContact O-N 3.1Å; G547-G595 PolarHBondContact O-N 3Å
548	I	86.5	Confident	88.2	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.015	19%	0.185	C	C	.	.			trans	-71.2	137.6	-178.7	-52.8	173	0	0	0	110.3	V513 M541 R545 S546 A559 G595	V513-I548 HydrophobicContact CG1-CD1 4.31Å; V513-I548 WeakPolarHBondContact O-CD1 3.28Å; M541-I548 HydrophobicContact CE-CD1 3.7Å; M541-I548 HydrophobicContact SD-CD1 4.17Å; R545-I548 HydrophobicContact CB-CD1 3.46Å; R545-I548 VanDerWaalsContact CB-CD1 3.46Å; R545-I548 HydrophobicContact CB-CG1 3.33Å; R545-I548 HydrophobicContact CG-CD1 4.4Å; R545-I548 HydrophobicContact CG-CG1 4.45Å; R545-I548 WeakPolarHBondContact O-CD1 3.33Å; S546-I548 VanDerWaalsContact C-N 3.27Å; S546-I548 PolarHBondContact O-N 3.3Å; I548-A559 HydrophobicContact CG2-CB 4.02Å; I548-G595 WeakPolarHBondContact O-CA 3.33Å
549	G	86.7	Confident	88.1	Confident	2 Å²	2	31.7 Å²	31.7	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.9	159.6	0	0	0	0	0	110.4	V560 V597	G549-V560 PolarHBondContact N-O 2.74Å; G549-V560 WeakPolarHBondContact O-CB 3.41Å; G549-V560 PolarHBondContact O-N 3.12Å; G549-V597 VanDerWaalsContact CA-CG2 3.49Å
550	L	90.8	Very high	87.7	Confident	15 Å²	15	29.8 Å²	29.8	8%	0.079	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126	-179.9	-167.4	79.6	0	0	0	109.6	A504 V513 L557 Y558 A559 W582	A504-L550 HydrophobicContact CB-CD2 3.94Å; A504-L550 HydrophobicContact CB-CG 4.09Å; V513-L550 HydrophobicContact CB-CD1 4.02Å; V513-L550 HydrophobicContact CB-CD2 3.94Å; V513-L550 HydrophobicContact CG1-CD1 4.28Å; V513-L550 HydrophobicContact CG2-CD1 3.93Å; V513-L550 HydrophobicContact CG2-CD2 3.57Å; V513-L550 HydrophobicContact CG2-CG 4.46Å; L550-L557 HydrophobicContact CD1-CD1 3.94Å; L550-L557 HydrophobicContact CD1-CG 4.1Å; L550-L557 HydrophobicContact CD2-CD1 4.03Å; L550-L557 HydrophobicContact CG-CD1 3.76Å; L550-L557 HydrophobicContact CG-CG 4.46Å; L550-Y558 WeakPolarHBondContact CA-O 3.47Å; L550-Y558 WeakPolarHBondContact CD1-O 3.14Å; L550-A559 HydrophobicContact CD1-CB 4.04Å; L550-W582 HydrophobicContact CD1-CH2 4.21Å
551	A	88.2	Confident	87.2	Confident	7 Å²	7	27.8 Å²	27.8	6%	0.058	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152	-173.2	0	0	0	0	0	111.3	M314 Y558 V597 V599	M314-A551 HydrophobicContact CG-CB 4.4Å; M314-A551 HydrophobicContact SD-CB 3.77Å; A551-Y558 PolarHBondContact N-O 3.21Å; A551-Y558 PolarHBondContact O-N 2.75Å; A551-V597 HydrophobicContact CB-CB 4.47Å; A551-V597 HydrophobicContact CB-CG1 3.56Å; A551-V599 HydrophobicContact CB-CG2 3.5Å
552	V	84.2	Confident	86.8	Confident	38 Å²	38	27.5 Å²	27.5	23%	0.23	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.5	171.4	178.3	0	0	0	0	108.7	A504 V505 Y506 Q556 L557	A504-V552 HydrophobicContact CB-CG2 4.27Å; V505-V552 WeakPolarHBondContact O-CG2 3.35Å; Y506-V552 HydrophobicContact CD2-CG1 4.18Å; Y506-V552 HydrophobicContact CD2-CG2 3.85Å; Y506-V552 HydrophobicContact CG-CG2 4.45Å; V552-Q556 CarbonylContact C-O 3.57Å; V552-Q556 VanDerWaalsContact CA-O 3.24Å; V552-Q556 WeakPolarHBondContact CA-O 3.34Å; V552-L557 HydrophobicContact CG2-CB 4.44Å; V552-L557 HydrophobicContact CG2-CD1 3.68Å
553	V	77.7	Confident	86.4	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	123.9	-177.3	-173.6	0	0	0	0	107.2	E312 M314 G555 Q556 Y558 V599	E312-V553 HydrophobicContact CB-CG1 3.81Å; E312-V553 WeakPolarHBondContact O-CG1 3.21Å; M314-V553 HydrophobicContact CB-CG2 3.73Å; M314-V553 HydrophobicContact CG-CG2 4.1Å; M314-V553 HydrophobicContact SD-CG2 3.89Å; V553-G555 PolarHBondContact O-N 3.15Å; V553-G555 VanDerWaalsContact O-N 3.14Å; V553-Q556 PolarHBondContact N-O 2.81Å; V553-Q556 PolarHBondContact O-N 3.41Å; V553-Y558 HydrophobicContact CB-CD2 3.94Å; V553-Y558 HydrophobicContact CB-CE2 3.81Å; V553-Y558 HydrophobicContact CG2-CD2 4.02Å; V553-Y558 HydrophobicContact CG2-CE2 4.36Å; V553-V599 HydrophobicContact CG2-CG1 4.09Å; V553-V599 HydrophobicContact CG2-CG2 3.71Å
554	N	72	Confident	86.3	Confident	47 Å²	47	23 Å²	23	25%	0.251	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	37.4	-178.4	-60.9	-42	0	0	0	113	R309 E312 Q556	R309-N554 VanDerWaalsContact O-CG 3.25Å; R309-N554 PolarHBondContact O-ND2 3.47Å; R309-N554 PolarHBondContact O-OD1 3.13Å; E312-N554 PolarHBondContact N-OD1 3.04Å; E312-N554 PolarHBondContact OE2-N 3.22Å; N554-Q556 VanDerWaalsContact C-N 3.29Å; N554-Q556 PolarHBondContact O-N 3.27Å
555	G	76.2	Confident	85.9	Confident	44 Å²	44	18.9 Å²	18.9	45%	0.454	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	17.7	-179.5	0	0	0	0	0	114.8	Y506 V553	Y506-G555 VanDerWaalsContact CE2-O 3.27Å; Y506-G555 WeakPolarHBondContact CE2-O 3.39Å; V553-G555 PolarHBondContact O-N 3.15Å; V553-G555 VanDerWaalsContact O-N 3.14Å
556	Q	83.8	Confident	85.4	Confident	90 Å²	90	23.8 Å²	23.8	42%	0.421	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.9	173.9	-64.9	-175.4	-33.7	0	0	110.5	V552 V553 N554 Y558 V574	V552-Q556 CarbonylContact C-O 3.57Å; V552-Q556 VanDerWaalsContact CA-O 3.24Å; V552-Q556 WeakPolarHBondContact CA-O 3.34Å; V553-Q556 PolarHBondContact N-O 2.81Å; V553-Q556 PolarHBondContact O-N 3.41Å; N554-Q556 VanDerWaalsContact C-N 3.29Å; N554-Q556 PolarHBondContact O-N 3.27Å; Q556-Y558 HydrophobicContact CB-CD2 4.32Å; Q556-Y558 HydrophobicContact CB-CE2 3.67Å; Q556-Y558 WeakPolarHBondContact O-CD2 3.46Å; Q556-Y558 PolarHBondContact OE1-OH 2.75Å; Q556-V574 HydrophobicContact CB-CG2 3.8Å; Q556-V574 HydrophobicContact CG-CG2 4.49Å
557	L	89.8	Confident	85.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.4	-177.8	179	70.3	0	0	0	110.2	A504 Y506 C511 L550 V552 V574 Y575 W582	A504-L557 HydrophobicContact CB-CD1 3.93Å; Y506-L557 HydrophobicContact CD1-CB 4.45Å; Y506-L557 HydrophobicContact CD1-CD2 4.49Å; Y506-L557 HydrophobicContact CD2-CB 3.9Å; Y506-L557 HydrophobicContact CE2-CB 4.16Å; Y506-L557 HydrophobicContact CG-CB 4.06Å; Y506-L557 HydrophobicContact CG-CD2 4.4Å; C511-L557 HydrophobicContact CB-CD2 4.27Å; L550-L557 HydrophobicContact CD1-CD1 3.94Å; L550-L557 HydrophobicContact CD1-CG 4.1Å; L550-L557 HydrophobicContact CD2-CD1 4.03Å; L550-L557 HydrophobicContact CG-CD1 3.76Å; L550-L557 HydrophobicContact CG-CG 4.46Å; V552-L557 HydrophobicContact CG2-CB 4.44Å; V552-L557 HydrophobicContact CG2-CD1 3.68Å; L557-V574 CarbonylContact O-C 3.52Å; L557-V574 WeakPolarHBondContact O-CA 3.1Å; L557-Y575 PolarHBondContact O-N 2.82Å; L557-W582 HydrophobicContact CD2-CH2 3.96Å; L557-W582 HydrophobicContact CD2-CZ2 4.46Å; L557-W582 HydrophobicContact CG-CH2 4.19Å
558	Y	89.5	Confident	84.8	Confident	16 Å²	16	31 Å²	31	6%	0.063	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	131.2	-177.8	-70.9	-95.6	0	0	0	111.6	M314 L550 A551 V553 Q556 V572 E573 V574 A585	M314-Y558 HydrophobicContact CE-CD1 4.4Å; M314-Y558 HydrophobicContact CE-CG 4.25Å; L550-Y558 WeakPolarHBondContact CA-O 3.47Å; L550-Y558 WeakPolarHBondContact CD1-O 3.14Å; A551-Y558 PolarHBondContact N-O 3.21Å; A551-Y558 PolarHBondContact O-N 2.75Å; V553-Y558 HydrophobicContact CB-CD2 3.94Å; V553-Y558 HydrophobicContact CB-CE2 3.81Å; V553-Y558 HydrophobicContact CG2-CD2 4.02Å; V553-Y558 HydrophobicContact CG2-CE2 4.36Å; Q556-Y558 HydrophobicContact CB-CD2 4.32Å; Q556-Y558 HydrophobicContact CB-CE2 3.67Å; Q556-Y558 WeakPolarHBondContact O-CD2 3.46Å; Q556-Y558 PolarHBondContact OE1-OH 2.75Å; Y558-V572 HydrophobicContact CD1-CG1 3.8Å; Y558-E573 CarbonylContact C-O 3.58Å; Y558-E573 WeakPolarHBondContact CA-O 3.49Å; Y558-V574 HydrophobicContact CD1-CB 3.98Å; Y558-V574 HydrophobicContact CD1-CG2 4.1Å; Y558-V574 HydrophobicContact CD2-CG2 4.33Å; Y558-V574 HydrophobicContact CE1-CB 3.86Å; Y558-V574 HydrophobicContact CE1-CG2 3.84Å; Y558-V574 HydrophobicContact CE2-CG2 4.06Å; Y558-V574 HydrophobicContact CG-CG2 4.35Å; Y558-A585 HydrophobicContact CD1-CB 4.29Å; Y558-A585 HydrophobicContact CE1-CB 3.95Å
559	A	91.3	Very high	84.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	114.4	168.6	0	0	0	0	0	109.6	M541 I548 L550 V572 E573 W582	M541-A559 HydrophobicContact SD-CB 3.81Å; I548-A559 HydrophobicContact CG2-CB 4.02Å; L550-A559 HydrophobicContact CD1-CB 4.04Å; A559-V572 WeakPolarHBondContact O-CA 3.38Å; A559-E573 PolarHBondContact N-O 3.47Å; A559-E573 PolarHBondContact O-N 2.8Å; A559-W582 HydrophobicContact CB-CE3 4.36Å; A559-W582 HydrophobicContact CB-CH2 4.12Å; A559-W582 HydrophobicContact CB-CZ3 3.64Å
560	V	87.9	Confident	84.5	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.036	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.1	-169.3	-177.1	0	0	0	0	110.4	M314 A316 W346 G549 V572 M588 V597	M314-V560 HydrophobicContact CE-CG2 3.47Å; M314-V560 VanDerWaalsContact CE-CG2 3.47Å; M314-V560 HydrophobicContact SD-CG2 3.68Å; A316-V560 HydrophobicContact CB-CG1 4.35Å; W346-V560 HydrophobicContact CH2-CG1 3.76Å; W346-V560 HydrophobicContact CH2-CG2 4.41Å; W346-V560 HydrophobicContact CZ2-CG1 4.04Å; G549-V560 PolarHBondContact N-O 2.74Å; G549-V560 WeakPolarHBondContact O-CB 3.41Å; G549-V560 PolarHBondContact O-N 3.12Å; V560-V572 HydrophobicContact CG1-CG2 4.31Å; V560-V572 HydrophobicContact CG2-CG1 4.08Å; V560-M588 HydrophobicContact CG1-CE 3.65Å; V560-M588 HydrophobicContact CG1-CG 4.26Å; V560-M588 HydrophobicContact CG1-SD 3.42Å; V560-M588 WeakPolarHBondContact CG1-SD 3.39Å; V560-V597 HydrophobicContact CB-CG2 4.12Å; V560-V597 HydrophobicContact CG1-CG2 4.35Å; V560-V597 HydrophobicContact CG2-CG2 4.4Å
561	G	85.5	Confident	84.4	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.1	-147.2	172	0	0	0	0	0	114.2	R545 L569 T571	R545-G561 PolarHBondContact NH1-O 3.39Å; G561-L569 WeakPolarHBondContact CA-O 3.31Å; G561-T571 PolarHBondContact N-O 3.44Å; G561-T571 VanDerWaalsContact N-O 3.13Å
562	G	86.1	Confident	84.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.3	-166.1	-178.8	0	0	0	0	0	113.5	S546 L569 R592	S546-G562 CarbonylContact O-C 3.57Å; S546-G562 WeakPolarHBondContact O-CA 3.33Å; G562-L569 PolarHBondContact O-N 2.76Å; G562-R592 PolarHBondContact N-O 2.98Å
563	F	84.9	Confident	84.8	Confident	41 Å²	41	34.6 Å²	34.6	18%	0.18	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.1	178.8	176.1	-114.1	0	0	0	110.5	E521 R545 S546 G565 T566 F567 Y568 L593	E521-F563 HydrophobicContact CG-CD1 4.15Å; E521-F563 WeakPolarHBondContact CG-O 3.29Å; R545-F563 CarbonylContact C-O 3.6Å; R545-F563 WeakPolarHBondContact CA-O 3.35Å; S546-F563 PolarHBondContact N-O 3.06Å; S546-F563 PolarHBondContact O-N 2.82Å; S546-F563 PolarHBondContact OG-O 3.21Å; F563-G565 VanDerWaalsContact CZ-O 3.24Å; F563-G565 WeakPolarHBondContact CZ-O 3.34Å; F563-T566 VanDerWaalsContact CE2-C 3.49Å; F563-F567 VanDerWaalsContact CD2-C 3.49Å; F563-F567 VanDerWaalsContact CD2-O 3.31Å; F563-F567 WeakPolarHBondContact CD2-O 3.23Å; F563-Y568 HydrophobicContact CB-CD1 3.82Å; F563-Y568 HydrophobicContact CB-CE1 3.92Å; F563-Y568 AromaticContact CD2-CD1 3.58Å; F563-Y568 HydrophobicContact CD2-CD1 3.58Å; F563-Y568 AromaticContact CD2-CE1 3.54Å; F563-Y568 HydrophobicContact CD2-CE1 3.54Å; F563-Y568 HydrophobicContact CD2-CE2 4.48Å; F563-Y568 HydrophobicContact CD2-CG 4.1Å; F563-Y568 HydrophobicContact CE2-CD1 4.5Å; F563-Y568 HydrophobicContact CE2-CE1 4.23Å; F563-Y568 HydrophobicContact CG-CD1 4.06Å; F563-Y568 AromaticContact CG-CE1 3.89Å; F563-Y568 HydrophobicContact CG-CE1 3.89Å; F563-L593 HydrophobicContact CB-CD1 3.74Å
564	D	88.8	Confident	85.4	Confident	36 Å²	36	35.4 Å²	35.4	19%	0.193	19%	0.194	C	C	.	.			trans	-93.5	0.2	-175.1	66.5	14.6	0	0	0	114.5	R544 T566 F567 L569	R544-D564 HydrophobicContact CB-CB 4.37Å; R544-D564 VanDerWaalsContact O-CA 3.24Å; R544-D564 WeakPolarHBondContact O-CA 3.36Å; R544-D564 WeakPolarHBondContact O-CB 3.42Å; D564-T566 WeakPolarHBondContact OD1-CA 3.41Å; D564-T566 PolarHBondContact OD1-N 2.9Å; D564-F567 PolarHBondContact N-O 3.39Å; D564-F567 VanDerWaalsContact N-O 3.13Å; D564-F567 PolarHBondContact OD1-N 2.99Å; D564-L569 HydrophobicContact CB-CD1 4.29Å; D564-L569 HydrophobicContact CB-CD2 4.39Å; D564-L569 HydrophobicContact CB-CG 4.47Å
565	G	84.7	Confident	86.3	Confident	31 Å²	31	33.5 Å²	33.5	32%	0.32	18%	0.184	S	C	.	.	S	Bend	trans	105.7	-19.1	-172.9	0	0	0	0	0	113.4	E521 F563	E521-G565 WeakPolarHBondContact OE2-CA 3.38Å; F563-G565 VanDerWaalsContact CZ-O 3.24Å; F563-G565 WeakPolarHBondContact CZ-O 3.34Å
566	T	84	Confident	86.7	Confident	103 Å²	103	33 Å²	33	63%	0.632	17%	0.171	S	C	*	.	S	Bend	trans	-126.8	-47.7	179.4	-50	0	0	0	0	112	F563 D564	F563-T566 VanDerWaalsContact CE2-C 3.49Å; D564-T566 WeakPolarHBondContact OD1-CA 3.41Å; D564-T566 PolarHBondContact OD1-N 2.9Å
567	F	82.2	Confident	86.6	Confident	121 Å²	121	32.1 Å²	32.1	53%	0.531	17%	0.169	S	C	.	.	S	Bend	trans	-123.4	143.8	-175.2	-56.6	-68.4	0	0	0	112	F563 D564	F563-F567 VanDerWaalsContact CD2-C 3.49Å; F563-F567 VanDerWaalsContact CD2-O 3.31Å; F563-F567 WeakPolarHBondContact CD2-O 3.23Å; D564-F567 PolarHBondContact N-O 3.39Å; D564-F567 VanDerWaalsContact N-O 3.13Å; D564-F567 PolarHBondContact OD1-N 2.99Å
568	Y	80	Confident	86.1	Confident	47 Å²	47	41.1 Å²	41.1	18%	0.184	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133	164.4	-62	-69	0	0	0	109.9	F321 F563 R591 L593	F321-Y568 HydrophobicContact CD1-CD2 4.2Å; F321-Y568 AromaticContact CD1-CE2 3.79Å; F321-Y568 HydrophobicContact CD1-CE2 3.79Å; F321-Y568 HydrophobicContact CD2-CD2 4.02Å; F321-Y568 HydrophobicContact CD2-CE2 4.08Å; F321-Y568 HydrophobicContact CD2-CG 4.33Å; F321-Y568 HydrophobicContact CE1-CD2 4.2Å; F321-Y568 AromaticContact CE1-CE2 3.39Å; F321-Y568 HydrophobicContact CE1-CE2 3.39Å; F321-Y568 AromaticContact CE1-CZ 3.7Å; F321-Y568 HydrophobicContact CE2-CD1 4.33Å; F321-Y568 HydrophobicContact CE2-CD2 4.14Å; F321-Y568 HydrophobicContact CE2-CE1 4.04Å; F321-Y568 AromaticContact CE2-CE2 3.83Å; F321-Y568 HydrophobicContact CE2-CE2 3.83Å; F321-Y568 HydrophobicContact CE2-CG 4.37Å; F321-Y568 AromaticContact CE2-CZ 3.76Å; F321-Y568 HydrophobicContact CG-CD2 4.06Å; F321-Y568 HydrophobicContact CG-CE2 4.07Å; F321-Y568 HydrophobicContact CZ-CD2 4.21Å; F321-Y568 AromaticContact CZ-CE1 4Å; F321-Y568 HydrophobicContact CZ-CE1 4Å; F321-Y568 AromaticContact CZ-CE2 3.45Å; F321-Y568 HydrophobicContact CZ-CE2 3.45Å; F321-Y568 VanDerWaalsContact CZ-CE2 3.45Å; F321-Y568 AromaticContact CZ-CZ 3.31Å; F321-Y568 VanDerWaalsContact CZ-OH 3.31Å; F321-Y568 WeakPolarHBondContact CZ-OH 3.39Å; F563-Y568 HydrophobicContact CB-CD1 3.82Å; F563-Y568 HydrophobicContact CB-CE1 3.92Å; F563-Y568 AromaticContact CD2-CD1 3.58Å; F563-Y568 HydrophobicContact CD2-CD1 3.58Å; F563-Y568 AromaticContact CD2-CE1 3.54Å; F563-Y568 HydrophobicContact CD2-CE1 3.54Å; F563-Y568 HydrophobicContact CD2-CE2 4.48Å; F563-Y568 HydrophobicContact CD2-CG 4.1Å; F563-Y568 HydrophobicContact CE2-CD1 4.5Å; F563-Y568 HydrophobicContact CE2-CE1 4.23Å; F563-Y568 HydrophobicContact CG-CD1 4.06Å; F563-Y568 AromaticContact CG-CE1 3.89Å; F563-Y568 HydrophobicContact CG-CE1 3.89Å; Y568-R591 WeakPolarHBondContact O-CD 3.45Å; Y568-R591 VanDerWaalsContact O-CG 3.3Å; Y568-R591 WeakPolarHBondContact O-CG 3.45Å; Y568-R591 PolarHBondContact O-NE 2.81Å; Y568-L593 HydrophobicContact CD1-CB 3.68Å; Y568-L593 HydrophobicContact CD1-CD1 4.46Å; Y568-L593 HydrophobicContact CD1-CD2 4.24Å; Y568-L593 HydrophobicContact CD1-CG 4.3Å; Y568-L593 HydrophobicContact CE1-CB 3.8Å; Y568-L593 HydrophobicContact CE1-CD1 4.33Å; Y568-L593 HydrophobicContact CE1-CD2 3.47Å; Y568-L593 VanDerWaalsContact CE1-CD2 3.47Å; Y568-L593 HydrophobicContact CE1-CG 4.01Å
569	L	83.6	Confident	85.9	Confident	17 Å²	17	42.4 Å²	42.4	9%	0.089	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	140.8	-174.2	-57.5	177.4	0	0	0	110.5	N543 R545 G561 G562 D564 R592	N543-L569 HydrophobicContact CB-CD1 4.41Å; R545-L569 HydrophobicContact CB-CD1 4.42Å; R545-L569 HydrophobicContact CG-CD1 3.68Å; G561-L569 WeakPolarHBondContact CA-O 3.31Å; G562-L569 PolarHBondContact O-N 2.76Å; D564-L569 HydrophobicContact CB-CD1 4.29Å; D564-L569 HydrophobicContact CB-CD2 4.39Å; D564-L569 HydrophobicContact CB-CG 4.47Å; L569-R592 PolarHBondContact O-N 2.7Å; L569-R592 VanDerWaalsContact O-N 3.13Å
570	K	83.6	Confident	85.7	Confident	89 Å²	89	46.2 Å²	46.2	39%	0.387	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-9	163.2	65.1	179.2	-169.4	164.6	0	112.4	S587 M588 Y590 R591	K570-S587 CarbonylContact O-C 3.56Å; K570-S587 VanDerWaalsContact O-CA 3.28Å; K570-S587 WeakPolarHBondContact O-CA 3.31Å; K570-M588 HydrophobicContact CB-CB 4.37Å; K570-M588 WeakPolarHBondContact CD-O 3.4Å; K570-M588 PolarHBondContact O-N 2.85Å; K570-Y590 WeakPolarHBondContact CB-O 3.42Å; K570-R591 HydrophobicContact CB-CG 4Å; K570-R591 HydrophobicContact CG-CG 4.35Å
571	T	87.9	Confident	85.9	Confident	32 Å²	32	51.2 Å²	51.2	20%	0.196	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	151.1	-175.4	55.9	0	0	0	0	111	R545 G561	R545-T571 PolarHBondContact NH1-O 2.88Å; R545-T571 PolarHBondContact NH2-OG1 3.48Å; G561-T571 PolarHBondContact N-O 3.44Å; G561-T571 VanDerWaalsContact N-O 3.13Å
572	V	89	Confident	86.3	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.5	177.8	-174.6	0	0	0	0	108.1	W346 Y558 A559 V560 A585 G586	W346-V572 HydrophobicContact CZ2-CG2 3.67Å; Y558-V572 HydrophobicContact CD1-CG1 3.8Å; A559-V572 WeakPolarHBondContact O-CA 3.38Å; V560-V572 HydrophobicContact CG1-CG2 4.31Å; V560-V572 HydrophobicContact CG2-CG1 4.08Å; V572-A585 HydrophobicContact CB-CB 4.5Å; V572-A585 HydrophobicContact CG1-CB 4.21Å; V572-A585 PolarHBondContact O-N 2.92Å; V572-G586 PolarHBondContact N-O 3.29Å
573	E	91.7	Very high	86.6	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.009	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.7	173.2	-70.9	177.5	-119.7	0	0	109.5	N542 N543 R545 Y558 A559 W582 R583	N542-E573 WeakPolarHBondContact CB-OE2 3.46Å; N542-E573 PolarHBondContact N-OE2 3.24Å; N542-E573 PolarHBondContact ND2-OE2 3.44Å; N543-E573 PolarHBondContact ND2-OE1 3.15Å; R545-E573 IonicContact CZ-OE1 2.75Å; R545-E573 IonicContact NE-OE1 3.17Å; R545-E573 PolarHBondContact NE-OE1 3.22Å; R545-E573 VanDerWaalsContact NE-OE1 3.07Å; R545-E573 IonicContact NH2-OE1 2.8Å; R545-E573 PolarHBondContact NH2-OE1 2.95Å; Y558-E573 CarbonylContact C-O 3.58Å; Y558-E573 WeakPolarHBondContact CA-O 3.49Å; A559-E573 PolarHBondContact N-O 3.47Å; A559-E573 PolarHBondContact O-N 2.8Å; E573-W582 HydrophobicContact CB-CB 4.41Å; E573-W582 HydrophobicContact CB-CE3 3.84Å; E573-R583 CarbonylContact C-O 3.5Å; E573-R583 VanDerWaalsContact CA-O 3.26Å; E573-R583 WeakPolarHBondContact CA-O 3.46Å
574	V	91.1	Very high	86.8	Confident	18 Å²	18	61.5 Å²	61.5	11%	0.109	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.8	173.4	68.4	0	0	0	0	109.3	Q556 L557 Y558 W582 R583 A585	Q556-V574 HydrophobicContact CB-CG2 3.8Å; Q556-V574 HydrophobicContact CG-CG2 4.49Å; L557-V574 CarbonylContact O-C 3.52Å; L557-V574 WeakPolarHBondContact O-CA 3.1Å; Y558-V574 HydrophobicContact CD1-CB 3.98Å; Y558-V574 HydrophobicContact CD1-CG2 4.1Å; Y558-V574 HydrophobicContact CD2-CG2 4.33Å; Y558-V574 HydrophobicContact CE1-CB 3.86Å; Y558-V574 HydrophobicContact CE1-CG2 3.84Å; Y558-V574 HydrophobicContact CE2-CG2 4.06Å; Y558-V574 HydrophobicContact CG-CG2 4.35Å; V574-W582 CarbonylContact O-C 3.57Å; V574-W582 WeakPolarHBondContact O-CA 3.47Å; V574-R583 HydrophobicContact CG1-CB 4.14Å; V574-R583 PolarHBondContact N-O 2.99Å; V574-R583 PolarHBondContact O-N 3.44Å; V574-A585 HydrophobicContact CB-CB 3.85Å; V574-A585 HydrophobicContact CG1-CB 3.81Å
575	Y	91.6	Very high	86.5	Confident	8 Å²	8	60.4 Å²	60.4	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	119.4	175.3	176.7	-105.3	0	0	0	110	Y506 V539 L557 N577 N580 W582	Y506-Y575 HydrophobicContact CD1-CD1 4.44Å; Y506-Y575 AromaticContact CE1-CD1 3.84Å; Y506-Y575 HydrophobicContact CE1-CD1 3.84Å; Y506-Y575 AromaticContact CE1-CE1 3.93Å; Y506-Y575 HydrophobicContact CE1-CE1 3.93Å; V539-Y575 HydrophobicContact CG1-CD2 3.99Å; V539-Y575 HydrophobicContact CG1-CE2 3.54Å; L557-Y575 PolarHBondContact O-N 2.82Å; Y575-N577 HydrophobicContact CE1-CB 4.02Å; Y575-N580 PolarHBondContact OH-OD1 2.94Å; Y575-W582 HydrophobicContact CD2-CD2 4.27Å; Y575-W582 AromaticContact CD2-CE2 3.93Å; Y575-W582 HydrophobicContact CD2-CG 4.48Å; Y575-W582 HydrophobicContact CD2-CZ2 4.34Å; Y575-W582 AromaticContact CD2-NE1 3.9Å; Y575-W582 HydrophobicContact CG-CZ2 4.42Å
576	D	84.4	Confident	86.4	Confident	33 Å²	33	59.7 Å²	59.7	18%	0.176	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.2	171.7	176.9	7.2	0	0	0	109.4	E578 S579 N580 Q581 R583	D576-E578 VanDerWaalsContact C-N 3.34Å; D576-E578 PolarHBondContact OD1-N 3.08Å; D576-S579 WeakPolarHBondContact OD2-CB 3.36Å; D576-S579 PolarHBondContact OD2-OG 2.72Å; D576-N580 VanDerWaalsContact O-CA 3.26Å; D576-N580 WeakPolarHBondContact O-CA 3.43Å; D576-N580 PolarHBondContact O-N 3.4Å; D576-Q581 PolarHBondContact N-O 2.88Å; D576-Q581 PolarHBondContact O-N 3.44Å; D576-R583 IonicContact OD2-CZ 2.71Å; D576-R583 IonicContact OD2-NE 2.63Å; D576-R583 PolarHBondContact OD2-NE 2.82Å; D576-R583 IonicContact OD2-NH1 2.97Å; D576-R583 IonicContact OD2-NH2 2.64Å; D576-R583 PolarHBondContact OD2-NH2 2.82Å
577	N	80.5	Confident	86.3	Confident	71 Å²	71	56.8 Å²	56.8	38%	0.38	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-26	-178.8	-173.3	75.8	0	0	0	113.2	Y506 Y575	Y506-N577 HydrophobicContact CE1-CB 4.35Å; Y575-N577 HydrophobicContact CE1-CB 4.02Å
578	E	79.4	Confident	86.1	Confident	189 Å²	189	51.2 Å²	51.2	88%	0.883	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-45.1	179.6	-65.6	-174.3	173.6	0	0	111.1	D576	D576-E578 VanDerWaalsContact C-N 3.34Å; D576-E578 PolarHBondContact OD1-N 3.08Å
579	S	85.8	Confident	85.6	Confident	44 Å²	44	52.8 Å²	52.8	31%	0.308	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-7.8	176.9	64.1	0	0	0	0	114.3	D576 Q581 R583	D576-S579 WeakPolarHBondContact OD2-CB 3.36Å; D576-S579 PolarHBondContact OD2-OG 2.72Å; S579-Q581 VanDerWaalsContact C-N 3.32Å; S579-Q581 PolarHBondContact O-N 3.12Å; S579-R583 PolarHBondContact OG-NH2 3.41Å; S579-R583 VanDerWaalsContact OG-NH2 3.14Å
580	N	86.9	Confident	84.9	Confident	79 Å²	79	56.8 Å²	56.8	42%	0.422	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	51.3	-174.1	-174.6	31.5	0	0	0	111.6	V539 Y575 D576	V539-N580 WeakPolarHBondContact CB-O 3.33Å; V539-N580 WeakPolarHBondContact CG1-O 3.36Å; Y575-N580 PolarHBondContact OH-OD1 2.94Å; D576-N580 VanDerWaalsContact O-CA 3.26Å; D576-N580 WeakPolarHBondContact O-CA 3.43Å; D576-N580 PolarHBondContact O-N 3.4Å
581	Q	92.3	Very high	84	Confident	112 Å²	112	58.2 Å²	58.2	52%	0.523	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154	-178.4	-71.9	-175.5	1	0	0	111.7	D576 S579	D576-Q581 PolarHBondContact N-O 2.88Å; D576-Q581 PolarHBondContact O-N 3.44Å; S579-Q581 VanDerWaalsContact C-N 3.32Å; S579-Q581 PolarHBondContact O-N 3.12Å
582	W	93.8	Very high	83.1	Confident	9 Å²	9	57.1 Å²	57.1	3%	0.034	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130	168.3	-67	88.3	0	0	0	109.8	V513 V539 A540 M541 N542 L550 L557 A559 E573 V574 Y575	V513-W582 HydrophobicContact CG1-CH2 4.13Å; V513-W582 HydrophobicContact CG1-CZ2 4.02Å; V513-W582 HydrophobicContact CG2-CH2 4.36Å; V513-W582 HydrophobicContact CG2-CZ2 4.25Å; V539-W582 PolarHBondContact O-NE1 3.01Å; A540-W582 VanDerWaalsContact O-CD1 3.25Å; M541-W582 HydrophobicContact CB-CG 4.39Å; M541-W582 HydrophobicContact CG-CD2 3.75Å; M541-W582 HydrophobicContact CG-CE3 4.24Å; M541-W582 HydrophobicContact CG-CG 4.06Å; M541-W582 HydrophobicContact CG-CH2 4.45Å; M541-W582 HydrophobicContact CG-CZ2 3.99Å; N542-W582 PolarHBondContact ND2-O 3.04Å; L550-W582 HydrophobicContact CD1-CH2 4.21Å; L557-W582 HydrophobicContact CD2-CH2 3.96Å; L557-W582 HydrophobicContact CD2-CZ2 4.46Å; L557-W582 HydrophobicContact CG-CH2 4.19Å; A559-W582 HydrophobicContact CB-CE3 4.36Å; A559-W582 HydrophobicContact CB-CH2 4.12Å; A559-W582 HydrophobicContact CB-CZ3 3.64Å; E573-W582 HydrophobicContact CB-CB 4.41Å; E573-W582 HydrophobicContact CB-CE3 3.84Å; V574-W582 CarbonylContact O-C 3.57Å; V574-W582 WeakPolarHBondContact O-CA 3.47Å; Y575-W582 HydrophobicContact CD2-CD2 4.27Å; Y575-W582 AromaticContact CD2-CE2 3.93Å; Y575-W582 HydrophobicContact CD2-CG 4.48Å; Y575-W582 HydrophobicContact CD2-CZ2 4.34Å; Y575-W582 AromaticContact CD2-NE1 3.9Å; Y575-W582 HydrophobicContact CG-CZ2 4.42Å
583	R	91.8	Very high	81.7	Confident	130 Å²	130	58.6 Å²	58.6	49%	0.491	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	145.1	177.4	-62	-177.1	-177.7	-173.2	2.7	109.9	E573 V574 D576 S579 A585	E573-R583 CarbonylContact C-O 3.5Å; E573-R583 VanDerWaalsContact CA-O 3.26Å; E573-R583 WeakPolarHBondContact CA-O 3.46Å; V574-R583 HydrophobicContact CG1-CB 4.14Å; V574-R583 PolarHBondContact N-O 2.99Å; V574-R583 PolarHBondContact O-N 3.44Å; D576-R583 IonicContact OD2-CZ 2.71Å; D576-R583 IonicContact OD2-NE 2.63Å; D576-R583 PolarHBondContact OD2-NE 2.82Å; D576-R583 IonicContact OD2-NH1 2.97Å; D576-R583 IonicContact OD2-NH2 2.64Å; D576-R583 PolarHBondContact OD2-NH2 2.82Å; S579-R583 PolarHBondContact OG-NH2 3.41Å; S579-R583 VanDerWaalsContact OG-NH2 3.14Å; R583-A585 PolarHBondContact O-N 2.82Å
584	H	89.1	Confident	80	Confident	120 Å²	120	59.2 Å²	59.2	56%	0.556	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	119.8	173.1	-176.5	-89.9	0	0	0	109.6	G586	H584-G586 VanDerWaalsContact CE1-CA 3.49Å; H584-G586 WeakPolarHBondContact CE1-CA 3.22Å; H584-G586 PolarHBondContact CE1-N 3.41Å; H584-G586 PolarHBondContact CE1-O 2.83Å; H584-G586 VanDerWaalsContact CE1-O 3.27Å; H584-G586 PolarHBondContact ND1-N 2.87Å; H584-G586 PolarHBondContact NE2-O 2.96Å; H584-G586 VanDerWaalsContact NE2-O 3.16Å
585	A	83.7	Confident	78.2	Confident	13 Å²	13	60.2 Å²	60.2	11%	0.107	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	9	-176.3	0	0	0	0	0	112.8	N344 Y558 V572 V574 R583	N344-A585 VanDerWaalsContact CG-O 3.26Å; N344-A585 PolarHBondContact ND2-O 3.29Å; N344-A585 PolarHBondContact OD1-O 2.79Å; Y558-A585 HydrophobicContact CD1-CB 4.29Å; Y558-A585 HydrophobicContact CE1-CB 3.95Å; V572-A585 HydrophobicContact CB-CB 4.5Å; V572-A585 HydrophobicContact CG1-CB 4.21Å; V572-A585 PolarHBondContact O-N 2.92Å; V574-A585 HydrophobicContact CB-CB 3.85Å; V574-A585 HydrophobicContact CG1-CB 3.81Å; R583-A585 PolarHBondContact O-N 2.82Å
586	G	81.8	Confident	76.7	Confident	15 Å²	15	59.9 Å²	59.9	16%	0.155	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	122.1	-166.1	179.3	0	0	0	0	0	112.7	V572 H584	V572-G586 PolarHBondContact N-O 3.29Å; H584-G586 VanDerWaalsContact CE1-CA 3.49Å; H584-G586 WeakPolarHBondContact CE1-CA 3.22Å; H584-G586 PolarHBondContact CE1-N 3.41Å; H584-G586 PolarHBondContact CE1-O 2.83Å; H584-G586 VanDerWaalsContact CE1-O 3.27Å; H584-G586 PolarHBondContact ND1-N 2.87Å; H584-G586 PolarHBondContact NE2-O 2.96Å; H584-G586 VanDerWaalsContact NE2-O 3.16Å
587	S	81.8	Confident	75.3	Confident	43 Å²	43	59.3 Å²	59.3	30%	0.301	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.8	-178.6	-72.7	0	0	0	0	110.9	W346 K570	W346-S587 VanDerWaalsContact CD1-C 3.49Å; K570-S587 CarbonylContact O-C 3.56Å; K570-S587 VanDerWaalsContact O-CA 3.28Å; K570-S587 WeakPolarHBondContact O-CA 3.31Å
588	M	78.9	Confident	74.1	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.015	29%	0.287	C	S	.	.			trans	-57.2	156.6	163.7	-66.5	177.7	-67.4	0	0	109.8	A316 W346 V560 K570 Y590 R592	A316-M588 HydrophobicContact CB-SD 3.97Å; W346-M588 HydrophobicContact CD2-CB 4.25Å; W346-M588 HydrophobicContact CD2-CG 3.55Å; W346-M588 VanDerWaalsContact CE2-CG 3.49Å; W346-M588 HydrophobicContact CE3-CG 3.76Å; W346-M588 HydrophobicContact CG-CB 4.4Å; W346-M588 HydrophobicContact CG-CG 4.18Å; W346-M588 HydrophobicContact CH2-CG 3.79Å; W346-M588 HydrophobicContact CH2-SD 4.09Å; W346-M588 HydrophobicContact CZ2-CG 3.63Å; W346-M588 HydrophobicContact CZ2-SD 4.41Å; W346-M588 HydrophobicContact CZ3-CG 3.87Å; W346-M588 HydrophobicContact CZ3-SD 4.21Å; V560-M588 HydrophobicContact CG1-CE 3.65Å; V560-M588 HydrophobicContact CG1-CG 4.26Å; V560-M588 HydrophobicContact CG1-SD 3.42Å; V560-M588 WeakPolarHBondContact CG1-SD 3.39Å; K570-M588 HydrophobicContact CB-CB 4.37Å; K570-M588 WeakPolarHBondContact CD-O 3.4Å; K570-M588 PolarHBondContact O-N 2.85Å; M588-Y590 WeakPolarHBondContact CB-O 3.48Å; M588-Y590 PolarHBondContact O-N 2.69Å; M588-R592 HydrophobicContact CE-CB 3.98Å; M588-R592 HydrophobicContact CE-CG 4.29Å; M588-R592 HydrophobicContact SD-CB 4.4Å; M588-R592 HydrophobicContact SD-CG 4.26Å
589	N	70	Confident	73	Confident	81 Å²	81	48.8 Å²	48.8	43%	0.433	26%	0.255	S	S	.	.	S	Bend	trans	-63.2	-32.2	175	-62.3	-63.9	0	0	0	110.6	E337 W346	E337-N589 WeakPolarHBondContact OE2-CB 3.29Å; E337-N589 PolarHBondContact OE2-N 3.2Å; E337-N589 PolarHBondContact OE2-ND2 3.07Å; W346-N589 PolarHBondContact O-ND2 3.13Å
590	Y	68.7	Low	71.4	Confident	100 Å²	100	46.7 Å²	46.7	39%	0.392	24%	0.24	S	C	.	.	S	Bend	trans	-126.3	151.2	-173.6	-59.4	-63.9	0	0	0	112.5	F320 K570 M588	F320-Y590 AromaticContact CD2-CD1 3.97Å; F320-Y590 HydrophobicContact CD2-CD1 3.97Å; F320-Y590 AromaticContact CD2-CG 3.94Å; F320-Y590 HydrophobicContact CD2-CG 3.94Å; F320-Y590 AromaticContact CE2-CD1 3.22Å; F320-Y590 HydrophobicContact CE2-CD1 3.22Å; F320-Y590 HydrophobicContact CE2-CE1 4.06Å; F320-Y590 AromaticContact CE2-CG 3.67Å; F320-Y590 HydrophobicContact CE2-CG 3.67Å; F320-Y590 AromaticContact CZ-CD1 3.68Å; F320-Y590 HydrophobicContact CZ-CD1 3.68Å; F320-Y590 HydrophobicContact CZ-CE1 4.06Å; F320-Y590 HydrophobicContact CZ-CG 4.4Å; K570-Y590 WeakPolarHBondContact CB-O 3.42Å; M588-Y590 WeakPolarHBondContact CB-O 3.48Å; M588-Y590 PolarHBondContact O-N 2.69Å
591	R	64.4	Low	69.7	Low	119 Å²	119	50.2 Å²	50.2	45%	0.449	25%	0.247	S	C	.	.			trans	-73.3	131.8	175	-66.4	171.3	175.3	-178.9	0.7	109.2	Y568 K570	Y568-R591 WeakPolarHBondContact O-CD 3.45Å; Y568-R591 VanDerWaalsContact O-CG 3.3Å; Y568-R591 WeakPolarHBondContact O-CG 3.45Å; Y568-R591 PolarHBondContact O-NE 2.81Å; K570-R591 HydrophobicContact CB-CG 4Å; K570-R591 HydrophobicContact CG-CG 4.35Å
592	R	68.7	Low	67.5	Low	10 Å²	10	45.4 Å²	45.4	4%	0.038	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	131.4	-177.3	-61.2	-177.7	179.2	-99.8	3.3	113.8	G318 M319 S335 E337 G562 L569 M588	G318-R592 PolarHBondContact O-NH1 2.94Å; G318-R592 VanDerWaalsContact O-NH1 3.14Å; M319-R592 WeakPolarHBondContact O-CA 3.44Å; S335-R592 PolarHBondContact O-NH1 3.37Å; S335-R592 PolarHBondContact OG-NH2 2.86Å; E337-R592 IonicContact OE1-CZ 2.6Å; E337-R592 VanDerWaalsContact OE1-CZ 3.24Å; E337-R592 IonicContact OE1-NE 2.88Å; E337-R592 PolarHBondContact OE1-NE 3.33Å; E337-R592 IonicContact OE1-NH2 3.06Å; E337-R592 PolarHBondContact OE1-NH2 2.97Å; G562-R592 PolarHBondContact N-O 2.98Å; L569-R592 PolarHBondContact O-N 2.7Å; L569-R592 VanDerWaalsContact O-N 3.13Å; M588-R592 HydrophobicContact CE-CB 3.98Å; M588-R592 HydrophobicContact CE-CG 4.29Å; M588-R592 HydrophobicContact SD-CB 4.4Å; M588-R592 HydrophobicContact SD-CG 4.26Å
593	L	59.6	Low	65	Low	31 Å²	31	47 Å²	47	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.1	169.2	177.4	69.6	0	0	0	109.5	M319 S546 F563 Y568	M319-L593 HydrophobicContact CB-CB 4.44Å; M319-L593 WeakPolarHBondContact CB-O 3.4Å; M319-L593 HydrophobicContact CE-CB 3.81Å; M319-L593 HydrophobicContact CE-CD2 3.34Å; M319-L593 HydrophobicContact CE-CG 3.56Å; M319-L593 WeakPolarHBondContact CE-O 3.2Å; M319-L593 PolarHBondContact N-O 3.03Å; S546-L593 WeakPolarHBondContact O-CD1 3.22Å; F563-L593 HydrophobicContact CB-CD1 3.74Å; Y568-L593 HydrophobicContact CD1-CB 3.68Å; Y568-L593 HydrophobicContact CD1-CD1 4.46Å; Y568-L593 HydrophobicContact CD1-CD2 4.24Å; Y568-L593 HydrophobicContact CD1-CG 4.3Å; Y568-L593 HydrophobicContact CE1-CB 3.8Å; Y568-L593 HydrophobicContact CE1-CD1 4.33Å; Y568-L593 HydrophobicContact CE1-CD2 3.47Å; Y568-L593 VanDerWaalsContact CE1-CD2 3.47Å; Y568-L593 HydrophobicContact CE1-CG 4.01Å
594	G	56	Low	62.7	Low	16 Å²	16	43.6 Å²	43.6	17%	0.165	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.5	64.1	172.3	0	0	0	0	0	112.6	G547 G596	G547-G594 PolarHBondContact O-N 2.91Å; G547-G594 VanDerWaalsContact O-N 3.1Å; G594-G596 PolarHBondContact O-N 2.79Å
595	G	52.2	Low	60.1	Low	39 Å²	39	41.2 Å²	41.2	40%	0.402	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)		54.8	-14.5	129.9	0	0	0	0	0	122.3	G547 I548 V597	G547-G595 PolarHBondContact O-N 3Å; I548-G595 WeakPolarHBondContact O-CA 3.33Å; G595-V597 PolarHBondContact O-N 3.05Å
596	G	61.4	Low	57.9	Low	1 Å²	1	44.5 Å²	44.5	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	67.2	-173.3	0	0	0	0	0	112.1	A317 V361 G594	A317-G596 WeakPolarHBondContact CA-O 3.22Å; A317-G596 PolarHBondContact N-O 2.85Å; A317-G596 CarbonylContact O-C 3.58Å; A317-G596 WeakPolarHBondContact O-CA 3.47Å; A317-G596 PolarHBondContact O-N 2.95Å; V361-G596 VanDerWaalsContact CG2-CA 3.42Å; G594-G596 PolarHBondContact O-N 2.79Å
597	V	54.8	Low	55.7	Low	20 Å²	20	47.6 Å²	47.6	12%	0.121	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.7	172.1	178.3	0	0	0	0	109.2	M314 Y315 A316 G549 A551 V560 G595	M314-V597 HydrophobicContact CG-CG1 3.36Å; M314-V597 HydrophobicContact SD-CG1 3.6Å; Y315-V597 CarbonylContact O-C 3.54Å; Y315-V597 VanDerWaalsContact O-CA 3.25Å; Y315-V597 WeakPolarHBondContact O-CA 3.42Å; A316-V597 HydrophobicContact CB-CG2 4.06Å; G549-V597 VanDerWaalsContact CA-CG2 3.49Å; A551-V597 HydrophobicContact CB-CB 4.47Å; A551-V597 HydrophobicContact CB-CG1 3.56Å; V560-V597 HydrophobicContact CB-CG2 4.12Å; V560-V597 HydrophobicContact CG1-CG2 4.35Å; V560-V597 HydrophobicContact CG2-CG2 4.4Å; G595-V597 PolarHBondContact O-N 3.05Å
598	G	54.9	Low	53.4	Low	6 Å²	6	50.3 Å²	50.3	6%	0.062	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	150.2	167	0	0	0	0	0	110	Y315	Y315-G598 WeakPolarHBondContact CA-O 3.27Å; Y315-G598 WeakPolarHBondContact CB-O 3.44Å; Y315-G598 PolarHBondContact N-O 3.26Å; Y315-G598 PolarHBondContact O-N 2.99Å
599	V	55.9	Low	51.1	Low	34 Å²	34	57.9 Å²	57.9	21%	0.206	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	109.5	174.3	-177.4	0	0	0	0	106.9	E312 M314 V363 A551 V553	E312-V599 HydrophobicContact CB-CG1 3.88Å; M314-V599 HydrophobicContact CG-CG2 4.35Å; V363-V599 WeakPolarHBondContact CG2-O 3.19Å; A551-V599 HydrophobicContact CB-CG2 3.5Å; V553-V599 HydrophobicContact CG2-CG1 4.09Å; V553-V599 HydrophobicContact CG2-CG2 3.71Å
600	V	52	Low	50.2	Low	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	135.1	174.6	-171.6	0	0	0	0	107.4	V313 Y315 V363 D366 L368 P388 L602	V313-V600 PolarHBondContact N-O 2.81Å; V313-V600 PolarHBondContact O-N 3.3Å; Y315-V600 HydrophobicContact CD2-CB 3.85Å; Y315-V600 HydrophobicContact CD2-CG2 3.63Å; Y315-V600 HydrophobicContact CE2-CB 3.8Å; Y315-V600 HydrophobicContact CE2-CG2 3.93Å; Y315-V600 HydrophobicContact CG-CG2 4.45Å; V363-V600 HydrophobicContact CB-CG2 4.49Å; V363-V600 HydrophobicContact CG1-CB 4.49Å; V363-V600 HydrophobicContact CG1-CG1 4.36Å; V363-V600 HydrophobicContact CG1-CG2 4.08Å; V363-V600 HydrophobicContact CG2-CB 4.45Å; V363-V600 HydrophobicContact CG2-CG2 3.53Å; D366-V600 HydrophobicContact CB-CG1 4.34Å; D366-V600 VanDerWaalsContact O-CG1 3.24Å; D366-V600 WeakPolarHBondContact O-CG1 3.28Å; L368-V600 HydrophobicContact CB-CG2 4.25Å; L368-V600 HydrophobicContact CD1-CG2 4.41Å; P388-V600 HydrophobicContact CG-CB 4.49Å; P388-V600 HydrophobicContact CG-CG1 4.07Å; P388-V600 HydrophobicContact CG-CG2 4.37Å; V600-L602 HydrophobicContact CB-CG 4.21Å; V600-L602 HydrophobicContact CG1-CD2 3.73Å; V600-L602 HydrophobicContact CG1-CG 3.86Å; V600-L602 PolarHBondContact O-N 2.78Å
601	R	51.4	Low	49.2	Very low	152 Å²	152	54.5 Å²	54.5	57%	0.574	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	110.7	170.8	-61.5	-167.7	168.4	146	-1.6	107.1	G311 E312	G311-R601 CarbonylContact O-C 3.51Å; G311-R601 WeakPolarHBondContact O-CA 3.42Å; E312-R601 HydrophobicContact CG-CG 4.18Å; E312-R601 IonicContact OE1-CZ 2.99Å; E312-R601 VanDerWaalsContact OE1-CZ 3.29Å; E312-R601 IonicContact OE1-NE 3.51Å; E312-R601 PolarHBondContact OE1-NE 2.76Å; E312-R601 IonicContact OE1-NH2 3.54Å; E312-R601 PolarHBondContact OE1-NH2 3.4Å
602	L	46.9	Very low	48.3	Very low	12 Å²	12	50.9 Å²	50.9	6%	0.063	29%	0.294	C	S	.	.			trans	-117.5	132.1	178.3	-66.2	175.6	0	0	0	109.4	G311 V313 Y315 P388 V600 N604	G311-L602 PolarHBondContact O-N 2.6Å; G311-L602 VanDerWaalsContact O-O 3.1Å; V313-L602 HydrophobicContact CB-CB 4.43Å; V313-L602 HydrophobicContact CB-CD1 4.15Å; V313-L602 HydrophobicContact CG1-CD1 4.35Å; V313-L602 HydrophobicContact CG2-CB 3.96Å; V313-L602 HydrophobicContact CG2-CD1 4.32Å; Y315-L602 HydrophobicContact CE2-CD1 3.52Å; Y315-L602 HydrophobicContact CE2-CG 4.46Å; Y315-L602 WeakPolarHBondContact OH-CD1 3.43Å; P388-L602 HydrophobicContact CB-CD1 3.42Å; P388-L602 VanDerWaalsContact CB-CD1 3.42Å; P388-L602 HydrophobicContact CB-CD2 3.47Å; P388-L602 VanDerWaalsContact CB-CD2 3.47Å; P388-L602 HydrophobicContact CB-CG 4.07Å; P388-L602 HydrophobicContact CG-CD1 3.98Å; P388-L602 HydrophobicContact CG-CD2 3.78Å; P388-L602 HydrophobicContact CG-CG 4.39Å; V600-L602 HydrophobicContact CB-CG 4.21Å; V600-L602 HydrophobicContact CG1-CD2 3.73Å; V600-L602 HydrophobicContact CG1-CG 3.86Å; V600-L602 PolarHBondContact O-N 2.78Å; L602-N604 PolarHBondContact O-N 2.65Å
603	A	42.1	Very low	47.1	Very low	41 Å²	41	53.3 Å²	53.3	34%	0.339	31%	0.309	S	S	.	.			trans	-71.2	119.8	161.3	0	0	0	0	0	107.7	H304 E605	H304-A603 HydrophobicContact CB-CB 4.27Å; H304-A603 WeakPolarHBondContact ND1-CB 3.13Å; A603-E605 PolarHBondContact O-N 2.9Å
604	N	41.6	Very low	46.4	Very low	59 Å²	59	54.7 Å²	54.7	32%	0.316	32%	0.318	S	S	.	.			trans	0.8	105.9	165.8	-66.1	-26.3	0	0	0	115.5	V219 L602	V219-N604 PolarHBondContact O-ND2 3.4Å; L602-N604 PolarHBondContact O-N 2.65Å
605	E	34.6	Very low	45.7	Very low	70 Å²	70	57.3 Å²	57.3	33%	0.327	33%	0.329	S	S	.	.			trans	-105.1	137.4	160.2	-76.7	-171.6	165.6	0	0	110.3	R338 A603	R338-E605 IonicContact NH1-OE2 2.69Å; R338-E605 PolarHBondContact NH1-OE2 3.07Å; A603-E605 PolarHBondContact O-N 2.9Å
606	D	38	Very low	45.3	Very low	82 Å²	82	58.6 Å²	58.6	44%	0.439	32%	0.323	S	S	.	.			trans	-59.6	141.5	-172.2	-161.5	30.6	0	0	0	113.1	S608 L609	D606-S608 PolarHBondContact O-N 3.22Å; D606-S608 VanDerWaalsContact O-N 3.1Å; D606-S608 PolarHBondContact OD2-OG 2.89Å; D606-L609 PolarHBondContact O-N 3.2Å
607	P	36.1	Very low	44	Very low	81 Å²	81	63 Å²	63	53%	0.526	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-3.8	175.6	-19.7	31.5	0	0	0	115.6	K347 L609	K347-P607 VanDerWaalsContact NZ-CA 3.35Å; K347-P607 PolarHBondContact NZ-O 3.37Å; P607-L609 VanDerWaalsContact C-N 3.3Å
608	S	33.9	Very low	43.1	Very low	99 Å²	99	66.6 Å²	66.6	69%	0.692	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	1.5	176.6	76.2	0	0	0	0	114.2	D606	D606-S608 PolarHBondContact O-N 3.22Å; D606-S608 VanDerWaalsContact O-N 3.1Å; D606-S608 PolarHBondContact OD2-OG 2.89Å
609	L	30.3	Very low	42.1	Very low	163 Å²	163	72.1 Å²	72.1	85%	0.853	39%	0.394	S	S	*	.			trans	-112.1	0	161.9	-66.8	168.1	0	0	0	110	D606 P607	D606-L609 PolarHBondContact O-N 3.2Å; P607-L609 VanDerWaalsContact C-N 3.3Å

Retrieved 609 of 609 residues in 2137.9 ms (Link to these results)

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