A0A077Z579_TRITR Loading...

Gamma syntrophin protein SYN2

AlphaFold DB , UniProt , Accession A0A077Z579, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 565 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	29.4	Very low	25	Very low	237 Å²	237	156.7 Å²	156.7	100%	1.167	83%	0.826	S	S	*	*				0	115.4	0	-83.3	-175.2	-173.1	0	0	105
2	T	31.2	Very low	25.1	Very low	115 Å²	115	151.8 Å²	151.8	71%	0.706	82%	0.824	S	S	*	*			cis	177.7	161.5	42	26.4	0	0	0	0	103.4
3	F	25.9	Very low	24.9	Very low	195 Å²	195	155.8 Å²	155.8	86%	0.855	83%	0.829	S	S	*	*			cis	-156	147.5	-20.9	-115.1	-73.2	0	0	0	105.8
4	R	20.7	Very low	24.7	Very low	216 Å²	216	152.6 Å²	152.6	82%	0.815	83%	0.825	S	S	*	*			trans	-75	156.3	168.4	-84.5	178.2	167.3	164.5	-5	112.1
5	N	23.1	Very low	24.7	Very low	140 Å²	140	149.3 Å²	149.3	75%	0.749	82%	0.818	S	S	*	*			trans	49.3	139.7	139.2	-66.1	-13.8	0	0	0	120.1
6	V	25.6	Very low	24.5	Very low	124 Å²	124	147.6 Å²	147.6	75%	0.752	82%	0.821	S	S	*	*				177.7	132.4	97.7	158.6	0	0	0	0	110	L8	V6-L8 HydrophobicContact CG1-CD1 4.36Å; V6-L8 HydrophobicContact CG1-CG 4.43Å
7	S	21.2	Very low	24.5	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	82%	0.818	S	S	*	*			trans	-90.6	141.7	161.6	52.8	0	0	0	0	110.5
8	L	25.9	Very low	24.5	Very low	166 Å²	166	142.3 Å²	142.3	87%	0.869	82%	0.821	S	S	*	*			trans	-149.9	141.2	161.2	-98.4	164.5	0	0	0	111.3	V6	V6-L8 HydrophobicContact CG1-CD1 4.36Å; V6-L8 HydrophobicContact CG1-CG 4.43Å
9	S	23.8	Very low	24.4	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	81%	0.811	S	S	*	*			trans	-89.4	159.5	178.3	82.8	0	0	0	0	112.6
10	S	25.4	Very low	24.5	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	81%	0.808	S	S	*	*				169.9	132.3	124.6	57.6	0	0	0	0	115
11	K	22.9	Very low	24.4	Very low	205 Å²	205	139.7 Å²	139.7	89%	0.891	80%	0.804	S	S	*	*			trans	14.7	137.3	141.4	-72.3	175.2	173.1	173	0	122.9
12	A	26.1	Very low	24.1	Very low	97 Å²	97	133.7 Å²	133.7	80%	0.802	79%	0.785	S	S	*	*				161.3	119.6	126	0	0	0	0	0	110
13	K	21.9	Very low	23.9	Very low	204 Å²	204	138 Å²	138	89%	0.887	79%	0.794	S	S	*	*				73	127.7	87.8	-92.8	-171	179.4	-177.3	0	118.1
14	S	22.9	Very low	23.7	Very low	111 Å²	111	134.9 Å²	134.9	78%	0.776	79%	0.792	S	S	*	*			trans	85.4	129	145.4	62.1	0	0	0	0	124.8
15	S	23.8	Very low	23.9	Very low	104 Å²	104	130 Å²	130	73%	0.727	79%	0.79	S	S	*	*			trans	86.7	112.2	132.7	67.7	0	0	0	0	123.7
16	S	22.8	Very low	23.8	Very low	122 Å²	122	133.8 Å²	133.8	85%	0.853	80%	0.796	S	S	*	*				50.5	128.1	128.2	65.6	0	0	0	0	123
17	G	24.5	Very low	23.8	Very low	75 Å²	75	139 Å²	139	77%	0.773	80%	0.802	S	S	*	*			trans	141.9	123	140.8	0	0	0	0	0	117.7
18	S	24.6	Very low	24	Very low	125 Å²	125	139 Å²	139	87%	0.874	80%	0.802	S	S	*	*			trans	82.5	120.6	145.1	-168.4	0	0	0	0	121.5
19	S	22.7	Very low	23.9	Very low	90 Å²	90	139.6 Å²	139.6	63%	0.629	81%	0.805	S	S	*	*			trans	-65.9	139.3	164.4	44.7	0	0	0	0	115.1
20	H	25.4	Very low	24	Very low	165 Å²	165	139.1 Å²	139.1	76%	0.764	80%	0.802	S	S	*	*			trans	150.8	116.1	131.3	-90	-73.3	0	0	0	112.8
21	T	23	Very low	24	Very low	117 Å²	117	144.7 Å²	144.7	72%	0.718	81%	0.806	S	S	*	*			trans	48.3	123.1	141.7	61	0	0	0	0	121.9
22	S	23	Very low	24.1	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	80%	0.8	S	S	*	*			trans	81	94.8	142	-54.1	0	0	0	0	119.3
23	K	26.1	Very low	24	Very low	205 Å²	205	145 Å²	145	89%	0.891	81%	0.807	S	S	*	*				-177.5	127.4	119	-99	168.7	-176.6	178.3	0	111.3
24	T	22.3	Very low	24.1	Very low	131 Å²	131	139 Å²	139	80%	0.804	80%	0.804	S	S	*	*			trans	-45.6	127.9	165.4	26.9	0	0	0	0	113.7
25	S	25.1	Very low	24.3	Very low	112 Å²	112	138.8 Å²	138.8	78%	0.783	81%	0.808	S	S	*	*			trans	-152.1	103.6	154	-174.2	0	0	0	0	108.9
26	Y	21.1	Very low	24.3	Very low	221 Å²	221	142.9 Å²	142.9	87%	0.867	81%	0.813	S	S	*	*			trans	-86.8	108.2	170.9	-86.9	-96.5	0	0	0	108.5
27	R	25.5	Very low	24.5	Very low	233 Å²	233	143.7 Å²	143.7	88%	0.879	81%	0.812	S	S	*	*			trans	-146.9	122.9	156.4	-85	-159	174	175.1	-1.8	113.9
28	S	26.3	Very low	24.5	Very low	111 Å²	111	150.4 Å²	150.4	78%	0.776	82%	0.816	S	S	*	*			trans	58.8	100.9	149.2	72.5	0	0	0	0	119.7
29	L	23.5	Very low	24.5	Very low	178 Å²	178	146.4 Å²	146.4	93%	0.932	80%	0.795	S	S	*	*			trans	-112.8	104.9	137.2	-86.6	162.2	0	0	0	108.8
30	S	24.6	Very low	24.5	Very low	96 Å²	96	149.4 Å²	149.4	67%	0.671	80%	0.804	S	S	*	*			trans	-73.8	135.3	157.5	54.1	0	0	0	0	109.8
31	R	25.3	Very low	24.5	Very low	227 Å²	227	147.6 Å²	147.6	86%	0.857	80%	0.804	S	S	*	*			trans	72.2	127.6	170.1	-54.2	177.9	177.1	169.2	-0.9	112.5
32	T	25.6	Very low	24.6	Very low	125 Å²	125	152.9 Å²	152.9	77%	0.767	81%	0.812	S	S	*	*			cis	-175.2	149.7	46.3	-19	0	0	0	0	107.2
33	L	23.4	Very low	24.9	Very low	183 Å²	183	152 Å²	152	96%	0.958	81%	0.806	S	S	*	*			trans	101.2	107.3	174	-62.9	142	0	0	0	115.3
34	G	23.9	Very low	25.3	Very low	78 Å²	78	144.9 Å²	144.9	80%	0.804	78%	0.782	S	S	*	*			trans	169	99.7	162.5	0	0	0	0	0	112.9
35	A	27.9	Very low	26.4	Very low	106 Å²	106	140.9 Å²	140.9	88%	0.876	75%	0.754	S	S	*	*			trans	64.5	95.5	167.5	0	0	0	0	0	118.7
36	K	24.9	Very low	28	Very low	190 Å²	190	136.7 Å²	136.7	83%	0.826	72%	0.722	S	S	*	*			trans	-4.5	129.6	150.8	-72	172.9	173	178.7	0	117.6	Y38	K36-Y38 PolarHBondContact O-N 2.96Å; K36-Y38 VanDerWaalsContact O-N 3.13Å
37	V	25.3	Very low	30	Very low	139 Å²	139	127.3 Å²	127.3	84%	0.842	69%	0.686	S	S	*	*			trans	-31.3	107.2	143.8	-179.4	0	0	0	0	111.2
38	Y	26.1	Very low	32.2	Very low	217 Å²	217	116.3 Å²	116.3	85%	0.851	65%	0.645	S	S	*	*			trans	-105	104.6	148	-83.3	-85.6	0	0	0	105	K36	K36-Y38 PolarHBondContact O-N 2.96Å; K36-Y38 VanDerWaalsContact O-N 3.13Å
39	G	23.9	Very low	34.3	Very low	41 Å²	41	111 Å²	111	42%	0.423	61%	0.608	S	S	.	*			cis	68.6	88.1	16.3	0	0	0	0	0	110
40	D	22.9	Very low	36.6	Very low	153 Å²	153	104.2 Å²	104.2	82%	0.818	57%	0.574	S	S	*	*			trans	88.2	127.9	170.3	-52	-29.8	0	0	0	118.5
41	V	24.5	Very low	39.1	Very low	127 Å²	127	102.4 Å²	102.4	77%	0.77	55%	0.554	S	S	*	*			trans	81.9	85.7	164.5	-156	0	0	0	0	116.6	S43	V41-S43 PolarHBondContact O-N 3.44Å; V41-S43 VanDerWaalsContact O-N 3.16Å
42	Y	26.6	Very low	41.8	Very low	228 Å²	228	91.6 Å²	91.6	89%	0.894	51%	0.513	S	S	*	.			trans	-51.8	107.5	154.7	-62.6	-95	0	0	0	110.9
43	S	28.7	Very low	44.5	Very low	90 Å²	90	87.8 Å²	87.8	63%	0.629	49%	0.485	S	S	*	.			trans	-126.6	67.7	152.7	66.3	0	0	0	0	108.9	V41 F45	V41-S43 PolarHBondContact O-N 3.44Å; V41-S43 VanDerWaalsContact O-N 3.16Å; S43-F45 PolarHBondContact O-N 3.41Å
44	S	33.8	Very low	47.3	Very low	57 Å²	57	83.7 Å²	83.7	40%	0.399	46%	0.457	S	S	.	.			trans	-70.4	118.7	172.1	51.9	0	0	0	0	109.8
45	F	45	Very low	49.9	Very low	47 Å²	47	80.8 Å²	80.8	21%	0.206	42%	0.424	C	S	.	.			trans	-77.5	146.5	149.5	-103.2	-118	0	0	0	110.8	S43 V138 E140 T143	S43-F45 PolarHBondContact O-N 3.41Å; F45-V138 HydrophobicContact CB-CB 4.07Å; F45-V138 VanDerWaalsContact CB-O 3.29Å; F45-V138 WeakPolarHBondContact CB-O 3.41Å; F45-V138 PolarHBondContact N-O 2.98Å; F45-E140 HydrophobicContact CD2-CB 4.22Å; F45-E140 HydrophobicContact CE2-CB 3.42Å; F45-E140 VanDerWaalsContact CE2-CB 3.42Å; F45-E140 HydrophobicContact CE2-CG 3.71Å; F45-E140 HydrophobicContact CZ-CB 4.13Å; F45-E140 HydrophobicContact CZ-CG 4.05Å; F45-T143 HydrophobicContact CD1-CG2 4.12Å; F45-T143 HydrophobicContact CE1-CG2 3.95Å; F45-T143 WeakPolarHBondContact CE1-OG1 3.39Å; F45-T143 WeakPolarHBondContact CZ-OG1 3.41Å
46	E	59.2	Low	52.4	Low	24 Å²	24	82.6 Å²	82.6	11%	0.112	42%	0.419	C	S	.	.			trans	-109.4	147.1	-152.6	-84.4	155.3	-161.8	0	0	112.1	T50 K51 Y53	E46-T50 WeakPolarHBondContact CB-OG1 3.47Å; E46-K51 VanDerWaalsContact CD-CG 3.5Å; E46-K51 HydrophobicContact CG-CG 4.4Å; E46-K51 WeakPolarHBondContact OE1-CD 3.5Å; E46-K51 WeakPolarHBondContact OE1-CE 3.33Å; E46-K51 IonicContact OE1-NZ 3.03Å; E46-K51 PolarHBondContact OE1-NZ 3.46Å; E46-K51 WeakPolarHBondContact OE2-CB 3.34Å; E46-K51 WeakPolarHBondContact OE2-CD 3.23Å; E46-K51 VanDerWaalsContact OE2-CG 3.3Å; E46-K51 WeakPolarHBondContact OE2-CG 3.33Å; E46-Y53 PolarHBondContact OE1-OH 2.83Å; E46-Y53 PolarHBondContact OE2-OH 3.39Å
47	L	64.1	Low	55.2	Low	23 Å²	23	79.8 Å²	79.8	12%	0.12	41%	0.409	C	S	.	.			trans	-64.3	140.6	170.3	-70.3	142.8	0	0	0	108.6	G49 T50 V152 A194 C198	L47-G49 PolarHBondContact O-N 2.67Å; L47-T50 HydrophobicContact CB-CG2 3.8Å; L47-T50 WeakPolarHBondContact O-CB 3.09Å; L47-T50 WeakPolarHBondContact O-CG2 3.26Å; L47-T50 PolarHBondContact O-N 3.3Å; L47-T50 PolarHBondContact O-OG1 2.92Å; L47-V152 HydrophobicContact CD2-CB 4.33Å; L47-V152 HydrophobicContact CD2-CG1 3.83Å; L47-V152 HydrophobicContact CG-CG1 4.33Å; L47-A194 HydrophobicContact CD2-CB 4.04Å; L47-A194 VanDerWaalsContact CD2-O 3.24Å; L47-A194 WeakPolarHBondContact CD2-O 3.45Å; L47-C198 HydrophobicContact CD1-CB 4.1Å; L47-C198 WeakPolarHBondContact CD1-SG 3.4Å
48	P	70	Confident	58.2	Low	3 Å²	3	76.1 Å²	76.1	2%	0.019	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	132	174.2	-28.3	36	0	0	0	111.9	L62 L64	P48-L62 CarbonylContact C-O 3.56Å; P48-L62 HydrophobicContact CB-CB 4.38Å; P48-L64 HydrophobicContact CB-CD2 3.87Å; P48-L64 HydrophobicContact CB-CG 3.86Å; P48-L64 HydrophobicContact CG-CD2 3.94Å; P48-L64 HydrophobicContact CG-CG 4.45Å
49	G	70.6	Confident	61.2	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	20.8	178.7	0	0	0	0	0	115.3	L47 L62 I293 D295	L47-G49 PolarHBondContact O-N 2.67Å; G49-L62 PolarHBondContact N-O 2.7Å; G49-I293 VanDerWaalsContact O-CG2 3.3Å; G49-I293 WeakPolarHBondContact O-CG2 3.43Å; G49-D295 WeakPolarHBondContact O-CB 3.43Å; G49-D295 PolarHBondContact O-N 3.06Å
50	T	72.7	Confident	64.2	Low	34 Å²	34	66 Å²	66	21%	0.209	33%	0.332	C	S	.	.	S	Bend	trans	-109.5	-20.8	-178.6	58.6	0	0	0	0	116	E46 L47 V298	E46-T50 WeakPolarHBondContact CB-OG1 3.47Å; L47-T50 HydrophobicContact CB-CG2 3.8Å; L47-T50 WeakPolarHBondContact O-CB 3.09Å; L47-T50 WeakPolarHBondContact O-CG2 3.26Å; L47-T50 PolarHBondContact O-N 3.3Å; L47-T50 PolarHBondContact O-OG1 2.92Å; T50-V298 WeakPolarHBondContact O-CG2 3.34Å
51	K	76.5	Confident	67.2	Low	58 Å²	58	58.8 Å²	58.8	25%	0.252	30%	0.295	S	S	.	.			trans	-145.2	164.7	170.2	-60.9	-161.3	-168.9	154.1	0	112.8	E46 Y53	E46-K51 VanDerWaalsContact CD-CG 3.5Å; E46-K51 HydrophobicContact CG-CG 4.4Å; E46-K51 WeakPolarHBondContact OE1-CD 3.5Å; E46-K51 WeakPolarHBondContact OE1-CE 3.33Å; E46-K51 IonicContact OE1-NZ 3.03Å; E46-K51 PolarHBondContact OE1-NZ 3.46Å; E46-K51 WeakPolarHBondContact OE2-CB 3.34Å; E46-K51 WeakPolarHBondContact OE2-CD 3.23Å; E46-K51 VanDerWaalsContact OE2-CG 3.3Å; E46-K51 WeakPolarHBondContact OE2-CG 3.33Å; K51-Y53 HydrophobicContact CB-CE2 4.35Å
52	I	83.2	Confident	70	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.5	171.8	-50.7	-173.8	0	0	0	107.5	Y59 F229 V230 T231 V298 L301 W302	I52-Y59 HydrophobicContact CG2-CD1 3.85Å; I52-Y59 HydrophobicContact CG2-CG 4.44Å; I52-F229 PolarHBondContact N-O 3.4Å; I52-V230 HydrophobicContact CB-CG2 4.48Å; I52-V230 CarbonylContact O-C 3.13Å; I52-V230 VanDerWaalsContact O-CA 3.23Å; I52-V230 WeakPolarHBondContact O-CA 3.29Å; I52-T231 PolarHBondContact O-N 2.59Å; I52-V298 HydrophobicContact CD1-CG1 4.29Å; I52-V298 HydrophobicContact CG1-CG1 3.91Å; I52-L301 HydrophobicContact CD1-CB 3.54Å; I52-L301 HydrophobicContact CD1-CD1 4.35Å; I52-W302 VanDerWaalsContact CD1-CD1 3.48Å; I52-W302 HydrophobicContact CD1-CD2 3.95Å; I52-W302 HydrophobicContact CD1-CG 3.79Å; I52-W302 HydrophobicContact CG1-CZ2 4.3Å; I52-W302 HydrophobicContact CG2-CH2 4.4Å; I52-W302 HydrophobicContact CG2-CZ2 4.04Å
53	Y	82.3	Confident	72.7	Confident	46 Å²	46	43.6 Å²	43.6	18%	0.18	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.9	173.3	-63.7	-92.8	0	0	0	108.7	E46 K51 Y59 H60 T231	E46-Y53 PolarHBondContact OE1-OH 2.83Å; E46-Y53 PolarHBondContact OE2-OH 3.39Å; K51-Y53 HydrophobicContact CB-CE2 4.35Å; Y53-Y59 CarbonylContact O-C 3.6Å; Y53-Y59 VanDerWaalsContact O-CA 3.24Å; Y53-Y59 WeakPolarHBondContact O-CA 3.41Å; Y53-H60 VanDerWaalsContact CB-CE1 3.48Å; Y53-H60 WeakPolarHBondContact CB-CE1 3.36Å; Y53-H60 WeakPolarHBondContact CB-NE2 3.47Å; Y53-H60 AromaticContact CG-NE2 3.91Å; Y53-H60 PolarHBondContact N-O 3.26Å; Y53-H60 PolarHBondContact O-N 2.76Å; Y53-T231 CarbonylContact C-O 3.3Å; Y53-T231 WeakPolarHBondContact CA-O 3.32Å; Y53-T231 HydrophobicContact CD1-CG2 4.28Å; Y53-T231 HydrophobicContact CE1-CG2 4.29Å
54	R	82	Confident	75.1	Confident	97 Å²	97	39.4 Å²	39.4	37%	0.366	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.2	176.9	-174.6	-173.9	176.8	167.7	4.5	109.7	D56 I58 Y59 V230 T231 T232 C233	R54-D56 PolarHBondContact NE-O 3.14Å; R54-D56 PolarHBondContact NH2-O 2.92Å; R54-I58 WeakPolarHBondContact CA-O 3.27Å; R54-Y59 HydrophobicContact CB-CD1 3.96Å; R54-Y59 HydrophobicContact CB-CE1 3.99Å; R54-Y59 HydrophobicContact CG-CD1 4.03Å; R54-Y59 HydrophobicContact CG-CE1 3.78Å; R54-Y59 PolarHBondContact NH1-OH 2.85Å; R54-V230 HydrophobicContact CB-CG1 4.06Å; R54-T231 PolarHBondContact N-O 2.72Å; R54-T232 WeakPolarHBondContact O-CA 3.31Å; R54-C233 PolarHBondContact O-N 3.25Å
55	S	77.4	Confident	77.3	Confident	17 Å²	17	37.1 Å²	37.1	12%	0.119	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	119.3	168.2	-171.8	0	0	0	0	107	E57 I58 C233	S55-E57 PolarHBondContact O-N 2.81Å; S55-E57 VanDerWaalsContact O-N 3.13Å; S55-I58 PolarHBondContact N-O 3.05Å; S55-I58 WeakPolarHBondContact O-CA 3.16Å; S55-I58 WeakPolarHBondContact O-CB 3.48Å; S55-I58 PolarHBondContact O-N 3.23Å; S55-C233 WeakPolarHBondContact CB-O 3.2Å; S55-C233 PolarHBondContact OG-O 2.94Å
56	D	81.6	Confident	78.7	Confident	144 Å²	144	37 Å²	37	77%	0.77	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	-113.8	-171.2	-59.4	-32.3	0	0	0	113.7	R54	R54-D56 PolarHBondContact NE-O 3.14Å; R54-D56 PolarHBondContact NH2-O 2.92Å
57	E	83.7	Confident	79	Confident	130 Å²	130	37 Å²	37	61%	0.607	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.4	3.7	176.1	-58.4	-164.9	150.9	0	0	113.3	S55 P81	S55-E57 PolarHBondContact O-N 2.81Å; S55-E57 VanDerWaalsContact O-N 3.13Å; E57-P81 HydrophobicContact CB-CG 3.77Å; E57-P81 VanDerWaalsContact OE2-CG 3.31Å; E57-P81 WeakPolarHBondContact OE2-CG 3.34Å
58	I	87.1	Confident	78.5	Confident	63 Å²	63	41 Å²	41	32%	0.323	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.8	-176.4	-59	175.5	0	0	0	109.8	R54 S55 E78 L79 N80	R54-I58 WeakPolarHBondContact CA-O 3.27Å; S55-I58 PolarHBondContact N-O 3.05Å; S55-I58 WeakPolarHBondContact O-CA 3.16Å; S55-I58 WeakPolarHBondContact O-CB 3.48Å; S55-I58 PolarHBondContact O-N 3.23Å; I58-E78 HydrophobicContact CG2-CG 3.99Å; I58-L79 WeakPolarHBondContact CA-O 3.39Å; I58-N80 VanDerWaalsContact CG2-OD1 3.31Å; I58-N80 WeakPolarHBondContact CG2-OD1 3.16Å
59	Y	89.8	Confident	77.7	Confident	24 Å²	24	46.9 Å²	46.9	9%	0.094	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.1	171.7	-61.8	-93.9	0	0	0	110	I52 Y53 R54 E78 L79 H305	I52-Y59 HydrophobicContact CG2-CD1 3.85Å; I52-Y59 HydrophobicContact CG2-CG 4.44Å; Y53-Y59 CarbonylContact O-C 3.6Å; Y53-Y59 VanDerWaalsContact O-CA 3.24Å; Y53-Y59 WeakPolarHBondContact O-CA 3.41Å; R54-Y59 HydrophobicContact CB-CD1 3.96Å; R54-Y59 HydrophobicContact CB-CE1 3.99Å; R54-Y59 HydrophobicContact CG-CD1 4.03Å; R54-Y59 HydrophobicContact CG-CE1 3.78Å; R54-Y59 PolarHBondContact NH1-OH 2.85Å; Y59-E78 CarbonylContact O-C 3.46Å; Y59-E78 WeakPolarHBondContact O-CA 3.05Å; Y59-L79 HydrophobicContact CD2-CD2 4.21Å; Y59-L79 PolarHBondContact N-O 3.27Å; Y59-L79 PolarHBondContact O-N 2.93Å; Y59-H305 AromaticContact CE1-CE1 3.8Å; Y59-H305 AromaticContact CE1-NE2 3.88Å; Y59-H305 AromaticContact CZ-CE1 3.81Å; Y59-H305 AromaticContact CZ-ND1 3.72Å
60	H	87.1	Confident	76.7	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.093	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157	174	58.4	-83.2	0	0	0	112	Y53 L77	Y53-H60 VanDerWaalsContact CB-CE1 3.48Å; Y53-H60 WeakPolarHBondContact CB-CE1 3.36Å; Y53-H60 WeakPolarHBondContact CB-NE2 3.47Å; Y53-H60 AromaticContact CG-NE2 3.91Å; Y53-H60 PolarHBondContact N-O 3.26Å; Y53-H60 PolarHBondContact O-N 2.76Å; H60-L77 CarbonylContact C-O 3.59Å; H60-L77 WeakPolarHBondContact CA-O 3.37Å; H60-L77 VanDerWaalsContact CB-O 3.32Å; H60-L77 WeakPolarHBondContact CB-O 3.43Å
61	G	84.8	Confident	76	Confident	3 Å²	3	52.2 Å²	52.2	3%	0.031	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	158	178	0	0	0	0	0	112.6	R76 L77	G61-R76 WeakPolarHBondContact O-CA 3.37Å; G61-L77 PolarHBondContact N-O 2.76Å; G61-L77 VanDerWaalsContact N-O 3.08Å; G61-L77 PolarHBondContact O-N 3.27Å
62	L	83.1	Confident	75.5	Confident	35 Å²	35	49.6 Å²	49.6	18%	0.183	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	137.9	174.1	-65.3	175.9	0	0	0	109.7	P48 G49 A75 R76 F151 W242	P48-L62 CarbonylContact C-O 3.56Å; P48-L62 HydrophobicContact CB-CB 4.38Å; G49-L62 PolarHBondContact N-O 2.7Å; L62-A75 CarbonylContact C-O 3.48Å; L62-A75 WeakPolarHBondContact CA-O 3.29Å; L62-R76 HydrophobicContact CD2-CB 4.25Å; L62-F151 HydrophobicContact CD2-CE1 4.41Å; L62-W242 HydrophobicContact CD2-CH2 3.42Å; L62-W242 VanDerWaalsContact CD2-CH2 3.42Å; L62-W242 HydrophobicContact CD2-CZ2 3.62Å; L62-W242 HydrophobicContact CD2-CZ3 4.43Å
63	V	84.1	Confident	75	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	174.3	177	-59.3	0	0	0	0	109.8	P74 A75 L77 I291 I293	V63-P74 WeakPolarHBondContact O-CA 3.41Å; V63-A75 HydrophobicContact CG2-CB 4.13Å; V63-A75 PolarHBondContact N-O 3.3Å; V63-A75 PolarHBondContact O-N 3Å; V63-A75 VanDerWaalsContact O-O 3.08Å; V63-L77 HydrophobicContact CB-CD1 4.44Å; V63-L77 HydrophobicContact CB-CG 4.44Å; V63-L77 HydrophobicContact CG1-CD1 3.67Å; V63-L77 HydrophobicContact CG1-CG 3.94Å; V63-L77 HydrophobicContact CG2-CD1 4.04Å; V63-L77 HydrophobicContact CG2-CD2 4.14Å; V63-L77 HydrophobicContact CG2-CG 3.64Å; V63-I291 HydrophobicContact CB-CG2 3.91Å; V63-I291 HydrophobicContact CG1-CG2 4.1Å; V63-I291 HydrophobicContact CG2-CG2 3.92Å; V63-I293 HydrophobicContact CG1-CD1 4.12Å; V63-I293 HydrophobicContact CG1-CG1 4.09Å
64	L	80.1	Confident	74.7	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.7	169	-65.2	177.5	0	0	0	108.9	P48 H73 F189 I291 L292	P48-L64 HydrophobicContact CB-CD2 3.87Å; P48-L64 HydrophobicContact CB-CG 3.86Å; P48-L64 HydrophobicContact CG-CD2 3.94Å; P48-L64 HydrophobicContact CG-CG 4.45Å; L64-H73 CarbonylContact C-O 3.55Å; L64-H73 WeakPolarHBondContact CA-O 3.5Å; L64-F189 HydrophobicContact CD2-CE1 3.96Å; L64-F189 HydrophobicContact CD2-CZ 3.91Å; L64-I291 CarbonylContact O-C 3.6Å; L64-L292 HydrophobicContact CB-CB 3.91Å; L64-L292 PolarHBondContact N-O 2.9Å; L64-L292 WeakPolarHBondContact O-CA 3.43Å; L64-L292 PolarHBondContact O-N 2.93Å
65	L	79.3	Confident	74.7	Confident	10 Å²	10	43.4 Å²	43.4	5%	0.052	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.6	165.3	-70.5	170.1	0	0	0	108.4	G72 H73 A75 V86 L88 I245 V290 I291	L65-G72 CarbonylContact O-C 3.51Å; L65-G72 WeakPolarHBondContact O-CA 3.4Å; L65-H73 VanDerWaalsContact CB-CE1 3.45Å; L65-H73 WeakPolarHBondContact CB-CE1 3.37Å; L65-H73 PolarHBondContact N-O 2.81Å; L65-H73 PolarHBondContact O-N 2.82Å; L65-A75 HydrophobicContact CD1-CB 3.49Å; L65-A75 VanDerWaalsContact CD1-CB 3.49Å; L65-A75 HydrophobicContact CG-CB 3.55Å; L65-V86 HydrophobicContact CD1-CG1 3.55Å; L65-V86 HydrophobicContact CD2-CG1 4.03Å; L65-V86 HydrophobicContact CG-CG1 4.25Å; L65-L88 HydrophobicContact CD1-CD2 3.84Å; L65-I245 HydrophobicContact CD1-CD1 4.25Å; L65-V290 CarbonylContact C-O 3.58Å; L65-V290 WeakPolarHBondContact CA-O 3.42Å; L65-I291 HydrophobicContact CD2-CG1 3.8Å
66	S	74.8	Confident	75	Confident	43 Å²	43	43.3 Å²	43.3	30%	0.301	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.7	178	-164.4	0	0	0	0	111.1	V290	S66-V290 PolarHBondContact N-O 3.01Å
67	D	64.1	Low	75.5	Confident	24 Å²	24	36.5 Å²	36.5	13%	0.128	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-86.5	169.6	158.7	68.6	21.8	0	0	0	110.7	K69 G70 F71	D67-K69 PolarHBondContact O-N 3.22Å; D67-K69 VanDerWaalsContact OD1-C 3.23Å; D67-K69 VanDerWaalsContact OD1-CA 3.26Å; D67-K69 WeakPolarHBondContact OD1-CA 3.38Å; D67-K69 WeakPolarHBondContact OD1-CB 3.16Å; D67-K69 PolarHBondContact OD1-N 2.77Å; D67-G70 PolarHBondContact OD1-N 2.81Å; D67-F71 PolarHBondContact N-O 2.81Å; D67-F71 PolarHBondContact OD1-N 3.04Å; D67-F71 WeakPolarHBondContact OD2-CB 3.43Å
68	S	53.6	Low	75.8	Confident	109 Å²	109	32.1 Å²	32.1	76%	0.762	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-5.6	174.6	50.6	0	0	0	0	113.9
69	K	53.1	Low	76.1	Confident	125 Å²	125	29.1 Å²	29.1	54%	0.543	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	0.3	-174.6	-58.8	178	-174.2	169.7	0	113.2	D67 F71	D67-K69 PolarHBondContact O-N 3.22Å; D67-K69 VanDerWaalsContact OD1-C 3.23Å; D67-K69 VanDerWaalsContact OD1-CA 3.26Å; D67-K69 WeakPolarHBondContact OD1-CA 3.38Å; D67-K69 WeakPolarHBondContact OD1-CB 3.16Å; D67-K69 PolarHBondContact OD1-N 2.77Å; K69-F71 HydrophobicContact CB-CD2 4.38Å
70	G	51.3	Low	76.3	Confident	48 Å²	48	29.8 Å²	29.8	50%	0.495	17%	0.17	S	C	.	.	S	Bend	trans	85.8	6.4	178.6	0	0	0	0	0	115	D67	D67-G70 PolarHBondContact OD1-N 2.81Å
71	F	56.6	Low	76.6	Confident	98 Å²	98	30.6 Å²	30.6	43%	0.43	18%	0.177	S	C	.	.			trans	-96.9	162.8	166.8	-61.6	-81.1	0	0	0	109.6	D67 K69	D67-F71 PolarHBondContact N-O 2.81Å; D67-F71 PolarHBondContact OD1-N 3.04Å; D67-F71 WeakPolarHBondContact OD2-CB 3.43Å; K69-F71 HydrophobicContact CB-CD2 4.38Å
72	G	65.8	Low	77.1	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.5	174.6	0	0	0	0	0	111.5	L65 F189	L65-G72 CarbonylContact O-C 3.51Å; L65-G72 WeakPolarHBondContact O-CA 3.4Å; G72-F189 VanDerWaalsContact O-CE1 3.28Å; G72-F189 WeakPolarHBondContact O-CE1 3.48Å
73	H	72.7	Confident	77.7	Confident	14 Å²	14	36.4 Å²	36.4	7%	0.065	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.4	172.8	34.4	92.1	0	0	0	110.5	L64 L65 A75	L64-H73 CarbonylContact C-O 3.55Å; L64-H73 WeakPolarHBondContact CA-O 3.5Å; L65-H73 VanDerWaalsContact CB-CE1 3.45Å; L65-H73 WeakPolarHBondContact CB-CE1 3.37Å; L65-H73 PolarHBondContact N-O 2.81Å; L65-H73 PolarHBondContact O-N 2.82Å; H73-A75 PolarHBondContact O-N 2.87Å
74	P	77.1	Confident	78.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	128.5	-177.6	28	-33.6	0	0	0	110.4	V63 F92 F151 F189	V63-P74 WeakPolarHBondContact O-CA 3.41Å; P74-F92 HydrophobicContact CG-CE2 4.49Å; P74-F151 HydrophobicContact CB-CD1 3.55Å; P74-F151 HydrophobicContact CB-CD2 4.34Å; P74-F151 HydrophobicContact CB-CE1 3.44Å; P74-F151 VanDerWaalsContact CB-CE1 3.44Å; P74-F151 HydrophobicContact CB-CE2 4.23Å; P74-F151 HydrophobicContact CB-CG 4Å; P74-F151 HydrophobicContact CB-CZ 3.78Å; P74-F151 HydrophobicContact CG-CD1 3.92Å; P74-F151 HydrophobicContact CG-CD2 3.78Å; P74-F151 HydrophobicContact CG-CE1 3.89Å; P74-F151 HydrophobicContact CG-CE2 3.72Å; P74-F151 HydrophobicContact CG-CG 3.86Å; P74-F151 HydrophobicContact CG-CZ 3.76Å; P74-F189 HydrophobicContact CG-CD1 4.46Å; P74-F189 HydrophobicContact CG-CD2 4.27Å; P74-F189 HydrophobicContact CG-CE2 4.34Å; P74-F189 HydrophobicContact CG-CG 4.34Å; P74-F189 HydrophobicContact CG-CZ 4.46Å
75	A	81.6	Confident	78.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	162.5	175.6	0	0	0	0	0	109.6	L62 V63 L65 H73 V86 Q87 L88	L62-A75 CarbonylContact C-O 3.48Å; L62-A75 WeakPolarHBondContact CA-O 3.29Å; V63-A75 HydrophobicContact CG2-CB 4.13Å; V63-A75 PolarHBondContact N-O 3.3Å; V63-A75 PolarHBondContact O-N 3Å; V63-A75 VanDerWaalsContact O-O 3.08Å; L65-A75 HydrophobicContact CD1-CB 3.49Å; L65-A75 VanDerWaalsContact CD1-CB 3.49Å; L65-A75 HydrophobicContact CG-CB 3.55Å; H73-A75 PolarHBondContact O-N 2.87Å; A75-V86 HydrophobicContact CB-CG1 4.41Å; A75-Q87 CarbonylContact C-O 3.6Å; A75-Q87 WeakPolarHBondContact CA-O 3.31Å; A75-L88 HydrophobicContact CB-CD2 3.99Å
76	R	84.2	Confident	79.4	Confident	15 Å²	15	36 Å²	36	6%	0.057	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.3	172.7	177.9	173.6	-176.4	-111	4.3	108.4	G61 L62 E78 Q87 P239 W242	G61-R76 WeakPolarHBondContact O-CA 3.37Å; L62-R76 HydrophobicContact CD2-CB 4.25Å; R76-E78 IonicContact NH1-OE2 3.75Å; R76-Q87 HydrophobicContact CB-CB 4.04Å; R76-Q87 PolarHBondContact N-O 2.89Å; R76-Q87 PolarHBondContact O-N 2.83Å; R76-P239 VanDerWaalsContact NH1-CD 3.27Å; R76-P239 VanDerWaalsContact NH1-CG 3.28Å; R76-W242 HydrophobicContact CB-CD2 4.07Å; R76-W242 HydrophobicContact CB-CE3 3.53Å; R76-W242 HydrophobicContact CB-CH2 3.85Å; R76-W242 HydrophobicContact CB-CZ2 4.36Å; R76-W242 HydrophobicContact CB-CZ3 3.41Å; R76-W242 VanDerWaalsContact CB-CZ3 3.41Å
77	L	90.8	Very high	79.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	140.3	168.4	-63.4	-178.9	0	0	0	109.2	H60 G61 V63 L84 T85 V86 F278 I291 W302	H60-L77 CarbonylContact C-O 3.59Å; H60-L77 WeakPolarHBondContact CA-O 3.37Å; H60-L77 VanDerWaalsContact CB-O 3.32Å; H60-L77 WeakPolarHBondContact CB-O 3.43Å; G61-L77 PolarHBondContact N-O 2.76Å; G61-L77 VanDerWaalsContact N-O 3.08Å; G61-L77 PolarHBondContact O-N 3.27Å; V63-L77 HydrophobicContact CB-CD1 4.44Å; V63-L77 HydrophobicContact CB-CG 4.44Å; V63-L77 HydrophobicContact CG1-CD1 3.67Å; V63-L77 HydrophobicContact CG1-CG 3.94Å; V63-L77 HydrophobicContact CG2-CD1 4.04Å; V63-L77 HydrophobicContact CG2-CD2 4.14Å; V63-L77 HydrophobicContact CG2-CG 3.64Å; L77-L84 HydrophobicContact CB-CD1 4.42Å; L77-L84 HydrophobicContact CD2-CD1 4.47Å; L77-T85 WeakPolarHBondContact CA-O 3.45Å; L77-V86 HydrophobicContact CD2-CB 4.49Å; L77-V86 HydrophobicContact CD2-CG1 4.49Å; L77-V86 HydrophobicContact CD2-CG2 3.9Å; L77-F278 HydrophobicContact CD1-CZ 4.14Å; L77-I291 HydrophobicContact CD1-CD1 3.89Å; L77-I291 HydrophobicContact CD1-CG1 4.5Å; L77-I291 HydrophobicContact CD1-CG2 3.98Å; L77-I291 HydrophobicContact CD2-CD1 3.78Å; L77-I291 HydrophobicContact CD2-CG1 4.3Å; L77-I291 HydrophobicContact CG-CD1 4.47Å; L77-W302 HydrophobicContact CB-CH2 3.77Å; L77-W302 HydrophobicContact CB-CZ2 4.12Å; L77-W302 HydrophobicContact CB-CZ3 4.16Å; L77-W302 HydrophobicContact CD1-CD2 4.33Å; L77-W302 HydrophobicContact CD1-CE3 4.37Å; L77-W302 HydrophobicContact CD1-CZ2 4.5Å; L77-W302 HydrophobicContact CD1-CZ3 4.46Å
78	E	90.4	Very high	80.6	Confident	39 Å²	39	33.4 Å²	33.4	18%	0.182	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	112.6	170.2	-174	-178.9	106.8	0	0	107.7	I58 Y59 R76 T85 Q87	I58-E78 HydrophobicContact CG2-CG 3.99Å; Y59-E78 CarbonylContact O-C 3.46Å; Y59-E78 WeakPolarHBondContact O-CA 3.05Å; R76-E78 IonicContact NH1-OE2 3.75Å; E78-T85 PolarHBondContact N-O 2.83Å; E78-T85 PolarHBondContact O-N 2.77Å; E78-Q87 PolarHBondContact OE2-NE2 3.23Å; E78-Q87 VanDerWaalsContact OE2-NE2 3.09Å
79	L	94.4	Very high	81.4	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.5	-179.6	170.4	67.1	0	0	0	108.7	I58 Y59 L84 L250 W302 H305 I306	I58-L79 WeakPolarHBondContact CA-O 3.39Å; Y59-L79 HydrophobicContact CD2-CD2 4.21Å; Y59-L79 PolarHBondContact N-O 3.27Å; Y59-L79 PolarHBondContact O-N 2.93Å; L79-L84 HydrophobicContact CB-CD1 4.03Å; L79-L84 HydrophobicContact CD1-CB 4.42Å; L79-L84 HydrophobicContact CD1-CD1 4.29Å; L79-L250 HydrophobicContact CD1-CD1 3.52Å; L79-W302 HydrophobicContact CB-CZ3 3.7Å; L79-W302 HydrophobicContact CD2-CE3 4.35Å; L79-W302 HydrophobicContact CD2-CZ3 4.14Å; L79-H305 HydrophobicContact CD2-CB 3.76Å; L79-I306 HydrophobicContact CD1-CG1 4.01Å; L79-I306 HydrophobicContact CD2-CG1 3.75Å; L79-I306 HydrophobicContact CG-CG1 4.47Å
80	N	92.5	Very high	82.1	Confident	37 Å²	37	25.2 Å²	25.2	20%	0.198	14%	0.141	C	C	.	.			trans	-96.8	168	170.2	-62.5	3.8	0	0	0	108.5	I58 E82 T83 N309	I58-N80 VanDerWaalsContact CG2-OD1 3.31Å; I58-N80 WeakPolarHBondContact CG2-OD1 3.16Å; N80-E82 PolarHBondContact O-N 3.31Å; N80-E82 VanDerWaalsContact O-N 3.07Å; N80-T83 PolarHBondContact N-O 2.85Å; N80-N309 PolarHBondContact O-ND2 3.04Å; N80-N309 VanDerWaalsContact O-ND2 3.08Å
81	P	94.5	Very high	82.6	Confident	38 Å²	38	24.9 Å²	24.9	25%	0.247	13%	0.134	C	C	.	.	S	Bend	trans	-54.9	-27.9	176.4	-29.1	36.7	0	0	0	114.3	E57 L313	E57-P81 HydrophobicContact CB-CG 3.77Å; E57-P81 VanDerWaalsContact OE2-CG 3.31Å; E57-P81 WeakPolarHBondContact OE2-CG 3.34Å; P81-L313 WeakPolarHBondContact O-CD1 3.36Å
82	E	95.9	Very high	82.6	Confident	123 Å²	123	20.6 Å²	20.6	58%	0.575	12%	0.115	S	C	*	.	S	Bend	trans	-112.5	-22.7	-172.6	-54.7	-167.9	164	0	0	114.2	N80 L250 L313	N80-E82 PolarHBondContact O-N 3.31Å; N80-E82 VanDerWaalsContact O-N 3.07Å; E82-L250 WeakPolarHBondContact O-CB 3.35Å; E82-L250 PolarHBondContact O-N 3.42Å; E82-L313 HydrophobicContact CG-CD2 4.19Å
83	T	95.6	Very high	82	Confident	36 Å²	36	25.7 Å²	25.7	22%	0.221	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	146.5	-170.8	59.7	0	0	0	0	112.1	N80 T247 I248	N80-T83 PolarHBondContact N-O 2.85Å; T83-T247 HydrophobicContact CG2-CG2 4.1Å; T83-I248 CarbonylContact C-O 3.58Å; T83-I248 VanDerWaalsContact CA-O 3.24Å; T83-I248 WeakPolarHBondContact CA-O 3.34Å
84	L	96.1	Very high	80.9	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	119.4	165	176.9	66.8	0	0	0	109	L77 L79 I248 L250 V280 T288 I306	L77-L84 HydrophobicContact CB-CD1 4.42Å; L77-L84 HydrophobicContact CD2-CD1 4.47Å; L79-L84 HydrophobicContact CB-CD1 4.03Å; L79-L84 HydrophobicContact CD1-CB 4.42Å; L79-L84 HydrophobicContact CD1-CD1 4.29Å; L84-I248 PolarHBondContact N-O 3.25Å; L84-I248 PolarHBondContact O-N 3.27Å; L84-L250 HydrophobicContact CB-CD2 3.9Å; L84-L250 HydrophobicContact CB-CG 4.48Å; L84-V280 HydrophobicContact CD2-CB 3.9Å; L84-V280 HydrophobicContact CD2-CG1 4.29Å; L84-V280 HydrophobicContact CD2-CG2 3.57Å; L84-T288 HydrophobicContact CD2-CG2 3.84Å; L84-T288 HydrophobicContact CG-CG2 4.48Å; L84-I306 HydrophobicContact CD2-CD1 4.03Å
85	T	92	Very high	79.6	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.6	-179.9	-59.1	0	0	0	0	110.1	L77 E78 Q87 N244 T246 T247	L77-T85 WeakPolarHBondContact CA-O 3.45Å; E78-T85 PolarHBondContact N-O 2.83Å; E78-T85 PolarHBondContact O-N 2.77Å; T85-Q87 HydrophobicContact CG2-CG 4.13Å; T85-N244 HydrophobicContact CG2-CB 4.01Å; T85-N244 WeakPolarHBondContact CG2-OD1 3.32Å; T85-T246 WeakPolarHBondContact CA-O 3.46Å; T85-T247 WeakPolarHBondContact CG2-OG1 3.27Å; T85-T247 WeakPolarHBondContact OG1-CG2 3.5Å; T85-T247 PolarHBondContact OG1-OG1 3.33Å; T85-T247 VanDerWaalsContact OG1-OG1 3.14Å
86	V	89.9	Confident	77.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.1	171.6	-173.6	0	0	0	0	108.1	L65 A75 L77 I245 T246 T288	L65-V86 HydrophobicContact CD1-CG1 3.55Å; L65-V86 HydrophobicContact CD2-CG1 4.03Å; L65-V86 HydrophobicContact CG-CG1 4.25Å; A75-V86 HydrophobicContact CB-CG1 4.41Å; L77-V86 HydrophobicContact CD2-CB 4.49Å; L77-V86 HydrophobicContact CD2-CG1 4.49Å; L77-V86 HydrophobicContact CD2-CG2 3.9Å; V86-I245 HydrophobicContact CB-CD1 4.37Å; V86-I245 HydrophobicContact CB-CG1 4.1Å; V86-I245 HydrophobicContact CG1-CD1 3.84Å; V86-I245 HydrophobicContact CG1-CG1 3.98Å; V86-I245 WeakPolarHBondContact O-CG1 3.45Å; V86-I245 PolarHBondContact O-N 3.29Å; V86-T246 PolarHBondContact N-O 3.41Å; V86-T246 PolarHBondContact O-N 2.96Å; V86-T288 HydrophobicContact CG2-CG2 3.83Å
87	Q	85	Confident	76.1	Confident	10 Å²	10	38.3 Å²	38.3	5%	0.047	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.6	-178.8	-73.3	166.3	-5.4	0	0	110.3	A75 R76 E78 T85 W242 K243 N244	A75-Q87 CarbonylContact C-O 3.6Å; A75-Q87 WeakPolarHBondContact CA-O 3.31Å; R76-Q87 HydrophobicContact CB-CB 4.04Å; R76-Q87 PolarHBondContact N-O 2.89Å; R76-Q87 PolarHBondContact O-N 2.83Å; E78-Q87 PolarHBondContact OE2-NE2 3.23Å; E78-Q87 VanDerWaalsContact OE2-NE2 3.09Å; T85-Q87 HydrophobicContact CG2-CG 4.13Å; Q87-W242 HydrophobicContact CB-CB 4.39Å; Q87-W242 HydrophobicContact CB-CE3 4.03Å; Q87-K243 CarbonylContact C-O 3.57Å; Q87-K243 VanDerWaalsContact CA-O 3.28Å; Q87-K243 WeakPolarHBondContact CA-O 3.37Å; Q87-N244 WeakPolarHBondContact CG-OD1 3.46Å; Q87-N244 PolarHBondContact NE2-OD1 2.91Å
88	L	79.9	Confident	74	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	153.4	168	-67.9	-173.8	0	0	0	110.5	L65 A75 F92 W242 K243 I245	L65-L88 HydrophobicContact CD1-CD2 3.84Å; A75-L88 HydrophobicContact CB-CD2 3.99Å; L88-F92 HydrophobicContact CD1-CB 4.49Å; L88-W242 CarbonylContact O-C 3.48Å; L88-W242 WeakPolarHBondContact O-CA 3.32Å; L88-K243 PolarHBondContact N-O 3.42Å; L88-K243 PolarHBondContact O-N 2.91Å; L88-I245 HydrophobicContact CB-CG2 3.95Å; L88-I245 HydrophobicContact CD1-CD1 3.91Å; L88-I245 HydrophobicContact CD1-CG2 3.86Å; L88-I245 HydrophobicContact CD2-CD1 4.3Å; L88-I245 HydrophobicContact CG-CD1 3.69Å; L88-I245 HydrophobicContact CG-CG1 4.04Å; L88-I245 HydrophobicContact CG-CG2 3.77Å
89	P	70	Confident	71.8	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	139.9	165.9	-30.4	38.2	0	0	0	112.1	A91 F92 P149 F151 G241 W242	P89-A91 PolarHBondContact O-N 3.02Å; P89-A91 VanDerWaalsContact O-N 3.14Å; P89-F92 HydrophobicContact CB-CD2 3.54Å; P89-F92 HydrophobicContact CB-CE2 3.82Å; P89-F92 HydrophobicContact CG-CD2 3.71Å; P89-F92 HydrophobicContact CG-CE2 3.62Å; P89-F92 WeakPolarHBondContact O-CB 3.41Å; P89-F92 PolarHBondContact O-N 3.17Å; P89-P149 HydrophobicContact CB-CG 3.68Å; P89-P149 HydrophobicContact CG-CG 3.74Å; P89-F151 HydrophobicContact CG-CE2 3.81Å; P89-F151 HydrophobicContact CG-CZ 3.5Å; P89-F151 VanDerWaalsContact CG-CZ 3.5Å; P89-G241 CarbonylContact C-O 3.55Å; P89-G241 VanDerWaalsContact CA-O 3.22Å; P89-G241 WeakPolarHBondContact CA-O 3.47Å; P89-W242 VanDerWaalsContact CD-CZ3 3.47Å; P89-W242 HydrophobicContact CG-CE3 4.17Å; P89-W242 HydrophobicContact CG-CH2 3.96Å; P89-W242 HydrophobicContact CG-CZ3 3.77Å
90	T	67.9	Low	69.6	Low	61 Å²	61	51 Å²	51	37%	0.374	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.6	-179.4	66.5	0	0	0	0	113.1	F92 D147 G241 K243	T90-F92 PolarHBondContact O-N 2.84Å; T90-F92 VanDerWaalsContact O-N 3.12Å; T90-D147 PolarHBondContact OG1-O 2.86Å; T90-G241 VanDerWaalsContact CG2-C 3.47Å; T90-G241 PolarHBondContact N-O 3.46Å; T90-K243 HydrophobicContact CG2-CB 4.19Å
91	A	61.8	Low	67.6	Low	40 Å²	40	51.4 Å²	51.4	33%	0.331	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.4	170.1	0	0	0	0	0	113.8	P89	P89-A91 PolarHBondContact O-N 3.02Å; P89-A91 VanDerWaalsContact O-N 3.14Å
92	F	57.4	Low	65.8	Low	9 Å²	9	55 Å²	55	4%	0.039	32%	0.321	C	S	.	.	S	Bend	trans	-104.2	113.1	174.8	-59.5	-67.5	0	0	0	109.6	P74 L88 P89 T90 L100 R105	P74-F92 HydrophobicContact CG-CE2 4.49Å; L88-F92 HydrophobicContact CD1-CB 4.49Å; P89-F92 HydrophobicContact CB-CD2 3.54Å; P89-F92 HydrophobicContact CB-CE2 3.82Å; P89-F92 HydrophobicContact CG-CD2 3.71Å; P89-F92 HydrophobicContact CG-CE2 3.62Å; P89-F92 WeakPolarHBondContact O-CB 3.41Å; P89-F92 PolarHBondContact O-N 3.17Å; T90-F92 PolarHBondContact O-N 2.84Å; T90-F92 VanDerWaalsContact O-N 3.12Å; F92-L100 HydrophobicContact CD1-CD1 4.36Å; F92-L100 HydrophobicContact CD1-CD2 3.52Å; F92-L100 HydrophobicContact CE1-CD2 4Å; F92-L100 HydrophobicContact CG-CD2 4.43Å; F92-R105 HydrophobicContact CE1-CG 4.19Å; F92-R105 VanDerWaalsContact CZ-CD 3.49Å
93	D	51.8	Low	64.3	Low	110 Å²	110	50.8 Å²	50.8	59%	0.588	30%	0.303	S	S	*	.			trans	-73.2	137	169.9	-95.8	-37.2	0	0	0	110.8	G95 E96	D93-G95 PolarHBondContact O-N 2.86Å; D93-E96 PolarHBondContact O-N 2.96Å
94	A	50.4	Low	63.5	Low	58 Å²	58	52.8 Å²	52.8	48%	0.479	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-60.3	-18.8	-176.4	0	0	0	0	0	113.7	E96	A94-E96 VanDerWaalsContact C-N 3.34Å
95	G	49.6	Very low	62.6	Low	80 Å²	80	53 Å²	53	83%	0.825	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-80.3	-6.1	177.4	0	0	0	0	0	115.2	D93	D93-G95 PolarHBondContact O-N 2.86Å
96	E	44.3	Very low	62	Low	97 Å²	97	56.7 Å²	56.7	45%	0.453	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-115.6	14	-172.4	-65.8	-159.3	148.2	0	0	115	D93 A94 D98 K99 L100	D93-E96 PolarHBondContact O-N 2.96Å; A94-E96 VanDerWaalsContact C-N 3.34Å; E96-D98 PolarHBondContact O-N 3.24Å; E96-K99 PolarHBondContact O-N 3.34Å; E96-L100 HydrophobicContact CB-CD2 4.39Å; E96-L100 VanDerWaalsContact O-CG 3.29Å; E96-L100 WeakPolarHBondContact O-CG 3.38Å
97	V	48.1	Very low	61.6	Low	58 Å²	58	56.8 Å²	56.8	35%	0.352	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-51.5	-33.5	-177.1	-177	0	0	0	0	112.9	K99 L100	V97-K99 VanDerWaalsContact C-N 3.34Å; V97-K99 PolarHBondContact O-N 3.37Å; V97-L100 HydrophobicContact CB-CD1 4.48Å
98	D	46.4	Very low	61.5	Low	133 Å²	133	59.1 Å²	59.1	71%	0.711	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13.6	179.9	-72.7	-34.5	0	0	0	115.4	E96	E96-D98 PolarHBondContact O-N 3.24Å
99	K	43.6	Very low	61.6	Low	156 Å²	156	59.1 Å²	59.1	68%	0.678	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-114.5	4.4	-174.6	-66.6	-176	-178.8	176.5	0	114.6	E96 V97 S101 T103	E96-K99 PolarHBondContact O-N 3.34Å; V97-K99 VanDerWaalsContact C-N 3.34Å; V97-K99 PolarHBondContact O-N 3.37Å; K99-S101 PolarHBondContact O-N 2.97Å; K99-T103 PolarHBondContact O-OG1 3.42Å
100	L	48.8	Very low	62.1	Low	16 Å²	16	62.7 Å²	62.7	8%	0.084	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-69.9	-24.1	-163.2	-68.7	178.5	0	0	0	117.9	F92 E96 V97 D102 T103	F92-L100 HydrophobicContact CD1-CD1 4.36Å; F92-L100 HydrophobicContact CD1-CD2 3.52Å; F92-L100 HydrophobicContact CE1-CD2 4Å; F92-L100 HydrophobicContact CG-CD2 4.43Å; E96-L100 HydrophobicContact CB-CD2 4.39Å; E96-L100 VanDerWaalsContact O-CG 3.29Å; E96-L100 WeakPolarHBondContact O-CG 3.38Å; V97-L100 HydrophobicContact CB-CD1 4.48Å; L100-D102 PolarHBondContact O-N 3.19Å; L100-T103 WeakPolarHBondContact CA-OG1 3.42Å; L100-T103 PolarHBondContact O-N 2.82Å; L100-T103 VanDerWaalsContact O-N 3.11Å
101	S	51.1	Low	62.7	Low	47 Å²	47	62.7 Å²	62.7	33%	0.329	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-62.8	-19.2	-175.8	67.2	0	0	0	0	113.5	K99	K99-S101 PolarHBondContact O-N 2.97Å
102	D	55.9	Low	63.3	Low	112 Å²	112	62.3 Å²	62.3	60%	0.599	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-114.3	3.2	179.3	-138.9	9.5	0	0	0	113	L100 E104 R188	L100-D102 PolarHBondContact O-N 3.19Å; D102-E104 PolarHBondContact O-N 2.83Å; D102-R188 IonicContact OD1-CZ 2.59Å; D102-R188 IonicContact OD1-NE 3.87Å
103	T	64.9	Low	63.8	Low	35 Å²	35	68.4 Å²	68.4	22%	0.215	40%	0.396	C	S	.	.			trans	-74.3	113.9	-174.8	-52.3	0	0	0	0	110.5	K99 L100	K99-T103 PolarHBondContact O-OG1 3.42Å; L100-T103 WeakPolarHBondContact CA-OG1 3.42Å; L100-T103 PolarHBondContact O-N 2.82Å; L100-T103 VanDerWaalsContact O-N 3.11Å
104	E	78.4	Confident	64.9	Low	78 Å²	78	69 Å²	69	36%	0.364	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	127.2	171.7	-57.4	178.9	148.6	0	0	108.9	D102 L157 K186 V187 R188	D102-E104 PolarHBondContact O-N 2.83Å; E104-L157 HydrophobicContact CB-CD1 4.4Å; E104-L157 HydrophobicContact CG-CD1 3.73Å; E104-L157 VanDerWaalsContact OE1-CD1 3.23Å; E104-L157 WeakPolarHBondContact OE1-CD1 3.32Å; E104-K186 HydrophobicContact CB-CG 4.35Å; E104-K186 WeakPolarHBondContact OE2-CE 3.21Å; E104-K186 IonicContact OE2-NZ 3.76Å; E104-K186 PolarHBondContact OE2-NZ 2.79Å; E104-V187 CarbonylContact C-O 3.52Å; E104-V187 WeakPolarHBondContact CA-O 3.46Å; E104-R188 IonicContact OE1-CZ 2.79Å; E104-R188 IonicContact OE1-NH2 3.48Å; E104-R188 PolarHBondContact OE1-NH2 2.86Å
105	R	76.8	Confident	65.9	Low	6 Å²	6	68.5 Å²	68.5	2%	0.023	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	140.8	179.8	-64	-178.7	-73	-177.2	5	110.4	F92 F151 D154 K186 V187	F92-R105 HydrophobicContact CE1-CG 4.19Å; F92-R105 VanDerWaalsContact CZ-CD 3.49Å; R105-F151 VanDerWaalsContact NH2-CD2 3.27Å; R105-D154 IonicContact CZ-OD1 3.62Å; R105-D154 IonicContact NH2-OD1 3.78Å; R105-D154 PolarHBondContact NH2-OD1 2.78Å; R105-D154 IonicContact NH2-OD2 2.73Å; R105-D154 PolarHBondContact NH2-OD2 2.89Å; R105-K186 CarbonylContact O-C 3.58Å; R105-K186 WeakPolarHBondContact O-CA 3.29Å; R105-V187 HydrophobicContact CB-CG2 4.05Å; R105-V187 PolarHBondContact N-O 3.49Å; R105-V187 PolarHBondContact O-N 3.03Å
106	T	80.6	Confident	67.3	Low	82 Å²	82	66 Å²	66	50%	0.503	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115	169.7	-60.7	0	0	0	0	108.8	T184 L185	T106-T184 HydrophobicContact CG2-CG2 3.36Å; T106-L185 CarbonylContact C-O 3.45Å; T106-L185 WeakPolarHBondContact CA-O 3.49Å
107	V	81.2	Confident	68.9	Low	1 Å²	1	62.3 Å²	62.3	1%	0.006	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.5	179.4	179.4	0	0	0	0	108.7	I109 S148 L150 L185 V187	V107-I109 HydrophobicContact CG1-CD1 4.3Å; V107-I109 HydrophobicContact CG1-CG1 3.83Å; V107-S148 WeakPolarHBondContact CG1-O 3.42Å; V107-L150 HydrophobicContact CB-CD1 4.5Å; V107-L150 HydrophobicContact CG1-CD1 4.39Å; V107-L150 HydrophobicContact CG2-CD1 4.34Å; V107-L185 PolarHBondContact N-O 2.98Å; V107-L185 PolarHBondContact O-N 3.36Å; V107-V187 HydrophobicContact CG2-CG2 3.85Å
108	V	82.3	Confident	70.3	Confident	60 Å²	60	60.4 Å²	60.4	36%	0.364	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.4	172.8	-175.9	0	0	0	0	108.7	E182 T184	V108-E182 HydrophobicContact CG1-CB 4.09Å; V108-E182 HydrophobicContact CG1-CG 4.41Å; V108-T184 HydrophobicContact CG2-CG2 4.45Å
109	I	81.6	Confident	72.1	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	110.1	-176.3	-63.5	-175.4	0	0	0	108	V107 L117 F119 Q142 L150 E182 V183 L185	V107-I109 HydrophobicContact CG1-CD1 4.3Å; V107-I109 HydrophobicContact CG1-CG1 3.83Å; I109-L117 HydrophobicContact CG2-CB 4.22Å; I109-L117 HydrophobicContact CG2-CD2 3.88Å; I109-F119 HydrophobicContact CD1-CD1 3.81Å; I109-F119 HydrophobicContact CD1-CE1 3.39Å; I109-F119 HydrophobicContact CD1-CZ 4.26Å; I109-F119 HydrophobicContact CG2-CE1 4.26Å; I109-Q142 HydrophobicContact CG2-CG 4.32Å; I109-L150 HydrophobicContact CD1-CD2 3.97Å; I109-E182 CarbonylContact O-C 3.56Å; I109-E182 WeakPolarHBondContact O-CA 3.42Å; I109-V183 PolarHBondContact N-O 3.45Å; I109-V183 PolarHBondContact O-N 3.47Å; I109-L185 HydrophobicContact CD1-CD1 3.45Å; I109-L185 VanDerWaalsContact CD1-CD1 3.45Å; I109-L185 HydrophobicContact CD1-CG 4.09Å
110	T	80.8	Confident	73.9	Confident	76 Å²	76	50.6 Å²	50.6	47%	0.466	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.2	169.2	-45.4	0	0	0	0	109.6	E182	T110-E182 HydrophobicContact CG2-CG 4.41Å
111	R	80.5	Confident	75.7	Confident	61 Å²	61	51 Å²	51	23%	0.23	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-63.9	140.7	177.7	-70.9	-178.6	-173.9	-77.5	-4.8	111.2	L117 L176 S177 G180 P181	R111-L117 HydrophobicContact CG-CD2 3.69Å; R111-L176 PolarHBondContact NH2-O 3.3Å; R111-S177 PolarHBondContact NH2-O 2.67Å; R111-G180 WeakPolarHBondContact CD-O 3.32Å; R111-G180 PolarHBondContact NE-O 3.39Å; R111-P181 PolarHBondContact N-O 2.87Å
112	Q	74	Confident	77.2	Confident	33 Å²	33	54.3 Å²	54.3	15%	0.154	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-74.5	159.8	175.5	-66.3	-176.5	13.5	0	0	110.9	D114 G115 G116 S139	Q112-D114 WeakPolarHBondContact CB-OD1 3.24Å; Q112-D114 PolarHBondContact O-N 3.28Å; Q112-D114 VanDerWaalsContact O-N 3.12Å; Q112-G115 PolarHBondContact O-N 3.15Å; Q112-G116 WeakPolarHBondContact CB-O 3.36Å; Q112-G116 PolarHBondContact N-O 2.87Å; Q112-S139 PolarHBondContact NE2-OG 3.33Å
113	P	69	Low	78.5	Confident	136 Å²	136	50 Å²	50	88%	0.883	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.2	-180	-24.4	34	0	0	0	114.4	G115	P113-G115 PolarHBondContact O-N 3.14Å
114	D	74.6	Confident	79.3	Confident	123 Å²	123	48.8 Å²	48.8	66%	0.658	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.3	176.4	68.9	-9.5	0	0	0	113.5	Q112 G116	Q112-D114 WeakPolarHBondContact CB-OD1 3.24Å; Q112-D114 PolarHBondContact O-N 3.28Å; Q112-D114 VanDerWaalsContact O-N 3.12Å; D114-G116 VanDerWaalsContact C-N 3.27Å; D114-G116 PolarHBondContact O-N 3.46Å; D114-G116 PolarHBondContact OD1-N 2.9Å
115	G	70.8	Confident	79.5	Confident	48 Å²	48	48.1 Å²	48.1	50%	0.495	29%	0.291	S	S	.	.	S	Bend	trans	84.1	-6.6	-176.6	0	0	0	0	0	114.4	Q112 P113	Q112-G115 PolarHBondContact O-N 3.15Å; P113-G115 PolarHBondContact O-N 3.14Å
116	G	78.6	Confident	79.4	Confident	26 Å²	26	54 Å²	54	27%	0.268	32%	0.323	S	S	.	.			trans	-74.4	153.4	177	0	0	0	0	0	112.7	Q112 D114 G118	Q112-G116 WeakPolarHBondContact CB-O 3.36Å; Q112-G116 PolarHBondContact N-O 2.87Å; D114-G116 VanDerWaalsContact C-N 3.27Å; D114-G116 PolarHBondContact O-N 3.46Å; D114-G116 PolarHBondContact OD1-N 2.9Å; G116-G118 VanDerWaalsContact C-N 3.34Å
117	L	79.5	Confident	79	Confident	20 Å²	20	53.7 Å²	53.7	11%	0.105	34%	0.335	C	S	.	.			trans	-88.8	-6.3	167.8	-65.7	172.5	0	0	0	112.5	I109 R111 F119 Q142 L176 V183	I109-L117 HydrophobicContact CG2-CB 4.22Å; I109-L117 HydrophobicContact CG2-CD2 3.88Å; R111-L117 HydrophobicContact CG-CD2 3.69Å; L117-F119 HydrophobicContact CB-CD1 3.79Å; L117-F119 HydrophobicContact CB-CE1 3.43Å; L117-F119 VanDerWaalsContact CB-CE1 3.43Å; L117-F119 HydrophobicContact CB-CZ 4.2Å; L117-F119 HydrophobicContact CD1-CE1 3.86Å; L117-F119 HydrophobicContact CD1-CZ 3.88Å; L117-F119 HydrophobicContact CG-CE1 4.22Å; L117-F119 WeakPolarHBondContact O-CD1 3.45Å; L117-F119 PolarHBondContact O-N 3.27Å; L117-Q142 PolarHBondContact O-OE1 3.16Å; L117-L176 HydrophobicContact CD1-CB 3.91Å; L117-L176 HydrophobicContact CD1-CD2 4.12Å; L117-V183 HydrophobicContact CD1-CG2 4.26Å; L117-V183 HydrophobicContact CD2-CB 4.14Å; L117-V183 HydrophobicContact CD2-CG2 3.64Å
118	G	77.1	Confident	78.7	Confident	18 Å²	18	60 Å²	60	19%	0.186	38%	0.379	C	S	.	.	S	Bend	trans	71.6	23.1	177.2	0	0	0	0	0	115.3	G116 V138 S139	G116-G118 VanDerWaalsContact C-N 3.34Å; G118-V138 CarbonylContact O-C 3.45Å; G118-V138 VanDerWaalsContact O-C 3.3Å; G118-V138 WeakPolarHBondContact O-CA 3.45Å; G118-S139 WeakPolarHBondContact CA-OG 3.3Å; G118-S139 VanDerWaalsContact O-CB 3.27Å; G118-S139 WeakPolarHBondContact O-CB 3.27Å; G118-S139 PolarHBondContact O-N 3Å; G118-S139 PolarHBondContact O-OG 3.11Å
119	F	83.5	Confident	78.1	Confident	28 Å²	28	60.5 Å²	60.5	12%	0.123	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	160.8	172	66.3	-92.3	0	0	0	111.7	I109 L117 I121 I135 K137 V138 L150 I156 L176 L185	I109-F119 HydrophobicContact CD1-CD1 3.81Å; I109-F119 HydrophobicContact CD1-CE1 3.39Å; I109-F119 HydrophobicContact CD1-CZ 4.26Å; I109-F119 HydrophobicContact CG2-CE1 4.26Å; L117-F119 HydrophobicContact CB-CD1 3.79Å; L117-F119 HydrophobicContact CB-CE1 3.43Å; L117-F119 VanDerWaalsContact CB-CE1 3.43Å; L117-F119 HydrophobicContact CB-CZ 4.2Å; L117-F119 HydrophobicContact CD1-CE1 3.86Å; L117-F119 HydrophobicContact CD1-CZ 3.88Å; L117-F119 HydrophobicContact CG-CE1 4.22Å; L117-F119 WeakPolarHBondContact O-CD1 3.45Å; L117-F119 PolarHBondContact O-N 3.27Å; F119-I121 HydrophobicContact CD2-CG2 3.82Å; F119-I121 HydrophobicContact CE2-CG2 3.6Å; F119-I135 HydrophobicContact CB-CG2 4.46Å; F119-I135 HydrophobicContact CD2-CG1 4.21Å; F119-K137 CarbonylContact C-O 3.55Å; F119-K137 WeakPolarHBondContact CA-O 3.38Å; F119-K137 WeakPolarHBondContact CB-O 3.47Å; F119-V138 HydrophobicContact CB-CG2 4.29Å; F119-L150 HydrophobicContact CB-CD2 3.92Å; F119-L150 HydrophobicContact CD1-CD2 3.84Å; F119-L150 HydrophobicContact CD2-CD2 4.22Å; F119-L150 HydrophobicContact CE1-CD2 4.41Å; F119-L150 HydrophobicContact CG-CD2 3.74Å; F119-I156 HydrophobicContact CE2-CD1 4.27Å; F119-L176 HydrophobicContact CE2-CD1 4.03Å; F119-L176 HydrophobicContact CZ-CD1 4.17Å; F119-L176 HydrophobicContact CZ-CD2 3.96Å; F119-L185 HydrophobicContact CE1-CD1 4.1Å; F119-L185 HydrophobicContact CE2-CD1 4.37Å; F119-L185 HydrophobicContact CZ-CD1 3.74Å
120	S	82.6	Confident	78	Confident	56 Å²	56	66.6 Å²	66.6	39%	0.392	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.1	178.8	-54	0	0	0	0	110.8	S136 K137	S120-S136 WeakPolarHBondContact CB-OG 3.23Å; S120-S136 PolarHBondContact O-N 3.36Å; S120-S136 PolarHBondContact O-OG 3.46Å; S120-K137 PolarHBondContact N-O 3.27Å; S120-K137 PolarHBondContact O-N 2.87Å
121	I	85.4	Confident	78	Confident	23 Å²	23	65.8 Å²	65.8	12%	0.118	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	152.8	179.4	59.4	165.1	0	0	0	112.3	F119 V133 L134 I135 I156 I172 V173 L176	F119-I121 HydrophobicContact CD2-CG2 3.82Å; F119-I121 HydrophobicContact CE2-CG2 3.6Å; I121-V133 HydrophobicContact CB-CG1 4.3Å; I121-V133 HydrophobicContact CD1-CG1 4.28Å; I121-L134 CarbonylContact C-O 3.58Å; I121-L134 VanDerWaalsContact CA-O 3.23Å; I121-L134 WeakPolarHBondContact CA-O 3.4Å; I121-I135 HydrophobicContact CG2-CG1 4.42Å; I121-I156 HydrophobicContact CG2-CD1 3.6Å; I121-I172 HydrophobicContact CD1-CB 4.36Å; I121-I172 HydrophobicContact CD1-CG2 3.64Å; I121-V173 HydrophobicContact CD1-CG2 3.97Å; I121-L176 HydrophobicContact CD1-CD1 3.82Å; I121-L176 HydrophobicContact CG2-CD1 4.28Å
122	K	83.2	Confident	78	Confident	118 Å²	118	66 Å²	66	51%	0.513	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.9	170.1	-75.6	-174.4	178.3	-176.1	0	109.5	V133 L134 L197	K122-V133 CarbonylContact O-C 3.59Å; K122-V133 WeakPolarHBondContact O-CA 3.42Å; K122-L134 PolarHBondContact N-O 2.81Å; K122-L134 PolarHBondContact O-N 2.77Å; K122-L197 HydrophobicContact CD-CD2 4.49Å
123	G	83.9	Confident	78.5	Confident	22 Å²	22	64.7 Å²	64.7	23%	0.227	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	93.5	-171.5	-179.1	0	0	0	0	0	112.9	H169	G123-H169 PolarHBondContact O-ND1 2.67Å
124	G	81.9	Confident	79.2	Confident	9 Å²	9	58.7 Å²	58.7	9%	0.093	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123	165.8	-160.9	0	0	0	0	0	110.5	V131	G124-V131 CarbonylContact C-O 3.5Å; G124-V131 PolarHBondContact N-O 3.36Å; G124-V131 PolarHBondContact O-N 2.7Å
125	E	80.7	Confident	79.6	Confident	63 Å²	63	52.9 Å²	52.9	29%	0.294	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	111.3	176.7	-167	160.3	162.5	0	0	109.4	K130 G166 K167 T168	E125-K130 HydrophobicContact CG-CB 4.45Å; E125-K130 IonicContact OE2-NZ 3.8Å; E125-G166 VanDerWaalsContact OE2-CA 3.25Å; E125-G166 WeakPolarHBondContact OE2-CA 3.33Å; E125-K167 PolarHBondContact N-O 3.42Å; E125-T168 VanDerWaalsContact O-CA 3.32Å; E125-T168 WeakPolarHBondContact O-CA 3.36Å; E125-T168 WeakPolarHBondContact O-CG2 3.45Å
126	D	76.6	Confident	79.8	Confident	131 Å²	131	51.6 Å²	51.6	70%	0.701	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	104.4	175.5	-175.6	16	0	0	0	109.5	S128 C129	D126-S128 PolarHBondContact O-N 3.21Å; D126-C129 PolarHBondContact N-O 2.77Å; D126-C129 VanDerWaalsContact N-O 3.08Å; D126-C129 PolarHBondContact O-N 3.03Å
127	G	72.1	Confident	79.5	Confident	74 Å²	74	56.3 Å²	56.3	76%	0.763	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	-100.5	179.3	0	0	0	0	0	113.5
128	S	73.3	Confident	79.2	Confident	133 Å²	133	55.7 Å²	55.7	93%	0.93	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-1.7	-179.9	59.9	0	0	0	0	114.2	D126	D126-S128 PolarHBondContact O-N 3.21Å
129	C	71.2	Confident	78.7	Confident	72 Å²	72	55.8 Å²	55.8	49%	0.486	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	102.2	-176.5	-161.8	0	0	0	0	110.3	D126 V131	D126-C129 PolarHBondContact N-O 2.77Å; D126-C129 VanDerWaalsContact N-O 3.08Å; D126-C129 PolarHBondContact O-N 3.03Å; C129-V131 VanDerWaalsContact SG-CG2 3.52Å
130	K	78.5	Confident	77.4	Confident	128 Å²	128	60.2 Å²	60.2	56%	0.557	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	101.9	173.6	-177.2	166.1	-179.1	154.6	0	109.8	E125 D165	E125-K130 HydrophobicContact CG-CB 4.45Å; E125-K130 IonicContact OE2-NZ 3.8Å; K130-D165 WeakPolarHBondContact CE-OD1 3.36Å; K130-D165 IonicContact NZ-OD1 3.96Å; K130-D165 PolarHBondContact NZ-OD1 2.9Å; K130-D165 IonicContact NZ-OD2 2.73Å; K130-D165 PolarHBondContact NZ-OD2 2.9Å
131	V	80.6	Confident	76.2	Confident	59 Å²	59	61.7 Å²	61.7	36%	0.358	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.5	178.7	-174.8	0	0	0	0	109.4	G124 C129	G124-V131 CarbonylContact C-O 3.5Å; G124-V131 PolarHBondContact N-O 3.36Å; G124-V131 PolarHBondContact O-N 2.7Å; C129-V131 VanDerWaalsContact SG-CG2 3.52Å
132	P	80.4	Confident	74.9	Confident	65 Å²	65	61.1 Å²	61.1	42%	0.422	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	146.4	176.6	25.1	-34.2	0	0	0	111.6	L134 T155	P132-L134 PolarHBondContact O-N 2.88Å; P132-T155 HydrophobicContact CB-CG2 4.1Å
133	V	85.8	Confident	73.6	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.042	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	109.6	-179.5	-172.1	0	0	0	0	109.4	I121 K122 T155 I156 V164 I172	I121-V133 HydrophobicContact CB-CG1 4.3Å; I121-V133 HydrophobicContact CD1-CG1 4.28Å; K122-V133 CarbonylContact O-C 3.59Å; K122-V133 WeakPolarHBondContact O-CA 3.42Å; V133-T155 CarbonylContact O-C 3.44Å; V133-T155 VanDerWaalsContact O-CA 3.29Å; V133-T155 WeakPolarHBondContact O-CA 3.3Å; V133-I156 HydrophobicContact CB-CB 4.3Å; V133-I156 HydrophobicContact CG1-CB 4.16Å; V133-I156 HydrophobicContact CG1-CD1 4.13Å; V133-I156 HydrophobicContact CG1-CG1 4.43Å; V133-I156 PolarHBondContact O-N 3.3Å; V133-V164 HydrophobicContact CB-CG2 4.35Å; V133-V164 HydrophobicContact CG2-CB 4.38Å; V133-V164 HydrophobicContact CG2-CG2 3.91Å; V133-I172 HydrophobicContact CB-CD1 4.48Å; V133-I172 HydrophobicContact CG1-CD1 4.36Å; V133-I172 HydrophobicContact CG1-CG2 4.13Å; V133-I172 HydrophobicContact CG2-CD1 3.31Å; V133-I172 HydrophobicContact CG2-CG1 4.41Å
134	L	82.1	Confident	72.1	Confident	10 Å²	10	57.6 Å²	57.6	5%	0.052	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.4	-173	-61.6	164.9	0	0	0	111.3	I121 K122 P132 S136 D154 T155 M193	I121-L134 CarbonylContact C-O 3.58Å; I121-L134 VanDerWaalsContact CA-O 3.23Å; I121-L134 WeakPolarHBondContact CA-O 3.4Å; K122-L134 PolarHBondContact N-O 2.81Å; K122-L134 PolarHBondContact O-N 2.77Å; P132-L134 PolarHBondContact O-N 2.88Å; L134-S136 PolarHBondContact O-N 2.9Å; L134-D154 CarbonylContact C-O 3.59Å; L134-D154 WeakPolarHBondContact CA-O 3.29Å; L134-T155 WeakPolarHBondContact CD2-OG1 3.34Å; L134-M193 HydrophobicContact CD1-CB 4.33Å; L134-M193 HydrophobicContact CD1-CE 3.44Å; L134-M193 VanDerWaalsContact CD1-CE 3.44Å; L134-M193 HydrophobicContact CD1-CG 4.45Å; L134-M193 HydrophobicContact CD2-CB 4Å; L134-M193 HydrophobicContact CD2-CG 4.14Å
135	I	83.9	Confident	70.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.8	167.3	-69.3	141.5	0	0	0	108.9	F119 I121 V138 L150 G153 D154 I156 V187	F119-I135 HydrophobicContact CB-CG2 4.46Å; F119-I135 HydrophobicContact CD2-CG1 4.21Å; I121-I135 HydrophobicContact CG2-CG1 4.42Å; I135-V138 HydrophobicContact CG2-CG2 3.56Å; I135-L150 HydrophobicContact CD1-CD1 3.45Å; I135-L150 VanDerWaalsContact CD1-CD1 3.45Å; I135-L150 HydrophobicContact CD1-CD2 3.62Å; I135-L150 HydrophobicContact CD1-CG 3.61Å; I135-L150 HydrophobicContact CG1-CD2 4.03Å; I135-L150 HydrophobicContact CG1-CG 4.43Å; I135-L150 HydrophobicContact CG2-CD2 4.11Å; I135-L150 HydrophobicContact CG2-CG 4.43Å; I135-G153 PolarHBondContact O-N 2.88Å; I135-D154 HydrophobicContact CB-CB 4.41Å; I135-D154 HydrophobicContact CD1-CB 3.5Å; I135-D154 VanDerWaalsContact CD1-CB 3.5Å; I135-D154 PolarHBondContact N-O 2.87Å; I135-I156 HydrophobicContact CD1-CD1 4.16Å; I135-I156 HydrophobicContact CD1-CG1 3.83Å; I135-I156 HydrophobicContact CG1-CD1 4.07Å; I135-I156 HydrophobicContact CG1-CG1 4.14Å; I135-V187 HydrophobicContact CD1-CG1 4.33Å
136	S	75.1	Confident	69.8	Low	21 Å²	21	61.8 Å²	61.8	15%	0.147	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-24.8	-176.9	65.7	0	0	0	0	113.8	S120 L134	S120-S136 WeakPolarHBondContact CB-OG 3.23Å; S120-S136 PolarHBondContact O-N 3.36Å; S120-S136 PolarHBondContact O-OG 3.46Å; L134-S136 PolarHBondContact O-N 2.9Å
137	K	72.7	Confident	69.1	Low	125 Å²	125	60.9 Å²	60.9	54%	0.543	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	148.4	176.7	-61.4	-175.7	178.2	-178.4	0	109.4	F119 S120	F119-K137 CarbonylContact C-O 3.55Å; F119-K137 WeakPolarHBondContact CA-O 3.38Å; F119-K137 WeakPolarHBondContact CB-O 3.47Å; S120-K137 PolarHBondContact N-O 3.27Å; S120-K137 PolarHBondContact O-N 2.87Å
138	V	72.2	Confident	68.9	Low	7 Å²	7	58.3 Å²	58.3	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	167.7	169.4	-172.7	0	0	0	0	107.2	F45 G118 F119 I135 Q142 T143 L150 V152	F45-V138 HydrophobicContact CB-CB 4.07Å; F45-V138 VanDerWaalsContact CB-O 3.29Å; F45-V138 WeakPolarHBondContact CB-O 3.41Å; F45-V138 PolarHBondContact N-O 2.98Å; G118-V138 CarbonylContact O-C 3.45Å; G118-V138 VanDerWaalsContact O-C 3.3Å; G118-V138 WeakPolarHBondContact O-CA 3.45Å; F119-V138 HydrophobicContact CB-CG2 4.29Å; I135-V138 HydrophobicContact CG2-CG2 3.56Å; V138-Q142 HydrophobicContact CG1-CB 4.11Å; V138-T143 HydrophobicContact CG1-CG2 3.87Å; V138-L150 HydrophobicContact CG1-CB 4.43Å; V138-L150 HydrophobicContact CG2-CB 4.38Å; V138-L150 HydrophobicContact CG2-CD2 4.17Å; V138-L150 HydrophobicContact CG2-CG 4.35Å; V138-V152 HydrophobicContact CG2-CG2 4.38Å
139	S	67.7	Low	68.7	Low	21 Å²	21	52 Å²	52	15%	0.147	27%	0.271	C	S	.	.			trans	-112.7	155.3	176.9	60.6	0	0	0	0	110.3	Q112 G118 M141 Q142	Q112-S139 PolarHBondContact NE2-OG 3.33Å; G118-S139 WeakPolarHBondContact CA-OG 3.3Å; G118-S139 VanDerWaalsContact O-CB 3.27Å; G118-S139 WeakPolarHBondContact O-CB 3.27Å; G118-S139 PolarHBondContact O-N 3Å; G118-S139 PolarHBondContact O-OG 3.11Å; S139-M141 PolarHBondContact O-N 3.4Å; S139-Q142 PolarHBondContact O-N 3.45Å; S139-Q142 VanDerWaalsContact O-N 3.12Å
140	E	56.2	Low	69	Low	121 Å²	121	48.9 Å²	48.9	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-58.3	-45.2	-177.6	-165.8	166.7	-169.4	0	0	113.4	F45 Q142 T143 C144	F45-E140 HydrophobicContact CD2-CB 4.22Å; F45-E140 HydrophobicContact CE2-CB 3.42Å; F45-E140 VanDerWaalsContact CE2-CB 3.42Å; F45-E140 HydrophobicContact CE2-CG 3.71Å; F45-E140 HydrophobicContact CZ-CB 4.13Å; F45-E140 HydrophobicContact CZ-CG 4.05Å; E140-Q142 PolarHBondContact O-N 2.86Å; E140-T143 PolarHBondContact O-N 2.98Å; E140-T143 PolarHBondContact O-OG1 3.38Å; E140-C144 PolarHBondContact O-N 2.86Å; E140-C144 PolarHBondContact O-SG 2.86Å
141	M	57.2	Low	68.7	Low	87 Å²	87	43 Å²	43	43%	0.429	22%	0.224	S	C	.	.	H	α-helix	trans	-57.4	-37.9	177.6	-63.9	-85.7	-74.5	0	0	111.3	S139 T143 Y145	S139-M141 PolarHBondContact O-N 3.4Å; M141-T143 PolarHBondContact O-N 3.47Å; M141-Y145 HydrophobicContact CB-CD2 4.38Å; M141-Y145 HydrophobicContact CB-CE2 4.36Å; M141-Y145 HydrophobicContact CE-CE2 3.99Å; M141-Y145 WeakPolarHBondContact O-CD2 3.49Å; M141-Y145 PolarHBondContact O-N 3.35Å; M141-Y145 HydrophobicContact SD-CE2 3.72Å
142	Q	58.5	Low	68.3	Low	11 Å²	11	40.7 Å²	40.7	5%	0.051	21%	0.209	C	C	.	.	H	α-helix	trans	-70.3	-34.4	-171.9	-159.9	58.8	40.3	0	0	113.6	I109 L117 V138 S139 E140 S146	I109-Q142 HydrophobicContact CG2-CG 4.32Å; L117-Q142 PolarHBondContact O-OE1 3.16Å; V138-Q142 HydrophobicContact CG1-CB 4.11Å; S139-Q142 PolarHBondContact O-N 3.45Å; S139-Q142 VanDerWaalsContact O-N 3.12Å; E140-Q142 PolarHBondContact O-N 2.86Å; Q142-S146 WeakPolarHBondContact O-CB 3.28Å; Q142-S146 PolarHBondContact O-OG 3.39Å; Q142-S146 VanDerWaalsContact O-OG 3.08Å
143	T	54.7	Low	68	Low	15 Å²	15	37.6 Å²	37.6	9%	0.092	19%	0.189	C	C	.	.	H	α-helix	trans	-85.9	-26	-178.4	58.7	0	0	0	0	113.1	F45 V138 E140 M141 P149	F45-T143 HydrophobicContact CD1-CG2 4.12Å; F45-T143 HydrophobicContact CE1-CG2 3.95Å; F45-T143 WeakPolarHBondContact CE1-OG1 3.39Å; F45-T143 WeakPolarHBondContact CZ-OG1 3.41Å; V138-T143 HydrophobicContact CG1-CG2 3.87Å; E140-T143 PolarHBondContact O-N 2.98Å; E140-T143 PolarHBondContact O-OG1 3.38Å; M141-T143 PolarHBondContact O-N 3.47Å; T143-P149 HydrophobicContact CG2-CB 4.5Å
144	C	52.8	Low	67.7	Low	51 Å²	51	37.3 Å²	37.3	35%	0.345	19%	0.187	S	C	.	.	H	α-helix	trans	-74.6	-32.5	177.9	-70.1	0	0	0	0	113.1	E140 K240	E140-C144 PolarHBondContact O-N 2.86Å; E140-C144 PolarHBondContact O-SG 2.86Å; C144-K240 WeakPolarHBondContact O-CB 3.49Å; C144-K240 PolarHBondContact O-N 3.1Å
145	Y	54.4	Low	67.9	Low	149 Å²	149	37.7 Å²	37.7	58%	0.584	19%	0.19	S	C	*	.	H	α-helix	trans	-99.7	-17.1	-174.2	-64.9	-63.1	0	0	0	114.8	M141	M141-Y145 HydrophobicContact CB-CD2 4.38Å; M141-Y145 HydrophobicContact CB-CE2 4.36Å; M141-Y145 HydrophobicContact CE-CE2 3.99Å; M141-Y145 WeakPolarHBondContact O-CD2 3.49Å; M141-Y145 PolarHBondContact O-N 3.35Å; M141-Y145 HydrophobicContact SD-CE2 3.72Å
146	S	60.9	Low	68.2	Low	11 Å²	11	37.8 Å²	37.8	8%	0.077	19%	0.191	C	C	.	.			trans	-87.9	141.8	-178.4	73.1	0	0	0	0	112.6	Q142 S148 K240	Q142-S146 WeakPolarHBondContact O-CB 3.28Å; Q142-S146 PolarHBondContact O-OG 3.39Å; Q142-S146 VanDerWaalsContact O-OG 3.08Å; S146-S148 PolarHBondContact O-N 3.43Å; S146-S148 PolarHBondContact OG-O 3.13Å; S146-K240 CarbonylContact O-C 3.54Å; S146-K240 VanDerWaalsContact O-O 3.13Å
147	D	61.3	Low	68.8	Low	111 Å²	111	38.9 Å²	38.9	59%	0.594	20%	0.195	S	C	*	.	S	Bend	trans	-70.1	-21	173	-67.8	-34.1	0	0	0	111.9	T90 G241	T90-D147 PolarHBondContact OG1-O 2.86Å; D147-G241 VanDerWaalsContact C-CA 3.48Å; D147-G241 WeakPolarHBondContact O-CA 3.28Å
148	S	66.9	Low	69.7	Low	20 Å²	20	33.4 Å²	33.4	14%	0.14	17%	0.173	C	C	.	.	S	Bend	trans	-123.5	107.1	173.8	-63.9	0	0	0	0	109.3	V107 S146	V107-S148 WeakPolarHBondContact CG1-O 3.42Å; S146-S148 PolarHBondContact O-N 3.43Å; S146-S148 PolarHBondContact OG-O 3.13Å
149	P	69.6	Low	70.5	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.013	17%	0.171	C	C	.	.			trans	-69	141.8	178.6	25.5	-35.3	0	0	0	111.9	P89 T143 F151 W242	P89-P149 HydrophobicContact CB-CG 3.68Å; P89-P149 HydrophobicContact CG-CG 3.74Å; T143-P149 HydrophobicContact CG2-CB 4.5Å; P149-F151 HydrophobicContact CB-CE2 4.23Å; P149-F151 HydrophobicContact CB-CZ 4.02Å; P149-F151 HydrophobicContact CG-CE2 3.97Å; P149-F151 HydrophobicContact CG-CZ 3.74Å; P149-F151 WeakPolarHBondContact O-CD2 3.22Å; P149-F151 VanDerWaalsContact O-CE2 3.22Å; P149-F151 WeakPolarHBondContact O-CE2 3.16Å; P149-W242 HydrophobicContact CB-CZ2 4.16Å; P149-W242 HydrophobicContact CG-CZ2 3.86Å
150	L	76.8	Confident	71.6	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	18%	0.18	C	C	.	.			trans	-91.9	141	173.4	-163.5	70.4	0	0	0	110.3	V107 I109 F119 I135 V138 L185 V187	V107-L150 HydrophobicContact CB-CD1 4.5Å; V107-L150 HydrophobicContact CG1-CD1 4.39Å; V107-L150 HydrophobicContact CG2-CD1 4.34Å; I109-L150 HydrophobicContact CD1-CD2 3.97Å; F119-L150 HydrophobicContact CB-CD2 3.92Å; F119-L150 HydrophobicContact CD1-CD2 3.84Å; F119-L150 HydrophobicContact CD2-CD2 4.22Å; F119-L150 HydrophobicContact CE1-CD2 4.41Å; F119-L150 HydrophobicContact CG-CD2 3.74Å; I135-L150 HydrophobicContact CD1-CD1 3.45Å; I135-L150 VanDerWaalsContact CD1-CD1 3.45Å; I135-L150 HydrophobicContact CD1-CD2 3.62Å; I135-L150 HydrophobicContact CD1-CG 3.61Å; I135-L150 HydrophobicContact CG1-CD2 4.03Å; I135-L150 HydrophobicContact CG1-CG 4.43Å; I135-L150 HydrophobicContact CG2-CD2 4.11Å; I135-L150 HydrophobicContact CG2-CG 4.43Å; V138-L150 HydrophobicContact CG1-CB 4.43Å; V138-L150 HydrophobicContact CG2-CB 4.38Å; V138-L150 HydrophobicContact CG2-CD2 4.17Å; V138-L150 HydrophobicContact CG2-CG 4.35Å; L150-L185 HydrophobicContact CD1-CD1 4.34Å; L150-V187 HydrophobicContact CD1-CG1 4.06Å; L150-V187 HydrophobicContact CD1-CG2 4.43Å
151	F	73.1	Confident	73	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.026	20%	0.195	C	C	.	.			trans	-116.9	147.5	-176.7	-62.1	-81.9	0	0	0	113	L62 P74 P89 R105 P149 G153 D154 F189 W242	L62-F151 HydrophobicContact CD2-CE1 4.41Å; P74-F151 HydrophobicContact CB-CD1 3.55Å; P74-F151 HydrophobicContact CB-CD2 4.34Å; P74-F151 HydrophobicContact CB-CE1 3.44Å; P74-F151 VanDerWaalsContact CB-CE1 3.44Å; P74-F151 HydrophobicContact CB-CE2 4.23Å; P74-F151 HydrophobicContact CB-CG 4Å; P74-F151 HydrophobicContact CB-CZ 3.78Å; P74-F151 HydrophobicContact CG-CD1 3.92Å; P74-F151 HydrophobicContact CG-CD2 3.78Å; P74-F151 HydrophobicContact CG-CE1 3.89Å; P74-F151 HydrophobicContact CG-CE2 3.72Å; P74-F151 HydrophobicContact CG-CG 3.86Å; P74-F151 HydrophobicContact CG-CZ 3.76Å; P89-F151 HydrophobicContact CG-CE2 3.81Å; P89-F151 HydrophobicContact CG-CZ 3.5Å; P89-F151 VanDerWaalsContact CG-CZ 3.5Å; R105-F151 VanDerWaalsContact NH2-CD2 3.27Å; P149-F151 HydrophobicContact CB-CE2 4.23Å; P149-F151 HydrophobicContact CB-CZ 4.02Å; P149-F151 HydrophobicContact CG-CE2 3.97Å; P149-F151 HydrophobicContact CG-CZ 3.74Å; P149-F151 WeakPolarHBondContact O-CD2 3.22Å; P149-F151 VanDerWaalsContact O-CE2 3.22Å; P149-F151 WeakPolarHBondContact O-CE2 3.16Å; F151-G153 PolarHBondContact O-N 2.83Å; F151-D154 PolarHBondContact N-OD2 2.85Å; F151-D154 VanDerWaalsContact O-CB 3.3Å; F151-D154 WeakPolarHBondContact O-CB 3.3Å; F151-D154 PolarHBondContact O-N 3.36Å; F151-D154 VanDerWaalsContact O-N 3.14Å; F151-F189 HydrophobicContact CB-CD2 3.96Å; F151-F189 HydrophobicContact CB-CE2 3.89Å; F151-W242 AromaticContact CE1-CH2 3.8Å; F151-W242 HydrophobicContact CE1-CH2 3.8Å; F151-W242 HydrophobicContact CE1-CZ2 4.1Å; F151-W242 AromaticContact CZ-CH2 3.71Å; F151-W242 HydrophobicContact CZ-CH2 3.71Å; F151-W242 HydrophobicContact CZ-CZ2 4.01Å
152	V	72	Confident	74.5	Confident	10 Å²	10	38.9 Å²	38.9	6%	0.061	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	129.4	167.9	179	0	0	0	0	109	L47 V138 L197	L47-V152 HydrophobicContact CD2-CB 4.33Å; L47-V152 HydrophobicContact CD2-CG1 3.83Å; L47-V152 HydrophobicContact CG-CG1 4.33Å; V138-V152 HydrophobicContact CG2-CG2 4.38Å; V152-L197 HydrophobicContact CG1-CD1 3.7Å
153	G	73.7	Confident	76	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-2.4	-172.4	0	0	0	0	0	114.7	I135 F151 T155 N190	I135-G153 PolarHBondContact O-N 2.88Å; F151-G153 PolarHBondContact O-N 2.83Å; G153-T155 PolarHBondContact O-N 3.29Å; G153-N190 PolarHBondContact O-N 2.92Å
154	D	80.5	Confident	77.6	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	130.5	167.7	-85.1	-26.9	0	0	0	110.3	R105 L134 I135 F151 V187 F189	R105-D154 IonicContact CZ-OD1 3.62Å; R105-D154 IonicContact NH2-OD1 3.78Å; R105-D154 PolarHBondContact NH2-OD1 2.78Å; R105-D154 IonicContact NH2-OD2 2.73Å; R105-D154 PolarHBondContact NH2-OD2 2.89Å; L134-D154 CarbonylContact C-O 3.59Å; L134-D154 WeakPolarHBondContact CA-O 3.29Å; I135-D154 HydrophobicContact CB-CB 4.41Å; I135-D154 HydrophobicContact CD1-CB 3.5Å; I135-D154 VanDerWaalsContact CD1-CB 3.5Å; I135-D154 PolarHBondContact N-O 2.87Å; F151-D154 PolarHBondContact N-OD2 2.85Å; F151-D154 VanDerWaalsContact O-CB 3.3Å; F151-D154 WeakPolarHBondContact O-CB 3.3Å; F151-D154 PolarHBondContact O-N 3.36Å; F151-D154 VanDerWaalsContact O-N 3.14Å; D154-V187 HydrophobicContact CB-CB 4.21Å; D154-F189 WeakPolarHBondContact OD1-CA 3.47Å; D154-F189 WeakPolarHBondContact OD1-CD2 3.4Å; D154-F189 PolarHBondContact OD1-N 3.25Å
155	T	85.8	Confident	79.2	Confident	19 Å²	19	45 Å²	45	12%	0.117	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.8	169.1	-55.1	0	0	0	0	109	P132 V133 L134 G153 L157 V187 R188	P132-T155 HydrophobicContact CB-CG2 4.1Å; V133-T155 CarbonylContact O-C 3.44Å; V133-T155 VanDerWaalsContact O-CA 3.29Å; V133-T155 WeakPolarHBondContact O-CA 3.3Å; L134-T155 WeakPolarHBondContact CD2-OG1 3.34Å; G153-T155 PolarHBondContact O-N 3.29Å; T155-L157 HydrophobicContact CG2-CD2 4.19Å; T155-V187 CarbonylContact O-C 3.51Å; T155-V187 WeakPolarHBondContact O-CA 3.45Å; T155-R188 PolarHBondContact N-O 2.96Å; T155-R188 PolarHBondContact O-N 2.91Å
156	I	89	Confident	80.6	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.6	171.7	-56.1	177.5	0	0	0	108.1	F119 I121 V133 I135 V159 V164 L185 V187	F119-I156 HydrophobicContact CE2-CD1 4.27Å; I121-I156 HydrophobicContact CG2-CD1 3.6Å; V133-I156 HydrophobicContact CB-CB 4.3Å; V133-I156 HydrophobicContact CG1-CB 4.16Å; V133-I156 HydrophobicContact CG1-CD1 4.13Å; V133-I156 HydrophobicContact CG1-CG1 4.43Å; V133-I156 PolarHBondContact O-N 3.3Å; I135-I156 HydrophobicContact CD1-CD1 4.16Å; I135-I156 HydrophobicContact CD1-CG1 3.83Å; I135-I156 HydrophobicContact CG1-CD1 4.07Å; I135-I156 HydrophobicContact CG1-CG1 4.14Å; I156-V159 HydrophobicContact CG2-CG2 3.94Å; I156-V164 HydrophobicContact CG2-CG1 4.15Å; I156-V164 HydrophobicContact CG2-CG2 4.38Å; I156-V164 WeakPolarHBondContact O-CG2 3.34Å; I156-L185 HydrophobicContact CD1-CD1 4.48Å; I156-V187 HydrophobicContact CG1-CG1 4.27Å
157	L	89.7	Confident	81.9	Confident	43 Å²	43	41.3 Å²	41.3	23%	0.225	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-37.5	178.2	-58	177	0	0	0	111.6	E104 T155 P163 V164 K186 R188	E104-L157 HydrophobicContact CB-CD1 4.4Å; E104-L157 HydrophobicContact CG-CD1 3.73Å; E104-L157 VanDerWaalsContact OE1-CD1 3.23Å; E104-L157 WeakPolarHBondContact OE1-CD1 3.32Å; T155-L157 HydrophobicContact CG2-CD2 4.19Å; L157-P163 WeakPolarHBondContact O-CA 3.49Å; L157-V164 PolarHBondContact O-N 3.46Å; L157-K186 WeakPolarHBondContact CB-O 3.26Å; L157-K186 PolarHBondContact N-O 2.85Å; L157-R188 HydrophobicContact CD1-CB 4.02Å; L157-R188 HydrophobicContact CG-CB 4.45Å
158	A	89.7	Confident	83.2	Confident	10 Å²	10	38.4 Å²	38.4	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	151.2	177.2	0	0	0	0	0	111.7	E162 K186	A158-E162 CarbonylContact C-O 3.51Å; A158-E162 WeakPolarHBondContact CA-O 3.21Å; A158-E162 WeakPolarHBondContact CB-O 3.15Å; A158-K186 HydrophobicContact CB-CB 3.93Å; A158-K186 PolarHBondContact N-O 3.4Å; A158-K186 PolarHBondContact O-N 3.35Å
159	V	90.7	Very high	84.1	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	124.8	172.2	180	0	0	0	0	107.5	I156 Q161 E162 V164 M175 L176 V183 L185	I156-V159 HydrophobicContact CG2-CG2 3.94Å; V159-Q161 PolarHBondContact O-N 3.46Å; V159-E162 PolarHBondContact N-O 3.49Å; V159-E162 WeakPolarHBondContact O-CB 3.32Å; V159-E162 PolarHBondContact O-N 2.94Å; V159-V164 HydrophobicContact CG2-CG1 3.87Å; V159-M175 HydrophobicContact CB-CE 4.09Å; V159-M175 HydrophobicContact CG1-CB 4.46Å; V159-L176 HydrophobicContact CB-CD2 4.49Å; V159-L176 HydrophobicContact CG1-CD2 3.81Å; V159-L176 HydrophobicContact CG2-CD2 3.79Å; V159-L176 HydrophobicContact CG2-CG 4.36Å; V159-V183 HydrophobicContact CG1-CG1 3.84Å; V159-L185 HydrophobicContact CB-CD2 4.28Å; V159-L185 HydrophobicContact CG1-CD2 4.1Å; V159-L185 HydrophobicContact CG2-CD2 3.82Å
160	N	89.1	Confident	84.8	Confident	62 Å²	62	48.1 Å²	48.1	33%	0.332	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	44.2	-177.4	-61.6	-29.3	0	0	0	113	E162 T184	N160-E162 PolarHBondContact O-N 3.3Å; N160-T184 PolarHBondContact N-O 3.11Å; N160-T184 PolarHBondContact OD1-N 2.68Å
161	Q	85.6	Confident	85.3	Confident	187 Å²	187	52.2 Å²	52.2	87%	0.874	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	-2.2	-176.6	-48.8	175.8	13.7	0	0	115.7	V159	V159-Q161 PolarHBondContact O-N 3.46Å
162	E	89.8	Confident	86	Confident	100 Å²	100	51.9 Å²	51.9	47%	0.467	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.8	177.7	-163.7	-173.9	163.7	0	0	110.6	A158 V159 N160 K167 M175	A158-E162 CarbonylContact C-O 3.51Å; A158-E162 WeakPolarHBondContact CA-O 3.21Å; A158-E162 WeakPolarHBondContact CB-O 3.15Å; V159-E162 PolarHBondContact N-O 3.49Å; V159-E162 WeakPolarHBondContact O-CB 3.32Å; V159-E162 PolarHBondContact O-N 2.94Å; N160-E162 PolarHBondContact O-N 3.3Å; E162-K167 VanDerWaalsContact CG-NZ 3.32Å; E162-K167 IonicContact OE1-NZ 2.62Å; E162-K167 PolarHBondContact OE1-NZ 2.91Å; E162-K167 IonicContact OE2-NZ 3.91Å; E162-M175 HydrophobicContact CB-CE 3.61Å; E162-M175 HydrophobicContact CG-CE 3.78Å; E162-M175 WeakPolarHBondContact OE2-CE 3.1Å
163	P	89.5	Confident	86.7	Confident	81 Å²	81	54.6 Å²	54.6	53%	0.526	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	146.5	-178.5	26.8	-34	0	0	0	111.4	L157 K167	L157-P163 WeakPolarHBondContact O-CA 3.49Å; P163-K167 WeakPolarHBondContact O-CE 3.43Å; P163-K167 PolarHBondContact O-NZ 2.96Å
164	V	89.1	Confident	87.3	Confident	10 Å²	10	59 Å²	59	6%	0.061	31%	0.314	C	S	.	.			trans	-97.3	-6	177.7	-56.3	0	0	0	0	113.6	V133 I156 L157 V159 K167 I172	V133-V164 HydrophobicContact CB-CG2 4.35Å; V133-V164 HydrophobicContact CG2-CB 4.38Å; V133-V164 HydrophobicContact CG2-CG2 3.91Å; I156-V164 HydrophobicContact CG2-CG1 4.15Å; I156-V164 HydrophobicContact CG2-CG2 4.38Å; I156-V164 WeakPolarHBondContact O-CG2 3.34Å; L157-V164 PolarHBondContact O-N 3.46Å; V159-V164 HydrophobicContact CG2-CG1 3.87Å; V164-K167 WeakPolarHBondContact O-CB 3.25Å; V164-K167 PolarHBondContact O-N 3.44Å; V164-I172 HydrophobicContact CB-CG1 4.27Å; V164-I172 HydrophobicContact CG1-CG1 4.5Å
165	D	86.1	Confident	87.7	Confident	116 Å²	116	60 Å²	60	62%	0.62	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	135.6	176.9	-166.1	30.1	0	0	0	110.4	K130 K167	K130-D165 WeakPolarHBondContact CE-OD1 3.36Å; K130-D165 IonicContact NZ-OD1 3.96Å; K130-D165 PolarHBondContact NZ-OD1 2.9Å; K130-D165 IonicContact NZ-OD2 2.73Å; K130-D165 PolarHBondContact NZ-OD2 2.9Å; D165-K167 VanDerWaalsContact C-N 3.34Å
166	G	83.9	Confident	87.7	Confident	48 Å²	48	59.6 Å²	59.6	50%	0.495	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	-3.1	-176	0	0	0	0	0	115.9	E125	E125-G166 VanDerWaalsContact OE2-CA 3.25Å; E125-G166 WeakPolarHBondContact OE2-CA 3.33Å
167	K	88.3	Confident	87.4	Confident	33 Å²	33	63.1 Å²	63.1	14%	0.143	34%	0.34	C	S	.	.			trans	-98.6	146	-175.3	-66	-175.4	177.6	155.6	0	113.6	E125 E162 P163 V164 D165 E171 I172 M175	E125-K167 PolarHBondContact N-O 3.42Å; E162-K167 VanDerWaalsContact CG-NZ 3.32Å; E162-K167 IonicContact OE1-NZ 2.62Å; E162-K167 PolarHBondContact OE1-NZ 2.91Å; E162-K167 IonicContact OE2-NZ 3.91Å; P163-K167 WeakPolarHBondContact O-CE 3.43Å; P163-K167 PolarHBondContact O-NZ 2.96Å; V164-K167 WeakPolarHBondContact O-CB 3.25Å; V164-K167 PolarHBondContact O-N 3.44Å; D165-K167 VanDerWaalsContact C-N 3.34Å; K167-E171 HydrophobicContact CB-CB 4.26Å; K167-I172 HydrophobicContact CB-CD1 4.31Å; K167-I172 HydrophobicContact CB-CG1 3.9Å; K167-M175 HydrophobicContact CD-CE 4.43Å; K167-M175 HydrophobicContact CD-SD 3.35Å; K167-M175 WeakPolarHBondContact CD-SD 3.19Å; K167-M175 PolarHBondContact NZ-SD 3.39Å
168	T	87.9	Confident	86.8	Confident	50 Å²	50	68 Å²	68	31%	0.307	36%	0.359	S	S	.	.			trans	-69.2	156.6	172.5	65.1	0	0	0	0	111.4	E125 E170 E171 I172	E125-T168 VanDerWaalsContact O-CA 3.32Å; E125-T168 WeakPolarHBondContact O-CA 3.36Å; E125-T168 WeakPolarHBondContact O-CG2 3.45Å; T168-E170 PolarHBondContact O-N 2.8Å; T168-E171 PolarHBondContact N-OE2 3.4Å; T168-E171 PolarHBondContact O-N 2.86Å; T168-E171 WeakPolarHBondContact OG1-CB 3.3Å; T168-E171 VanDerWaalsContact OG1-CD 3.24Å; T168-E171 WeakPolarHBondContact OG1-CG 3.32Å; T168-E171 PolarHBondContact OG1-N 2.95Å; T168-E171 PolarHBondContact OG1-OE2 3.4Å; T168-I172 WeakPolarHBondContact O-CD1 3.07Å; T168-I172 VanDerWaalsContact O-CG1 3.31Å; T168-I172 WeakPolarHBondContact O-CG1 3.45Å; T168-I172 PolarHBondContact O-N 3.01Å; T168-I172 VanDerWaalsContact O-N 3.07Å
169	H	85.1	Confident	85.7	Confident	81 Å²	81	69.3 Å²	69.3	38%	0.375	37%	0.374	S	S	.	.	H	α-helix	trans	-53.3	-41.9	175.9	-175.9	78.1	0	0	0	112.1	G123 I172 V173	G123-H169 PolarHBondContact O-ND1 2.67Å; H169-I172 PolarHBondContact O-N 3.16Å; H169-V173 WeakPolarHBondContact O-CG2 3.22Å; H169-V173 PolarHBondContact O-N 3.15Å
170	E	86.2	Confident	85	Confident	146 Å²	146	71.3 Å²	71.3	68%	0.682	40%	0.396	S	S	*	.	H	α-helix	trans	-67.5	-41.5	-178.9	-65.8	170.1	-178.8	0	0	112	T168 I172 V173 Q174	T168-E170 PolarHBondContact O-N 2.8Å; E170-I172 VanDerWaalsContact C-N 3.33Å; E170-I172 PolarHBondContact O-N 2.95Å; E170-V173 PolarHBondContact O-N 3.26Å; E170-Q174 WeakPolarHBondContact O-CG 3.47Å; E170-Q174 PolarHBondContact O-N 3.29Å
171	E	86.8	Confident	84.6	Confident	90 Å²	90	73.2 Å²	73.2	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-62	-41.1	174.3	-74.6	165.8	148.9	0	0	111.6	K167 T168 Q174 M175	K167-E171 HydrophobicContact CB-CB 4.26Å; T168-E171 PolarHBondContact N-OE2 3.4Å; T168-E171 PolarHBondContact O-N 2.86Å; T168-E171 WeakPolarHBondContact OG1-CB 3.3Å; T168-E171 VanDerWaalsContact OG1-CD 3.24Å; T168-E171 WeakPolarHBondContact OG1-CG 3.32Å; T168-E171 PolarHBondContact OG1-N 2.95Å; T168-E171 PolarHBondContact OG1-OE2 3.4Å; E171-Q174 CarbonylContact O-C 3.56Å; E171-Q174 WeakPolarHBondContact O-CB 3.42Å; E171-Q174 PolarHBondContact O-N 3.43Å; E171-M175 VanDerWaalsContact O-CG 3.3Å; E171-M175 WeakPolarHBondContact O-CG 3.47Å; E171-M175 PolarHBondContact O-N 2.96Å
172	I	87.5	Confident	84.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-65.8	-43.4	178.1	-61.9	154.7	0	0	0	110.9	I121 V133 V164 K167 T168 H169 E170 Q174 M175 L176	I121-I172 HydrophobicContact CD1-CB 4.36Å; I121-I172 HydrophobicContact CD1-CG2 3.64Å; V133-I172 HydrophobicContact CB-CD1 4.48Å; V133-I172 HydrophobicContact CG1-CD1 4.36Å; V133-I172 HydrophobicContact CG1-CG2 4.13Å; V133-I172 HydrophobicContact CG2-CD1 3.31Å; V133-I172 HydrophobicContact CG2-CG1 4.41Å; V164-I172 HydrophobicContact CB-CG1 4.27Å; V164-I172 HydrophobicContact CG1-CG1 4.5Å; K167-I172 HydrophobicContact CB-CD1 4.31Å; K167-I172 HydrophobicContact CB-CG1 3.9Å; T168-I172 WeakPolarHBondContact O-CD1 3.07Å; T168-I172 VanDerWaalsContact O-CG1 3.31Å; T168-I172 WeakPolarHBondContact O-CG1 3.45Å; T168-I172 PolarHBondContact O-N 3.01Å; T168-I172 VanDerWaalsContact O-N 3.07Å; H169-I172 PolarHBondContact O-N 3.16Å; E170-I172 VanDerWaalsContact C-N 3.33Å; E170-I172 PolarHBondContact O-N 2.95Å; I172-Q174 VanDerWaalsContact C-N 3.26Å; I172-Q174 PolarHBondContact O-N 3.24Å; I172-M175 WeakPolarHBondContact O-CB 3.38Å; I172-M175 PolarHBondContact O-N 3.26Å; I172-M175 VanDerWaalsContact O-N 3.13Å; I172-L176 HydrophobicContact CG2-CD1 4.38Å; I172-L176 WeakPolarHBondContact O-CG 3.46Å; I172-L176 PolarHBondContact O-N 2.8Å
173	V	87.2	Confident	84.3	Confident	67 Å²	67	64.6 Å²	64.6	41%	0.406	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-37.8	173.8	173.1	0	0	0	0	110.8	I121 H169 E170 L176 S177	I121-V173 HydrophobicContact CD1-CG2 3.97Å; H169-V173 WeakPolarHBondContact O-CG2 3.22Å; H169-V173 PolarHBondContact O-N 3.15Å; E170-V173 PolarHBondContact O-N 3.26Å; V173-L176 PolarHBondContact O-N 3.04Å; V173-S177 WeakPolarHBondContact O-CB 3.48Å; V173-S177 PolarHBondContact O-N 3.06Å; V173-S177 PolarHBondContact O-OG 3.38Å
174	Q	86.3	Confident	84.2	Confident	93 Å²	93	63.1 Å²	63.1	44%	0.435	36%	0.36	S	S	.	.	H	α-helix	trans	-65.2	-39.1	172.7	-74.2	-176.9	30.6	0	0	112.4	E170 E171 I172 S177 K178	E170-Q174 WeakPolarHBondContact O-CG 3.47Å; E170-Q174 PolarHBondContact O-N 3.29Å; E171-Q174 CarbonylContact O-C 3.56Å; E171-Q174 WeakPolarHBondContact O-CB 3.42Å; E171-Q174 PolarHBondContact O-N 3.43Å; I172-Q174 VanDerWaalsContact C-N 3.26Å; I172-Q174 PolarHBondContact O-N 3.24Å; Q174-S177 WeakPolarHBondContact CA-OG 3.4Å; Q174-S177 PolarHBondContact O-N 3.21Å; Q174-S177 PolarHBondContact O-OG 3.11Å; Q174-K178 WeakPolarHBondContact O-CB 3.39Å; Q174-K178 WeakPolarHBondContact O-CG 3.42Å; Q174-K178 PolarHBondContact O-N 3.22Å; Q174-K178 VanDerWaalsContact OE1-NZ 3.12Å
175	M	87.5	Confident	84.2	Confident	19 Å²	19	62.6 Å²	62.6	9%	0.094	36%	0.357	C	S	.	.	H	α-helix	trans	-65.8	-38.4	175.9	-69.6	171.3	68.5	0	0	112.3	V159 E162 K167 E171 I172 S177 K178	V159-M175 HydrophobicContact CB-CE 4.09Å; V159-M175 HydrophobicContact CG1-CB 4.46Å; E162-M175 HydrophobicContact CB-CE 3.61Å; E162-M175 HydrophobicContact CG-CE 3.78Å; E162-M175 WeakPolarHBondContact OE2-CE 3.1Å; K167-M175 HydrophobicContact CD-CE 4.43Å; K167-M175 HydrophobicContact CD-SD 3.35Å; K167-M175 WeakPolarHBondContact CD-SD 3.19Å; K167-M175 PolarHBondContact NZ-SD 3.39Å; E171-M175 VanDerWaalsContact O-CG 3.3Å; E171-M175 WeakPolarHBondContact O-CG 3.47Å; E171-M175 PolarHBondContact O-N 2.96Å; I172-M175 WeakPolarHBondContact O-CB 3.38Å; I172-M175 PolarHBondContact O-N 3.26Å; I172-M175 VanDerWaalsContact O-N 3.13Å; M175-S177 VanDerWaalsContact C-N 3.32Å; M175-K178 VanDerWaalsContact O-O 3.1Å
176	L	85.6	Confident	84.3	Confident	12 Å²	12	61 Å²	61	6%	0.063	35%	0.345	C	S	.	.	H	α-helix	trans	-69	-31.2	175.5	-70.2	174	0	0	0	112.3	R111 L117 F119 I121 V159 I172 V173 V183 L185	R111-L176 PolarHBondContact NH2-O 3.3Å; L117-L176 HydrophobicContact CD1-CB 3.91Å; L117-L176 HydrophobicContact CD1-CD2 4.12Å; F119-L176 HydrophobicContact CE2-CD1 4.03Å; F119-L176 HydrophobicContact CZ-CD1 4.17Å; F119-L176 HydrophobicContact CZ-CD2 3.96Å; I121-L176 HydrophobicContact CD1-CD1 3.82Å; I121-L176 HydrophobicContact CG2-CD1 4.28Å; V159-L176 HydrophobicContact CB-CD2 4.49Å; V159-L176 HydrophobicContact CG1-CD2 3.81Å; V159-L176 HydrophobicContact CG2-CD2 3.79Å; V159-L176 HydrophobicContact CG2-CG 4.36Å; I172-L176 HydrophobicContact CG2-CD1 4.38Å; I172-L176 WeakPolarHBondContact O-CG 3.46Å; I172-L176 PolarHBondContact O-N 2.8Å; V173-L176 PolarHBondContact O-N 3.04Å; L176-V183 HydrophobicContact CD2-CG1 4.12Å; L176-L185 HydrophobicContact CD2-CD2 3.68Å
177	S	82.9	Confident	84.4	Confident	75 Å²	75	58.7 Å²	58.7	52%	0.524	32%	0.321	S	S	.	.	H	α-helix	trans	-82.6	-33.6	175.1	59.5	0	0	0	0	113.1	R111 V173 Q174 M175 G179	R111-S177 PolarHBondContact NH2-O 2.67Å; V173-S177 WeakPolarHBondContact O-CB 3.48Å; V173-S177 PolarHBondContact O-N 3.06Å; V173-S177 PolarHBondContact O-OG 3.38Å; Q174-S177 WeakPolarHBondContact CA-OG 3.4Å; Q174-S177 PolarHBondContact O-N 3.21Å; Q174-S177 PolarHBondContact O-OG 3.11Å; M175-S177 VanDerWaalsContact C-N 3.32Å; S177-G179 PolarHBondContact O-N 3.04Å; S177-G179 VanDerWaalsContact O-N 3.08Å
178	K	76.9	Confident	84.1	Confident	145 Å²	145	60.9 Å²	60.9	63%	0.63	33%	0.329	S	S	*	.	S	Bend	trans	-77.3	85.4	173.4	-71.1	170.3	-179	168.5	0	110	Q174 M175	Q174-K178 WeakPolarHBondContact O-CB 3.39Å; Q174-K178 WeakPolarHBondContact O-CG 3.42Å; Q174-K178 PolarHBondContact O-N 3.22Å; Q174-K178 VanDerWaalsContact OE1-NZ 3.12Å; M175-K178 VanDerWaalsContact O-O 3.1Å
179	G	68.2	Low	83.3	Confident	38 Å²	38	59.8 Å²	59.8	39%	0.392	32%	0.32	S	S	.	.	S	Bend	trans	-171.7	166.4	174.6	0	0	0	0	0	112.6	S177	S177-G179 PolarHBondContact O-N 3.04Å; S177-G179 VanDerWaalsContact O-N 3.08Å
180	G	74.9	Confident	82.5	Confident	45 Å²	45	58.9 Å²	58.9	46%	0.464	32%	0.317	S	S	.	.	S	Bend	trans	-70.4	-159.2	177	0	0	0	0	0	113.7	R111 E182	R111-G180 WeakPolarHBondContact CD-O 3.32Å; R111-G180 PolarHBondContact NE-O 3.39Å; G180-E182 PolarHBondContact O-N 2.99Å; G180-E182 VanDerWaalsContact O-N 3.17Å
181	P	81.2	Confident	81.3	Confident	101 Å²	101	52.1 Å²	52.1	66%	0.656	29%	0.287	S	S	*	.	S	Bend	trans	-63.5	-18.1	178.9	27.3	-35	0	0	0	113.3	R111	R111-P181 PolarHBondContact N-O 2.87Å
182	E	82.8	Confident	80	Confident	107 Å²	107	48.7 Å²	48.7	50%	0.5	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.2	-179.9	-63	-179.4	162.6	0	0	110.8	V108 I109 T110 G180	V108-E182 HydrophobicContact CG1-CB 4.09Å; V108-E182 HydrophobicContact CG1-CG 4.41Å; I109-E182 CarbonylContact O-C 3.56Å; I109-E182 WeakPolarHBondContact O-CA 3.42Å; T110-E182 HydrophobicContact CG2-CG 4.41Å; G180-E182 PolarHBondContact O-N 2.99Å; G180-E182 VanDerWaalsContact O-N 3.17Å
183	V	86.3	Confident	78.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.9	174.2	178	0	0	0	0	108.3	I109 L117 V159 L176 L185	I109-V183 PolarHBondContact N-O 3.45Å; I109-V183 PolarHBondContact O-N 3.47Å; L117-V183 HydrophobicContact CD1-CG2 4.26Å; L117-V183 HydrophobicContact CD2-CB 4.14Å; L117-V183 HydrophobicContact CD2-CG2 3.64Å; V159-V183 HydrophobicContact CG1-CG1 3.84Å; L176-V183 HydrophobicContact CD2-CG1 4.12Å; V183-L185 HydrophobicContact CG1-CD2 3.73Å; V183-L185 HydrophobicContact CG1-CG 4.34Å
184	T	87.1	Confident	77.4	Confident	49 Å²	49	48 Å²	48	30%	0.301	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.3	176.8	-59.1	0	0	0	0	109.5	T106 V108 N160	T106-T184 HydrophobicContact CG2-CG2 3.36Å; V108-T184 HydrophobicContact CG2-CG2 4.45Å; N160-T184 PolarHBondContact N-O 3.11Å; N160-T184 PolarHBondContact OD1-N 2.68Å
185	L	89.1	Confident	75.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.5	176.7	-57.1	-174.8	0	0	0	110.5	T106 V107 I109 F119 L150 I156 V159 L176 V183 V187	T106-L185 CarbonylContact C-O 3.45Å; T106-L185 WeakPolarHBondContact CA-O 3.49Å; V107-L185 PolarHBondContact N-O 2.98Å; V107-L185 PolarHBondContact O-N 3.36Å; I109-L185 HydrophobicContact CD1-CD1 3.45Å; I109-L185 VanDerWaalsContact CD1-CD1 3.45Å; I109-L185 HydrophobicContact CD1-CG 4.09Å; F119-L185 HydrophobicContact CE1-CD1 4.1Å; F119-L185 HydrophobicContact CE2-CD1 4.37Å; F119-L185 HydrophobicContact CZ-CD1 3.74Å; L150-L185 HydrophobicContact CD1-CD1 4.34Å; I156-L185 HydrophobicContact CD1-CD1 4.48Å; V159-L185 HydrophobicContact CB-CD2 4.28Å; V159-L185 HydrophobicContact CG1-CD2 4.1Å; V159-L185 HydrophobicContact CG2-CD2 3.82Å; L176-L185 HydrophobicContact CD2-CD2 3.68Å; V183-L185 HydrophobicContact CG1-CD2 3.73Å; V183-L185 HydrophobicContact CG1-CG 4.34Å; L185-V187 HydrophobicContact CB-CG1 3.83Å; L185-V187 HydrophobicContact CD1-CG1 4.49Å
186	K	88	Confident	74.3	Confident	81 Å²	81	54.1 Å²	54.1	35%	0.352	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.6	163.1	-165.5	176.4	-173.8	-169.8	0	107.9	E104 R105 L157 A158	E104-K186 HydrophobicContact CB-CG 4.35Å; E104-K186 WeakPolarHBondContact OE2-CE 3.21Å; E104-K186 IonicContact OE2-NZ 3.76Å; E104-K186 PolarHBondContact OE2-NZ 2.79Å; R105-K186 CarbonylContact O-C 3.58Å; R105-K186 WeakPolarHBondContact O-CA 3.29Å; L157-K186 WeakPolarHBondContact CB-O 3.26Å; L157-K186 PolarHBondContact N-O 2.85Å; A158-K186 HydrophobicContact CB-CB 3.93Å; A158-K186 PolarHBondContact N-O 3.4Å; A158-K186 PolarHBondContact O-N 3.35Å
187	V	86.9	Confident	72.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.3	-173.8	-58	0	0	0	0	111.8	E104 R105 V107 I135 L150 D154 T155 I156 L185	E104-V187 CarbonylContact C-O 3.52Å; E104-V187 WeakPolarHBondContact CA-O 3.46Å; R105-V187 HydrophobicContact CB-CG2 4.05Å; R105-V187 PolarHBondContact N-O 3.49Å; R105-V187 PolarHBondContact O-N 3.03Å; V107-V187 HydrophobicContact CG2-CG2 3.85Å; I135-V187 HydrophobicContact CD1-CG1 4.33Å; L150-V187 HydrophobicContact CD1-CG1 4.06Å; L150-V187 HydrophobicContact CD1-CG2 4.43Å; D154-V187 HydrophobicContact CB-CB 4.21Å; T155-V187 CarbonylContact O-C 3.51Å; T155-V187 WeakPolarHBondContact O-CA 3.45Å; I156-V187 HydrophobicContact CG1-CG1 4.27Å; L185-V187 HydrophobicContact CB-CG1 3.83Å; L185-V187 HydrophobicContact CD1-CG1 4.49Å
188	R	82.7	Confident	71	Confident	80 Å²	80	52.8 Å²	52.8	30%	0.302	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.8	170.7	-173.3	-176.2	-59.7	151.8	3.8	109.2	D102 E104 T155 L157 N190	D102-R188 IonicContact OD1-CZ 2.59Å; D102-R188 IonicContact OD1-NE 3.87Å; E104-R188 IonicContact OE1-CZ 2.79Å; E104-R188 IonicContact OE1-NH2 3.48Å; E104-R188 PolarHBondContact OE1-NH2 2.86Å; T155-R188 PolarHBondContact N-O 2.96Å; T155-R188 PolarHBondContact O-N 2.91Å; L157-R188 HydrophobicContact CD1-CB 4.02Å; L157-R188 HydrophobicContact CG-CB 4.45Å; R188-N190 PolarHBondContact O-N 2.77Å
189	F	69.9	Low	69.3	Low	27 Å²	27	53.3 Å²	53.3	12%	0.118	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	122	176.7	-172.1	-111.7	0	0	0	110.2	L64 G72 P74 F151 D154 A194	L64-F189 HydrophobicContact CD2-CE1 3.96Å; L64-F189 HydrophobicContact CD2-CZ 3.91Å; G72-F189 VanDerWaalsContact O-CE1 3.28Å; G72-F189 WeakPolarHBondContact O-CE1 3.48Å; P74-F189 HydrophobicContact CG-CD1 4.46Å; P74-F189 HydrophobicContact CG-CD2 4.27Å; P74-F189 HydrophobicContact CG-CE2 4.34Å; P74-F189 HydrophobicContact CG-CG 4.34Å; P74-F189 HydrophobicContact CG-CZ 4.46Å; F151-F189 HydrophobicContact CB-CD2 3.96Å; F151-F189 HydrophobicContact CB-CE2 3.89Å; D154-F189 WeakPolarHBondContact OD1-CA 3.47Å; D154-F189 WeakPolarHBondContact OD1-CD2 3.4Å; D154-F189 PolarHBondContact OD1-N 3.25Å; F189-A194 HydrophobicContact CZ-CB 4.4Å
190	N	69.1	Low	67.8	Low	61 Å²	61	55.9 Å²	55.9	33%	0.326	29%	0.293	S	S	.	.			trans	-112.4	92.9	173.1	-169.6	-23.7	0	0	0	110.1	G153 R188 G192 M193 A194	G153-N190 PolarHBondContact O-N 2.92Å; R188-N190 PolarHBondContact O-N 2.77Å; N190-G192 PolarHBondContact O-N 3.04Å; N190-G192 VanDerWaalsContact O-N 3.16Å; N190-G192 PolarHBondContact OD1-N 3.32Å; N190-G192 VanDerWaalsContact OD1-N 3.13Å; N190-M193 HydrophobicContact CB-CB 4.12Å; N190-M193 HydrophobicContact CB-CG 4.06Å; N190-M193 WeakPolarHBondContact ND2-CG 3.22Å; N190-M193 PolarHBondContact O-N 3.25Å; N190-M193 PolarHBondContact OD1-N 3.21Å; N190-A194 PolarHBondContact O-N 3.25Å; N190-A194 VanDerWaalsContact O-N 3.1Å
191	S	60	Low	66.1	Low	5 Å²	5	56.7 Å²	56.7	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-53.5	-35	177.9	179.7	0	0	0	0	112.6	M193 R195	S191-M193 PolarHBondContact O-N 2.93Å; S191-R195 PolarHBondContact O-N 3.11Å
192	G	60.5	Low	63.8	Low	17 Å²	17	57 Å²	57	18%	0.175	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-39.2	175.8	0	0	0	0	0	113	N190 R195 F196	N190-G192 PolarHBondContact O-N 3.04Å; N190-G192 VanDerWaalsContact O-N 3.16Å; N190-G192 PolarHBondContact OD1-N 3.32Å; N190-G192 VanDerWaalsContact OD1-N 3.13Å; G192-R195 WeakPolarHBondContact O-CB 3.44Å; G192-R195 PolarHBondContact O-N 3.19Å; G192-F196 WeakPolarHBondContact O-CD2 3.42Å; G192-F196 PolarHBondContact O-N 2.7Å
193	M	62.4	Low	61.2	Low	51 Å²	51	58.3 Å²	58.3	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-78.1	-31.9	-179.5	-64.1	-53.5	-70.2	0	0	113.1	L134 N190 S191 R195 F196 L197	L134-M193 HydrophobicContact CD1-CB 4.33Å; L134-M193 HydrophobicContact CD1-CE 3.44Å; L134-M193 VanDerWaalsContact CD1-CE 3.44Å; L134-M193 HydrophobicContact CD1-CG 4.45Å; L134-M193 HydrophobicContact CD2-CB 4Å; L134-M193 HydrophobicContact CD2-CG 4.14Å; N190-M193 HydrophobicContact CB-CB 4.12Å; N190-M193 HydrophobicContact CB-CG 4.06Å; N190-M193 WeakPolarHBondContact ND2-CG 3.22Å; N190-M193 PolarHBondContact O-N 3.25Å; N190-M193 PolarHBondContact OD1-N 3.21Å; S191-M193 PolarHBondContact O-N 2.93Å; M193-R195 VanDerWaalsContact C-N 3.26Å; M193-R195 PolarHBondContact O-N 2.81Å; M193-F196 PolarHBondContact O-N 3.49Å; M193-F196 HydrophobicContact SD-CD2 3.95Å; M193-L197 PolarHBondContact O-N 3.39Å
194	A	57.3	Low	58.5	Low	1 Å²	1	63.6 Å²	63.6	1%	0.008	34%	0.338	C	S	.	.	H	α-helix	trans	-54	-46.7	169.5	0	0	0	0	0	110.5	L47 F189 N190 F196 L197 C198	L47-A194 HydrophobicContact CD2-CB 4.04Å; L47-A194 VanDerWaalsContact CD2-O 3.24Å; L47-A194 WeakPolarHBondContact CD2-O 3.45Å; F189-A194 HydrophobicContact CZ-CB 4.4Å; N190-A194 PolarHBondContact O-N 3.25Å; N190-A194 VanDerWaalsContact O-N 3.1Å; A194-F196 PolarHBondContact O-N 2.94Å; A194-L197 WeakPolarHBondContact O-CB 3.44Å; A194-L197 PolarHBondContact O-N 3.12Å; A194-C198 PolarHBondContact O-N 2.98Å; A194-C198 PolarHBondContact O-SG 3.06Å
195	R	52.5	Low	55.7	Low	107 Å²	107	66.1 Å²	66.1	40%	0.404	36%	0.364	S	S	.	.	H	α-helix	trans	-60.1	-38.3	177.4	-70.8	173.7	-178.1	164.7	4.7	114.5	S191 G192 M193 L197 C198 E294	S191-R195 PolarHBondContact O-N 3.11Å; G192-R195 WeakPolarHBondContact O-CB 3.44Å; G192-R195 PolarHBondContact O-N 3.19Å; M193-R195 VanDerWaalsContact C-N 3.26Å; M193-R195 PolarHBondContact O-N 2.81Å; R195-L197 VanDerWaalsContact C-N 3.31Å; R195-L197 PolarHBondContact O-N 3Å; R195-C198 VanDerWaalsContact O-CB 3.31Å; R195-C198 WeakPolarHBondContact O-CB 3.36Å; R195-C198 PolarHBondContact O-N 2.82Å; R195-E294 WeakPolarHBondContact CG-OE1 3.29Å; R195-E294 IonicContact NE-OE1 2.92Å
196	F	55.7	Low	52.8	Low	134 Å²	134	71 Å²	71	59%	0.588	40%	0.398	S	S	*	.	H	α-helix	trans	-68.3	-31.7	179.1	-76.7	-72.4	0	0	0	112.2	G192 M193 A194 C198	G192-F196 WeakPolarHBondContact O-CD2 3.42Å; G192-F196 PolarHBondContact O-N 2.7Å; M193-F196 PolarHBondContact O-N 3.49Å; M193-F196 HydrophobicContact SD-CD2 3.95Å; A194-F196 PolarHBondContact O-N 2.94Å; F196-C198 VanDerWaalsContact C-N 3.27Å; F196-C198 PolarHBondContact O-N 3.34Å
197	L	54.7	Low	49.7	Very low	36 Å²	36	72.6 Å²	72.6	19%	0.188	42%	0.415	C	S	.	.	H	α-helix	trans	-67.6	-27.9	174.7	-64.1	170.5	0	0	0	111.8	K122 V152 M193 A194 R195	K122-L197 HydrophobicContact CD-CD2 4.49Å; V152-L197 HydrophobicContact CG1-CD1 3.7Å; M193-L197 PolarHBondContact O-N 3.39Å; A194-L197 WeakPolarHBondContact O-CB 3.44Å; A194-L197 PolarHBondContact O-N 3.12Å; R195-L197 VanDerWaalsContact C-N 3.31Å; R195-L197 PolarHBondContact O-N 3Å
198	C	43.9	Very low	47.1	Very low	23 Å²	23	79.4 Å²	79.4	16%	0.155	46%	0.456	C	S	.	.	H	α-helix	trans	-64.4	-43.8	177.8	-55.3	0	0	0	0	113.8	L47 A194 R195 F196 S200 A201 T202 E294	L47-C198 HydrophobicContact CD1-CB 4.1Å; L47-C198 WeakPolarHBondContact CD1-SG 3.4Å; A194-C198 PolarHBondContact O-N 2.98Å; A194-C198 PolarHBondContact O-SG 3.06Å; R195-C198 VanDerWaalsContact O-CB 3.31Å; R195-C198 WeakPolarHBondContact O-CB 3.36Å; R195-C198 PolarHBondContact O-N 2.82Å; F196-C198 VanDerWaalsContact C-N 3.27Å; F196-C198 PolarHBondContact O-N 3.34Å; C198-S200 VanDerWaalsContact C-N 3.25Å; C198-S200 PolarHBondContact O-N 2.97Å; C198-A201 PolarHBondContact O-N 2.92Å; C198-T202 PolarHBondContact O-N 2.75Å; C198-T202 PolarHBondContact O-OG1 3.38Å; C198-E294 PolarHBondContact SG-OE2 3.09Å
199	K	42.1	Very low	44.4	Very low	156 Å²	156	86 Å²	86	68%	0.678	48%	0.481	S	S	*	.	H	α-helix	trans	-66.2	-27	-175.4	-72.5	-174.6	178.7	179.5	0	113.3
200	S	36.3	Very low	42.3	Very low	92 Å²	92	90.5 Å²	90.5	64%	0.643	52%	0.515	S	S	*	.	H	α-helix	trans	-79.6	-22.6	174.8	-66	0	0	0	0	113	C198	C198-S200 VanDerWaalsContact C-N 3.25Å; C198-S200 PolarHBondContact O-N 2.97Å
201	A	39.3	Very low	40.1	Very low	63 Å²	63	95 Å²	95	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-77.9	-35.2	178.9	0	0	0	0	0	112.3	C198 N203 T204	C198-A201 PolarHBondContact O-N 2.92Å; A201-N203 PolarHBondContact O-N 2.91Å; A201-T204 PolarHBondContact O-OG1 3.4Å
202	T	32.5	Very low	38.7	Very low	106 Å²	106	99.7 Å²	99.7	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-78.5	-15.6	-174.8	44	0	0	0	0	115.2	C198 T204	C198-T202 PolarHBondContact O-N 2.75Å; C198-T202 PolarHBondContact O-OG1 3.38Å; T202-T204 PolarHBondContact O-N 3.19Å
203	N	29.2	Very low	37.1	Very low	136 Å²	136	108.4 Å²	108.4	73%	0.727	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	7.2	-178.5	-87.2	2.5	0	0	0	115.6	A201	A201-N203 PolarHBondContact O-N 2.91Å
204	T	29.6	Very low	35.5	Very low	111 Å²	111	112.8 Å²	112.8	68%	0.681	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	5	-177.4	52.2	0	0	0	0	115.3	A201 T202 S206	A201-T204 PolarHBondContact O-OG1 3.4Å; T202-T204 PolarHBondContact O-N 3.19Å; T204-S206 VanDerWaalsContact C-N 3.25Å; T204-S206 PolarHBondContact O-N 2.98Å
205	A	28.2	Very low	34.1	Very low	102 Å²	102	121.8 Å²	121.8	84%	0.843	68%	0.678	S	S	*	*	S	Bend	trans	-82.4	10	173.6	0	0	0	0	0	114.7
206	S	27.4	Very low	32.8	Very low	101 Å²	101	125.4 Å²	125.4	71%	0.706	70%	0.696	S	S	*	*			trans	-126.1	72.3	171.5	64.9	0	0	0	0	111.1	T204	T204-S206 VanDerWaalsContact C-N 3.25Å; T204-S206 PolarHBondContact O-N 2.98Å
207	T	24.3	Very low	31.7	Very low	116 Å²	116	125.1 Å²	125.1	71%	0.712	71%	0.708	S	S	*	*			trans	-138.6	67.3	157.7	-54.7	0	0	0	0	108.7
208	V	31	Very low	30.5	Very low	142 Å²	142	129.9 Å²	129.9	86%	0.861	73%	0.734	S	S	*	*			trans	-106.3	105.6	149	178.8	0	0	0	0	105.6
209	R	25.5	Very low	29.7	Very low	220 Å²	220	138.1 Å²	138.1	83%	0.83	77%	0.77	S	S	*	*			trans	-61.8	130.1	159.9	-66.5	172.8	173.3	157.2	-2.4	107.1
210	S	26.9	Very low	29.3	Very low	120 Å²	120	137.8 Å²	137.8	84%	0.839	77%	0.774	S	S	*	*				-176.3	133.3	121.6	-74.5	0	0	0	0	110
211	D	23.6	Very low	29.3	Very low	156 Å²	156	137.9 Å²	137.9	83%	0.834	77%	0.773	S	S	*	*			trans	-46.3	149.3	176	-74.3	-56.9	0	0	0	115.1
212	S	29.9	Very low	29	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	79%	0.787	S	S	*	*				130.7	108.4	123.5	61	0	0	0	0	115.8
213	F	27.6	Very low	29	Very low	199 Å²	199	143.2 Å²	143.2	87%	0.873	79%	0.786	S	S	*	*			trans	21.4	116.9	145.3	-66.8	-93.1	0	0	0	119.2
214	T	28.8	Very low	29.4	Very low	144 Å²	144	143 Å²	143	88%	0.883	79%	0.785	S	S	*	*				174.3	149.8	109	31.8	0	0	0	0	111.8
215	E	26.4	Very low	30.1	Very low	190 Å²	190	143.5 Å²	143.5	89%	0.888	78%	0.784	S	S	*	*			trans	-68.4	125.2	-177.2	-61.5	164.9	140.7	0	0	113.4
216	K	25.3	Very low	31.1	Very low	182 Å²	182	142.6 Å²	142.6	79%	0.791	76%	0.761	S	S	*	*				174.7	141.7	125.4	-101.6	177.3	178	176.7	0	110.3	D218	K216-D218 PolarHBondContact O-N 3.39Å; K216-D218 VanDerWaalsContact O-N 3.16Å
217	P	32.5	Very low	32.3	Very low	129 Å²	129	143.6 Å²	143.6	84%	0.838	76%	0.757	S	S	*	*			trans	-83.7	91.9	-179.5	32.3	-28.6	0	0	0	109.5
218	D	30.8	Very low	34	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	75%	0.75	S	S	*	*			trans	-79.8	127.3	166.8	-74.9	-33.7	0	0	0	109.5	K216 I220	K216-D218 PolarHBondContact O-N 3.39Å; K216-D218 VanDerWaalsContact O-N 3.16Å; D218-I220 PolarHBondContact O-N 3.31Å
219	E	27	Very low	35.5	Very low	197 Å²	197	136.7 Å²	136.7	92%	0.921	72%	0.716	S	S	*	*			trans	-52	119.3	171.6	-62.8	172.3	156.3	0	0	110.5
220	I	33.1	Very low	37.5	Very low	148 Å²	148	127.9 Å²	127.9	76%	0.759	69%	0.686	S	S	*	*			trans	-130.2	135.6	173.7	-59.5	174.8	0	0	0	109.1	D218	D218-I220 PolarHBondContact O-N 3.31Å
221	P	35.5	Very low	39.7	Very low	95 Å²	95	124.7 Å²	124.7	62%	0.617	66%	0.662	S	S	*	*			trans	-82.6	139.6	-155.3	-3.8	22.9	0	0	0	113	T223	P221-T223 PolarHBondContact O-N 3.08Å
222	E	33.4	Very low	41.8	Very low	178 Å²	178	122.9 Å²	122.9	83%	0.832	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	9.3	-177.1	-62.4	-173	151.9	0	0	116.1
223	T	34.1	Very low	43.3	Very low	103 Å²	103	119.5 Å²	119.5	63%	0.632	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-24.3	-170.6	8.8	0	0	0	0	115	P221	P221-T223 PolarHBondContact O-N 3.08Å
224	D	36.8	Very low	44.5	Very low	132 Å²	132	115.4 Å²	115.4	71%	0.706	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-14.8	-172.2	-80.4	-17.2	0	0	0	115.3
225	N	45	Very low	45.4	Very low	120 Å²	120	115.8 Å²	115.8	64%	0.642	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-17.4	-177.7	-83.9	-26.8	0	0	0	114.7	S228	N225-S228 PolarHBondContact O-OG 2.86Å
226	F	48.1	Very low	46.6	Very low	83 Å²	83	109.6 Å²	109.6	36%	0.364	60%	0.6	S	S	.	*	S	Bend	trans	-76	-25.3	-176.5	-83.6	-80	0	0	0	113.8	S228 F229 K297 L301	F226-S228 PolarHBondContact O-N 3.15Å; F226-F229 PolarHBondContact O-N 2.92Å; F226-K297 HydrophobicContact CE1-CB 4.4Å; F226-L301 HydrophobicContact CD1-CD1 4.21Å; F226-L301 HydrophobicContact CD1-CD2 3.68Å; F226-L301 HydrophobicContact CD1-CG 3.98Å; F226-L301 HydrophobicContact CE1-CD2 4.22Å; F226-L301 HydrophobicContact CE1-CG 4.33Å
227	I	53.3	Low	47.8	Very low	123 Å²	123	108 Å²	108	63%	0.631	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-63.6	-31.3	-177.1	-57.3	175.2	0	0	0	111	F229 V230	I227-F229 PolarHBondContact O-N 3.45Å; I227-F229 VanDerWaalsContact O-N 3.14Å; I227-V230 PolarHBondContact O-N 3.14Å
228	S	60	Low	48.9	Very low	80 Å²	80	107 Å²	107	56%	0.559	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-63	-20.8	-179.5	65.9	0	0	0	0	115	N225 F226	N225-S228 PolarHBondContact O-OG 2.86Å; F226-S228 PolarHBondContact O-N 3.15Å
229	F	63	Low	50.3	Low	32 Å²	32	101.4 Å²	101.4	14%	0.14	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-90	-15.1	179.7	-65.9	-81.6	0	0	0	113.8	I52 F226 I227 D295 K297 V298 L301	I52-F229 PolarHBondContact N-O 3.4Å; F226-F229 PolarHBondContact O-N 2.92Å; I227-F229 PolarHBondContact O-N 3.45Å; I227-F229 VanDerWaalsContact O-N 3.14Å; F229-D295 VanDerWaalsContact CE1-OD2 3.3Å; F229-D295 WeakPolarHBondContact CE1-OD2 3.33Å; F229-K297 HydrophobicContact CE2-CB 4.23Å; F229-K297 HydrophobicContact CE2-CD 3.55Å; F229-K297 HydrophobicContact CZ-CB 4.27Å; F229-K297 HydrophobicContact CZ-CD 3.61Å; F229-V298 HydrophobicContact CB-CG2 4.48Å; F229-V298 HydrophobicContact CD1-CG2 3.63Å; F229-V298 HydrophobicContact CE1-CG2 4.24Å; F229-V298 HydrophobicContact CG-CG2 4.3Å; F229-L301 HydrophobicContact CB-CD1 3.75Å
230	V	66.1	Low	52	Low	36 Å²	36	97.9 Å²	97.9	22%	0.218	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	107.2	-178.2	-175.3	0	0	0	0	109.4	I52 R54 I227 L301	I52-V230 HydrophobicContact CB-CG2 4.48Å; I52-V230 CarbonylContact O-C 3.13Å; I52-V230 VanDerWaalsContact O-CA 3.23Å; I52-V230 WeakPolarHBondContact O-CA 3.29Å; R54-V230 HydrophobicContact CB-CG1 4.06Å; I227-V230 PolarHBondContact O-N 3.14Å; V230-L301 HydrophobicContact CG2-CD1 3.97Å
231	T	74.1	Confident	53.7	Low	53 Å²	53	91.2 Å²	91.2	33%	0.325	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	125.7	179.5	-55.1	0	0	0	0	110.3	I52 Y53 R54	I52-T231 PolarHBondContact O-N 2.59Å; Y53-T231 CarbonylContact C-O 3.3Å; Y53-T231 WeakPolarHBondContact CA-O 3.32Å; Y53-T231 HydrophobicContact CD1-CG2 4.28Å; Y53-T231 HydrophobicContact CE1-CG2 4.29Å; R54-T231 PolarHBondContact N-O 2.72Å
232	T	66.9	Low	55.6	Low	117 Å²	117	88.4 Å²	88.4	72%	0.718	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.7	174.8	51	0	0	0	0	110.7	R54	R54-T232 WeakPolarHBondContact O-CA 3.31Å
233	C	62.6	Low	57.7	Low	34 Å²	34	84.5 Å²	84.5	23%	0.23	47%	0.471	C	S	.	.			trans	-126	141.4	178.4	52.5	0	0	0	0	112	R54 S55	R54-C233 PolarHBondContact O-N 3.25Å; S55-C233 WeakPolarHBondContact CB-O 3.2Å; S55-C233 PolarHBondContact OG-O 2.94Å
234	S	52.5	Low	60.2	Low	112 Å²	112	83.8 Å²	83.8	78%	0.783	46%	0.463	S	S	*	.	S	Bend	trans	-86.5	-29.8	-170.9	-51.2	0	0	0	0	114.6
235	D	47.9	Very low	62.4	Low	152 Å²	152	80.4 Å²	80.4	81%	0.813	44%	0.444	S	S	*	.			trans	-140.2	106.4	-172.7	-66.6	-54.7	0	0	0	110.2
236	V	50.1	Low	64.4	Low	61 Å²	61	76.5 Å²	76.5	37%	0.37	43%	0.425	S	S	.	.			trans	-114.6	90.6	169.4	-173.4	0	0	0	0	108.1
237	L	50.9	Low	66.5	Low	149 Å²	149	75.8 Å²	75.8	78%	0.78	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-53.6	137.5	152.5	-71.9	169.2	0	0	0	107.1	P239	L237-P239 WeakPolarHBondContact O-CD 3.28Å
238	P	54.9	Low	68.4	Low	106 Å²	106	70 Å²	70	69%	0.688	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-51.9	120.8	173.6	20	-30	0	0	0	107.6	K240	P238-K240 PolarHBondContact O-N 3.47Å
239	P	61.5	Low	70.1	Confident	19 Å²	19	69.1 Å²	69.1	12%	0.123	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-60.3	130.9	-175	21.7	-30.5	0	0	0	108.2	R76 L237 W242	R76-P239 VanDerWaalsContact NH1-CD 3.27Å; R76-P239 VanDerWaalsContact NH1-CG 3.28Å; L237-P239 WeakPolarHBondContact O-CD 3.28Å; P239-W242 HydrophobicContact CG-CG 4.27Å
240	K	62.3	Low	71.6	Confident	122 Å²	122	67.6 Å²	67.6	53%	0.53	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	151.8	175.3	-67.8	-174.4	177.3	-177.1	0	109.2	C144 S146 P238 W242	C144-K240 WeakPolarHBondContact O-CB 3.49Å; C144-K240 PolarHBondContact O-N 3.1Å; S146-K240 CarbonylContact O-C 3.54Å; S146-K240 VanDerWaalsContact O-O 3.13Å; P238-K240 PolarHBondContact O-N 3.47Å; K240-W242 PolarHBondContact O-N 3.21Å
241	G	68.3	Low	73	Confident	8 Å²	8	70.3 Å²	70.3	8%	0.082	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	14.1	177.4	0	0	0	0	0	116.4	P89 T90 D147	P89-G241 CarbonylContact C-O 3.55Å; P89-G241 VanDerWaalsContact CA-O 3.22Å; P89-G241 WeakPolarHBondContact CA-O 3.47Å; T90-G241 VanDerWaalsContact CG2-C 3.47Å; T90-G241 PolarHBondContact N-O 3.46Å; D147-G241 VanDerWaalsContact C-CA 3.48Å; D147-G241 WeakPolarHBondContact O-CA 3.28Å
242	W	75.8	Confident	73.9	Confident	36 Å²	36	69.1 Å²	69.1	14%	0.136	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.6	169.8	-64.6	85.2	0	0	0	111.4	L62 R76 Q87 L88 P89 P149 F151 P239 K240	L62-W242 HydrophobicContact CD2-CH2 3.42Å; L62-W242 VanDerWaalsContact CD2-CH2 3.42Å; L62-W242 HydrophobicContact CD2-CZ2 3.62Å; L62-W242 HydrophobicContact CD2-CZ3 4.43Å; R76-W242 HydrophobicContact CB-CD2 4.07Å; R76-W242 HydrophobicContact CB-CE3 3.53Å; R76-W242 HydrophobicContact CB-CH2 3.85Å; R76-W242 HydrophobicContact CB-CZ2 4.36Å; R76-W242 HydrophobicContact CB-CZ3 3.41Å; R76-W242 VanDerWaalsContact CB-CZ3 3.41Å; Q87-W242 HydrophobicContact CB-CB 4.39Å; Q87-W242 HydrophobicContact CB-CE3 4.03Å; L88-W242 CarbonylContact O-C 3.48Å; L88-W242 WeakPolarHBondContact O-CA 3.32Å; P89-W242 VanDerWaalsContact CD-CZ3 3.47Å; P89-W242 HydrophobicContact CG-CE3 4.17Å; P89-W242 HydrophobicContact CG-CH2 3.96Å; P89-W242 HydrophobicContact CG-CZ3 3.77Å; P149-W242 HydrophobicContact CB-CZ2 4.16Å; P149-W242 HydrophobicContact CG-CZ2 3.86Å; F151-W242 AromaticContact CE1-CH2 3.8Å; F151-W242 HydrophobicContact CE1-CH2 3.8Å; F151-W242 HydrophobicContact CE1-CZ2 4.1Å; F151-W242 AromaticContact CZ-CH2 3.71Å; F151-W242 HydrophobicContact CZ-CH2 3.71Å; F151-W242 HydrophobicContact CZ-CZ2 4.01Å; P239-W242 HydrophobicContact CG-CG 4.27Å; K240-W242 PolarHBondContact O-N 3.21Å
243	K	77.6	Confident	75.2	Confident	97 Å²	97	63.7 Å²	63.7	42%	0.422	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.2	179.2	-178.2	178	177.8	-179.8	0	109.8	Q87 L88 T90 I245	Q87-K243 CarbonylContact C-O 3.57Å; Q87-K243 VanDerWaalsContact CA-O 3.28Å; Q87-K243 WeakPolarHBondContact CA-O 3.37Å; L88-K243 PolarHBondContact N-O 3.42Å; L88-K243 PolarHBondContact O-N 2.91Å; T90-K243 HydrophobicContact CG2-CB 4.19Å; K243-I245 PolarHBondContact O-N 3.11Å
244	N	86.8	Confident	76.5	Confident	88 Å²	88	63.4 Å²	63.4	47%	0.471	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	122.7	171.1	-65.6	-5.7	0	0	0	109.1	T85 Q87	T85-N244 HydrophobicContact CG2-CB 4.01Å; T85-N244 WeakPolarHBondContact CG2-OD1 3.32Å; Q87-N244 WeakPolarHBondContact CG-OD1 3.46Å; Q87-N244 PolarHBondContact NE2-OD1 2.91Å
245	I	83	Confident	78.3	Confident	60 Å²	60	58.4 Å²	58.4	31%	0.308	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-36.5	175.5	55.9	151.4	0	0	0	112	L65 V86 L88 K243	L65-I245 HydrophobicContact CD1-CD1 4.25Å; V86-I245 HydrophobicContact CB-CD1 4.37Å; V86-I245 HydrophobicContact CB-CG1 4.1Å; V86-I245 HydrophobicContact CG1-CD1 3.84Å; V86-I245 HydrophobicContact CG1-CG1 3.98Å; V86-I245 WeakPolarHBondContact O-CG1 3.45Å; V86-I245 PolarHBondContact O-N 3.29Å; L88-I245 HydrophobicContact CB-CG2 3.95Å; L88-I245 HydrophobicContact CD1-CD1 3.91Å; L88-I245 HydrophobicContact CD1-CG2 3.86Å; L88-I245 HydrophobicContact CD2-CD1 4.3Å; L88-I245 HydrophobicContact CG-CD1 3.69Å; L88-I245 HydrophobicContact CG-CG1 4.04Å; L88-I245 HydrophobicContact CG-CG2 3.77Å; K243-I245 PolarHBondContact O-N 3.11Å
246	T	87.1	Confident	80	Confident	38 Å²	38	51.6 Å²	51.6	23%	0.233	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	127.8	-176.5	-51	0	0	0	0	108.4	T85 V86 I248 T286	T85-T246 WeakPolarHBondContact CA-O 3.46Å; V86-T246 PolarHBondContact N-O 3.41Å; V86-T246 PolarHBondContact O-N 2.96Å; T246-I248 HydrophobicContact CG2-CG1 4.14Å; T246-T286 HydrophobicContact CG2-CG2 4.12Å
247	T	92	Very high	81.3	Confident	69 Å²	69	51.3 Å²	51.3	42%	0.423	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.1	172.3	-64.8	0	0	0	0	108.4	T83 T85	T83-T247 HydrophobicContact CG2-CG2 4.1Å; T85-T247 WeakPolarHBondContact CG2-OG1 3.27Å; T85-T247 WeakPolarHBondContact OG1-CG2 3.5Å; T85-T247 PolarHBondContact OG1-OG1 3.33Å; T85-T247 VanDerWaalsContact OG1-OG1 3.14Å
248	I	92.8	Very high	82	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.1	-178.5	-69.9	-175.1	0	0	0	109.7	T83 L84 T246 V280 T286 T288	T83-I248 CarbonylContact C-O 3.58Å; T83-I248 VanDerWaalsContact CA-O 3.24Å; T83-I248 WeakPolarHBondContact CA-O 3.34Å; L84-I248 PolarHBondContact N-O 3.25Å; L84-I248 PolarHBondContact O-N 3.27Å; T246-I248 HydrophobicContact CG2-CG1 4.14Å; I248-V280 VanDerWaalsContact CD1-O 3.31Å; I248-V280 WeakPolarHBondContact CD1-O 3.48Å; I248-V280 HydrophobicContact CG2-CG1 4.34Å; I248-T286 HydrophobicContact CG1-CG2 4.41Å; I248-T288 HydrophobicContact CD1-CG2 3.42Å; I248-T288 VanDerWaalsContact CD1-CG2 3.42Å; I248-T288 VanDerWaalsContact CD1-N 3.35Å; I248-T288 HydrophobicContact CG1-CG2 4.36Å
249	P	95.1	Very high	82.2	Confident	62 Å²	62	44.6 Å²	44.6	40%	0.403	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	132.4	166.7	26.9	-28.2	0	0	0	109.5	S282	P249-S282 WeakPolarHBondContact CD-OG 3.38Å; P249-S282 WeakPolarHBondContact CG-OG 3.42Å; P249-S282 PolarHBondContact O-OG 3.45Å; P249-S282 VanDerWaalsContact O-OG 3.12Å
250	L	95.7	Very high	81.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.			trans	-85	-15.5	-175.6	-67.4	177.8	0	0	0	113.2	L79 E82 L84 M252 A253 V280 I306 N309 I310 L313	L79-L250 HydrophobicContact CD1-CD1 3.52Å; E82-L250 WeakPolarHBondContact O-CB 3.35Å; E82-L250 PolarHBondContact O-N 3.42Å; L84-L250 HydrophobicContact CB-CD2 3.9Å; L84-L250 HydrophobicContact CB-CG 4.48Å; L250-M252 PolarHBondContact O-N 2.9Å; L250-A253 WeakPolarHBondContact O-CB 3.44Å; L250-A253 PolarHBondContact O-N 3.16Å; L250-A253 VanDerWaalsContact O-N 3.09Å; L250-V280 HydrophobicContact CD2-CG1 4.3Å; L250-I306 HydrophobicContact CD2-CG2 4.07Å; L250-N309 HydrophobicContact CD1-CB 3.83Å; L250-I310 HydrophobicContact CB-CG1 4.01Å; L250-I310 HydrophobicContact CD2-CD1 4.39Å; L250-I310 HydrophobicContact CD2-CG1 4.08Å; L250-I310 WeakPolarHBondContact O-CG1 3.29Å; L250-L313 HydrophobicContact CB-CD1 3.51Å
251	Q	94.5	Very high	80.7	Confident	93 Å²	93	47.8 Å²	47.8	44%	0.435	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	124.3	175.6	-179.2	171.3	-46.3	0	0	109.5	A253 L313	Q251-A253 PolarHBondContact O-N 2.99Å; Q251-A253 VanDerWaalsContact O-N 3.09Å; Q251-L313 HydrophobicContact CB-CB 4.28Å; Q251-L313 HydrophobicContact CB-CD1 4.37Å
252	M	93.2	Very high	79.5	Confident	28 Å²	28	49.1 Å²	49.1	14%	0.138	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	17.2	-174.3	-55.6	173.7	-178.3	0	0	114.5	L250 V283 N314 L334 W336 F359 P373	L250-M252 PolarHBondContact O-N 2.9Å; M252-V283 HydrophobicContact CB-CB 4.34Å; M252-N314 WeakPolarHBondContact CA-OD1 3.27Å; M252-N314 PolarHBondContact N-OD1 2.8Å; M252-L334 HydrophobicContact CE-CD1 4.46Å; M252-W336 PolarHBondContact O-NE1 3.36Å; M252-F359 HydrophobicContact CB-CE2 4.26Å; M252-F359 HydrophobicContact CB-CZ 4.32Å; M252-F359 HydrophobicContact CG-CE2 4.49Å; M252-F359 HydrophobicContact CG-CZ 4.07Å; M252-F359 HydrophobicContact SD-CZ 4.38Å; M252-P373 HydrophobicContact CB-CG 4.3Å; M252-P373 HydrophobicContact SD-CB 3.81Å; M252-P373 HydrophobicContact SD-CG 4.42Å
253	A	93.8	Very high	77.9	Confident	2 Å²	2	50 Å²	50	2%	0.017	25%	0.252	C	S	.	.			trans	-75.3	170.1	170.1	0	0	0	0	0	111	L250 Q251 V280 R281 I310	L250-A253 WeakPolarHBondContact O-CB 3.44Å; L250-A253 PolarHBondContact O-N 3.16Å; L250-A253 VanDerWaalsContact O-N 3.09Å; Q251-A253 PolarHBondContact O-N 2.99Å; Q251-A253 VanDerWaalsContact O-N 3.09Å; A253-V280 HydrophobicContact CB-CG1 4.42Å; A253-R281 CarbonylContact C-O 3.54Å; A253-R281 WeakPolarHBondContact CA-O 3.47Å; A253-R281 VanDerWaalsContact CB-O 3.23Å; A253-R281 WeakPolarHBondContact CB-O 3.47Å; A253-I310 HydrophobicContact CB-CD1 4.07Å; A253-I310 HydrophobicContact CB-CG1 4.26Å; A253-I310 WeakPolarHBondContact O-CG2 3.24Å
254	Y	90.8	Very high	76.1	Confident	28 Å²	28	54 Å²	54	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	154.2	168.2	67.2	-76.5	0	0	0	112.1	T256 V280 R281 W336 P357	Y254-T256 HydrophobicContact CE2-CG2 4.26Å; Y254-V280 WeakPolarHBondContact O-CA 3.26Å; Y254-R281 HydrophobicContact CD1-CB 4.14Å; Y254-R281 HydrophobicContact CE1-CB 3.61Å; Y254-R281 PolarHBondContact N-O 3.46Å; Y254-R281 PolarHBondContact O-N 3.21Å; Y254-R281 WeakPolarHBondContact OH-CD 3.47Å; Y254-W336 HydrophobicContact CD1-CB 4.4Å; Y254-W336 AromaticContact CD1-CD1 3.68Å; Y254-W336 AromaticContact CD1-CD2 3.59Å; Y254-W336 HydrophobicContact CD1-CD2 3.59Å; Y254-W336 AromaticContact CD1-CE2 3.55Å; Y254-W336 HydrophobicContact CD1-CE3 4.27Å; Y254-W336 AromaticContact CD1-CG 3.66Å; Y254-W336 HydrophobicContact CD1-CG 3.66Å; Y254-W336 HydrophobicContact CD1-CZ2 4.17Å; Y254-W336 AromaticContact CD1-NE1 3.59Å; Y254-W336 AromaticContact CE1-CD2 3.98Å; Y254-W336 HydrophobicContact CE1-CD2 3.98Å; Y254-W336 AromaticContact CE1-CE2 3.95Å; Y254-W336 HydrophobicContact CE1-CE3 4.23Å; Y254-W336 HydrophobicContact CE1-CG 4.47Å; Y254-W336 HydrophobicContact CE1-CH2 4.38Å; Y254-W336 HydrophobicContact CE1-CZ2 4.15Å; Y254-W336 HydrophobicContact CE1-CZ3 4.43Å; Y254-W336 HydrophobicContact CG-CB 4.06Å; Y254-W336 AromaticContact CG-CD1 3.93Å; Y254-W336 HydrophobicContact CG-CD2 4.15Å; Y254-W336 AromaticContact CG-CG 3.78Å; Y254-W336 HydrophobicContact CG-CG 3.78Å; Y254-P357 HydrophobicContact CE2-CB 4.4Å
255	V	90.5	Very high	73.6	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	136.2	172.8	-173.5	0	0	0	0	107.5	F278 E279 V280 V303 I306 I310 E425	V255-F278 HydrophobicContact CG1-CB 4.15Å; V255-F278 HydrophobicContact CG1-CD2 3.91Å; V255-F278 HydrophobicContact CG1-CG 4.38Å; V255-E279 CarbonylContact C-O 3.42Å; V255-E279 WeakPolarHBondContact CA-O 3.4Å; V255-V280 HydrophobicContact CG2-CG2 4.19Å; V255-V303 HydrophobicContact CG1-CG1 4.25Å; V255-V303 HydrophobicContact CG1-CG2 4.27Å; V255-I306 HydrophobicContact CG2-CB 4.19Å; V255-I306 HydrophobicContact CG2-CG2 3.55Å; V255-I310 HydrophobicContact CG2-CD1 3.97Å; V255-E425 WeakPolarHBondContact O-CG 3.43Å
256	T	84.3	Confident	71.3	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.5	172.6	-169.4	0	0	0	0	112.2	Y254 F278 E279 E425	Y254-T256 HydrophobicContact CE2-CG2 4.26Å; T256-F278 WeakPolarHBondContact O-CA 3.4Å; T256-E279 HydrophobicContact CG2-CB 4.13Å; T256-E279 PolarHBondContact N-O 3.34Å; T256-E279 PolarHBondContact O-N 3.4Å; T256-E425 PolarHBondContact OG1-OE1 2.79Å; T256-E425 VanDerWaalsContact OG1-OE1 3.13Å
257	R	77.3	Confident	68.9	Low	55 Å²	55	64.7 Å²	64.7	21%	0.208	32%	0.316	C	S	.	.			trans	-107	-4.4	179.3	-65.1	-169	61.1	146	-1.1	114.4	R274 S275 F278 E425	R257-R274 PolarHBondContact NH2-O 2.87Å; R257-R274 WeakPolarHBondContact O-CB 3.43Å; R257-R274 PolarHBondContact O-N 3.1Å; R257-S275 PolarHBondContact NH2-O 2.9Å; R257-F278 HydrophobicContact CG-CB 4.2Å; R257-E425 PolarHBondContact N-OE2 3.44Å
258	Y	65.5	Low	66.2	Low	29 Å²	29	64.6 Å²	64.6	11%	0.114	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-94.8	141.6	-173.2	-60.8	-80	0	0	0	111.5	R406 E425	Y258-R406 HydrophobicContact CE1-CG 3.8Å; Y258-R406 HydrophobicContact CE2-CG 4.29Å; Y258-E425 WeakPolarHBondContact CD2-OE1 3.45Å; Y258-E425 WeakPolarHBondContact CE2-OE2 3.3Å
259	L	58.5	Low	63.7	Low	85 Å²	85	68.2 Å²	68.2	45%	0.445	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-82.3	137.7	168.5	-148.9	79	0	0	0	108.7	G261 T262 R274	L259-G261 PolarHBondContact O-N 3.35Å; L259-T262 HydrophobicContact CB-CG2 3.75Å; L259-T262 WeakPolarHBondContact CB-OG1 3.22Å; L259-T262 HydrophobicContact CD2-CG2 3.4Å; L259-T262 VanDerWaalsContact CD2-CG2 3.4Å; L259-T262 HydrophobicContact CG-CG2 4.11Å; L259-T262 PolarHBondContact O-OG1 2.81Å; L259-R274 HydrophobicContact CD1-CG 4.43Å
260	W	48.3	Very low	60.9	Low	183 Å²	183	73.8 Å²	73.8	69%	0.693	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	129.9	171.1	-67.8	2.9	0	0	0	109.5	T262	W260-T262 PolarHBondContact O-N 3.36Å
261	G	44.3	Very low	58.1	Low	25 Å²	25	80.8 Å²	80.8	26%	0.258	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	-0.1	173.1	0	0	0	0	0	118.4	L259 D263 L352	L259-G261 PolarHBondContact O-N 3.35Å; G261-D263 PolarHBondContact O-N 2.94Å; G261-L352 VanDerWaalsContact CA-O 3.23Å; G261-L352 WeakPolarHBondContact CA-O 3.37Å; G261-L352 PolarHBondContact N-O 3.1Å; G261-L352 VanDerWaalsContact O-CD2 3.24Å; G261-L352 WeakPolarHBondContact O-CD2 3.46Å
262	T	41.9	Very low	55.7	Low	36 Å²	36	77.2 Å²	77.2	22%	0.221	37%	0.373	C	S	.	.			trans	-86.1	6.9	-176.3	51.3	0	0	0	0	116.3	L259 W260 R264 T272	L259-T262 HydrophobicContact CB-CG2 3.75Å; L259-T262 WeakPolarHBondContact CB-OG1 3.22Å; L259-T262 HydrophobicContact CD2-CG2 3.4Å; L259-T262 VanDerWaalsContact CD2-CG2 3.4Å; L259-T262 HydrophobicContact CG-CG2 4.11Å; L259-T262 PolarHBondContact O-OG1 2.81Å; W260-T262 PolarHBondContact O-N 3.36Å; T262-R264 PolarHBondContact O-N 3.18Å; T262-R264 VanDerWaalsContact O-N 3.08Å; T262-T272 WeakPolarHBondContact O-CG2 3.22Å
263	D	42.1	Very low	53.3	Low	54 Å²	54	77.8 Å²	77.8	29%	0.289	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	1.1	-172.8	-95.1	1.8	0	0	0	115.7	G261 W355	G261-D263 PolarHBondContact O-N 2.94Å; D263-W355 PolarHBondContact OD2-NE1 3.24Å
264	R	39.7	Very low	51.3	Low	181 Å²	181	79.3 Å²	79.3	68%	0.683	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	19.3	-177.3	-86.8	-137.8	-153.8	129.4	4.1	119.7	T262 Y266	T262-R264 PolarHBondContact O-N 3.18Å; T262-R264 VanDerWaalsContact O-N 3.08Å; R264-Y266 PolarHBondContact O-N 3.43Å
265	C	34.3	Very low	49.7	Very low	72 Å²	72	81.6 Å²	81.6	49%	0.486	41%	0.405	S	S	.	.			trans	-81.7	86	166.8	-128.4	0	0	0	0	110.7	V267 V268 I269	C265-V267 PolarHBondContact O-N 2.85Å; C265-V268 HydrophobicContact CB-CB 4.28Å; C265-V268 CarbonylContact O-C 3.43Å; C265-V268 PolarHBondContact O-N 3.18Å; C265-I269 PolarHBondContact O-N 2.94Å
266	Y	36.1	Very low	48.6	Very low	207 Å²	207	84.6 Å²	84.6	81%	0.812	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-13.8	175	-157.1	-95.8	0	0	0	112.8	R264 I269	R264-Y266 PolarHBondContact O-N 3.43Å; Y266-I269 HydrophobicContact CD2-CD1 4.25Å; Y266-I269 HydrophobicContact CG-CD1 4.3Å; Y266-I269 VanDerWaalsContact O-CD1 3.27Å; Y266-I269 WeakPolarHBondContact O-CD1 3.39Å
267	V	37.2	Very low	48.3	Very low	133 Å²	133	84.1 Å²	84.1	81%	0.806	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	8	177	-174.3	0	0	0	0	113.1	C265	C265-V267 PolarHBondContact O-N 2.85Å
268	V	33.6	Very low	48.8	Very low	67 Å²	67	81.5 Å²	81.5	41%	0.406	41%	0.408	S	S	.	.			trans	-140.8	53.8	166.3	-162.2	0	0	0	0	110.2	C265 H270 M271	C265-V268 HydrophobicContact CB-CB 4.28Å; C265-V268 CarbonylContact O-C 3.43Å; C265-V268 PolarHBondContact O-N 3.18Å; V268-H270 PolarHBondContact O-N 2.89Å; V268-H270 VanDerWaalsContact O-N 3.12Å; V268-M271 HydrophobicContact CG1-CB 3.97Å; V268-M271 HydrophobicContact CG1-CG 3.92Å; V268-M271 HydrophobicContact CG1-SD 3.89Å; V268-M271 PolarHBondContact O-N 2.84Å
269	I	40.4	Very low	49.8	Very low	77 Å²	77	80.7 Å²	80.7	40%	0.395	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-65.9	-11.8	-179.1	-65.6	172.8	0	0	0	112.6	C265 Y266 K405	C265-I269 PolarHBondContact O-N 2.94Å; Y266-I269 HydrophobicContact CD2-CD1 4.25Å; Y266-I269 HydrophobicContact CG-CD1 4.3Å; Y266-I269 VanDerWaalsContact O-CD1 3.27Å; Y266-I269 WeakPolarHBondContact O-CD1 3.39Å; I269-K405 PolarHBondContact O-NZ 2.88Å
270	H	36.5	Very low	51.4	Low	178 Å²	178	76.6 Å²	76.6	82%	0.824	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-87.6	2.3	176.4	-79.5	-88.2	0	0	0	115.3	V268	V268-H270 PolarHBondContact O-N 2.89Å; V268-H270 VanDerWaalsContact O-N 3.12Å
271	M	37	Very low	53.4	Low	147 Å²	147	70.1 Å²	70.1	72%	0.724	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-123.9	14.3	178.7	-67.9	-178	90.8	0	0	115.5	V268	V268-M271 HydrophobicContact CG1-CB 3.97Å; V268-M271 HydrophobicContact CG1-CG 3.92Å; V268-M271 HydrophobicContact CG1-SD 3.89Å; V268-M271 PolarHBondContact O-N 2.84Å
272	T	43.9	Very low	55.5	Low	19 Å²	19	69 Å²	69	12%	0.117	35%	0.348	C	S	.	.	S	Bend	trans	-88.1	-27.7	-171.9	54.4	0	0	0	0	116.2	T262	T262-T272 WeakPolarHBondContact O-CG2 3.22Å
273	C	43.4	Very low	57.6	Low	39 Å²	39	69.6 Å²	69.6	26%	0.264	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-85.9	141.4	157.4	-84.1	0	0	0	0	106.8	S275	C273-S275 PolarHBondContact O-N 2.98Å
274	R	51.9	Low	59.5	Low	34 Å²	34	72.2 Å²	72.2	13%	0.128	37%	0.365	C	S	.	.			trans	-60.8	89.5	157.9	-65.4	175.7	178.7	154.6	-2.1	105.8	R257 L259 N276 G277 E279 V290	R257-R274 PolarHBondContact NH2-O 2.87Å; R257-R274 WeakPolarHBondContact O-CB 3.43Å; R257-R274 PolarHBondContact O-N 3.1Å; L259-R274 HydrophobicContact CD1-CG 4.43Å; R274-N276 PolarHBondContact O-N 3.18Å; R274-G277 WeakPolarHBondContact CB-O 3.41Å; R274-G277 PolarHBondContact O-N 3.45Å; R274-E279 IonicContact CZ-OE2 3.37Å; R274-E279 IonicContact NH1-OE2 3.87Å; R274-E279 PolarHBondContact NH1-OE2 2.83Å; R274-E279 IonicContact NH2-OE2 3.79Å; R274-E279 PolarHBondContact NH2-OE2 3.24Å; R274-V290 VanDerWaalsContact CZ-CG2 3.49Å
275	S	56.1	Low	61.5	Low	77 Å²	77	65.8 Å²	65.8	54%	0.538	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-32.9	-173.2	50	0	0	0	0	110.2	R257 C273	R257-S275 PolarHBondContact NH2-O 2.9Å; C273-S275 PolarHBondContact O-N 2.98Å
276	N	69	Low	64	Low	69 Å²	69	65.1 Å²	65.1	37%	0.369	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	30.7	-174.4	-69.2	4.8	0	0	0	112.1	R274 L292 I293	R274-N276 PolarHBondContact O-N 3.18Å; N276-L292 CarbonylContact O-C 3.5Å; N276-L292 VanDerWaalsContact O-CA 3.23Å; N276-L292 WeakPolarHBondContact O-CA 3.4Å; N276-I293 CarbonylContact C-O 3.57Å; N276-I293 WeakPolarHBondContact CA-O 3.32Å; N276-I293 WeakPolarHBondContact CB-O 3.44Å; N276-I293 PolarHBondContact O-N 2.85Å
277	G	78.2	Confident	66.3	Low	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	164.4	179.2	0	0	0	0	0	117.3	R274 I291	R274-G277 WeakPolarHBondContact CB-O 3.41Å; R274-G277 PolarHBondContact O-N 3.45Å; G277-I291 CarbonylContact C-O 3.58Å; G277-I291 WeakPolarHBondContact CA-O 3.45Å
278	F	86.7	Confident	68.5	Low	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	167.5	177.7	71	-80.5	0	0	0	110.3	L77 V255 T256 R257 V280 I291 I293 L299 W302 V303 I306	L77-F278 HydrophobicContact CD1-CZ 4.14Å; V255-F278 HydrophobicContact CG1-CB 4.15Å; V255-F278 HydrophobicContact CG1-CD2 3.91Å; V255-F278 HydrophobicContact CG1-CG 4.38Å; T256-F278 WeakPolarHBondContact O-CA 3.4Å; R257-F278 HydrophobicContact CG-CB 4.2Å; F278-V280 HydrophobicContact CD2-CG2 3.86Å; F278-V280 HydrophobicContact CE2-CG2 3.71Å; F278-I291 HydrophobicContact CD1-CB 4.22Å; F278-I291 HydrophobicContact CD1-CG2 4.18Å; F278-I291 HydrophobicContact CD2-CD1 4.4Å; F278-I291 HydrophobicContact CE1-CB 3.96Å; F278-I291 HydrophobicContact CE1-CD1 4.45Å; F278-I291 HydrophobicContact CE1-CG2 3.56Å; F278-I291 HydrophobicContact CE2-CB 4.48Å; F278-I291 HydrophobicContact CE2-CD1 3.68Å; F278-I291 HydrophobicContact CZ-CB 4.11Å; F278-I291 HydrophobicContact CZ-CD1 3.73Å; F278-I291 HydrophobicContact CZ-CG2 3.87Å; F278-I291 PolarHBondContact N-O 3.14Å; F278-I291 PolarHBondContact O-N 2.97Å; F278-I293 HydrophobicContact CD1-CD1 4.41Å; F278-I293 HydrophobicContact CE1-CD1 3.63Å; F278-I293 HydrophobicContact CE1-CG1 4.3Å; F278-L299 HydrophobicContact CB-CD1 4.46Å; F278-L299 HydrophobicContact CD1-CD1 3.38Å; F278-L299 HydrophobicContact CE1-CD1 4.03Å; F278-L299 HydrophobicContact CG-CD1 4.33Å; F278-W302 HydrophobicContact CE1-CB 4.12Å; F278-W302 HydrophobicContact CZ-CB 4.12Å; F278-V303 HydrophobicContact CB-CG2 4.16Å; F278-V303 HydrophobicContact CD1-CG2 4.24Å; F278-V303 HydrophobicContact CG-CG2 4.07Å; F278-I306 HydrophobicContact CD2-CD1 4.49Å; F278-I306 HydrophobicContact CE2-CD1 3.47Å; F278-I306 VanDerWaalsContact CE2-CD1 3.47Å; F278-I306 HydrophobicContact CZ-CD1 3.77Å
279	E	87.1	Confident	70.7	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.051	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	142	176.1	176.6	-179	169	0	0	108.1	V255 T256 R274 R281 S287	V255-E279 CarbonylContact C-O 3.42Å; V255-E279 WeakPolarHBondContact CA-O 3.4Å; T256-E279 HydrophobicContact CG2-CB 4.13Å; T256-E279 PolarHBondContact N-O 3.34Å; T256-E279 PolarHBondContact O-N 3.4Å; R274-E279 IonicContact CZ-OE2 3.37Å; R274-E279 IonicContact NH1-OE2 3.87Å; R274-E279 PolarHBondContact NH1-OE2 2.83Å; R274-E279 IonicContact NH2-OE2 3.79Å; R274-E279 PolarHBondContact NH2-OE2 3.24Å; E279-R281 HydrophobicContact CG-CG 4.39Å; E279-R281 IonicContact OE1-CZ 2.95Å; E279-R281 IonicContact OE1-NE 3.94Å; E279-R281 PolarHBondContact OE1-NE 2.98Å; E279-R281 IonicContact OE1-NH2 3.95Å; E279-R281 PolarHBondContact OE1-NH2 2.99Å; E279-S287 VanDerWaalsContact CD-OG 3.26Å; E279-S287 WeakPolarHBondContact CG-OG 3.1Å; E279-S287 PolarHBondContact OE1-OG 3.44Å
280	V	91.4	Very high	72.7	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.1	174.3	-174.4	0	0	0	0	108.2	L84 I248 L250 A253 Y254 V255 F278 S287 T288 I306	L84-V280 HydrophobicContact CD2-CB 3.9Å; L84-V280 HydrophobicContact CD2-CG1 4.29Å; L84-V280 HydrophobicContact CD2-CG2 3.57Å; I248-V280 VanDerWaalsContact CD1-O 3.31Å; I248-V280 WeakPolarHBondContact CD1-O 3.48Å; I248-V280 HydrophobicContact CG2-CG1 4.34Å; L250-V280 HydrophobicContact CD2-CG1 4.3Å; A253-V280 HydrophobicContact CB-CG1 4.42Å; Y254-V280 WeakPolarHBondContact O-CA 3.26Å; V255-V280 HydrophobicContact CG2-CG2 4.19Å; F278-V280 HydrophobicContact CD2-CG2 3.86Å; F278-V280 HydrophobicContact CE2-CG2 3.71Å; V280-S287 WeakPolarHBondContact O-CA 3.44Å; V280-T288 HydrophobicContact CB-CG2 3.92Å; V280-T288 PolarHBondContact N-OG1 2.97Å; V280-T288 VanDerWaalsContact N-OG1 3.09Å; V280-T288 PolarHBondContact O-N 3.25Å; V280-I306 HydrophobicContact CG2-CD1 4.23Å; V280-I306 HydrophobicContact CG2-CG2 4.17Å
281	R	90.1	Very high	75	Confident	46 Å²	46	38.5 Å²	38.5	17%	0.174	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.5	178.2	-73.7	178.3	176.1	-128.7	1.5	109.8	A253 Y254 E279 T286	A253-R281 CarbonylContact C-O 3.54Å; A253-R281 WeakPolarHBondContact CA-O 3.47Å; A253-R281 VanDerWaalsContact CB-O 3.23Å; A253-R281 WeakPolarHBondContact CB-O 3.47Å; Y254-R281 HydrophobicContact CD1-CB 4.14Å; Y254-R281 HydrophobicContact CE1-CB 3.61Å; Y254-R281 PolarHBondContact N-O 3.46Å; Y254-R281 PolarHBondContact O-N 3.21Å; Y254-R281 WeakPolarHBondContact OH-CD 3.47Å; E279-R281 HydrophobicContact CG-CG 4.39Å; E279-R281 IonicContact OE1-CZ 2.95Å; E279-R281 IonicContact OE1-NE 3.94Å; E279-R281 PolarHBondContact OE1-NE 2.98Å; E279-R281 IonicContact OE1-NH2 3.95Å; E279-R281 PolarHBondContact OE1-NH2 2.99Å; R281-T286 WeakPolarHBondContact CA-O 3.36Å
282	S	88.9	Confident	77	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.014	21%	0.205	C	C	.	.			trans	-82.2	173.1	174.1	-157.2	0	0	0	0	111.7	P249 D284 G285 T286	P249-S282 WeakPolarHBondContact CD-OG 3.38Å; P249-S282 WeakPolarHBondContact CG-OG 3.42Å; P249-S282 PolarHBondContact O-OG 3.45Å; P249-S282 VanDerWaalsContact O-OG 3.12Å; S282-D284 VanDerWaalsContact CB-OD1 3.27Å; S282-D284 WeakPolarHBondContact CB-OD1 3.35Å; S282-D284 PolarHBondContact O-N 3.13Å; S282-G285 PolarHBondContact O-N 2.86Å; S282-G285 VanDerWaalsContact O-N 3.12Å; S282-T286 PolarHBondContact N-O 2.89Å
283	V	86.8	Confident	78.8	Confident	48 Å²	48	32 Å²	32	29%	0.291	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-32	176.5	57.1	0	0	0	0	113.2	M252 G285 P373	M252-V283 HydrophobicContact CB-CB 4.34Å; V283-G285 VanDerWaalsContact C-N 3.27Å; V283-G285 PolarHBondContact O-N 2.9Å; V283-P373 HydrophobicContact CG2-CB 4.01Å; V283-P373 HydrophobicContact CG2-CG 3.67Å
284	D	82.3	Confident	80.3	Confident	110 Å²	110	32.1 Å²	32.1	59%	0.588	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.2	179.3	68.2	-7	0	0	0	113.5	S282 T286	S282-D284 VanDerWaalsContact CB-OD1 3.27Å; S282-D284 WeakPolarHBondContact CB-OD1 3.35Å; S282-D284 PolarHBondContact O-N 3.13Å; D284-T286 VanDerWaalsContact C-N 3.34Å; D284-T286 WeakPolarHBondContact OD1-CB 3.24Å; D284-T286 PolarHBondContact OD1-N 3.47Å; D284-T286 PolarHBondContact OD1-OG1 3.3Å; D284-T286 PolarHBondContact OD2-OG1 2.66Å
285	G	81.2	Confident	81.5	Confident	46 Å²	46	32.7 Å²	32.7	47%	0.474	20%	0.202	S	C	.	.	S	Bend	trans	86.3	-4.2	-176.3	0	0	0	0	0	114.9	S282 V283 S287	S282-G285 PolarHBondContact O-N 2.86Å; S282-G285 VanDerWaalsContact O-N 3.12Å; V283-G285 VanDerWaalsContact C-N 3.27Å; V283-G285 PolarHBondContact O-N 2.9Å; G285-S287 PolarHBondContact O-N 3.42Å
286	T	85.4	Confident	82.7	Confident	58 Å²	58	31.7 Å²	31.7	36%	0.356	20%	0.199	S	C	.	.			trans	-60.6	135.7	174.2	-59.9	0	0	0	0	110.1	T246 I248 R281 S282 D284	T246-T286 HydrophobicContact CG2-CG2 4.12Å; I248-T286 HydrophobicContact CG1-CG2 4.41Å; R281-T286 WeakPolarHBondContact CA-O 3.36Å; S282-T286 PolarHBondContact N-O 2.89Å; D284-T286 VanDerWaalsContact C-N 3.34Å; D284-T286 WeakPolarHBondContact OD1-CB 3.24Å; D284-T286 PolarHBondContact OD1-N 3.47Å; D284-T286 PolarHBondContact OD1-OG1 3.3Å; D284-T286 PolarHBondContact OD2-OG1 2.66Å
287	S	85.4	Confident	83.4	Confident	33 Å²	33	33.1 Å²	33.1	23%	0.231	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-120	148.9	-175.1	175.7	0	0	0	0	112	E279 V280 G285 G289	E279-S287 VanDerWaalsContact CD-OG 3.26Å; E279-S287 WeakPolarHBondContact CG-OG 3.1Å; E279-S287 PolarHBondContact OE1-OG 3.44Å; V280-S287 WeakPolarHBondContact O-CA 3.44Å; G285-S287 PolarHBondContact O-N 3.42Å; S287-G289 PolarHBondContact O-N 3.37Å; S287-G289 PolarHBondContact OG-N 2.83Å
288	T	83.4	Confident	83.8	Confident	7 Å²	7	33.1 Å²	33.1	4%	0.043	20%	0.201	C	C	.	.			trans	-69.1	-13.1	170.7	51.8	0	0	0	0	112.9	L84 V86 I248 V280 I291	L84-T288 HydrophobicContact CD2-CG2 3.84Å; L84-T288 HydrophobicContact CG-CG2 4.48Å; V86-T288 HydrophobicContact CG2-CG2 3.83Å; I248-T288 HydrophobicContact CD1-CG2 3.42Å; I248-T288 VanDerWaalsContact CD1-CG2 3.42Å; I248-T288 VanDerWaalsContact CD1-N 3.35Å; I248-T288 HydrophobicContact CG1-CG2 4.36Å; V280-T288 HydrophobicContact CB-CG2 3.92Å; V280-T288 PolarHBondContact N-OG1 2.97Å; V280-T288 VanDerWaalsContact N-OG1 3.09Å; V280-T288 PolarHBondContact O-N 3.25Å; T288-I291 HydrophobicContact CG2-CD1 4.25Å
289	G	80.5	Confident	83.7	Confident	32 Å²	32	33.2 Å²	33.2	33%	0.33	20%	0.202	S	C	.	.			trans	72.2	178.7	-155.3	0	0	0	0	0	111.2	S287 I291	S287-G289 PolarHBondContact O-N 3.37Å; S287-G289 PolarHBondContact OG-N 2.83Å; G289-I291 PolarHBondContact O-N 2.9Å
290	V	81.1	Confident	83.7	Confident	30 Å²	30	35.3 Å²	35.3	18%	0.182	22%	0.218	C	C	.	.			trans	-81	113.1	-176.9	-175.1	0	0	0	0	109.7	L65 S66 R274 L292	L65-V290 CarbonylContact C-O 3.58Å; L65-V290 WeakPolarHBondContact CA-O 3.42Å; S66-V290 PolarHBondContact N-O 3.01Å; R274-V290 VanDerWaalsContact CZ-CG2 3.49Å; V290-L292 HydrophobicContact CG1-CD2 3.97Å; V290-L292 HydrophobicContact CG1-CG 4.49Å
291	I	84.4	Confident	83.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124	173.3	-64.6	159	0	0	0	108.1	V63 L64 L65 L77 G277 F278 T288 G289 I293	V63-I291 HydrophobicContact CB-CG2 3.91Å; V63-I291 HydrophobicContact CG1-CG2 4.1Å; V63-I291 HydrophobicContact CG2-CG2 3.92Å; L64-I291 CarbonylContact O-C 3.6Å; L65-I291 HydrophobicContact CD2-CG1 3.8Å; L77-I291 HydrophobicContact CD1-CD1 3.89Å; L77-I291 HydrophobicContact CD1-CG1 4.5Å; L77-I291 HydrophobicContact CD1-CG2 3.98Å; L77-I291 HydrophobicContact CD2-CD1 3.78Å; L77-I291 HydrophobicContact CD2-CG1 4.3Å; L77-I291 HydrophobicContact CG-CD1 4.47Å; G277-I291 CarbonylContact C-O 3.58Å; G277-I291 WeakPolarHBondContact CA-O 3.45Å; F278-I291 HydrophobicContact CD1-CB 4.22Å; F278-I291 HydrophobicContact CD1-CG2 4.18Å; F278-I291 HydrophobicContact CD2-CD1 4.4Å; F278-I291 HydrophobicContact CE1-CB 3.96Å; F278-I291 HydrophobicContact CE1-CD1 4.45Å; F278-I291 HydrophobicContact CE1-CG2 3.56Å; F278-I291 HydrophobicContact CE2-CB 4.48Å; F278-I291 HydrophobicContact CE2-CD1 3.68Å; F278-I291 HydrophobicContact CZ-CB 4.11Å; F278-I291 HydrophobicContact CZ-CD1 3.73Å; F278-I291 HydrophobicContact CZ-CG2 3.87Å; F278-I291 PolarHBondContact N-O 3.14Å; F278-I291 PolarHBondContact O-N 2.97Å; T288-I291 HydrophobicContact CG2-CD1 4.25Å; G289-I291 PolarHBondContact O-N 2.9Å; I291-I293 HydrophobicContact CG2-CD1 4.34Å; I291-I293 HydrophobicContact CG2-CG1 4.04Å
292	L	80.5	Confident	83.7	Confident	30 Å²	30	33.2 Å²	33.2	16%	0.157	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.7	177.2	-58.7	174.3	0	0	0	109.8	L64 N276 V290	L64-L292 HydrophobicContact CB-CB 3.91Å; L64-L292 PolarHBondContact N-O 2.9Å; L64-L292 WeakPolarHBondContact O-CA 3.43Å; L64-L292 PolarHBondContact O-N 2.93Å; N276-L292 CarbonylContact O-C 3.5Å; N276-L292 VanDerWaalsContact O-CA 3.23Å; N276-L292 WeakPolarHBondContact O-CA 3.4Å; V290-L292 HydrophobicContact CG1-CD2 3.97Å; V290-L292 HydrophobicContact CG1-CG 4.49Å
293	I	81.2	Confident	83.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	22%	0.216	C	C	.	.			trans	-131.5	122	-179.7	-61.2	-168.8	0	0	0	108.2	G49 V63 N276 F278 I291 D295 V298 L299 W302	G49-I293 VanDerWaalsContact O-CG2 3.3Å; G49-I293 WeakPolarHBondContact O-CG2 3.43Å; V63-I293 HydrophobicContact CG1-CD1 4.12Å; V63-I293 HydrophobicContact CG1-CG1 4.09Å; N276-I293 CarbonylContact C-O 3.57Å; N276-I293 WeakPolarHBondContact CA-O 3.32Å; N276-I293 WeakPolarHBondContact CB-O 3.44Å; N276-I293 PolarHBondContact O-N 2.85Å; F278-I293 HydrophobicContact CD1-CD1 4.41Å; F278-I293 HydrophobicContact CE1-CD1 3.63Å; F278-I293 HydrophobicContact CE1-CG1 4.3Å; I291-I293 HydrophobicContact CG2-CD1 4.34Å; I291-I293 HydrophobicContact CG2-CG1 4.04Å; I293-D295 WeakPolarHBondContact CG2-O 3.46Å; I293-V298 HydrophobicContact CG2-CB 3.98Å; I293-V298 HydrophobicContact CG2-CG1 3.91Å; I293-L299 HydrophobicContact CB-CB 4.02Å; I293-L299 HydrophobicContact CB-CD1 4.2Å; I293-L299 HydrophobicContact CD1-CD1 4.2Å; I293-L299 HydrophobicContact CG1-CD1 4.39Å; I293-L299 HydrophobicContact CG2-CB 3.87Å; I293-W302 HydrophobicContact CD1-CB 4.18Å; I293-W302 HydrophobicContact CD1-CG 3.89Å
294	E	74.6	Confident	84	Confident	40 Å²	40	37.5 Å²	37.5	19%	0.187	22%	0.223	C	C	.	.	S	Bend	trans	-74.3	-36.6	-174.2	-60	-166.7	164.4	0	0	113.4	R195 C198	R195-E294 WeakPolarHBondContact CG-OE1 3.29Å; R195-E294 IonicContact NE-OE1 2.92Å; C198-E294 PolarHBondContact SG-OE2 3.09Å
295	D	77.5	Confident	84.6	Confident	46 Å²	46	33.1 Å²	33.1	25%	0.246	20%	0.199	C	C	.	.			trans	-86.3	117.2	176.8	-168.5	-41.4	0	0	0	110.8	G49 F229 I293 K297 V298 L299	G49-D295 WeakPolarHBondContact O-CB 3.43Å; G49-D295 PolarHBondContact O-N 3.06Å; F229-D295 VanDerWaalsContact CE1-OD2 3.3Å; F229-D295 WeakPolarHBondContact CE1-OD2 3.33Å; I293-D295 WeakPolarHBondContact CG2-O 3.46Å; D295-K297 PolarHBondContact O-N 3.12Å; D295-K297 WeakPolarHBondContact OD1-CA 3.45Å; D295-K297 VanDerWaalsContact OD1-CB 3.24Å; D295-K297 WeakPolarHBondContact OD1-CB 3.46Å; D295-K297 PolarHBondContact OD1-N 2.95Å; D295-V298 HydrophobicContact CB-CB 4Å; D295-V298 HydrophobicContact CB-CG2 3.76Å; D295-V298 PolarHBondContact O-N 2.79Å; D295-V298 PolarHBondContact OD1-N 2.93Å; D295-L299 WeakPolarHBondContact O-CB 3.26Å; D295-L299 PolarHBondContact O-N 2.9Å
296	A	80.4	Confident	85.2	Confident	57 Å²	57	30.9 Å²	30.9	47%	0.471	18%	0.176	S	C	.	.	H	α-helix	trans	-60.3	-29.4	178.9	0	0	0	0	0	113.5	S300	A296-S300 WeakPolarHBondContact O-CB 3.28Å; A296-S300 PolarHBondContact O-N 2.87Å; A296-S300 PolarHBondContact O-OG 3.23Å
297	K	85.3	Confident	85.6	Confident	99 Å²	99	28.8 Å²	28.8	43%	0.43	16%	0.164	S	C	.	.	H	α-helix	trans	-71.8	-46	176.4	-62.1	179.2	177.5	179.7	0	110.6	F226 F229 D295 L299 S300 L301	F226-K297 HydrophobicContact CE1-CB 4.4Å; F229-K297 HydrophobicContact CE2-CB 4.23Å; F229-K297 HydrophobicContact CE2-CD 3.55Å; F229-K297 HydrophobicContact CZ-CB 4.27Å; F229-K297 HydrophobicContact CZ-CD 3.61Å; D295-K297 PolarHBondContact O-N 3.12Å; D295-K297 WeakPolarHBondContact OD1-CA 3.45Å; D295-K297 VanDerWaalsContact OD1-CB 3.24Å; D295-K297 WeakPolarHBondContact OD1-CB 3.46Å; D295-K297 PolarHBondContact OD1-N 2.95Å; K297-L299 VanDerWaalsContact C-N 3.3Å; K297-L299 PolarHBondContact O-N 3.46Å; K297-S300 WeakPolarHBondContact O-CB 3.31Å; K297-S300 PolarHBondContact O-N 3.44Å; K297-L301 WeakPolarHBondContact O-CG 3.37Å; K297-L301 PolarHBondContact O-N 3.25Å
298	V	85	Confident	85.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-40.4	176.4	176.9	0	0	0	0	110.6	T50 I52 F229 I293 D295 S300 L301 W302	T50-V298 WeakPolarHBondContact O-CG2 3.34Å; I52-V298 HydrophobicContact CD1-CG1 4.29Å; I52-V298 HydrophobicContact CG1-CG1 3.91Å; F229-V298 HydrophobicContact CB-CG2 4.48Å; F229-V298 HydrophobicContact CD1-CG2 3.63Å; F229-V298 HydrophobicContact CE1-CG2 4.24Å; F229-V298 HydrophobicContact CG-CG2 4.3Å; I293-V298 HydrophobicContact CG2-CB 3.98Å; I293-V298 HydrophobicContact CG2-CG1 3.91Å; D295-V298 HydrophobicContact CB-CB 4Å; D295-V298 HydrophobicContact CB-CG2 3.76Å; D295-V298 PolarHBondContact O-N 2.79Å; D295-V298 PolarHBondContact OD1-N 2.93Å; V298-S300 VanDerWaalsContact C-N 3.33Å; V298-S300 PolarHBondContact O-N 2.81Å; V298-L301 WeakPolarHBondContact O-CB 3.32Å; V298-L301 PolarHBondContact O-N 2.87Å; V298-W302 VanDerWaalsContact O-CD1 3.3Å; V298-W302 PolarHBondContact O-N 2.9Å
299	L	85.9	Confident	86.5	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-47.6	174	175.1	59.3	0	0	0	111.5	F278 I293 D295 K297 L301 W302 V303	F278-L299 HydrophobicContact CB-CD1 4.46Å; F278-L299 HydrophobicContact CD1-CD1 3.38Å; F278-L299 HydrophobicContact CE1-CD1 4.03Å; F278-L299 HydrophobicContact CG-CD1 4.33Å; I293-L299 HydrophobicContact CB-CB 4.02Å; I293-L299 HydrophobicContact CB-CD1 4.2Å; I293-L299 HydrophobicContact CD1-CD1 4.2Å; I293-L299 HydrophobicContact CG1-CD1 4.39Å; I293-L299 HydrophobicContact CG2-CB 3.87Å; D295-L299 WeakPolarHBondContact O-CB 3.26Å; D295-L299 PolarHBondContact O-N 2.9Å; K297-L299 VanDerWaalsContact C-N 3.3Å; K297-L299 PolarHBondContact O-N 3.46Å; L299-L301 VanDerWaalsContact C-N 3.31Å; L299-L301 PolarHBondContact O-N 2.94Å; L299-W302 PolarHBondContact O-N 3.42Å; L299-V303 HydrophobicContact CD1-CG2 4.28Å; L299-V303 WeakPolarHBondContact O-CG2 3.3Å; L299-V303 PolarHBondContact O-N 2.94Å
300	S	87.2	Confident	87.2	Confident	56 Å²	56	30.4 Å²	30.4	39%	0.392	16%	0.162	S	C	.	.	H	α-helix	trans	-63.9	-37.2	178.5	-57.1	0	0	0	0	112	A296 K297 V298 R304	A296-S300 WeakPolarHBondContact O-CB 3.28Å; A296-S300 PolarHBondContact O-N 2.87Å; A296-S300 PolarHBondContact O-OG 3.23Å; K297-S300 WeakPolarHBondContact O-CB 3.31Å; K297-S300 PolarHBondContact O-N 3.44Å; V298-S300 VanDerWaalsContact C-N 3.33Å; V298-S300 PolarHBondContact O-N 2.81Å; S300-R304 WeakPolarHBondContact O-CB 3.27Å; S300-R304 PolarHBondContact O-N 2.74Å
301	L	90.2	Very high	87.8	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-48.5	174.4	-71.5	176.7	0	0	0	112.1	I52 F226 F229 V230 K297 V298 L299 R304 H305	I52-L301 HydrophobicContact CD1-CB 3.54Å; I52-L301 HydrophobicContact CD1-CD1 4.35Å; F226-L301 HydrophobicContact CD1-CD1 4.21Å; F226-L301 HydrophobicContact CD1-CD2 3.68Å; F226-L301 HydrophobicContact CD1-CG 3.98Å; F226-L301 HydrophobicContact CE1-CD2 4.22Å; F226-L301 HydrophobicContact CE1-CG 4.33Å; F229-L301 HydrophobicContact CB-CD1 3.75Å; V230-L301 HydrophobicContact CG2-CD1 3.97Å; K297-L301 WeakPolarHBondContact O-CG 3.37Å; K297-L301 PolarHBondContact O-N 3.25Å; V298-L301 WeakPolarHBondContact O-CB 3.32Å; V298-L301 PolarHBondContact O-N 2.87Å; L299-L301 VanDerWaalsContact C-N 3.31Å; L299-L301 PolarHBondContact O-N 2.94Å; L301-R304 PolarHBondContact O-N 3.39Å; L301-H305 PolarHBondContact O-CD2 3.22Å; L301-H305 PolarHBondContact O-N 2.98Å
302	W	91.6	Very high	88.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-51.9	176.6	-85.6	109.1	0	0	0	112	I52 L77 L79 F278 I293 V298 L299 R304 H305 I306	I52-W302 VanDerWaalsContact CD1-CD1 3.48Å; I52-W302 HydrophobicContact CD1-CD2 3.95Å; I52-W302 HydrophobicContact CD1-CG 3.79Å; I52-W302 HydrophobicContact CG1-CZ2 4.3Å; I52-W302 HydrophobicContact CG2-CH2 4.4Å; I52-W302 HydrophobicContact CG2-CZ2 4.04Å; L77-W302 HydrophobicContact CB-CH2 3.77Å; L77-W302 HydrophobicContact CB-CZ2 4.12Å; L77-W302 HydrophobicContact CB-CZ3 4.16Å; L77-W302 HydrophobicContact CD1-CD2 4.33Å; L77-W302 HydrophobicContact CD1-CE3 4.37Å; L77-W302 HydrophobicContact CD1-CZ2 4.5Å; L77-W302 HydrophobicContact CD1-CZ3 4.46Å; L79-W302 HydrophobicContact CB-CZ3 3.7Å; L79-W302 HydrophobicContact CD2-CE3 4.35Å; L79-W302 HydrophobicContact CD2-CZ3 4.14Å; F278-W302 HydrophobicContact CE1-CB 4.12Å; F278-W302 HydrophobicContact CZ-CB 4.12Å; I293-W302 HydrophobicContact CD1-CB 4.18Å; I293-W302 HydrophobicContact CD1-CG 3.89Å; V298-W302 VanDerWaalsContact O-CD1 3.3Å; V298-W302 PolarHBondContact O-N 2.9Å; L299-W302 PolarHBondContact O-N 3.42Å; W302-R304 VanDerWaalsContact C-N 3.26Å; W302-R304 PolarHBondContact O-N 3.35Å; W302-H305 PolarHBondContact O-N 3.39Å; W302-I306 HydrophobicContact CE3-CD1 4.26Å; W302-I306 WeakPolarHBondContact O-CB 3.4Å; W302-I306 WeakPolarHBondContact O-CD1 3.22Å; W302-I306 WeakPolarHBondContact O-CG1 3.32Å; W302-I306 PolarHBondContact O-N 3.47Å
303	V	90.6	Very high	89.1	Confident	24 Å²	24	33.4 Å²	33.4	15%	0.145	18%	0.178	C	C	.	.	H	α-helix	trans	-57	-43.1	178.6	171.5	0	0	0	0	110.8	V255 F278 L299 S307	V255-V303 HydrophobicContact CG1-CG1 4.25Å; V255-V303 HydrophobicContact CG1-CG2 4.27Å; F278-V303 HydrophobicContact CB-CG2 4.16Å; F278-V303 HydrophobicContact CD1-CG2 4.24Å; F278-V303 HydrophobicContact CG-CG2 4.07Å; L299-V303 HydrophobicContact CD1-CG2 4.28Å; L299-V303 WeakPolarHBondContact O-CG2 3.3Å; L299-V303 PolarHBondContact O-N 2.94Å; V303-S307 WeakPolarHBondContact O-CB 3.47Å; V303-S307 PolarHBondContact O-N 3.49Å; V303-S307 PolarHBondContact O-OG 3.43Å
304	R	91.3	Very high	89.7	Confident	116 Å²	116	33.8 Å²	33.8	44%	0.438	18%	0.18	S	C	.	.	H	α-helix	trans	-64.6	-47.9	178.2	-175.2	170.4	63.6	84.8	-0.6	112.3	S300 L301 W302 S307 N308	S300-R304 WeakPolarHBondContact O-CB 3.27Å; S300-R304 PolarHBondContact O-N 2.74Å; L301-R304 PolarHBondContact O-N 3.39Å; W302-R304 VanDerWaalsContact C-N 3.26Å; W302-R304 PolarHBondContact O-N 3.35Å; R304-S307 PolarHBondContact O-N 3.21Å; R304-N308 VanDerWaalsContact O-CB 3.31Å; R304-N308 WeakPolarHBondContact O-CB 3.28Å; R304-N308 PolarHBondContact O-N 2.97Å; R304-N308 PolarHBondContact O-ND2 2.95Å; R304-N308 PolarHBondContact O-OD1 3.22Å
305	H	93.1	Very high	90.7	Very high	18 Å²	18	35.3 Å²	35.3	8%	0.083	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-44.5	179.6	-70.5	-55.4	0	0	0	111.9	Y59 L79 L301 W302 N308 N309	Y59-H305 AromaticContact CE1-CE1 3.8Å; Y59-H305 AromaticContact CE1-NE2 3.88Å; Y59-H305 AromaticContact CZ-CE1 3.81Å; Y59-H305 AromaticContact CZ-ND1 3.72Å; L79-H305 HydrophobicContact CD2-CB 3.76Å; L301-H305 PolarHBondContact O-CD2 3.22Å; L301-H305 PolarHBondContact O-N 2.98Å; W302-H305 PolarHBondContact O-N 3.39Å; H305-N308 PolarHBondContact O-N 2.94Å; H305-N309 PolarHBondContact O-N 2.96Å; H305-N309 PolarHBondContact O-OD1 3.05Å
306	I	94.5	Very high	91.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-49.3	177.4	-63.1	164.6	0	0	0	110.4	L79 L84 L250 V255 F278 V280 W302 N308 N309 I310	L79-I306 HydrophobicContact CD1-CG1 4.01Å; L79-I306 HydrophobicContact CD2-CG1 3.75Å; L79-I306 HydrophobicContact CG-CG1 4.47Å; L84-I306 HydrophobicContact CD2-CD1 4.03Å; L250-I306 HydrophobicContact CD2-CG2 4.07Å; V255-I306 HydrophobicContact CG2-CB 4.19Å; V255-I306 HydrophobicContact CG2-CG2 3.55Å; F278-I306 HydrophobicContact CD2-CD1 4.49Å; F278-I306 HydrophobicContact CE2-CD1 3.47Å; F278-I306 VanDerWaalsContact CE2-CD1 3.47Å; F278-I306 HydrophobicContact CZ-CD1 3.77Å; V280-I306 HydrophobicContact CG2-CD1 4.23Å; V280-I306 HydrophobicContact CG2-CG2 4.17Å; W302-I306 HydrophobicContact CE3-CD1 4.26Å; W302-I306 WeakPolarHBondContact O-CB 3.4Å; W302-I306 WeakPolarHBondContact O-CD1 3.22Å; W302-I306 WeakPolarHBondContact O-CG1 3.32Å; W302-I306 PolarHBondContact O-N 3.47Å; I306-N308 VanDerWaalsContact C-N 3.26Å; I306-N308 PolarHBondContact O-N 2.89Å; I306-N309 PolarHBondContact O-N 2.9Å; I306-N309 VanDerWaalsContact O-N 3.15Å; I306-I310 HydrophobicContact CG2-CD1 3.8Å; I306-I310 HydrophobicContact CG2-CG1 4.38Å; I306-I310 WeakPolarHBondContact O-CG1 3.31Å; I306-I310 PolarHBondContact O-N 2.82Å
307	S	92.9	Very high	92.2	Very high	14 Å²	14	37.4 Å²	37.4	10%	0.098	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-36.5	-179.9	-59.1	0	0	0	0	112.3	V303 R304 T311	V303-S307 WeakPolarHBondContact O-CB 3.47Å; V303-S307 PolarHBondContact O-N 3.49Å; V303-S307 PolarHBondContact O-OG 3.43Å; R304-S307 PolarHBondContact O-N 3.21Å; S307-T311 WeakPolarHBondContact O-CB 3.4Å; S307-T311 PolarHBondContact O-N 3.02Å; S307-T311 PolarHBondContact O-OG1 2.73Å
308	N	93	Very high	92.6	Very high	70 Å²	70	33.4 Å²	33.4	37%	0.374	17%	0.171	S	C	.	.	H	α-helix	trans	-66	-44.3	175.1	-74.5	-9.4	0	0	0	111.9	R304 H305 I306 T311 N312	R304-N308 VanDerWaalsContact O-CB 3.31Å; R304-N308 WeakPolarHBondContact O-CB 3.28Å; R304-N308 PolarHBondContact O-N 2.97Å; R304-N308 PolarHBondContact O-ND2 2.95Å; R304-N308 PolarHBondContact O-OD1 3.22Å; H305-N308 PolarHBondContact O-N 2.94Å; I306-N308 VanDerWaalsContact C-N 3.26Å; I306-N308 PolarHBondContact O-N 2.89Å; N308-T311 PolarHBondContact O-N 3.37Å; N308-N312 WeakPolarHBondContact O-CB 3.21Å; N308-N312 PolarHBondContact O-N 2.92Å; N308-N312 PolarHBondContact O-ND2 2.78Å
309	N	95.6	Very high	93	Very high	25 Å²	25	41.1 Å²	41.1	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-47.5	176.5	-73.6	5.4	0	0	0	111.1	N80 L250 H305 I306 T311 N312 L313	N80-N309 PolarHBondContact O-ND2 3.04Å; N80-N309 VanDerWaalsContact O-ND2 3.08Å; L250-N309 HydrophobicContact CD1-CB 3.83Å; H305-N309 PolarHBondContact O-N 2.96Å; H305-N309 PolarHBondContact O-OD1 3.05Å; I306-N309 PolarHBondContact O-N 2.9Å; I306-N309 VanDerWaalsContact O-N 3.15Å; N309-T311 PolarHBondContact O-N 3.03Å; N309-N312 PolarHBondContact O-N 3.33Å; N309-L313 VanDerWaalsContact O-CG 3.32Å; N309-L313 WeakPolarHBondContact O-CG 3.33Å; N309-L313 PolarHBondContact O-N 2.77Å
310	I	95.4	Very high	93.4	Very high	11 Å²	11	46.3 Å²	46.3	6%	0.056	23%	0.232	C	C	.	.	H	α-helix	trans	-55.3	-50.3	174.9	-65.8	169.6	0	0	0	110.7	L250 A253 V255 I306 N312 L313 N314	L250-I310 HydrophobicContact CB-CG1 4.01Å; L250-I310 HydrophobicContact CD2-CD1 4.39Å; L250-I310 HydrophobicContact CD2-CG1 4.08Å; L250-I310 WeakPolarHBondContact O-CG1 3.29Å; A253-I310 HydrophobicContact CB-CD1 4.07Å; A253-I310 HydrophobicContact CB-CG1 4.26Å; A253-I310 WeakPolarHBondContact O-CG2 3.24Å; V255-I310 HydrophobicContact CG2-CD1 3.97Å; I306-I310 HydrophobicContact CG2-CD1 3.8Å; I306-I310 HydrophobicContact CG2-CG1 4.38Å; I306-I310 WeakPolarHBondContact O-CG1 3.31Å; I306-I310 PolarHBondContact O-N 2.82Å; I310-N312 VanDerWaalsContact C-N 3.32Å; I310-N312 PolarHBondContact O-N 3.45Å; I310-L313 PolarHBondContact O-N 2.8Å; I310-N314 WeakPolarHBondContact O-CB 3.49Å; I310-N314 VanDerWaalsContact O-CG 3.28Å; I310-N314 PolarHBondContact O-N 3.09Å; I310-N314 PolarHBondContact O-OD1 2.82Å
311	T	94	Very high	93.6	Very high	23 Å²	23	45.8 Å²	45.8	14%	0.141	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-41.9	-179.6	-58	0	0	0	0	111.4	S307 N308 N309 N314 N315	S307-T311 WeakPolarHBondContact O-CB 3.4Å; S307-T311 PolarHBondContact O-N 3.02Å; S307-T311 PolarHBondContact O-OG1 2.73Å; N308-T311 PolarHBondContact O-N 3.37Å; N309-T311 PolarHBondContact O-N 3.03Å; T311-N314 PolarHBondContact O-N 2.76Å; T311-N315 WeakPolarHBondContact O-CB 3.2Å; T311-N315 PolarHBondContact O-N 2.88Å; T311-N315 PolarHBondContact O-ND2 2.87Å; T311-N315 VanDerWaalsContact O-ND2 3.13Å
312	N	95	Very high	93.8	Very high	89 Å²	89	47.7 Å²	47.7	48%	0.476	24%	0.239	S	C	.	.	H	α-helix	trans	-64.6	-41.6	177.7	-72.9	-25	0	0	0	112.2	N308 N309 I310 N315 K316	N308-N312 WeakPolarHBondContact O-CB 3.21Å; N308-N312 PolarHBondContact O-N 2.92Å; N308-N312 PolarHBondContact O-ND2 2.78Å; N309-N312 PolarHBondContact O-N 3.33Å; I310-N312 VanDerWaalsContact C-N 3.32Å; I310-N312 PolarHBondContact O-N 3.45Å; N312-N315 PolarHBondContact O-N 3.41Å; N312-K316 WeakPolarHBondContact O-CG 3.4Å; N312-K316 PolarHBondContact O-N 2.89Å
313	L	96.3	Very high	93.9	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-44.2	175.5	-67.3	168	0	0	0	111.8	P81 E82 L250 Q251 N309 I310 N315 K316 S317	P81-L313 WeakPolarHBondContact O-CD1 3.36Å; E82-L313 HydrophobicContact CG-CD2 4.19Å; L250-L313 HydrophobicContact CB-CD1 3.51Å; Q251-L313 HydrophobicContact CB-CB 4.28Å; Q251-L313 HydrophobicContact CB-CD1 4.37Å; N309-L313 VanDerWaalsContact O-CG 3.32Å; N309-L313 WeakPolarHBondContact O-CG 3.33Å; N309-L313 PolarHBondContact O-N 2.77Å; I310-L313 PolarHBondContact O-N 2.8Å; L313-N315 VanDerWaalsContact C-N 3.3Å; L313-N315 PolarHBondContact O-N 3.31Å; L313-K316 WeakPolarHBondContact O-CB 3.44Å; L313-K316 PolarHBondContact O-N 3.12Å; L313-K316 VanDerWaalsContact O-N 3.14Å; L313-S317 PolarHBondContact O-N 2.83Å
314	N	94.6	Very high	93.9	Very high	9 Å²	9	62.3 Å²	62.3	5%	0.048	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-42.3	175.9	-70	-4.1	0	0	0	110.8	M252 I310 T311 K316 S317 I318	M252-N314 WeakPolarHBondContact CA-OD1 3.27Å; M252-N314 PolarHBondContact N-OD1 2.8Å; I310-N314 WeakPolarHBondContact O-CB 3.49Å; I310-N314 VanDerWaalsContact O-CG 3.28Å; I310-N314 PolarHBondContact O-N 3.09Å; I310-N314 PolarHBondContact O-OD1 2.82Å; T311-N314 PolarHBondContact O-N 2.76Å; N314-K316 PolarHBondContact O-N 2.85Å; N314-S317 WeakPolarHBondContact O-CB 3.45Å; N314-S317 PolarHBondContact O-N 3.23Å; N314-I318 WeakPolarHBondContact O-CG1 3.44Å; N314-I318 PolarHBondContact O-N 2.92Å
315	N	94.8	Very high	93.9	Very high	73 Å²	73	59 Å²	59	39%	0.39	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-37.2	175.1	-75.8	-32.7	0	0	0	113	T311 N312 L313 K319	T311-N315 WeakPolarHBondContact O-CB 3.2Å; T311-N315 PolarHBondContact O-N 2.88Å; T311-N315 PolarHBondContact O-ND2 2.87Å; T311-N315 VanDerWaalsContact O-ND2 3.13Å; N312-N315 PolarHBondContact O-N 3.41Å; L313-N315 VanDerWaalsContact C-N 3.3Å; L313-N315 PolarHBondContact O-N 3.31Å; N315-K319 VanDerWaalsContact O-CG 3.31Å; N315-K319 WeakPolarHBondContact O-CG 3.31Å; N315-K319 PolarHBondContact O-N 2.84Å; N315-K319 VanDerWaalsContact O-N 3.08Å
316	K	95.3	Very high	93.7	Very high	130 Å²	130	63.4 Å²	63.4	57%	0.565	31%	0.308	S	S	*	.	H	α-helix	trans	-63.4	-44	172.1	-73.5	174.5	-178.7	178.8	0	110.9	N312 L313 N314 K319 L320	N312-K316 WeakPolarHBondContact O-CG 3.4Å; N312-K316 PolarHBondContact O-N 2.89Å; L313-K316 WeakPolarHBondContact O-CB 3.44Å; L313-K316 PolarHBondContact O-N 3.12Å; L313-K316 VanDerWaalsContact O-N 3.14Å; N314-K316 PolarHBondContact O-N 2.85Å; K316-K319 PolarHBondContact O-N 3.07Å; K316-L320 PolarHBondContact O-N 2.97Å
317	S	93.7	Very high	93.4	Very high	17 Å²	17	67.9 Å²	67.9	12%	0.119	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-47.3	176.6	-176.8	0	0	0	0	111.8	L313 N314 K319 L320 S321	L313-S317 PolarHBondContact O-N 2.83Å; N314-S317 WeakPolarHBondContact O-CB 3.45Å; N314-S317 PolarHBondContact O-N 3.23Å; S317-K319 PolarHBondContact O-N 3.08Å; S317-L320 PolarHBondContact O-N 3.15Å; S317-S321 PolarHBondContact O-N 3.31Å; S317-S321 PolarHBondContact O-OG 3.27Å
318	I	93.8	Very high	93.2	Very high	14 Å²	14	70.4 Å²	70.4	7%	0.072	35%	0.349	C	S	.	.	H	α-helix	trans	-56.3	-48.9	175.1	-68.4	169.5	0	0	0	111.1	N314 L320 S321 N322 I331 L334	N314-I318 WeakPolarHBondContact O-CG1 3.44Å; N314-I318 PolarHBondContact O-N 2.92Å; I318-L320 VanDerWaalsContact C-N 3.31Å; I318-L320 PolarHBondContact O-N 3.06Å; I318-S321 PolarHBondContact O-N 3.21Å; I318-N322 WeakPolarHBondContact CG2-ND2 3.27Å; I318-N322 WeakPolarHBondContact O-CB 3.11Å; I318-N322 VanDerWaalsContact O-CG 3.23Å; I318-N322 PolarHBondContact O-N 3.18Å; I318-I331 HydrophobicContact CD1-CG2 4.46Å; I318-I331 HydrophobicContact CG1-CG2 3.97Å; I318-I331 HydrophobicContact CG2-CB 4.36Å; I318-I331 HydrophobicContact CG2-CG2 4.39Å; I318-I331 VanDerWaalsContact CG2-O 3.22Å; I318-I331 WeakPolarHBondContact CG2-O 3.23Å; I318-L334 HydrophobicContact CD1-CB 4.2Å; I318-L334 HydrophobicContact CD1-CD1 4.31Å; I318-L334 HydrophobicContact CD1-CG 4.02Å; I318-L334 HydrophobicContact CG1-CB 4.38Å; I318-L334 HydrophobicContact CG1-CD1 3.58Å; I318-L334 HydrophobicContact CG1-CG 3.75Å
319	K	94.7	Very high	93	Very high	162 Å²	162	71.3 Å²	71.3	70%	0.704	35%	0.351	S	S	*	.	H	α-helix	trans	-60.9	-40.4	179.5	-74.2	174.4	-178.1	-179.3	0	112.3	N315 K316 S317 K323	N315-K319 VanDerWaalsContact O-CG 3.31Å; N315-K319 WeakPolarHBondContact O-CG 3.31Å; N315-K319 PolarHBondContact O-N 2.84Å; N315-K319 VanDerWaalsContact O-N 3.08Å; K316-K319 PolarHBondContact O-N 3.07Å; S317-K319 PolarHBondContact O-N 3.08Å; K319-K323 PolarHBondContact O-N 3.14Å
320	L	93.4	Very high	92.9	Very high	111 Å²	111	73 Å²	73	58%	0.581	36%	0.36	S	S	*	.	H	α-helix	trans	-67.2	-47.5	178.5	-175.8	63.3	0	0	0	111.2	K316 S317 I318 K323 Y324	K316-L320 PolarHBondContact O-N 2.97Å; S317-L320 PolarHBondContact O-N 3.15Å; I318-L320 VanDerWaalsContact C-N 3.31Å; I318-L320 PolarHBondContact O-N 3.06Å; L320-K323 VanDerWaalsContact O-CB 3.32Å; L320-K323 WeakPolarHBondContact O-CB 3.46Å; L320-K323 PolarHBondContact O-N 3.43Å; L320-Y324 HydrophobicContact CD1-CE2 4.23Å; L320-Y324 VanDerWaalsContact O-CD2 3.28Å; L320-Y324 WeakPolarHBondContact O-CD2 3.43Å
321	S	91.4	Very high	92.9	Very high	45 Å²	45	73.2 Å²	73.2	32%	0.315	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-45	177.8	-61.8	0	0	0	0	111.9	S317 I318 K323 Y324 L325	S317-S321 PolarHBondContact O-N 3.31Å; S317-S321 PolarHBondContact O-OG 3.27Å; I318-S321 PolarHBondContact O-N 3.21Å; S321-K323 PolarHBondContact O-N 3.44Å; S321-K323 VanDerWaalsContact O-N 3.11Å; S321-Y324 PolarHBondContact O-N 3.47Å; S321-L325 WeakPolarHBondContact O-CG 3.41Å; S321-L325 PolarHBondContact O-N 3.47Å
322	N	94	Very high	92.9	Very high	41 Å²	41	73 Å²	73	22%	0.219	36%	0.359	C	S	.	.	H	α-helix	trans	-63.4	-17.7	179.5	-77.5	-5.7	0	0	0	114.1	I318 Y324 L330 I331	I318-N322 WeakPolarHBondContact CG2-ND2 3.27Å; I318-N322 WeakPolarHBondContact O-CB 3.11Å; I318-N322 VanDerWaalsContact O-CG 3.23Å; I318-N322 PolarHBondContact O-N 3.18Å; N322-Y324 PolarHBondContact O-N 3.42Å; N322-L330 HydrophobicContact CB-CD2 3.75Å; N322-I331 PolarHBondContact ND2-O 3.3Å; N322-I331 PolarHBondContact OD1-N 2.88Å
323	K	94.3	Very high	92.9	Very high	157 Å²	157	69.7 Å²	69.7	68%	0.683	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.9	172.9	-171.1	179	177.1	-174.6	0	112.5	K319 L320 S321	K319-K323 PolarHBondContact O-N 3.14Å; L320-K323 VanDerWaalsContact O-CB 3.32Å; L320-K323 WeakPolarHBondContact O-CB 3.46Å; L320-K323 PolarHBondContact O-N 3.43Å; S321-K323 PolarHBondContact O-N 3.44Å; S321-K323 VanDerWaalsContact O-N 3.11Å
324	Y	91.1	Very high	92.9	Very high	173 Å²	173	69.8 Å²	69.8	68%	0.678	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-7.6	-174.8	-56	-76.1	0	0	0	113.4	L320 S321 N322	L320-Y324 HydrophobicContact CD1-CE2 4.23Å; L320-Y324 VanDerWaalsContact O-CD2 3.28Å; L320-Y324 WeakPolarHBondContact O-CD2 3.43Å; S321-Y324 PolarHBondContact O-N 3.47Å; N322-Y324 PolarHBondContact O-N 3.42Å
325	L	90.3	Very high	92.9	Very high	47 Å²	47	69.5 Å²	69.5	25%	0.246	34%	0.341	C	S	.	.	S	Bend	trans	-88.5	148.7	178.1	-67.9	169.5	0	0	0	111	S321 L330 I331	S321-L325 WeakPolarHBondContact O-CG 3.41Å; S321-L325 PolarHBondContact O-N 3.47Å; L325-L330 HydrophobicContact CB-CD2 4.35Å; L325-I331 HydrophobicContact CD1-CD1 3.95Å; L325-I331 HydrophobicContact CD1-CG1 3.87Å
326	H	90.1	Very high	92.9	Very high	110 Å²	110	67.6 Å²	67.6	51%	0.509	33%	0.328	S	S	.	.			trans	-61.1	147.3	169.6	-173.9	-95.9	0	0	0	109.9	D328 E329 L330	H326-D328 VanDerWaalsContact CE1-CG 3.49Å; H326-D328 IonicContact CE1-OD1 3.76Å; H326-D328 IonicContact CE1-OD2 3.61Å; H326-D328 WeakPolarHBondContact ND1-CB 3.34Å; H326-D328 PolarHBondContact ND1-N 3.13Å; H326-D328 VanDerWaalsContact ND1-N 3.17Å; H326-D328 IonicContact ND1-OD1 3.2Å; H326-D328 IonicContact ND1-OD2 2.84Å; H326-D328 PolarHBondContact O-N 3.43Å; H326-E329 WeakPolarHBondContact O-CA 3.24Å; H326-E329 PolarHBondContact O-N 2.95Å; H326-L330 PolarHBondContact O-N 2.84Å
327	P	88.9	Confident	92.8	Very high	94 Å²	94	61.5 Å²	61.5	61%	0.61	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-51.8	-28.7	178.1	-31.3	37.4	0	0	0	115.2	E329 L330	P327-E329 VanDerWaalsContact C-N 3.31Å; P327-L330 WeakPolarHBondContact O-CD1 3.12Å; P327-L330 VanDerWaalsContact O-CG 3.29Å; P327-L330 WeakPolarHBondContact O-CG 3.28Å
328	D	87.3	Confident	92.6	Very high	67 Å²	67	61.3 Å²	61.3	36%	0.358	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-80	-12.4	177.9	-65.9	0.1	0	0	0	114.1	H326 G364 K447	H326-D328 VanDerWaalsContact CE1-CG 3.49Å; H326-D328 IonicContact CE1-OD1 3.76Å; H326-D328 IonicContact CE1-OD2 3.61Å; H326-D328 WeakPolarHBondContact ND1-CB 3.34Å; H326-D328 PolarHBondContact ND1-N 3.13Å; H326-D328 VanDerWaalsContact ND1-N 3.17Å; H326-D328 IonicContact ND1-OD1 3.2Å; H326-D328 IonicContact ND1-OD2 2.84Å; H326-D328 PolarHBondContact O-N 3.43Å; D328-G364 WeakPolarHBondContact O-CA 3.45Å; D328-K447 WeakPolarHBondContact OD2-CE 3.37Å; D328-K447 IonicContact OD2-NZ 3.81Å; D328-K447 PolarHBondContact OD2-NZ 2.86Å
329	E	89.5	Confident	92.5	Very high	89 Å²	89	61.9 Å²	61.9	42%	0.416	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-115.1	14.7	-175	-68.7	-163.1	-168	0	0	112.3	H326 P327 I331 K363	H326-E329 WeakPolarHBondContact O-CA 3.24Å; H326-E329 PolarHBondContact O-N 2.95Å; P327-E329 VanDerWaalsContact C-N 3.31Å; E329-I331 PolarHBondContact O-N 3.34Å; E329-K363 WeakPolarHBondContact O-CE 3.21Å; E329-K363 VanDerWaalsContact O-CG 3.22Å; E329-K363 WeakPolarHBondContact O-CG 3.31Å; E329-K363 IonicContact OE2-NZ 2.77Å; E329-K363 PolarHBondContact OE2-NZ 3.33Å
330	L	94.1	Very high	92	Very high	60 Å²	60	57.1 Å²	57.1	31%	0.314	28%	0.28	S	S	.	.			trans	-63	136.4	-177.5	-62.9	174.9	0	0	0	111	N322 L325 H326 P327 G364	N322-L330 HydrophobicContact CB-CD2 3.75Å; L325-L330 HydrophobicContact CB-CD2 4.35Å; H326-L330 PolarHBondContact O-N 2.84Å; P327-L330 WeakPolarHBondContact O-CD1 3.12Å; P327-L330 VanDerWaalsContact O-CG 3.29Å; P327-L330 WeakPolarHBondContact O-CG 3.28Å; L330-G364 PolarHBondContact O-N 3.12Å
331	I	94.3	Very high	91.4	Very high	17 Å²	17	54.3 Å²	54.3	9%	0.087	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	124.5	171.5	-59.4	171.3	0	0	0	107.8	I318 N322 L325 E329 L334 I361 K363	I318-I331 HydrophobicContact CD1-CG2 4.46Å; I318-I331 HydrophobicContact CG1-CG2 3.97Å; I318-I331 HydrophobicContact CG2-CB 4.36Å; I318-I331 HydrophobicContact CG2-CG2 4.39Å; I318-I331 VanDerWaalsContact CG2-O 3.22Å; I318-I331 WeakPolarHBondContact CG2-O 3.23Å; N322-I331 PolarHBondContact ND2-O 3.3Å; N322-I331 PolarHBondContact OD1-N 2.88Å; L325-I331 HydrophobicContact CD1-CD1 3.95Å; L325-I331 HydrophobicContact CD1-CG1 3.87Å; E329-I331 PolarHBondContact O-N 3.34Å; I331-L334 HydrophobicContact CG2-CD1 4.25Å; I331-L334 HydrophobicContact CG2-CD2 3.69Å; I331-L334 HydrophobicContact CG2-CG 3.68Å; I331-I361 HydrophobicContact CG2-CG2 4.49Å; I331-K363 HydrophobicContact CG1-CB 4.45Å; I331-K363 HydrophobicContact CG1-CD 4.48Å; I331-K363 HydrophobicContact CG1-CG 4.19Å
332	V	94.2	Very high	90.3	Very high	17 Å²	17	58.5 Å²	58.5	10%	0.103	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-29	-177.5	-176.7	0	0	0	0	111.2	L362 A436 R439 C440 Y443	V332-L362 HydrophobicContact CB-CB 4.47Å; V332-L362 PolarHBondContact N-O 3.23Å; V332-A436 HydrophobicContact CG1-CB 4.08Å; V332-R439 HydrophobicContact CG1-CB 4.17Å; V332-R439 VanDerWaalsContact CG1-CZ 3.44Å; V332-R439 PolarHBondContact O-NH2 2.79Å; V332-C440 WeakPolarHBondContact CB-SG 3.17Å; V332-C440 VanDerWaalsContact CG2-SG 3.54Å; V332-Y443 HydrophobicContact CG2-CD2 4.36Å; V332-Y443 HydrophobicContact CG2-CE2 4.35Å
333	Y	96	Very high	88.4	Confident	20 Å²	20	59.4 Å²	59.4	8%	0.078	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	145.3	179.5	-179.6	-94.7	0	0	0	112.3	L360 L362 Q432 V433 A436	Y333-L360 HydrophobicContact CD1-CD2 4.16Å; Y333-L360 HydrophobicContact CD1-CG 4.23Å; Y333-L360 HydrophobicContact CE1-CB 4.47Å; Y333-L360 HydrophobicContact CE1-CD2 4.02Å; Y333-L360 HydrophobicContact CE1-CG 4.31Å; Y333-L362 PolarHBondContact O-N 3.48Å; Y333-L362 VanDerWaalsContact O-N 3.1Å; Y333-Q432 HydrophobicContact CE2-CB 4.25Å; Y333-V433 HydrophobicContact CE1-CG2 3.76Å; Y333-V433 HydrophobicContact CE2-CG2 3.95Å; Y333-V433 VanDerWaalsContact CZ-CG2 3.4Å; Y333-V433 VanDerWaalsContact OH-CG2 3.29Å; Y333-V433 WeakPolarHBondContact OH-CG2 3.34Å; Y333-A436 HydrophobicContact CD2-CB 4.19Å; Y333-A436 HydrophobicContact CG-CB 4.06Å
334	L	94.5	Very high	86.3	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.063	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.4	170.1	-62.7	176.7	0	0	0	108.4	M252 I318 I331 F359 I361	M252-L334 HydrophobicContact CE-CD1 4.46Å; I318-L334 HydrophobicContact CD1-CB 4.2Å; I318-L334 HydrophobicContact CD1-CD1 4.31Å; I318-L334 HydrophobicContact CD1-CG 4.02Å; I318-L334 HydrophobicContact CG1-CB 4.38Å; I318-L334 HydrophobicContact CG1-CD1 3.58Å; I318-L334 HydrophobicContact CG1-CG 3.75Å; I331-L334 HydrophobicContact CG2-CD1 4.25Å; I331-L334 HydrophobicContact CG2-CD2 3.69Å; I331-L334 HydrophobicContact CG2-CG 3.68Å; L334-F359 HydrophobicContact CB-CE1 4.45Å; L334-F359 HydrophobicContact CB-CZ 4.1Å; L334-F359 HydrophobicContact CD2-CE1 4.15Å; L334-I361 HydrophobicContact CD2-CB 4.02Å; L334-I361 HydrophobicContact CD2-CD1 3.64Å; L334-I361 HydrophobicContact CD2-CG1 3.51Å; L334-I361 HydrophobicContact CD2-CG2 3.72Å
335	G	94.8	Very high	84	Confident	4 Å²	4	53.8 Å²	53.8	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178	165.4	175.1	0	0	0	0	0	113.9	L360	G335-L360 PolarHBondContact N-O 3.07Å; G335-L360 VanDerWaalsContact N-O 3.12Å; G335-L360 PolarHBondContact O-N 2.71Å
336	W	94.5	Very high	82	Confident	32 Å²	32	57.3 Å²	57.3	12%	0.121	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	137.5	176.7	-70.5	90.4	0	0	0	111.2	M252 Y254 P357 F359 P373	M252-W336 PolarHBondContact O-NE1 3.36Å; Y254-W336 HydrophobicContact CD1-CB 4.4Å; Y254-W336 AromaticContact CD1-CD1 3.68Å; Y254-W336 AromaticContact CD1-CD2 3.59Å; Y254-W336 HydrophobicContact CD1-CD2 3.59Å; Y254-W336 AromaticContact CD1-CE2 3.55Å; Y254-W336 HydrophobicContact CD1-CE3 4.27Å; Y254-W336 AromaticContact CD1-CG 3.66Å; Y254-W336 HydrophobicContact CD1-CG 3.66Å; Y254-W336 HydrophobicContact CD1-CZ2 4.17Å; Y254-W336 AromaticContact CD1-NE1 3.59Å; Y254-W336 AromaticContact CE1-CD2 3.98Å; Y254-W336 HydrophobicContact CE1-CD2 3.98Å; Y254-W336 AromaticContact CE1-CE2 3.95Å; Y254-W336 HydrophobicContact CE1-CE3 4.23Å; Y254-W336 HydrophobicContact CE1-CG 4.47Å; Y254-W336 HydrophobicContact CE1-CH2 4.38Å; Y254-W336 HydrophobicContact CE1-CZ2 4.15Å; Y254-W336 HydrophobicContact CE1-CZ3 4.43Å; Y254-W336 HydrophobicContact CG-CB 4.06Å; Y254-W336 AromaticContact CG-CD1 3.93Å; Y254-W336 HydrophobicContact CG-CD2 4.15Å; Y254-W336 AromaticContact CG-CG 3.78Å; Y254-W336 HydrophobicContact CG-CG 3.78Å; W336-P357 HydrophobicContact CE3-CB 3.87Å; W336-P357 HydrophobicContact CZ3-CB 3.96Å; W336-F359 AromaticContact CD1-CD2 3.7Å; W336-F359 AromaticContact CD1-CE2 3.85Å; W336-F359 HydrophobicContact CD2-CB 4.43Å; W336-F359 AromaticContact CD2-CD2 3.76Å; W336-F359 HydrophobicContact CD2-CD2 3.76Å; W336-F359 AromaticContact CE2-CD2 3.58Å; W336-F359 HydrophobicContact CE3-CB 4.27Å; W336-F359 HydrophobicContact CE3-CD2 4.43Å; W336-F359 AromaticContact CG-CD2 3.88Å; W336-F359 HydrophobicContact CG-CD2 3.88Å; W336-F359 HydrophobicContact CG-CE2 4.44Å; W336-F359 HydrophobicContact CH2-CB 4.45Å; W336-F359 HydrophobicContact CZ2-CD2 4.16Å; W336-F359 HydrophobicContact CZ3-CB 4.28Å; W336-F359 AromaticContact NE1-CD2 3.52Å; W336-F359 AromaticContact NE1-CE2 3.73Å; W336-P373 HydrophobicContact CZ2-CG 3.85Å
337	V	94.2	Very high	79.9	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.018	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	156.4	167.7	-62.1	0	0	0	0	108.3	P357 R358 L360 L369 F410 L422 V424	V337-P357 CarbonylContact O-C 3.59Å; V337-P357 WeakPolarHBondContact O-CA 3.49Å; V337-R358 HydrophobicContact CG2-CB 4.17Å; V337-R358 WeakPolarHBondContact CG2-O 3.46Å; V337-R358 PolarHBondContact N-O 2.89Å; V337-R358 PolarHBondContact O-N 3.14Å; V337-L360 HydrophobicContact CG1-CB 4.13Å; V337-L360 HydrophobicContact CG1-CD2 4Å; V337-L360 HydrophobicContact CG2-CB 4.14Å; V337-L369 HydrophobicContact CG2-CD2 3.87Å; V337-F410 HydrophobicContact CG1-CZ 4.35Å; V337-L422 HydrophobicContact CG2-CD1 4.44Å; V337-L422 HydrophobicContact CG2-CD2 4.18Å; V337-V424 HydrophobicContact CG1-CG1 3.94Å
338	C	90.2	Very high	77.9	Confident	12 Å²	12	58.8 Å²	58.8	8%	0.081	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.3	169.4	-68.4	0	0	0	0	108.4	W355 E356 R406 L422 S423	C338-W355 HydrophobicContact CB-CE3 3.96Å; C338-W355 HydrophobicContact CB-CZ3 4.4Å; C338-W355 WeakPolarHBondContact O-CZ3 3.42Å; C338-E356 CarbonylContact C-O 3.53Å; C338-E356 WeakPolarHBondContact CA-O 3.34Å; C338-R406 PolarHBondContact SG-NH1 3.14Å; C338-L422 CarbonylContact O-C 3.44Å; C338-L422 VanDerWaalsContact O-CA 3.29Å; C338-L422 WeakPolarHBondContact O-CA 3.46Å; C338-S423 PolarHBondContact N-O 3.43Å; C338-S423 PolarHBondContact O-N 2.74Å
339	E	90.9	Very high	75.8	Confident	27 Å²	27	58.4 Å²	58.4	13%	0.126	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.8	174.1	179.5	-178.8	-157.7	0	0	110.3	L341 W355 E356 R358 L422	E339-L341 HydrophobicContact CG-CD2 4.35Å; E339-W355 VanDerWaalsContact C-CE3 3.44Å; E339-W355 CarbonylContact O-C 3.43Å; E339-W355 VanDerWaalsContact O-CA 3.24Å; E339-W355 WeakPolarHBondContact O-CA 3.38Å; E339-E356 PolarHBondContact N-O 2.83Å; E339-E356 PolarHBondContact O-N 2.96Å; E339-R358 HydrophobicContact CB-CG 3.72Å; E339-R358 VanDerWaalsContact OE2-CG 3.3Å; E339-R358 WeakPolarHBondContact OE2-CG 3.34Å; E339-R358 IonicContact OE2-CZ 3.88Å; E339-R358 IonicContact OE2-NE 3.11Å; E339-R358 PolarHBondContact OE2-NE 2.99Å; E339-L422 HydrophobicContact CB-CD2 3.62Å; E339-L422 HydrophobicContact CG-CD2 3.89Å
340	R	85.1	Confident	73.6	Confident	61 Å²	61	59.3 Å²	59.3	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.6	171.7	-175.6	-166.8	170.7	104.7	-5.6	109.8	S354 W355 V403 Y421	R340-S354 CarbonylContact C-O 3.53Å; R340-S354 WeakPolarHBondContact CA-O 3.39Å; R340-S354 VanDerWaalsContact CG-O 3.28Å; R340-S354 WeakPolarHBondContact CG-O 3.46Å; R340-W355 HydrophobicContact CB-CD2 3.91Å; R340-W355 HydrophobicContact CB-CE3 3.68Å; R340-W355 HydrophobicContact CB-CH2 3.77Å; R340-W355 HydrophobicContact CB-CZ2 3.94Å; R340-W355 HydrophobicContact CB-CZ3 3.62Å; R340-W355 HydrophobicContact CG-CD2 4.29Å; R340-W355 HydrophobicContact CG-CH2 4.46Å; R340-W355 HydrophobicContact CG-CZ2 4.15Å; R340-V403 VanDerWaalsContact NH1-CB 3.27Å; R340-Y421 HydrophobicContact CB-CD1 4.01Å; R340-Y421 HydrophobicContact CB-CG 4.25Å; R340-Y421 PolarHBondContact N-O 3.29Å
341	L	80.3	Confident	71.3	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.277	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-81.2	138	173.4	-62.8	-174	0	0	0	111.2	E339 V343 S354 E356	E339-L341 HydrophobicContact CG-CD2 4.35Å; L341-V343 PolarHBondContact O-N 2.96Å; L341-V343 VanDerWaalsContact O-N 3.14Å; L341-S354 PolarHBondContact N-O 2.91Å; L341-E356 HydrophobicContact CD1-CG 3.81Å; L341-E356 WeakPolarHBondContact CD1-OE2 3.4Å; L341-E356 HydrophobicContact CG-CG 4.28Å
342	N	68	Low	69.1	Low	132 Å²	132	64.7 Å²	64.7	71%	0.706	36%	0.357	S	S	*	.			trans	-74	101	173.9	-73.4	-32.3	0	0	0	110	T344	N342-T344 PolarHBondContact O-N 2.85Å; N342-T344 VanDerWaalsContact O-N 3.07Å
343	V	53.4	Low	67.2	Low	61 Å²	61	70.3 Å²	70.3	37%	0.37	38%	0.38	S	S	.	.			trans	-77.4	90.4	169.4	-172.9	0	0	0	0	108.3	L341 F351	L341-V343 PolarHBondContact O-N 2.96Å; L341-V343 VanDerWaalsContact O-N 3.14Å; V343-F351 HydrophobicContact CG1-CD1 4.49Å
344	T	51	Low	66	Low	122 Å²	122	70.3 Å²	70.3	75%	0.748	38%	0.383	S	S	*	.			trans	-79.4	-18.2	174.8	47.1	0	0	0	0	113	N342 V346	N342-T344 PolarHBondContact O-N 2.85Å; N342-T344 VanDerWaalsContact O-N 3.07Å; T344-V346 PolarHBondContact O-N 3.5Å
345	N	43.1	Very low	65.3	Low	90 Å²	90	71.5 Å²	71.5	48%	0.481	39%	0.387	S	S	.	.			trans	-85.6	105.1	178.5	-88.5	-2.9	0	0	0	111.9	E347 S348	N345-E347 PolarHBondContact O-N 2.78Å; N345-S348 PolarHBondContact ND2-OG 3.12Å
346	V	48.1	Very low	64.8	Low	120 Å²	120	73.8 Å²	73.8	73%	0.727	40%	0.396	S	S	*	.	S	Bend	trans	-68.7	-20.9	165.7	-179.3	0	0	0	0	111.3	T344 F351	T344-V346 PolarHBondContact O-N 3.5Å; V346-F351 HydrophobicContact CG1-CZ 4.48Å; V346-F351 WeakPolarHBondContact O-CZ 3.42Å
347	E	46.4	Very low	64.6	Low	186 Å²	186	74.1 Å²	74.1	87%	0.869	40%	0.403	S	S	*	.	S	Bend	trans	-87.2	-28.6	-173.6	-63.1	-174.1	167.3	0	0	114	N345 G349	N345-E347 PolarHBondContact O-N 2.78Å; E347-G349 PolarHBondContact O-N 2.84Å
348	S	45.6	Very low	64.6	Low	50 Å²	50	74.9 Å²	74.9	35%	0.35	41%	0.405	S	S	.	.	S	Bend	trans	-83.2	108.8	170.8	-41.6	0	0	0	0	106.8	N345 D350	N345-S348 PolarHBondContact ND2-OG 3.12Å; S348-D350 PolarHBondContact O-N 2.88Å
349	G	43.3	Very low	64.8	Low	59 Å²	59	74.4 Å²	74.4	61%	0.608	40%	0.402	S	S	*	.	S	Bend	trans	-56.5	5.8	174	0	0	0	0	0	115.5	E347 F351	E347-G349 PolarHBondContact O-N 2.84Å; G349-F351 PolarHBondContact O-N 2.92Å
350	D	43.3	Very low	65	Low	107 Å²	107	73.2 Å²	73.2	57%	0.572	40%	0.396	S	S	*	.			trans	-72	39.1	172.5	-75.8	-21.7	0	0	0	113.2	S348 L352 K353	S348-D350 PolarHBondContact O-N 2.88Å; D350-L352 PolarHBondContact O-N 2.99Å; D350-K353 PolarHBondContact O-N 2.98Å
351	F	46.1	Very low	65.6	Low	80 Å²	80	70.5 Å²	70.5	35%	0.351	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-8.3	168.1	-59.3	-70.5	0	0	0	113	V343 V346 G349	V343-F351 HydrophobicContact CG1-CD1 4.49Å; V346-F351 HydrophobicContact CG1-CZ 4.48Å; V346-F351 WeakPolarHBondContact O-CZ 3.42Å; G349-F351 PolarHBondContact O-N 2.92Å
352	L	49.1	Very low	66.3	Low	110 Å²	110	68 Å²	68	58%	0.576	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-19.1	-176.4	-58.5	176.8	0	0	0	113.6	G261 D350	G261-L352 VanDerWaalsContact CA-O 3.23Å; G261-L352 WeakPolarHBondContact CA-O 3.37Å; G261-L352 PolarHBondContact N-O 3.1Å; G261-L352 VanDerWaalsContact O-CD2 3.24Å; G261-L352 WeakPolarHBondContact O-CD2 3.46Å; D350-L352 PolarHBondContact O-N 2.99Å
353	K	52.7	Low	67.5	Low	135 Å²	135	63 Å²	63	59%	0.587	35%	0.345	S	S	*	.			trans	-101.4	53.3	-178.9	-68.5	-168.3	178.3	-173.8	0	113.2	D350 W355	D350-K353 PolarHBondContact O-N 2.98Å; K353-W355 VanDerWaalsContact C-N 3.33Å
354	S	70.8	Confident	69.3	Low	20 Å²	20	60.6 Å²	60.6	14%	0.14	33%	0.333	C	S	.	.	S	Bend	trans	-79.7	-15.4	175.7	68.1	0	0	0	0	113.5	R340 L341	R340-S354 CarbonylContact C-O 3.53Å; R340-S354 WeakPolarHBondContact CA-O 3.39Å; R340-S354 VanDerWaalsContact CG-O 3.28Å; R340-S354 WeakPolarHBondContact CG-O 3.46Å; L341-S354 PolarHBondContact N-O 2.91Å
355	W	80.8	Confident	71.3	Confident	37 Å²	37	56.4 Å²	56.4	14%	0.14	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133.6	-175	-65.9	99.4	0	0	0	112.8	D263 C338 E339 R340 K353 Y421	D263-W355 PolarHBondContact OD2-NE1 3.24Å; C338-W355 HydrophobicContact CB-CE3 3.96Å; C338-W355 HydrophobicContact CB-CZ3 4.4Å; C338-W355 WeakPolarHBondContact O-CZ3 3.42Å; E339-W355 VanDerWaalsContact C-CE3 3.44Å; E339-W355 CarbonylContact O-C 3.43Å; E339-W355 VanDerWaalsContact O-CA 3.24Å; E339-W355 WeakPolarHBondContact O-CA 3.38Å; R340-W355 HydrophobicContact CB-CD2 3.91Å; R340-W355 HydrophobicContact CB-CE3 3.68Å; R340-W355 HydrophobicContact CB-CH2 3.77Å; R340-W355 HydrophobicContact CB-CZ2 3.94Å; R340-W355 HydrophobicContact CB-CZ3 3.62Å; R340-W355 HydrophobicContact CG-CD2 4.29Å; R340-W355 HydrophobicContact CG-CH2 4.46Å; R340-W355 HydrophobicContact CG-CZ2 4.15Å; K353-W355 VanDerWaalsContact C-N 3.33Å; W355-Y421 AromaticContact CH2-CD1 3.52Å; W355-Y421 HydrophobicContact CH2-CD1 3.52Å; W355-Y421 AromaticContact CH2-CE1 3.49Å; W355-Y421 HydrophobicContact CH2-CE1 3.49Å; W355-Y421 VanDerWaalsContact CH2-CE1 3.49Å; W355-Y421 HydrophobicContact CZ2-CD1 4.33Å; W355-Y421 HydrophobicContact CZ2-CE1 4.12Å; W355-Y421 HydrophobicContact CZ3-CD1 4.11Å; W355-Y421 HydrophobicContact CZ3-CE1 4.45Å
356	E	84.9	Confident	73.7	Confident	52 Å²	52	55.3 Å²	55.3	24%	0.243	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.2	175	-67.8	-170	164.1	0	0	111	C338 E339 L341 R358	C338-E356 CarbonylContact C-O 3.53Å; C338-E356 WeakPolarHBondContact CA-O 3.34Å; E339-E356 PolarHBondContact N-O 2.83Å; E339-E356 PolarHBondContact O-N 2.96Å; L341-E356 HydrophobicContact CD1-CG 3.81Å; L341-E356 WeakPolarHBondContact CD1-OE2 3.4Å; L341-E356 HydrophobicContact CG-CG 4.28Å; E356-R358 IonicContact OE2-CZ 2.88Å; E356-R358 IonicContact OE2-NH2 2.81Å; E356-R358 PolarHBondContact OE2-NH2 3.26Å
357	P	90	Very high	76	Confident	40 Å²	40	49.7 Å²	49.7	26%	0.26	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.5	171.3	30.9	-33.3	0	0	0	109.7	Y254 W336 V337	Y254-P357 HydrophobicContact CE2-CB 4.4Å; W336-P357 HydrophobicContact CE3-CB 3.87Å; W336-P357 HydrophobicContact CZ3-CB 3.96Å; V337-P357 CarbonylContact O-C 3.59Å; V337-P357 WeakPolarHBondContact O-CA 3.49Å
358	R	92.7	Very high	78.3	Confident	19 Å²	19	41.4 Å²	41.4	7%	0.072	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.4	174.2	-62	-69.6	-177.2	-177.5	-18.2	109.2	V337 E339 E356 L369 F370 E371	V337-R358 HydrophobicContact CG2-CB 4.17Å; V337-R358 WeakPolarHBondContact CG2-O 3.46Å; V337-R358 PolarHBondContact N-O 2.89Å; V337-R358 PolarHBondContact O-N 3.14Å; E339-R358 HydrophobicContact CB-CG 3.72Å; E339-R358 VanDerWaalsContact OE2-CG 3.3Å; E339-R358 WeakPolarHBondContact OE2-CG 3.34Å; E339-R358 IonicContact OE2-CZ 3.88Å; E339-R358 IonicContact OE2-NE 3.11Å; E339-R358 PolarHBondContact OE2-NE 2.99Å; E356-R358 IonicContact OE2-CZ 2.88Å; E356-R358 IonicContact OE2-NH2 2.81Å; E356-R358 PolarHBondContact OE2-NH2 3.26Å; R358-L369 HydrophobicContact CB-CB 4.33Å; R358-L369 HydrophobicContact CB-CD2 4.16Å; R358-F370 CarbonylContact C-O 3.53Å; R358-F370 VanDerWaalsContact CA-O 3.27Å; R358-F370 WeakPolarHBondContact CA-O 3.47Å; R358-E371 IonicContact CZ-OE1 3.01Å; R358-E371 IonicContact NH1-OE1 2.62Å; R358-E371 PolarHBondContact NH1-OE1 3.3Å; R358-E371 IonicContact NH2-OE1 3.55Å
359	F	94.9	Very high	80.7	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	113.8	175	-164	-106.3	0	0	0	110	M252 L334 W336 I361 L369 F370 P373	M252-F359 HydrophobicContact CB-CE2 4.26Å; M252-F359 HydrophobicContact CB-CZ 4.32Å; M252-F359 HydrophobicContact CG-CE2 4.49Å; M252-F359 HydrophobicContact CG-CZ 4.07Å; M252-F359 HydrophobicContact SD-CZ 4.38Å; L334-F359 HydrophobicContact CB-CE1 4.45Å; L334-F359 HydrophobicContact CB-CZ 4.1Å; L334-F359 HydrophobicContact CD2-CE1 4.15Å; W336-F359 AromaticContact CD1-CD2 3.7Å; W336-F359 AromaticContact CD1-CE2 3.85Å; W336-F359 HydrophobicContact CD2-CB 4.43Å; W336-F359 AromaticContact CD2-CD2 3.76Å; W336-F359 HydrophobicContact CD2-CD2 3.76Å; W336-F359 AromaticContact CE2-CD2 3.58Å; W336-F359 HydrophobicContact CE3-CB 4.27Å; W336-F359 HydrophobicContact CE3-CD2 4.43Å; W336-F359 AromaticContact CG-CD2 3.88Å; W336-F359 HydrophobicContact CG-CD2 3.88Å; W336-F359 HydrophobicContact CG-CE2 4.44Å; W336-F359 HydrophobicContact CH2-CB 4.45Å; W336-F359 HydrophobicContact CZ2-CD2 4.16Å; W336-F359 HydrophobicContact CZ3-CB 4.28Å; W336-F359 AromaticContact NE1-CD2 3.52Å; W336-F359 AromaticContact NE1-CE2 3.73Å; F359-I361 HydrophobicContact CD1-CD1 4.02Å; F359-I361 HydrophobicContact CD1-CG1 3.77Å; F359-I361 HydrophobicContact CE1-CD1 3.89Å; F359-I361 HydrophobicContact CE1-CG1 3.81Å; F359-L369 CarbonylContact O-C 3.35Å; F359-L369 WeakPolarHBondContact O-CA 3.36Å; F359-F370 HydrophobicContact CB-CB 4.32Å; F359-F370 PolarHBondContact N-O 2.71Å; F359-F370 PolarHBondContact O-N 2.9Å; F359-P373 HydrophobicContact CB-CG 4.32Å; F359-P373 HydrophobicContact CD1-CB 3.84Å; F359-P373 HydrophobicContact CD1-CG 3.97Å; F359-P373 HydrophobicContact CD2-CB 4.39Å; F359-P373 HydrophobicContact CD2-CG 3.67Å; F359-P373 HydrophobicContact CE1-CB 3.78Å; F359-P373 HydrophobicContact CE1-CG 4.11Å; F359-P373 HydrophobicContact CE2-CB 4.34Å; F359-P373 HydrophobicContact CE2-CG 3.81Å; F359-P373 HydrophobicContact CG-CB 4.13Å; F359-P373 HydrophobicContact CG-CG 3.73Å; F359-P373 HydrophobicContact CZ-CB 4.04Å; F359-P373 HydrophobicContact CZ-CG 4.02Å
360	L	96.5	Very high	83.1	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.8	-179.7	174.3	63.9	0	0	0	110.5	Y333 G335 V337 L362 C367 F368 L369 V433 W437	Y333-L360 HydrophobicContact CD1-CD2 4.16Å; Y333-L360 HydrophobicContact CD1-CG 4.23Å; Y333-L360 HydrophobicContact CE1-CB 4.47Å; Y333-L360 HydrophobicContact CE1-CD2 4.02Å; Y333-L360 HydrophobicContact CE1-CG 4.31Å; G335-L360 PolarHBondContact N-O 3.07Å; G335-L360 VanDerWaalsContact N-O 3.12Å; G335-L360 PolarHBondContact O-N 2.71Å; V337-L360 HydrophobicContact CG1-CB 4.13Å; V337-L360 HydrophobicContact CG1-CD2 4Å; V337-L360 HydrophobicContact CG2-CB 4.14Å; L360-L362 HydrophobicContact CD1-CD2 3.95Å; L360-L362 HydrophobicContact CD1-CG 4.46Å; L360-C367 WeakPolarHBondContact CD1-SG 3.47Å; L360-F368 WeakPolarHBondContact CA-O 3.43Å; L360-L369 HydrophobicContact CB-CD2 3.87Å; L360-L369 HydrophobicContact CD1-CD2 3.75Å; L360-L369 HydrophobicContact CG-CD2 4.38Å; L360-V433 HydrophobicContact CD2-CG1 3.87Å; L360-W437 HydrophobicContact CD1-CZ3 4.42Å
361	I	95.8	Very high	85.3	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.1	170.6	-55.6	-166.5	0	0	0	109	I331 L334 F359 K363 F368 F370 P374 F380	I331-I361 HydrophobicContact CG2-CG2 4.49Å; L334-I361 HydrophobicContact CD2-CB 4.02Å; L334-I361 HydrophobicContact CD2-CD1 3.64Å; L334-I361 HydrophobicContact CD2-CG1 3.51Å; L334-I361 HydrophobicContact CD2-CG2 3.72Å; F359-I361 HydrophobicContact CD1-CD1 4.02Å; F359-I361 HydrophobicContact CD1-CG1 3.77Å; F359-I361 HydrophobicContact CE1-CD1 3.89Å; F359-I361 HydrophobicContact CE1-CG1 3.81Å; I361-K363 HydrophobicContact CG2-CB 4.09Å; I361-F368 HydrophobicContact CB-CB 4.36Å; I361-F368 PolarHBondContact N-O 2.74Å; I361-F368 PolarHBondContact O-N 2.86Å; I361-F370 HydrophobicContact CB-CE2 4.23Å; I361-F370 HydrophobicContact CD1-CD2 4.14Å; I361-F370 HydrophobicContact CD1-CE2 3.76Å; I361-F370 HydrophobicContact CG1-CD2 4.13Å; I361-F370 HydrophobicContact CG1-CE2 3.94Å; I361-P374 HydrophobicContact CD1-CG 3.46Å; I361-P374 VanDerWaalsContact CD1-CG 3.46Å; I361-F380 HydrophobicContact CD1-CE1 4.39Å; I361-F380 HydrophobicContact CD1-CZ 4.14Å; I361-F380 HydrophobicContact CG2-CE1 4.25Å
362	L	96.3	Very high	87.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	110.4	168.2	-58.4	-178.2	0	0	0	108.4	V332 Y333 L360 C367 I389 A436 W437	V332-L362 HydrophobicContact CB-CB 4.47Å; V332-L362 PolarHBondContact N-O 3.23Å; Y333-L362 PolarHBondContact O-N 3.48Å; Y333-L362 VanDerWaalsContact O-N 3.1Å; L360-L362 HydrophobicContact CD1-CD2 3.95Å; L360-L362 HydrophobicContact CD1-CG 4.46Å; L362-C367 HydrophobicContact CD2-CB 3.71Å; L362-I389 HydrophobicContact CD2-CD1 4.23Å; L362-A436 HydrophobicContact CD1-CB 3.82Å; L362-W437 HydrophobicContact CD1-CB 4.43Å; L362-W437 HydrophobicContact CD1-CE3 4.05Å; L362-W437 HydrophobicContact CD2-CE3 3.86Å; L362-W437 HydrophobicContact CD2-CZ3 3.81Å
363	K	93	Very high	89.3	Confident	27 Å²	27	32.7 Å²	32.7	12%	0.117	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.2	-173.7	-179.4	-178.7	179.1	-88.6	0	109.7	E329 I331 I361 N365 E366 F368 F380	E329-K363 WeakPolarHBondContact O-CE 3.21Å; E329-K363 VanDerWaalsContact O-CG 3.22Å; E329-K363 WeakPolarHBondContact O-CG 3.31Å; E329-K363 IonicContact OE2-NZ 2.77Å; E329-K363 PolarHBondContact OE2-NZ 3.33Å; I331-K363 HydrophobicContact CG1-CB 4.45Å; I331-K363 HydrophobicContact CG1-CD 4.48Å; I331-K363 HydrophobicContact CG1-CG 4.19Å; I361-K363 HydrophobicContact CG2-CB 4.09Å; K363-N365 PolarHBondContact O-N 2.93Å; K363-N365 VanDerWaalsContact O-N 3.16Å; K363-E366 PolarHBondContact N-O 3.42Å; K363-E366 PolarHBondContact O-N 2.78Å; K363-F368 HydrophobicContact CB-CD2 4.5Å; K363-F368 HydrophobicContact CB-CE2 4.16Å; K363-F380 HydrophobicContact CD-CE1 3.88Å; K363-F380 HydrophobicContact CD-CZ 4.16Å
364	G	90.7	Very high	91	Very high	11 Å²	11	27.1 Å²	27.1	11%	0.113	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-117.1	-177.5	0	0	0	0	0	111.8	D328 L330	D328-G364 WeakPolarHBondContact O-CA 3.45Å; L330-G364 PolarHBondContact O-N 3.12Å
365	N	93.1	Very high	91.6	Very high	34 Å²	34	33 Å²	33	18%	0.182	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	18.8	175.7	68.3	-49.8	0	0	0	113.3	K363 Q388 I389 A444	K363-N365 PolarHBondContact O-N 2.93Å; K363-N365 VanDerWaalsContact O-N 3.16Å; N365-Q388 CarbonylContact O-C 3.45Å; N365-Q388 WeakPolarHBondContact O-CA 3.31Å; N365-I389 PolarHBondContact O-N 3.42Å; N365-A444 HydrophobicContact CB-CB 3.57Å
366	E	94.1	Very high	91.7	Very high	68 Å²	68	34.6 Å²	34.6	32%	0.318	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.9	-176.5	-65	-178	126.8	0	0	111.8	K363 F368 Q387 Q388	K363-E366 PolarHBondContact N-O 3.42Å; K363-E366 PolarHBondContact O-N 2.78Å; E366-F368 HydrophobicContact CB-CD2 4.33Å; E366-F368 HydrophobicContact CB-CE2 3.46Å; E366-F368 VanDerWaalsContact CB-CE2 3.46Å; E366-F368 HydrophobicContact CB-CZ 3.63Å; E366-F368 HydrophobicContact CG-CZ 4.4Å; E366-F368 WeakPolarHBondContact OE2-CZ 3.2Å; E366-Q387 WeakPolarHBondContact CA-O 3.45Å; E366-Q388 HydrophobicContact CG-CG 4.49Å
367	C	95.1	Very high	91.6	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.014	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.9	173	173	0	0	0	0	109.4	L360 L362 S386 Q387 I389 W437	L360-C367 WeakPolarHBondContact CD1-SG 3.47Å; L362-C367 HydrophobicContact CD2-CB 3.71Å; C367-S386 WeakPolarHBondContact O-CA 3.43Å; C367-Q387 PolarHBondContact N-O 3.02Å; C367-Q387 PolarHBondContact O-N 3.44Å; C367-Q387 VanDerWaalsContact O-N 3.1Å; C367-I389 HydrophobicContact CB-CD1 3.78Å; C367-I389 HydrophobicContact CB-CG1 4.39Å; C367-W437 HydrophobicContact CB-CH2 3.91Å; C367-W437 HydrophobicContact CB-CZ3 4.32Å; C367-W437 WeakPolarHBondContact SG-CH2 3.47Å; C367-W437 VanDerWaalsContact SG-CZ3 3.55Å
368	F	95.7	Very high	91.3	Very high	12 Å²	12	42.5 Å²	42.5	5%	0.053	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.6	179	-56.5	-91.1	0	0	0	111.3	L360 I361 K363 E366 F370 F380 F385 S386	L360-F368 WeakPolarHBondContact CA-O 3.43Å; I361-F368 HydrophobicContact CB-CB 4.36Å; I361-F368 PolarHBondContact N-O 2.74Å; I361-F368 PolarHBondContact O-N 2.86Å; K363-F368 HydrophobicContact CB-CD2 4.5Å; K363-F368 HydrophobicContact CB-CE2 4.16Å; E366-F368 HydrophobicContact CB-CD2 4.33Å; E366-F368 HydrophobicContact CB-CE2 3.46Å; E366-F368 VanDerWaalsContact CB-CE2 3.46Å; E366-F368 HydrophobicContact CB-CZ 3.63Å; E366-F368 HydrophobicContact CG-CZ 4.4Å; E366-F368 WeakPolarHBondContact OE2-CZ 3.2Å; F368-F370 HydrophobicContact CB-CD2 4.14Å; F368-F370 HydrophobicContact CB-CE2 3.33Å; F368-F370 HydrophobicContact CB-CZ 3.75Å; F368-F370 HydrophobicContact CD1-CZ 4.25Å; F368-F370 HydrophobicContact CG-CE2 4.13Å; F368-F370 HydrophobicContact CG-CZ 4.16Å; F368-F380 HydrophobicContact CD1-CD1 4.2Å; F368-F380 HydrophobicContact CD2-CD1 4.19Å; F368-F380 HydrophobicContact CD2-CE1 4.18Å; F368-F380 HydrophobicContact CE1-CD1 4.14Å; F368-F380 HydrophobicContact CE2-CD1 4.13Å; F368-F380 HydrophobicContact CE2-CE1 4.3Å; F368-F380 HydrophobicContact CG-CD1 4.23Å; F368-F380 HydrophobicContact CZ-CD1 4.11Å; F368-F385 CarbonylContact C-O 3.59Å; F368-F385 VanDerWaalsContact CA-O 3.27Å; F368-F385 WeakPolarHBondContact CA-O 3.47Å; F368-S386 WeakPolarHBondContact CE1-OG 3.24Å
369	L	95.4	Very high	91	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.7	163.4	-60.8	170.3	0	0	0	109.9	V337 R358 F359 L360 S383 A384 F385 L420 L422	V337-L369 HydrophobicContact CG2-CD2 3.87Å; R358-L369 HydrophobicContact CB-CB 4.33Å; R358-L369 HydrophobicContact CB-CD2 4.16Å; F359-L369 CarbonylContact O-C 3.35Å; F359-L369 WeakPolarHBondContact O-CA 3.36Å; L360-L369 HydrophobicContact CB-CD2 3.87Å; L360-L369 HydrophobicContact CD1-CD2 3.75Å; L360-L369 HydrophobicContact CG-CD2 4.38Å; L369-S383 CarbonylContact O-C 3.59Å; L369-A384 PolarHBondContact O-N 3.32Å; L369-F385 HydrophobicContact CB-CB 3.96Å; L369-F385 HydrophobicContact CD1-CB 4.11Å; L369-F385 HydrophobicContact CD1-CD1 4.24Å; L369-F385 HydrophobicContact CD1-CG 4.35Å; L369-F385 HydrophobicContact CG-CB 4.24Å; L369-F385 HydrophobicContact CG-CD1 4.22Å; L369-F385 PolarHBondContact N-O 2.84Å; L369-F385 PolarHBondContact O-N 3.47Å; L369-L420 HydrophobicContact CD1-CD1 3.84Å; L369-L422 HydrophobicContact CD1-CD2 4.47Å
370	F	93.5	Very high	90.6	Very high	7 Å²	7	46.3 Å²	46.3	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	157.5	177.2	-58.6	-90.9	0	0	0	111.5	R358 F359 I361 F368 S372 P374 F380	R358-F370 CarbonylContact C-O 3.53Å; R358-F370 VanDerWaalsContact CA-O 3.27Å; R358-F370 WeakPolarHBondContact CA-O 3.47Å; F359-F370 HydrophobicContact CB-CB 4.32Å; F359-F370 PolarHBondContact N-O 2.71Å; F359-F370 PolarHBondContact O-N 2.9Å; I361-F370 HydrophobicContact CB-CE2 4.23Å; I361-F370 HydrophobicContact CD1-CD2 4.14Å; I361-F370 HydrophobicContact CD1-CE2 3.76Å; I361-F370 HydrophobicContact CG1-CD2 4.13Å; I361-F370 HydrophobicContact CG1-CE2 3.94Å; F368-F370 HydrophobicContact CB-CD2 4.14Å; F368-F370 HydrophobicContact CB-CE2 3.33Å; F368-F370 HydrophobicContact CB-CZ 3.75Å; F368-F370 HydrophobicContact CD1-CZ 4.25Å; F368-F370 HydrophobicContact CG-CE2 4.13Å; F368-F370 HydrophobicContact CG-CZ 4.16Å; F370-S372 WeakPolarHBondContact CB-O 3.33Å; F370-P374 HydrophobicContact CD1-CB 4.46Å; F370-P374 HydrophobicContact CD1-CG 4.39Å; F370-P374 HydrophobicContact CD2-CG 4.12Å; F370-P374 HydrophobicContact CE1-CB 4.22Å; F370-P374 HydrophobicContact CE1-CG 4.16Å; F370-P374 HydrophobicContact CE2-CG 3.85Å; F370-P374 HydrophobicContact CG-CG 4.39Å; F370-P374 HydrophobicContact CZ-CB 4.38Å; F370-P374 HydrophobicContact CZ-CG 3.89Å; F370-F380 HydrophobicContact CE2-CD1 4.5Å; F370-F380 HydrophobicContact CE2-CE1 4.45Å; F370-F380 AromaticContact CZ-CD1 3.82Å; F370-F380 HydrophobicContact CZ-CD1 3.82Å; F370-F380 HydrophobicContact CZ-CE1 4.17Å; F370-F380 HydrophobicContact CZ-CG 4.14Å
371	E	90.8	Very high	90	Very high	138 Å²	138	54.7 Å²	54.7	65%	0.645	28%	0.277	S	S	*	.	S	Bend	trans	-74.5	-33.3	168.8	-71.9	-180	-179.3	0	0	112.1	R358	R358-E371 IonicContact CZ-OE1 3.01Å; R358-E371 IonicContact NH1-OE1 2.62Å; R358-E371 PolarHBondContact NH1-OE1 3.3Å; R358-E371 IonicContact NH2-OE1 3.55Å
372	S	88.6	Confident	89.6	Confident	72 Å²	72	60.6 Å²	60.6	50%	0.503	31%	0.309	S	S	.	.	S	Bend	trans	-140.2	151	175.1	54.3	0	0	0	0	109.8	F370	F370-S372 WeakPolarHBondContact CB-O 3.33Å
373	P	90.1	Very high	89.3	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.026	32%	0.318	C	S	.	.			trans	-56.3	128.3	178.8	-26.4	35.5	0	0	0	112	M252 V283 W336 F359	M252-P373 HydrophobicContact CB-CG 4.3Å; M252-P373 HydrophobicContact SD-CB 3.81Å; M252-P373 HydrophobicContact SD-CG 4.42Å; V283-P373 HydrophobicContact CG2-CB 4.01Å; V283-P373 HydrophobicContact CG2-CG 3.67Å; W336-P373 HydrophobicContact CZ2-CG 3.85Å; F359-P373 HydrophobicContact CB-CG 4.32Å; F359-P373 HydrophobicContact CD1-CB 3.84Å; F359-P373 HydrophobicContact CD1-CG 3.97Å; F359-P373 HydrophobicContact CD2-CB 4.39Å; F359-P373 HydrophobicContact CD2-CG 3.67Å; F359-P373 HydrophobicContact CE1-CB 3.78Å; F359-P373 HydrophobicContact CE1-CG 4.11Å; F359-P373 HydrophobicContact CE2-CB 4.34Å; F359-P373 HydrophobicContact CE2-CG 3.81Å; F359-P373 HydrophobicContact CG-CB 4.13Å; F359-P373 HydrophobicContact CG-CG 3.73Å; F359-P373 HydrophobicContact CZ-CB 4.04Å; F359-P373 HydrophobicContact CZ-CG 4.02Å
374	P	89.2	Confident	89.1	Confident	18 Å²	18	63.4 Å²	63.4	12%	0.117	34%	0.336	C	S	.	.			trans	-70.1	133.7	179.1	28.9	-34.8	0	0	0	111.1	I361 F370 E379 F380	I361-P374 HydrophobicContact CD1-CG 3.46Å; I361-P374 VanDerWaalsContact CD1-CG 3.46Å; F370-P374 HydrophobicContact CD1-CB 4.46Å; F370-P374 HydrophobicContact CD1-CG 4.39Å; F370-P374 HydrophobicContact CD2-CG 4.12Å; F370-P374 HydrophobicContact CE1-CB 4.22Å; F370-P374 HydrophobicContact CE1-CG 4.16Å; F370-P374 HydrophobicContact CE2-CG 3.85Å; F370-P374 HydrophobicContact CG-CG 4.39Å; F370-P374 HydrophobicContact CZ-CB 4.38Å; F370-P374 HydrophobicContact CZ-CG 3.89Å; P374-E379 VanDerWaalsContact CA-OE2 3.27Å; P374-E379 WeakPolarHBondContact CA-OE2 3.45Å; P374-E379 HydrophobicContact CB-CB 3.87Å; P374-F380 HydrophobicContact CB-CD2 4.35Å; P374-F380 HydrophobicContact CB-CE2 4.23Å; P374-F380 HydrophobicContact CG-CD2 4.45Å; P374-F380 HydrophobicContact CG-CE2 3.98Å; P374-F380 HydrophobicContact CG-CZ 4.14Å
375	M	83.5	Confident	89.1	Confident	143 Å²	143	63.9 Å²	63.9	70%	0.704	34%	0.335	S	S	*	.	S	Bend	trans	-93.9	-18.2	-177	-61.8	-56.2	-63.9	0	0	113.2	E379	M375-E379 PolarHBondContact N-OE2 2.99Å
376	N	82.7	Confident	89.2	Confident	71 Å²	71	64.7 Å²	64.7	38%	0.38	34%	0.343	S	S	.	.	S	Bend	trans	-145.1	170.4	178.7	60	60.6	0	0	0	111.3	E378 E379	N376-E378 VanDerWaalsContact C-N 3.28Å; N376-E378 PolarHBondContact O-N 2.88Å; N376-E378 WeakPolarHBondContact OD1-CB 3.2Å; N376-E378 PolarHBondContact OD1-N 2.93Å; N376-E379 PolarHBondContact ND2-OE1 3.31Å; N376-E379 PolarHBondContact O-N 3.18Å; N376-E379 WeakPolarHBondContact OD1-CG 3.46Å; N376-E379 PolarHBondContact OD1-N 2.63Å
377	T	81.5	Confident	89.2	Confident	111 Å²	111	63 Å²	63	68%	0.681	34%	0.335	S	S	*	.	S	Bend	trans	-68.1	-24.9	-178.6	-48.7	0	0	0	0	113.2	F380	T377-F380 PolarHBondContact O-N 3.49Å
378	E	84.3	Confident	89.2	Confident	147 Å²	147	66.1 Å²	66.1	69%	0.687	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-72.5	-33.3	-179.3	-58.6	-166.4	140.4	0	0	111.9	N376 F380 K381	N376-E378 VanDerWaalsContact C-N 3.28Å; N376-E378 PolarHBondContact O-N 2.88Å; N376-E378 WeakPolarHBondContact OD1-CB 3.2Å; N376-E378 PolarHBondContact OD1-N 2.93Å; E378-F380 PolarHBondContact O-N 3.24Å; E378-K381 WeakPolarHBondContact O-CB 3.13Å; E378-K381 PolarHBondContact O-N 2.87Å; E378-K381 VanDerWaalsContact O-N 3.11Å
379	E	86.5	Confident	89.2	Confident	61 Å²	61	65.5 Å²	65.5	29%	0.285	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-65.4	-17.4	177.2	-76.5	169.9	-148.4	0	0	113.8	P374 M375 N376 K381 N382	P374-E379 VanDerWaalsContact CA-OE2 3.27Å; P374-E379 WeakPolarHBondContact CA-OE2 3.45Å; P374-E379 HydrophobicContact CB-CB 3.87Å; M375-E379 PolarHBondContact N-OE2 2.99Å; N376-E379 PolarHBondContact ND2-OE1 3.31Å; N376-E379 PolarHBondContact O-N 3.18Å; N376-E379 WeakPolarHBondContact OD1-CG 3.46Å; N376-E379 PolarHBondContact OD1-N 2.63Å; E379-K381 PolarHBondContact O-N 3.27Å; E379-K381 VanDerWaalsContact O-N 3.16Å; E379-N382 WeakPolarHBondContact O-CA 3.49Å; E379-N382 WeakPolarHBondContact O-CB 3.44Å; E379-N382 PolarHBondContact O-N 2.99Å
380	F	85.5	Confident	89.2	Confident	39 Å²	39	65.5 Å²	65.5	17%	0.171	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-58.7	-26.7	171.4	-81.3	-102	0	0	0	112.2	I361 K363 F368 F370 P374 T377 E378 N382 S383	I361-F380 HydrophobicContact CD1-CE1 4.39Å; I361-F380 HydrophobicContact CD1-CZ 4.14Å; I361-F380 HydrophobicContact CG2-CE1 4.25Å; K363-F380 HydrophobicContact CD-CE1 3.88Å; K363-F380 HydrophobicContact CD-CZ 4.16Å; F368-F380 HydrophobicContact CD1-CD1 4.2Å; F368-F380 HydrophobicContact CD2-CD1 4.19Å; F368-F380 HydrophobicContact CD2-CE1 4.18Å; F368-F380 HydrophobicContact CE1-CD1 4.14Å; F368-F380 HydrophobicContact CE2-CD1 4.13Å; F368-F380 HydrophobicContact CE2-CE1 4.3Å; F368-F380 HydrophobicContact CG-CD1 4.23Å; F368-F380 HydrophobicContact CZ-CD1 4.11Å; F370-F380 HydrophobicContact CE2-CD1 4.5Å; F370-F380 HydrophobicContact CE2-CE1 4.45Å; F370-F380 AromaticContact CZ-CD1 3.82Å; F370-F380 HydrophobicContact CZ-CD1 3.82Å; F370-F380 HydrophobicContact CZ-CE1 4.17Å; F370-F380 HydrophobicContact CZ-CG 4.14Å; P374-F380 HydrophobicContact CB-CD2 4.35Å; P374-F380 HydrophobicContact CB-CE2 4.23Å; P374-F380 HydrophobicContact CG-CD2 4.45Å; P374-F380 HydrophobicContact CG-CE2 3.98Å; P374-F380 HydrophobicContact CG-CZ 4.14Å; T377-F380 PolarHBondContact O-N 3.49Å; E378-F380 PolarHBondContact O-N 3.24Å; F380-N382 PolarHBondContact O-N 3.17Å; F380-S383 PolarHBondContact O-N 2.98Å; F380-S383 PolarHBondContact O-OG 3.43Å
381	K	85.4	Confident	89.3	Confident	177 Å²	177	65.9 Å²	65.9	77%	0.77	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-68.8	-20.6	174.6	-62.6	176.8	-178.9	171.8	0	113.1	E378 E379 S383	E378-K381 WeakPolarHBondContact O-CB 3.13Å; E378-K381 PolarHBondContact O-N 2.87Å; E378-K381 VanDerWaalsContact O-N 3.11Å; E379-K381 PolarHBondContact O-N 3.27Å; E379-K381 VanDerWaalsContact O-N 3.16Å; K381-S383 VanDerWaalsContact C-N 3.34Å
382	N	87.2	Confident	89.6	Confident	129 Å²	129	59.8 Å²	59.8	69%	0.69	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-96.1	16.7	179.8	-59.2	-27.2	0	0	0	112	E379 F380 A384	E379-N382 WeakPolarHBondContact O-CA 3.49Å; E379-N382 WeakPolarHBondContact O-CB 3.44Å; E379-N382 PolarHBondContact O-N 2.99Å; F380-N382 PolarHBondContact O-N 3.17Å; N382-A384 PolarHBondContact O-N 2.92Å
383	S	89	Confident	89.9	Confident	26 Å²	26	61.2 Å²	61.2	18%	0.182	32%	0.315	C	S	.	.			trans	-59.6	134.9	175.1	61.8	0	0	0	0	110.6	L369 F380 K381 F385	L369-S383 CarbonylContact O-C 3.59Å; F380-S383 PolarHBondContact O-N 2.98Å; F380-S383 PolarHBondContact O-OG 3.43Å; K381-S383 VanDerWaalsContact C-N 3.34Å; S383-F385 WeakPolarHBondContact CB-O 3.16Å; S383-F385 PolarHBondContact O-N 2.85Å
384	A	89	Confident	90.1	Very high	60 Å²	60	62.7 Å²	62.7	50%	0.496	32%	0.321	S	S	.	.	S	Bend	trans	-64.7	-29.5	173.4	0	0	0	0	0	111.7	L369 N382	L369-A384 PolarHBondContact O-N 3.32Å; N382-A384 PolarHBondContact O-N 2.92Å
385	F	92	Very high	90.3	Very high	20 Å²	20	64.9 Å²	64.9	9%	0.088	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.1	175.6	173.2	-94.9	0	0	0	109.8	F368 L369 S383 Q387 T414 L420	F368-F385 CarbonylContact C-O 3.59Å; F368-F385 VanDerWaalsContact CA-O 3.27Å; F368-F385 WeakPolarHBondContact CA-O 3.47Å; L369-F385 HydrophobicContact CB-CB 3.96Å; L369-F385 HydrophobicContact CD1-CB 4.11Å; L369-F385 HydrophobicContact CD1-CD1 4.24Å; L369-F385 HydrophobicContact CD1-CG 4.35Å; L369-F385 HydrophobicContact CG-CB 4.24Å; L369-F385 HydrophobicContact CG-CD1 4.22Å; L369-F385 PolarHBondContact N-O 2.84Å; L369-F385 PolarHBondContact O-N 3.47Å; S383-F385 WeakPolarHBondContact CB-O 3.16Å; S383-F385 PolarHBondContact O-N 2.85Å; F385-Q387 HydrophobicContact CE1-CB 3.88Å; F385-Q387 HydrophobicContact CE2-CB 4.24Å; F385-Q387 HydrophobicContact CZ-CB 3.47Å; F385-Q387 VanDerWaalsContact CZ-CB 3.47Å; F385-Q387 HydrophobicContact CZ-CG 4.43Å; F385-T414 HydrophobicContact CE2-CG2 3.76Å; F385-T414 HydrophobicContact CZ-CG2 3.64Å; F385-L420 HydrophobicContact CD1-CD1 3.91Å; F385-L420 HydrophobicContact CD2-CD1 3.93Å; F385-L420 HydrophobicContact CD2-CD2 4.48Å; F385-L420 HydrophobicContact CE1-CD1 3.79Å; F385-L420 HydrophobicContact CE2-CD1 3.83Å; F385-L420 HydrophobicContact CG-CD1 3.98Å; F385-L420 HydrophobicContact CZ-CD1 3.74Å
386	S	93.7	Very high	90.6	Very high	51 Å²	51	61.5 Å²	61.5	36%	0.357	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	123.6	173.4	177.4	0	0	0	0	110.2	C367 F368	C367-S386 WeakPolarHBondContact O-CA 3.43Å; F368-S386 WeakPolarHBondContact CE1-OG 3.24Å
387	Q	94.5	Very high	90.7	Very high	33 Å²	33	58.6 Å²	58.6	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	149	176.3	-165.9	70.4	51.2	0	0	111.3	E366 C367 F385 E391 T392	E366-Q387 WeakPolarHBondContact CA-O 3.45Å; C367-Q387 PolarHBondContact N-O 3.02Å; C367-Q387 PolarHBondContact O-N 3.44Å; C367-Q387 VanDerWaalsContact O-N 3.1Å; F385-Q387 HydrophobicContact CE1-CB 3.88Å; F385-Q387 HydrophobicContact CE2-CB 4.24Å; F385-Q387 HydrophobicContact CZ-CB 3.47Å; F385-Q387 VanDerWaalsContact CZ-CB 3.47Å; F385-Q387 HydrophobicContact CZ-CG 4.43Å; Q387-E391 HydrophobicContact CG-CB 4.14Å; Q387-E391 PolarHBondContact NE2-OE2 3.01Å; Q387-T392 HydrophobicContact CB-CG2 3.76Å; Q387-T392 HydrophobicContact CG-CG2 3.54Å
388	Q	95.4	Very high	90.9	Very high	67 Å²	67	59.8 Å²	59.8	31%	0.313	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	135.2	170.5	-62.8	-169.6	-20.8	0	0	111.1	N365 E366 Q390 E391	N365-Q388 CarbonylContact O-C 3.45Å; N365-Q388 WeakPolarHBondContact O-CA 3.31Å; E366-Q388 HydrophobicContact CG-CG 4.49Å; Q388-Q390 VanDerWaalsContact C-N 3.31Å; Q388-Q390 PolarHBondContact O-N 3.3Å; Q388-E391 HydrophobicContact CB-CB 4.48Å; Q388-E391 HydrophobicContact CB-CG 4.47Å; Q388-E391 CarbonylContact O-C 3.37Å; Q388-E391 WeakPolarHBondContact O-CA 3.48Å; Q388-E391 WeakPolarHBondContact O-CB 3.49Å; Q388-E391 PolarHBondContact O-N 2.64Å
389	I	95.8	Very high	90.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-60.4	-38	-173	-83.3	-67.4	0	0	0	112.8	L362 N365 C367 E391 T392 W437 C440 T441	L362-I389 HydrophobicContact CD2-CD1 4.23Å; N365-I389 PolarHBondContact O-N 3.42Å; C367-I389 HydrophobicContact CB-CD1 3.78Å; C367-I389 HydrophobicContact CB-CG1 4.39Å; I389-E391 PolarHBondContact O-N 2.96Å; I389-T392 WeakPolarHBondContact CA-OG1 3.35Å; I389-T392 PolarHBondContact O-N 3.13Å; I389-T392 VanDerWaalsContact O-O 3.11Å; I389-T392 PolarHBondContact O-OG1 3.07Å; I389-W437 HydrophobicContact CD1-CD2 4Å; I389-W437 HydrophobicContact CD1-CE3 4.48Å; I389-W437 HydrophobicContact CD1-CG 4.49Å; I389-W437 HydrophobicContact CD1-CH2 4.17Å; I389-W437 HydrophobicContact CD1-CZ2 3.68Å; I389-C440 HydrophobicContact CD1-CB 4.45Å; I389-C440 HydrophobicContact CG1-CB 4.02Å; I389-C440 HydrophobicContact CG2-CB 4.28Å; I389-T441 VanDerWaalsContact CG2-CA 3.46Å; I389-T441 HydrophobicContact CG2-CG2 4.34Å; I389-T441 WeakPolarHBondContact CG2-OG1 3.42Å
390	Q	94.9	Very high	90.1	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.009	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-70.7	-10.8	177.4	70.5	-79.2	5.3	0	0	113.7	Q388 I445 L448 Y531 A534	Q388-Q390 VanDerWaalsContact C-N 3.31Å; Q388-Q390 PolarHBondContact O-N 3.3Å; Q390-I445 HydrophobicContact CB-CD1 4.1Å; Q390-L448 HydrophobicContact CG-CD1 4.01Å; Q390-Y531 HydrophobicContact CG-CD1 4.35Å; Q390-Y531 HydrophobicContact CG-CD2 4.42Å; Q390-Y531 HydrophobicContact CG-CE1 3.69Å; Q390-Y531 HydrophobicContact CG-CE2 3.81Å; Q390-Y531 WeakPolarHBondContact CG-OH 3.31Å; Q390-Y531 PolarHBondContact NE2-OH 2.79Å; Q390-A534 HydrophobicContact CB-CB 4.06Å
391	E	96.4	Very high	89.8	Confident	15 Å²	15	64.5 Å²	64.5	7%	0.07	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-100	14.3	171.6	-68.4	-174.3	145.9	0	0	112.1	Q387 Q388 I389 V415 R527 Y531	Q387-E391 HydrophobicContact CG-CB 4.14Å; Q387-E391 PolarHBondContact NE2-OE2 3.01Å; Q388-E391 HydrophobicContact CB-CB 4.48Å; Q388-E391 HydrophobicContact CB-CG 4.47Å; Q388-E391 CarbonylContact O-C 3.37Å; Q388-E391 WeakPolarHBondContact O-CA 3.48Å; Q388-E391 WeakPolarHBondContact O-CB 3.49Å; Q388-E391 PolarHBondContact O-N 2.64Å; I389-E391 PolarHBondContact O-N 2.96Å; E391-V415 HydrophobicContact CB-CB 4Å; E391-V415 HydrophobicContact CB-CG1 3.76Å; E391-V415 HydrophobicContact CG-CB 4.47Å; E391-V415 HydrophobicContact CG-CG1 4.17Å; E391-V415 PolarHBondContact O-N 2.75Å; E391-R527 IonicContact OE1-CZ 3.85Å; E391-R527 IonicContact OE1-NE 3.14Å; E391-R527 PolarHBondContact OE1-NE 2.91Å; E391-R527 IonicContact OE1-NH2 3.78Å; E391-R527 PolarHBondContact OE1-NH2 3.49Å; E391-R527 VanDerWaalsContact OE1-NH2 3.11Å; E391-Y531 HydrophobicContact CG-CE2 3.75Å
392	T	96.6	Very high	89.5	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.055	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.9	178.1	65.3	0	0	0	0	111.2	Q387 I389 V412 E413 T414 W437	Q387-T392 HydrophobicContact CB-CG2 3.76Å; Q387-T392 HydrophobicContact CG-CG2 3.54Å; I389-T392 WeakPolarHBondContact CA-OG1 3.35Å; I389-T392 PolarHBondContact O-N 3.13Å; I389-T392 VanDerWaalsContact O-O 3.11Å; I389-T392 PolarHBondContact O-OG1 3.07Å; T392-V412 HydrophobicContact CG2-CG1 4.42Å; T392-E413 CarbonylContact C-O 3.54Å; T392-E413 VanDerWaalsContact CA-O 3.22Å; T392-E413 WeakPolarHBondContact CA-O 3.4Å; T392-T414 HydrophobicContact CG2-CG2 4.48Å; T392-W437 HydrophobicContact CG2-CZ2 4.45Å; T392-W437 VanDerWaalsContact OG1-CZ2 3.22Å; T392-W437 WeakPolarHBondContact OG1-CZ2 2.87Å
393	R	94.2	Very high	88.6	Confident	103 Å²	103	56.2 Å²	56.2	39%	0.389	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	123.2	177.7	-173.4	-169.5	-173.9	-174.1	5.8	110.4	V412 E413 F530	R393-V412 WeakPolarHBondContact O-CA 3.23Å; R393-E413 HydrophobicContact CB-CB 4.34Å; R393-E413 WeakPolarHBondContact CD-OE2 3.32Å; R393-E413 PolarHBondContact N-O 2.94Å; R393-E413 IonicContact NH1-OE2 2.7Å; R393-E413 PolarHBondContact O-N 3.45Å; R393-F530 HydrophobicContact CB-CD1 4.17Å; R393-F530 HydrophobicContact CB-CE1 3.72Å
394	F	95.3	Very high	87.6	Confident	34 Å²	34	57.6 Å²	57.6	15%	0.149	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124.3	171.1	-170.2	-77.7	0	0	0	110	D396 F410 V412 L430 V433 R434 W437	F394-D396 WeakPolarHBondContact CE1-OD1 3.12Å; F394-F410 AromaticContact CD2-CD2 3.84Å; F394-F410 HydrophobicContact CD2-CD2 3.84Å; F394-F410 HydrophobicContact CD2-CE2 4.06Å; F394-F410 HydrophobicContact CE1-CB 4.07Å; F394-F410 HydrophobicContact CE1-CD2 4.34Å; F394-F410 HydrophobicContact CE1-CG 4.32Å; F394-F410 HydrophobicContact CE2-CB 4.35Å; F394-F410 HydrophobicContact CE2-CD1 4.4Å; F394-F410 AromaticContact CE2-CD2 3.16Å; F394-F410 HydrophobicContact CE2-CD2 3.16Å; F394-F410 AromaticContact CE2-CE2 3.35Å; F394-F410 HydrophobicContact CE2-CE2 3.35Å; F394-F410 AromaticContact CE2-CG 3.74Å; F394-F410 HydrophobicContact CE2-CG 3.74Å; F394-F410 HydrophobicContact CE2-CZ 4.08Å; F394-F410 HydrophobicContact CZ-CB 3.75Å; F394-F410 HydrophobicContact CZ-CD1 4.13Å; F394-F410 AromaticContact CZ-CD2 3.46Å; F394-F410 HydrophobicContact CZ-CD2 3.46Å; F394-F410 VanDerWaalsContact CZ-CD2 3.46Å; F394-F410 HydrophobicContact CZ-CE2 4.02Å; F394-F410 AromaticContact CZ-CG 3.51Å; F394-F410 HydrophobicContact CZ-CG 3.51Å; F394-V412 HydrophobicContact CD2-CG2 4.48Å; F394-L430 HydrophobicContact CZ-CD1 4.1Å; F394-V433 HydrophobicContact CE2-CG1 3.96Å; F394-R434 HydrophobicContact CD1-CG 4.11Å; F394-R434 HydrophobicContact CE1-CB 3.95Å; F394-R434 HydrophobicContact CE1-CG 3.84Å; F394-R434 HydrophobicContact CE2-CB 4.49Å; F394-R434 HydrophobicContact CZ-CB 3.91Å; F394-R434 HydrophobicContact CZ-CG 4.32Å; F394-W437 HydrophobicContact CB-CD2 4.24Å; F394-W437 HydrophobicContact CB-CG 3.95Å; F394-W437 HydrophobicContact CD2-CB 4.26Å; F394-W437 AromaticContact CD2-CD2 3.99Å; F394-W437 HydrophobicContact CD2-CD2 3.99Å; F394-W437 HydrophobicContact CD2-CE3 4.12Å; F394-W437 HydrophobicContact CD2-CG 4.05Å; F394-W437 HydrophobicContact CG-CG 4.36Å
395	R	92.2	Very high	86.4	Confident	65 Å²	65	59.4 Å²	59.4	25%	0.245	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	118.9	179.6	-173.3	169.6	72.2	87.9	-12.1	111.2	E401 F410 I411 E413	R395-E401 IonicContact CZ-OE1 3.57Å; R395-E401 IonicContact NH1-OE1 2.74Å; R395-E401 PolarHBondContact NH1-OE1 2.96Å; R395-E401 IonicContact NH1-OE2 3.95Å; R395-E401 PolarHBondContact NH1-OE2 2.81Å; R395-E401 IonicContact NH2-OE1 3.82Å; R395-F410 WeakPolarHBondContact O-CA 3.33Å; R395-I411 PolarHBondContact N-O 3.23Å; R395-I411 PolarHBondContact O-N 3.36Å; R395-E413 WeakPolarHBondContact CD-OE1 3.23Å; R395-E413 IonicContact CZ-OE1 2.79Å; R395-E413 IonicContact NE-OE1 2.96Å; R395-E413 PolarHBondContact NE-OE1 3.07Å; R395-E413 IonicContact NH2-OE1 3.48Å
396	D	89.8	Confident	85.7	Confident	71 Å²	71	59.1 Å²	59.1	38%	0.38	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	136.6	169.1	-73.7	-42.8	0	0	0	110	F394 R434	F394-D396 WeakPolarHBondContact CE1-OD1 3.12Å; D396-R434 IonicContact OD1-NH1 3.79Å; D396-R434 IonicContact OD2-NH1 3.95Å; D396-R434 PolarHBondContact OD2-NH1 3.41Å
397	L	86.5	Confident	84.9	Confident	10 Å²	10	62 Å²	62	5%	0.052	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-88.1	133.1	178.2	-72.6	174.8	0	0	0	112.1	E401 R402 I411 Y421	L397-E401 HydrophobicContact CD2-CB 3.87Å; L397-R402 HydrophobicContact CB-CG 4.19Å; L397-I411 HydrophobicContact CD1-CG1 4.17Å; L397-I411 HydrophobicContact CD2-CD1 3.67Å; L397-I411 HydrophobicContact CD2-CG1 3.89Å; L397-I411 HydrophobicContact CG-CD1 4.48Å; L397-I411 HydrophobicContact CG-CG1 4.2Å; L397-Y421 HydrophobicContact CD1-CD2 4.23Å; L397-Y421 HydrophobicContact CD1-CE1 4Å; L397-Y421 HydrophobicContact CD1-CE2 3.48Å; L397-Y421 VanDerWaalsContact CD1-CE2 3.48Å; L397-Y421 WeakPolarHBondContact CD1-OH 3.47Å
398	K	84.5	Confident	84.6	Confident	136 Å²	136	63.6 Å²	63.6	59%	0.591	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-72.2	155.4	168.7	-60.9	177.5	-175.2	172.4	0	110	H400 E401 R402	K398-H400 VanDerWaalsContact C-N 3.26Å; K398-H400 PolarHBondContact O-N 2.75Å; K398-H400 VanDerWaalsContact O-N 3.12Å; K398-E401 HydrophobicContact CB-CG 4.26Å; K398-E401 WeakPolarHBondContact CB-OE2 3.45Å; K398-E401 PolarHBondContact N-OE2 3.09Å; K398-E401 WeakPolarHBondContact O-CB 3.47Å; K398-E401 PolarHBondContact O-N 3.31Å; K398-R402 PolarHBondContact O-N 2.84Å
399	E	78.2	Confident	84.3	Confident	135 Å²	135	60.5 Å²	60.5	63%	0.631	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-51.5	-42	-175.5	-169.6	59.5	-154.4	0	0	113.8	E401 R402	E399-E401 VanDerWaalsContact C-N 3.32Å; E399-E401 PolarHBondContact O-N 2.96Å; E399-R402 WeakPolarHBondContact O-CB 3.49Å; E399-R402 PolarHBondContact O-N 2.92Å; E399-R402 IonicContact OE2-CZ 3.93Å; E399-R402 IonicContact OE2-NE 3.87Å; E399-R402 PolarHBondContact OE2-NE 3.32Å; E399-R402 IonicContact OE2-NH1 2.87Å; E399-R402 PolarHBondContact OE2-NH1 3.07Å
400	H	76.6	Confident	84.2	Confident	149 Å²	149	60.5 Å²	60.5	69%	0.69	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-75.2	-16.4	-179.3	63.4	-90.4	0	0	0	114.6	K398	K398-H400 VanDerWaalsContact C-N 3.26Å; K398-H400 PolarHBondContact O-N 2.75Å; K398-H400 VanDerWaalsContact O-N 3.12Å
401	E	79.4	Confident	84.1	Confident	62 Å²	62	61.1 Å²	61.1	29%	0.29	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-87.1	-13.1	176	-58.5	177	112.7	0	0	111.6	R395 L397 K398 E399	R395-E401 IonicContact CZ-OE1 3.57Å; R395-E401 IonicContact NH1-OE1 2.74Å; R395-E401 PolarHBondContact NH1-OE1 2.96Å; R395-E401 IonicContact NH1-OE2 3.95Å; R395-E401 PolarHBondContact NH1-OE2 2.81Å; R395-E401 IonicContact NH2-OE1 3.82Å; L397-E401 HydrophobicContact CD2-CB 3.87Å; K398-E401 HydrophobicContact CB-CG 4.26Å; K398-E401 WeakPolarHBondContact CB-OE2 3.45Å; K398-E401 PolarHBondContact N-OE2 3.09Å; K398-E401 WeakPolarHBondContact O-CB 3.47Å; K398-E401 PolarHBondContact O-N 3.31Å; E399-E401 VanDerWaalsContact C-N 3.32Å; E399-E401 PolarHBondContact O-N 2.96Å
402	R	77.4	Confident	84	Confident	75 Å²	75	60.4 Å²	60.4	28%	0.283	29%	0.287	S	S	.	.			trans	-72.2	136.2	-177.6	-64.9	172.1	-172.9	-171.2	-11.8	110.3	L397 K398 E399 E407 Y421	L397-R402 HydrophobicContact CB-CG 4.19Å; K398-R402 PolarHBondContact O-N 2.84Å; E399-R402 WeakPolarHBondContact O-CB 3.49Å; E399-R402 PolarHBondContact O-N 2.92Å; E399-R402 IonicContact OE2-CZ 3.93Å; E399-R402 IonicContact OE2-NE 3.87Å; E399-R402 PolarHBondContact OE2-NE 3.32Å; E399-R402 IonicContact OE2-NH1 2.87Å; E399-R402 PolarHBondContact OE2-NH1 3.07Å; R402-E407 PolarHBondContact NH1-O 3.23Å; R402-E407 PolarHBondContact NH2-O 3.08Å; R402-Y421 WeakPolarHBondContact CA-OH 3.36Å
403	V	69.7	Low	83.9	Confident	58 Å²	58	61.7 Å²	61.7	35%	0.352	29%	0.292	S	S	.	.			trans	-103.8	118	172.6	-164.6	0	0	0	0	110.1	R340 Y421	R340-V403 VanDerWaalsContact NH1-CB 3.27Å; V403-Y421 HydrophobicContact CG2-CE2 4.16Å; V403-Y421 PolarHBondContact N-OH 2.97Å
404	G	67.3	Low	83.9	Confident	54 Å²	54	57 Å²	57	56%	0.557	28%	0.275	S	S	*	.	S	Bend	trans	82.7	-160.6	179.3	0	0	0	0	0	113.6
405	K	64.4	Low	83.8	Confident	99 Å²	99	56.3 Å²	56.3	43%	0.43	27%	0.273	S	S	.	.	S	Bend	trans	-92.5	13.8	-178.1	-71.3	-174.2	174.2	173.3	0	114.2	I269 E407	I269-K405 PolarHBondContact O-NZ 2.88Å; K405-E407 PolarHBondContact O-N 2.92Å
406	R	77.7	Confident	83.7	Confident	14 Å²	14	58.1 Å²	58.1	5%	0.053	29%	0.291	C	S	.	.			trans	-82	85.9	179.7	-71	-168.9	179.6	-121.6	9.2	110.3	Y258 C338 Y408 S409 S423	Y258-R406 HydrophobicContact CE1-CG 3.8Å; Y258-R406 HydrophobicContact CE2-CG 4.29Å; C338-R406 PolarHBondContact SG-NH1 3.14Å; R406-Y408 PolarHBondContact O-N 3.09Å; R406-S409 WeakPolarHBondContact CB-OG 3.48Å; R406-S409 PolarHBondContact O-OG 2.95Å; R406-S423 WeakPolarHBondContact CD-OG 3.24Å
407	E	75.6	Confident	83.6	Confident	112 Å²	112	57.6 Å²	57.6	52%	0.523	30%	0.302	S	S	.	.	S	Bend	trans	-59.8	-29.9	-174.6	-62	-178.9	164	0	0	113.4	R402 K405 S409	R402-E407 PolarHBondContact NH1-O 3.23Å; R402-E407 PolarHBondContact NH2-O 3.08Å; K405-E407 PolarHBondContact O-N 2.92Å; E407-S409 PolarHBondContact O-N 2.86Å
408	Y	87.9	Confident	83.7	Confident	66 Å²	66	61.9 Å²	61.9	26%	0.259	32%	0.322	S	S	.	.	S	Bend	trans	-105.3	60.3	-177.5	-43.2	-56.9	0	0	0	110.8	R406 S423 V424 S426 F427	R406-Y408 PolarHBondContact O-N 3.09Å; Y408-S423 WeakPolarHBondContact O-CA 2.94Å; Y408-S423 PolarHBondContact O-OG 2.96Å; Y408-V424 PolarHBondContact O-N 3.32Å; Y408-S426 VanDerWaalsContact CD2-CA 3.46Å; Y408-F427 HydrophobicContact CD1-CB 4.05Å; Y408-F427 HydrophobicContact CD1-CD2 4.27Å; Y408-F427 HydrophobicContact CE1-CB 3.63Å; Y408-F427 HydrophobicContact CE1-CD2 4.21Å; Y408-F427 HydrophobicContact CE1-CG 4.41Å
409	S	89.7	Confident	84	Confident	2 Å²	2	60 Å²	60	1%	0.014	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.2	177.5	-59.3	0	0	0	0	111.7	R406 E407 L422	R406-S409 WeakPolarHBondContact CB-OG 3.48Å; R406-S409 PolarHBondContact O-OG 2.95Å; E407-S409 PolarHBondContact O-N 2.86Å; S409-L422 CarbonylContact C-O 3.56Å; S409-L422 VanDerWaalsContact CA-O 3.28Å; S409-L422 WeakPolarHBondContact CA-O 3.43Å
410	F	94.1	Very high	84.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	165.2	178.4	60.9	-83.4	0	0	0	110.1	V337 F394 R395 V412 L422 V424 L430 V433	V337-F410 HydrophobicContact CG1-CZ 4.35Å; F394-F410 AromaticContact CD2-CD2 3.84Å; F394-F410 HydrophobicContact CD2-CD2 3.84Å; F394-F410 HydrophobicContact CD2-CE2 4.06Å; F394-F410 HydrophobicContact CE1-CB 4.07Å; F394-F410 HydrophobicContact CE1-CD2 4.34Å; F394-F410 HydrophobicContact CE1-CG 4.32Å; F394-F410 HydrophobicContact CE2-CB 4.35Å; F394-F410 HydrophobicContact CE2-CD1 4.4Å; F394-F410 AromaticContact CE2-CD2 3.16Å; F394-F410 HydrophobicContact CE2-CD2 3.16Å; F394-F410 AromaticContact CE2-CE2 3.35Å; F394-F410 HydrophobicContact CE2-CE2 3.35Å; F394-F410 AromaticContact CE2-CG 3.74Å; F394-F410 HydrophobicContact CE2-CG 3.74Å; F394-F410 HydrophobicContact CE2-CZ 4.08Å; F394-F410 HydrophobicContact CZ-CB 3.75Å; F394-F410 HydrophobicContact CZ-CD1 4.13Å; F394-F410 AromaticContact CZ-CD2 3.46Å; F394-F410 HydrophobicContact CZ-CD2 3.46Å; F394-F410 VanDerWaalsContact CZ-CD2 3.46Å; F394-F410 HydrophobicContact CZ-CE2 4.02Å; F394-F410 AromaticContact CZ-CG 3.51Å; F394-F410 HydrophobicContact CZ-CG 3.51Å; R395-F410 WeakPolarHBondContact O-CA 3.33Å; F410-V412 HydrophobicContact CD2-CG2 4.24Å; F410-V412 HydrophobicContact CE2-CG2 4.05Å; F410-L422 HydrophobicContact CD1-CB 4.44Å; F410-L422 HydrophobicContact CD2-CB 4.17Å; F410-L422 HydrophobicContact CE1-CB 3.98Å; F410-L422 HydrophobicContact CE2-CB 3.7Å; F410-L422 HydrophobicContact CE2-CD1 3.68Å; F410-L422 HydrophobicContact CE2-CG 4.26Å; F410-L422 HydrophobicContact CZ-CB 3.59Å; F410-L422 HydrophobicContact CZ-CD1 4Å; F410-L422 HydrophobicContact CZ-CG 4.45Å; F410-L422 PolarHBondContact N-O 3.49Å; F410-L422 PolarHBondContact O-N 3.34Å; F410-L422 VanDerWaalsContact O-O 3.05Å; F410-V424 HydrophobicContact CE1-CG1 4.17Å; F410-L430 HydrophobicContact CB-CD1 4.3Å; F410-L430 HydrophobicContact CD1-CD1 3.46Å; F410-L430 VanDerWaalsContact CD1-CD1 3.46Å; F410-L430 HydrophobicContact CE1-CD1 4.06Å; F410-L430 HydrophobicContact CG-CD1 4.12Å; F410-V433 HydrophobicContact CE2-CG1 4.39Å; F410-V433 HydrophobicContact CZ-CG1 4.01Å
411	I	92.9	Very high	85.3	Confident	15 Å²	15	48.3 Å²	48.3	8%	0.077	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.7	175.9	-67.5	-179.2	0	0	0	109.8	R395 L397 E413 N419 L420 Y421	R395-I411 PolarHBondContact N-O 3.23Å; R395-I411 PolarHBondContact O-N 3.36Å; L397-I411 HydrophobicContact CD1-CG1 4.17Å; L397-I411 HydrophobicContact CD2-CD1 3.67Å; L397-I411 HydrophobicContact CD2-CG1 3.89Å; L397-I411 HydrophobicContact CG-CD1 4.48Å; L397-I411 HydrophobicContact CG-CG1 4.2Å; I411-E413 HydrophobicContact CG2-CG 3.78Å; I411-N419 HydrophobicContact CG2-CB 4.05Å; I411-L420 VanDerWaalsContact CA-O 3.31Å; I411-L420 WeakPolarHBondContact CA-O 3.33Å; I411-Y421 HydrophobicContact CD1-CD2 3.91Å; I411-Y421 HydrophobicContact CD1-CE2 4.44Å; I411-Y421 HydrophobicContact CG1-CD2 4.02Å; I411-Y421 HydrophobicContact CG1-CG 4.35Å
412	V	95	Very high	86	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	110	163.1	177.1	0	0	0	0	107.9	T392 R393 F394 F410 L420 L422 W437	T392-V412 HydrophobicContact CG2-CG1 4.42Å; R393-V412 WeakPolarHBondContact O-CA 3.23Å; F394-V412 HydrophobicContact CD2-CG2 4.48Å; F410-V412 HydrophobicContact CD2-CG2 4.24Å; F410-V412 HydrophobicContact CE2-CG2 4.05Å; V412-L420 HydrophobicContact CB-CB 4.22Å; V412-L420 HydrophobicContact CB-CD1 4.38Å; V412-L420 HydrophobicContact CG1-CD1 4.46Å; V412-L420 PolarHBondContact N-O 3.45Å; V412-L420 PolarHBondContact O-N 3.03Å; V412-L422 HydrophobicContact CG2-CD1 4.01Å; V412-W437 HydrophobicContact CB-CH2 4.18Å; V412-W437 HydrophobicContact CB-CZ2 4.44Å; V412-W437 HydrophobicContact CG1-CH2 3.5Å; V412-W437 HydrophobicContact CG1-CZ2 3.54Å; V412-W437 HydrophobicContact CG2-CH2 3.57Å; V412-W437 HydrophobicContact CG2-CZ2 4.01Å; V412-W437 HydrophobicContact CG2-CZ3 3.9Å
413	E	94.2	Very high	86.6	Confident	36 Å²	36	41.9 Å²	41.9	17%	0.168	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	142.3	174	-51.4	176.4	161.6	0	0	108.2	T392 R393 R395 I411 N419 F530	T392-E413 CarbonylContact C-O 3.54Å; T392-E413 VanDerWaalsContact CA-O 3.22Å; T392-E413 WeakPolarHBondContact CA-O 3.4Å; R393-E413 HydrophobicContact CB-CB 4.34Å; R393-E413 WeakPolarHBondContact CD-OE2 3.32Å; R393-E413 PolarHBondContact N-O 2.94Å; R393-E413 IonicContact NH1-OE2 2.7Å; R393-E413 PolarHBondContact O-N 3.45Å; R395-E413 WeakPolarHBondContact CD-OE1 3.23Å; R395-E413 IonicContact CZ-OE1 2.79Å; R395-E413 IonicContact NE-OE1 2.96Å; R395-E413 PolarHBondContact NE-OE1 3.07Å; R395-E413 IonicContact NH2-OE1 3.48Å; I411-E413 HydrophobicContact CG2-CG 3.78Å; E413-N419 WeakPolarHBondContact CG-OD1 3.46Å; E413-F530 HydrophobicContact CB-CE1 4.39Å; E413-F530 HydrophobicContact CB-CZ 4.15Å; E413-F530 WeakPolarHBondContact O-CE1 3.48Å
414	T	94.7	Very high	87.7	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.025	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	156	-178.9	68.8	0	0	0	0	111.1	F385 T392 V416 G417 E418 F530	F385-T414 HydrophobicContact CE2-CG2 3.76Å; F385-T414 HydrophobicContact CZ-CG2 3.64Å; T392-T414 HydrophobicContact CG2-CG2 4.48Å; T414-V416 PolarHBondContact O-N 2.79Å; T414-G417 PolarHBondContact O-N 2.92Å; T414-E418 HydrophobicContact CG2-CB 4.29Å; T414-E418 PolarHBondContact N-O 3.14Å; T414-E418 WeakPolarHBondContact OG1-CA 3.28Å; T414-E418 WeakPolarHBondContact OG1-CB 3.45Å; T414-E418 PolarHBondContact OG1-N 3.17Å; T414-E418 PolarHBondContact OG1-O 3.19Å; T414-F530 VanDerWaalsContact C-CZ 3.42Å; T414-F530 WeakPolarHBondContact O-CZ 3.38Å
415	V	93	Very high	88.5	Confident	19 Å²	19	38.3 Å²	38.3	12%	0.115	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.7	175.1	72.4	0	0	0	0	112.9	E391 G417 I526 R527 F530	E391-V415 HydrophobicContact CB-CB 4Å; E391-V415 HydrophobicContact CB-CG1 3.76Å; E391-V415 HydrophobicContact CG-CB 4.47Å; E391-V415 HydrophobicContact CG-CG1 4.17Å; E391-V415 PolarHBondContact O-N 2.75Å; V415-G417 PolarHBondContact O-N 2.86Å; V415-I526 HydrophobicContact CG2-CG2 4.12Å; V415-R527 HydrophobicContact CG2-CB 3.84Å; V415-R527 HydrophobicContact CG2-CG 4.27Å; V415-F530 HydrophobicContact CB-CD2 4.44Å; V415-F530 HydrophobicContact CG2-CD2 4.48Å
416	V	89.9	Confident	89.5	Confident	104 Å²	104	35.1 Å²	35.1	63%	0.63	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.2	179.6	-170.9	0	0	0	0	111.7	T414	T414-V416 PolarHBondContact O-N 2.79Å
417	G	87.4	Confident	90	Very high	59 Å²	59	39.1 Å²	39.1	61%	0.608	21%	0.21	S	C	*	.	S	Bend	trans	91.2	6.9	-179	0	0	0	0	0	114.2	T414 V415	T414-G417 PolarHBondContact O-N 2.92Å; V415-G417 PolarHBondContact O-N 2.86Å
418	E	89	Confident	90.7	Very high	101 Å²	101	38.1 Å²	38.1	47%	0.472	21%	0.208	S	C	.	.			trans	-76.9	137.3	170	-56.4	-173.2	151.5	0	0	110.4	T414	T414-E418 HydrophobicContact CG2-CB 4.29Å; T414-E418 PolarHBondContact N-O 3.14Å; T414-E418 WeakPolarHBondContact OG1-CA 3.28Å; T414-E418 WeakPolarHBondContact OG1-CB 3.45Å; T414-E418 PolarHBondContact OG1-N 3.17Å; T414-E418 PolarHBondContact OG1-O 3.19Å
419	N	89.7	Confident	90.9	Very high	95 Å²	95	36.7 Å²	36.7	51%	0.508	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	102.9	175.5	-70.6	-28.1	0	0	0	109	I411 E413 Y421	I411-N419 HydrophobicContact CG2-CB 4.05Å; E413-N419 WeakPolarHBondContact CG-OD1 3.46Å; N419-Y421 PolarHBondContact O-N 3.28Å
420	L	91.8	Very high	91	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.073	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	107.6	178.5	-51.5	175.5	0	0	0	108.5	L369 F385 I411 V412 L422	L369-L420 HydrophobicContact CD1-CD1 3.84Å; F385-L420 HydrophobicContact CD1-CD1 3.91Å; F385-L420 HydrophobicContact CD2-CD1 3.93Å; F385-L420 HydrophobicContact CD2-CD2 4.48Å; F385-L420 HydrophobicContact CE1-CD1 3.79Å; F385-L420 HydrophobicContact CE2-CD1 3.83Å; F385-L420 HydrophobicContact CG-CD1 3.98Å; F385-L420 HydrophobicContact CZ-CD1 3.74Å; I411-L420 VanDerWaalsContact CA-O 3.31Å; I411-L420 WeakPolarHBondContact CA-O 3.33Å; V412-L420 HydrophobicContact CB-CB 4.22Å; V412-L420 HydrophobicContact CB-CD1 4.38Å; V412-L420 HydrophobicContact CG1-CD1 4.46Å; V412-L420 PolarHBondContact N-O 3.45Å; V412-L420 PolarHBondContact O-N 3.03Å; L420-L422 HydrophobicContact CB-CD1 4.37Å; L420-L422 HydrophobicContact CB-CD2 4.35Å; L420-L422 HydrophobicContact CB-CG 4.15Å; L420-L422 PolarHBondContact O-N 3.16Å
421	Y	90.8	Very high	91	Very high	26 Å²	26	37.9 Å²	37.9	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	108.6	175	-168.9	-58.3	0	0	0	108.5	R340 W355 L397 R402 V403 I411 N419	R340-Y421 HydrophobicContact CB-CD1 4.01Å; R340-Y421 HydrophobicContact CB-CG 4.25Å; R340-Y421 PolarHBondContact N-O 3.29Å; W355-Y421 AromaticContact CH2-CD1 3.52Å; W355-Y421 HydrophobicContact CH2-CD1 3.52Å; W355-Y421 AromaticContact CH2-CE1 3.49Å; W355-Y421 HydrophobicContact CH2-CE1 3.49Å; W355-Y421 VanDerWaalsContact CH2-CE1 3.49Å; W355-Y421 HydrophobicContact CZ2-CD1 4.33Å; W355-Y421 HydrophobicContact CZ2-CE1 4.12Å; W355-Y421 HydrophobicContact CZ3-CD1 4.11Å; W355-Y421 HydrophobicContact CZ3-CE1 4.45Å; L397-Y421 HydrophobicContact CD1-CD2 4.23Å; L397-Y421 HydrophobicContact CD1-CE1 4Å; L397-Y421 HydrophobicContact CD1-CE2 3.48Å; L397-Y421 VanDerWaalsContact CD1-CE2 3.48Å; L397-Y421 WeakPolarHBondContact CD1-OH 3.47Å; R402-Y421 WeakPolarHBondContact CA-OH 3.36Å; V403-Y421 HydrophobicContact CG2-CE2 4.16Å; V403-Y421 PolarHBondContact N-OH 2.97Å; I411-Y421 HydrophobicContact CD1-CD2 3.91Å; I411-Y421 HydrophobicContact CD1-CE2 4.44Å; I411-Y421 HydrophobicContact CG1-CD2 4.02Å; I411-Y421 HydrophobicContact CG1-CG 4.35Å; N419-Y421 PolarHBondContact O-N 3.28Å
422	L	93.2	Very high	91	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	157.1	-172.3	-58.9	178	0	0	0	111.3	V337 C338 E339 L369 S409 F410 V412 L420	V337-L422 HydrophobicContact CG2-CD1 4.44Å; V337-L422 HydrophobicContact CG2-CD2 4.18Å; C338-L422 CarbonylContact O-C 3.44Å; C338-L422 VanDerWaalsContact O-CA 3.29Å; C338-L422 WeakPolarHBondContact O-CA 3.46Å; E339-L422 HydrophobicContact CB-CD2 3.62Å; E339-L422 HydrophobicContact CG-CD2 3.89Å; L369-L422 HydrophobicContact CD1-CD2 4.47Å; S409-L422 CarbonylContact C-O 3.56Å; S409-L422 VanDerWaalsContact CA-O 3.28Å; S409-L422 WeakPolarHBondContact CA-O 3.43Å; F410-L422 HydrophobicContact CD1-CB 4.44Å; F410-L422 HydrophobicContact CD2-CB 4.17Å; F410-L422 HydrophobicContact CE1-CB 3.98Å; F410-L422 HydrophobicContact CE2-CB 3.7Å; F410-L422 HydrophobicContact CE2-CD1 3.68Å; F410-L422 HydrophobicContact CE2-CG 4.26Å; F410-L422 HydrophobicContact CZ-CB 3.59Å; F410-L422 HydrophobicContact CZ-CD1 4Å; F410-L422 HydrophobicContact CZ-CG 4.45Å; F410-L422 PolarHBondContact N-O 3.49Å; F410-L422 PolarHBondContact O-N 3.34Å; F410-L422 VanDerWaalsContact O-O 3.05Å; V412-L422 HydrophobicContact CG2-CD1 4.01Å; L420-L422 HydrophobicContact CB-CD1 4.37Å; L420-L422 HydrophobicContact CB-CD2 4.35Å; L420-L422 HydrophobicContact CB-CG 4.15Å; L420-L422 PolarHBondContact O-N 3.16Å
423	S	91.3	Very high	91	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	149.3	176.2	177.1	0	0	0	0	112.3	C338 R406 Y408	C338-S423 PolarHBondContact N-O 3.43Å; C338-S423 PolarHBondContact O-N 2.74Å; R406-S423 WeakPolarHBondContact CD-OG 3.24Å; Y408-S423 WeakPolarHBondContact O-CA 2.94Å; Y408-S423 PolarHBondContact O-OG 2.96Å
424	V	91.3	Very high	91	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	23%	0.225	C	C	.	.			trans	-120.9	168.4	174	-68.7	0	0	0	0	110.8	V337 Y408 F410 Q429 L430 V433	V337-V424 HydrophobicContact CG1-CG1 3.94Å; Y408-V424 PolarHBondContact O-N 3.32Å; F410-V424 HydrophobicContact CE1-CG1 4.17Å; V424-Q429 HydrophobicContact CB-CB 3.94Å; V424-Q429 HydrophobicContact CG1-CB 4.36Å; V424-Q429 HydrophobicContact CG2-CB 4.1Å; V424-L430 HydrophobicContact CG2-CB 3.7Å; V424-L430 HydrophobicContact CG2-CD1 4.31Å; V424-V433 HydrophobicContact CG1-CG2 4.35Å
425	E	84.6	Confident	91	Very high	36 Å²	36	41.9 Å²	41.9	17%	0.168	23%	0.228	C	C	.	.	S	Bend	trans	-90.8	-17.3	-169.6	-62.4	-85.7	168.7	0	0	112.7	V255 T256 R257 Y258	V255-E425 WeakPolarHBondContact O-CG 3.43Å; T256-E425 PolarHBondContact OG1-OE1 2.79Å; T256-E425 VanDerWaalsContact OG1-OE1 3.13Å; R257-E425 PolarHBondContact N-OE2 3.44Å; Y258-E425 WeakPolarHBondContact CD2-OE1 3.45Å; Y258-E425 WeakPolarHBondContact CE2-OE2 3.3Å
426	S	85.2	Confident	91	Very high	31 Å²	31	41 Å²	41	22%	0.217	22%	0.222	C	C	.	.	S	Bend	trans	-141.1	157.8	177.5	77.9	0	0	0	0	113.7	Y408 D428 Q429 L430	Y408-S426 VanDerWaalsContact CD2-CA 3.46Å; S426-D428 VanDerWaalsContact C-N 3.29Å; S426-D428 PolarHBondContact O-N 3.41Å; S426-Q429 PolarHBondContact O-N 2.77Å; S426-Q429 WeakPolarHBondContact OG-CG 3.38Å; S426-Q429 PolarHBondContact OG-N 2.82Å; S426-L430 PolarHBondContact O-N 2.83Å; S426-L430 VanDerWaalsContact O-N 3.14Å
427	F	88.9	Confident	91.3	Very high	98 Å²	98	36.2 Å²	36.2	43%	0.43	19%	0.193	S	C	.	.	H	α-helix	trans	-60.8	-38.3	173.5	-176.8	-104.5	0	0	0	112.5	Y408 Q429 L430 L431	Y408-F427 HydrophobicContact CD1-CB 4.05Å; Y408-F427 HydrophobicContact CD1-CD2 4.27Å; Y408-F427 HydrophobicContact CE1-CB 3.63Å; Y408-F427 HydrophobicContact CE1-CD2 4.21Å; Y408-F427 HydrophobicContact CE1-CG 4.41Å; F427-Q429 VanDerWaalsContact C-N 3.32Å; F427-Q429 PolarHBondContact O-N 3.32Å; F427-L430 WeakPolarHBondContact O-CB 3.42Å; F427-L430 PolarHBondContact O-N 2.81Å; F427-L431 PolarHBondContact O-N 2.9Å
428	D	90	Very high	91.6	Very high	92 Å²	92	34.3 Å²	34.3	49%	0.492	17%	0.168	S	C	.	.	H	α-helix	trans	-61.8	-40.7	177.2	-66.4	-55.4	0	0	0	111.7	S426 L431 Q432	S426-D428 VanDerWaalsContact C-N 3.29Å; S426-D428 PolarHBondContact O-N 3.41Å; D428-L431 PolarHBondContact O-N 3.28Å; D428-Q432 VanDerWaalsContact O-CG 3.26Å; D428-Q432 WeakPolarHBondContact O-CG 3.43Å; D428-Q432 PolarHBondContact O-N 2.94Å
429	Q	91.3	Very high	91.8	Very high	36 Å²	36	33.2 Å²	33.2	17%	0.168	16%	0.16	C	C	.	.	H	α-helix	trans	-63.7	-41.9	174.5	-74	175.3	-9.3	0	0	111.3	V424 S426 F427 L431 Q432 V433	V424-Q429 HydrophobicContact CB-CB 3.94Å; V424-Q429 HydrophobicContact CG1-CB 4.36Å; V424-Q429 HydrophobicContact CG2-CB 4.1Å; S426-Q429 PolarHBondContact O-N 2.77Å; S426-Q429 WeakPolarHBondContact OG-CG 3.38Å; S426-Q429 PolarHBondContact OG-N 2.82Å; F427-Q429 VanDerWaalsContact C-N 3.32Å; F427-Q429 PolarHBondContact O-N 3.32Å; Q429-L431 VanDerWaalsContact C-N 3.32Å; Q429-L431 PolarHBondContact O-N 3.3Å; Q429-Q432 PolarHBondContact O-N 3.47Å; Q429-V433 WeakPolarHBondContact O-CG2 3.21Å; Q429-V433 PolarHBondContact O-N 2.89Å
430	L	93.2	Very high	92	Very high	13 Å²	13	28.7 Å²	28.7	7%	0.068	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-44.4	177.8	-178.8	64.2	0	0	0	111	F394 F410 V424 S426 F427 Q432 V433 R434	F394-L430 HydrophobicContact CZ-CD1 4.1Å; F410-L430 HydrophobicContact CB-CD1 4.3Å; F410-L430 HydrophobicContact CD1-CD1 3.46Å; F410-L430 VanDerWaalsContact CD1-CD1 3.46Å; F410-L430 HydrophobicContact CE1-CD1 4.06Å; F410-L430 HydrophobicContact CG-CD1 4.12Å; V424-L430 HydrophobicContact CG2-CB 3.7Å; V424-L430 HydrophobicContact CG2-CD1 4.31Å; S426-L430 PolarHBondContact O-N 2.83Å; S426-L430 VanDerWaalsContact O-N 3.14Å; F427-L430 WeakPolarHBondContact O-CB 3.42Å; F427-L430 PolarHBondContact O-N 2.81Å; L430-Q432 VanDerWaalsContact C-N 3.35Å; L430-Q432 PolarHBondContact O-N 2.87Å; L430-V433 PolarHBondContact O-N 2.81Å; L430-R434 VanDerWaalsContact O-CB 3.28Å; L430-R434 WeakPolarHBondContact O-CB 3.21Å; L430-R434 PolarHBondContact O-N 3.48Å
431	L	93.2	Very high	92.2	Very high	13 Å²	13	28.3 Å²	28.3	7%	0.068	13%	0.134	C	C	.	.	H	α-helix	trans	-62.5	-41.7	176.7	-177	62.4	0	0	0	111.8	F427 D428 Q429 G435 L550	F427-L431 PolarHBondContact O-N 2.9Å; D428-L431 PolarHBondContact O-N 3.28Å; Q429-L431 VanDerWaalsContact C-N 3.32Å; Q429-L431 PolarHBondContact O-N 3.3Å; L431-G435 PolarHBondContact O-N 3.01Å; L431-L550 HydrophobicContact CD1-CB 4.31Å; L431-L550 HydrophobicContact CD1-CD1 4.32Å; L431-L550 HydrophobicContact CD1-CD2 4.2Å
432	Q	93.1	Very high	92.3	Very high	76 Å²	76	29.6 Å²	29.6	36%	0.355	14%	0.139	S	C	.	.	H	α-helix	trans	-64.3	-47.5	177.4	-73.5	173.5	18.9	0	0	112.2	Y333 D428 Q429 L430 G435 A436	Y333-Q432 HydrophobicContact CE2-CB 4.25Å; D428-Q432 VanDerWaalsContact O-CG 3.26Å; D428-Q432 WeakPolarHBondContact O-CG 3.43Å; D428-Q432 PolarHBondContact O-N 2.94Å; Q429-Q432 PolarHBondContact O-N 3.47Å; L430-Q432 VanDerWaalsContact C-N 3.35Å; L430-Q432 PolarHBondContact O-N 2.87Å; Q432-G435 PolarHBondContact O-N 3.2Å; Q432-A436 VanDerWaalsContact O-CB 3.26Å; Q432-A436 WeakPolarHBondContact O-CB 3.24Å; Q432-A436 PolarHBondContact O-N 2.72Å
433	V	95.1	Very high	92.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-49.8	177.8	175.2	0	0	0	0	110	Y333 L360 F394 F410 V424 Q429 L430 G435 A436 W437	Y333-V433 HydrophobicContact CE1-CG2 3.76Å; Y333-V433 HydrophobicContact CE2-CG2 3.95Å; Y333-V433 VanDerWaalsContact CZ-CG2 3.4Å; Y333-V433 VanDerWaalsContact OH-CG2 3.29Å; Y333-V433 WeakPolarHBondContact OH-CG2 3.34Å; L360-V433 HydrophobicContact CD2-CG1 3.87Å; F394-V433 HydrophobicContact CE2-CG1 3.96Å; F410-V433 HydrophobicContact CE2-CG1 4.39Å; F410-V433 HydrophobicContact CZ-CG1 4.01Å; V424-V433 HydrophobicContact CG1-CG2 4.35Å; Q429-V433 WeakPolarHBondContact O-CG2 3.21Å; Q429-V433 PolarHBondContact O-N 2.89Å; L430-V433 PolarHBondContact O-N 2.81Å; V433-G435 PolarHBondContact O-N 2.7Å; V433-A436 PolarHBondContact O-N 3.2Å; V433-W437 WeakPolarHBondContact O-CB 3.3Å; V433-W437 PolarHBondContact O-N 3.24Å
434	R	94.9	Very high	92.4	Very high	56 Å²	56	35.4 Å²	35.4	21%	0.211	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-48	179.2	-176.7	176.4	64.9	-167.8	-3.1	111.8	F394 D396 L430 A436 W437 Q438	F394-R434 HydrophobicContact CD1-CG 4.11Å; F394-R434 HydrophobicContact CE1-CB 3.95Å; F394-R434 HydrophobicContact CE1-CG 3.84Å; F394-R434 HydrophobicContact CE2-CB 4.49Å; F394-R434 HydrophobicContact CZ-CB 3.91Å; F394-R434 HydrophobicContact CZ-CG 4.32Å; D396-R434 IonicContact OD1-NH1 3.79Å; D396-R434 IonicContact OD2-NH1 3.95Å; D396-R434 PolarHBondContact OD2-NH1 3.41Å; L430-R434 VanDerWaalsContact O-CB 3.28Å; L430-R434 WeakPolarHBondContact O-CB 3.21Å; L430-R434 PolarHBondContact O-N 3.48Å; R434-A436 VanDerWaalsContact C-N 3.3Å; R434-A436 PolarHBondContact O-N 2.91Å; R434-W437 WeakPolarHBondContact O-CB 3.43Å; R434-W437 PolarHBondContact O-N 3.44Å; R434-Q438 WeakPolarHBondContact O-CB 2.98Å; R434-Q438 VanDerWaalsContact O-CG 3.24Å; R434-Q438 WeakPolarHBondContact O-CG 3.24Å; R434-Q438 PolarHBondContact O-N 2.63Å
435	G	93.5	Very high	92.6	Very high	8 Å²	8	35.3 Å²	35.3	8%	0.082	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-33.9	178.1	0	0	0	0	0	112.9	L431 Q432 V433 R439 L550	L431-G435 PolarHBondContact O-N 3.01Å; Q432-G435 PolarHBondContact O-N 3.2Å; V433-G435 PolarHBondContact O-N 2.7Å; G435-R439 WeakPolarHBondContact O-CB 3.19Å; G435-R439 VanDerWaalsContact O-CG 3.28Å; G435-R439 WeakPolarHBondContact O-CG 3.45Å; G435-R439 PolarHBondContact O-N 2.75Å; G435-R439 VanDerWaalsContact O-N 3.11Å; G435-R439 PolarHBondContact O-NE 3.38Å; G435-L550 VanDerWaalsContact CA-CD1 3.46Å
436	A	94.4	Very high	92.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.5	-43.1	172.1	0	0	0	0	0	112.4	V332 Y333 L362 Q432 V433 R434 Q438 R439 C440	V332-A436 HydrophobicContact CG1-CB 4.08Å; Y333-A436 HydrophobicContact CD2-CB 4.19Å; Y333-A436 HydrophobicContact CG-CB 4.06Å; L362-A436 HydrophobicContact CD1-CB 3.82Å; Q432-A436 VanDerWaalsContact O-CB 3.26Å; Q432-A436 WeakPolarHBondContact O-CB 3.24Å; Q432-A436 PolarHBondContact O-N 2.72Å; V433-A436 PolarHBondContact O-N 3.2Å; R434-A436 VanDerWaalsContact C-N 3.3Å; R434-A436 PolarHBondContact O-N 2.91Å; A436-Q438 VanDerWaalsContact C-N 3.35Å; A436-Q438 PolarHBondContact O-N 3.45Å; A436-R439 PolarHBondContact O-N 3.21Å; A436-C440 PolarHBondContact O-N 2.93Å; A436-C440 PolarHBondContact O-SG 3.08Å
437	W	95.2	Very high	93.3	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-56.9	-50.7	176.4	-158.6	-75.7	0	0	0	111.2	L360 L362 C367 I389 T392 F394 V412 V433 R434 R439 C440 T441	L360-W437 HydrophobicContact CD1-CZ3 4.42Å; L362-W437 HydrophobicContact CD1-CB 4.43Å; L362-W437 HydrophobicContact CD1-CE3 4.05Å; L362-W437 HydrophobicContact CD2-CE3 3.86Å; L362-W437 HydrophobicContact CD2-CZ3 3.81Å; C367-W437 HydrophobicContact CB-CH2 3.91Å; C367-W437 HydrophobicContact CB-CZ3 4.32Å; C367-W437 WeakPolarHBondContact SG-CH2 3.47Å; C367-W437 VanDerWaalsContact SG-CZ3 3.55Å; I389-W437 HydrophobicContact CD1-CD2 4Å; I389-W437 HydrophobicContact CD1-CE3 4.48Å; I389-W437 HydrophobicContact CD1-CG 4.49Å; I389-W437 HydrophobicContact CD1-CH2 4.17Å; I389-W437 HydrophobicContact CD1-CZ2 3.68Å; T392-W437 HydrophobicContact CG2-CZ2 4.45Å; T392-W437 VanDerWaalsContact OG1-CZ2 3.22Å; T392-W437 WeakPolarHBondContact OG1-CZ2 2.87Å; F394-W437 HydrophobicContact CB-CD2 4.24Å; F394-W437 HydrophobicContact CB-CG 3.95Å; F394-W437 HydrophobicContact CD2-CB 4.26Å; F394-W437 AromaticContact CD2-CD2 3.99Å; F394-W437 HydrophobicContact CD2-CD2 3.99Å; F394-W437 HydrophobicContact CD2-CE3 4.12Å; F394-W437 HydrophobicContact CD2-CG 4.05Å; F394-W437 HydrophobicContact CG-CG 4.36Å; V412-W437 HydrophobicContact CB-CH2 4.18Å; V412-W437 HydrophobicContact CB-CZ2 4.44Å; V412-W437 HydrophobicContact CG1-CH2 3.5Å; V412-W437 HydrophobicContact CG1-CZ2 3.54Å; V412-W437 HydrophobicContact CG2-CH2 3.57Å; V412-W437 HydrophobicContact CG2-CZ2 4.01Å; V412-W437 HydrophobicContact CG2-CZ3 3.9Å; V433-W437 WeakPolarHBondContact O-CB 3.3Å; V433-W437 PolarHBondContact O-N 3.24Å; R434-W437 WeakPolarHBondContact O-CB 3.43Å; R434-W437 PolarHBondContact O-N 3.44Å; W437-R439 PolarHBondContact O-N 2.92Å; W437-C440 WeakPolarHBondContact O-CB 3.35Å; W437-C440 PolarHBondContact O-N 3.06Å; W437-C440 VanDerWaalsContact O-N 3.14Å; W437-T441 PolarHBondContact O-N 2.82Å; W437-T441 PolarHBondContact O-OG1 3.02Å; W437-T441 VanDerWaalsContact O-OG1 3.1Å
438	Q	93.7	Very high	93.6	Very high	19 Å²	19	38.3 Å²	38.3	9%	0.089	18%	0.175	C	C	.	.	H	α-helix	trans	-58.3	-45.5	177.8	-71.7	172.8	-18.6	0	0	111.6	R434 A436 C440 T441 Y442 L537 M541 Y547	R434-Q438 WeakPolarHBondContact O-CB 2.98Å; R434-Q438 VanDerWaalsContact O-CG 3.24Å; R434-Q438 WeakPolarHBondContact O-CG 3.24Å; R434-Q438 PolarHBondContact O-N 2.63Å; A436-Q438 VanDerWaalsContact C-N 3.35Å; A436-Q438 PolarHBondContact O-N 3.45Å; Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 3.03Å; Q438-T441 PolarHBondContact O-N 2.98Å; Q438-Y442 PolarHBondContact O-N 3.48Å; Q438-L537 HydrophobicContact CG-CD1 4.33Å; Q438-L537 HydrophobicContact CG-CD2 4.2Å; Q438-M541 HydrophobicContact CB-CE 3.8Å; Q438-M541 HydrophobicContact CB-SD 3.71Å; Q438-M541 WeakPolarHBondContact O-CE 3.38Å; Q438-Y547 PolarHBondContact NE2-OH 3.48Å
439	R	92.7	Very high	93.8	Very high	78 Å²	78	38 Å²	38	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-60.8	-41.7	175.5	-75.8	-178.7	-61.9	131.2	0.4	112.1	V332 G435 A436 W437 T441 Y442 Y443 M541 L548	V332-R439 HydrophobicContact CG1-CB 4.17Å; V332-R439 VanDerWaalsContact CG1-CZ 3.44Å; V332-R439 PolarHBondContact O-NH2 2.79Å; G435-R439 WeakPolarHBondContact O-CB 3.19Å; G435-R439 VanDerWaalsContact O-CG 3.28Å; G435-R439 WeakPolarHBondContact O-CG 3.45Å; G435-R439 PolarHBondContact O-N 2.75Å; G435-R439 VanDerWaalsContact O-N 3.11Å; G435-R439 PolarHBondContact O-NE 3.38Å; A436-R439 PolarHBondContact O-N 3.21Å; W437-R439 PolarHBondContact O-N 2.92Å; R439-T441 VanDerWaalsContact C-N 3.34Å; R439-Y442 WeakPolarHBondContact O-CB 3.43Å; R439-Y442 PolarHBondContact O-N 3.2Å; R439-Y443 HydrophobicContact CB-CE2 4.14Å; R439-Y443 WeakPolarHBondContact O-CD2 3.22Å; R439-Y443 VanDerWaalsContact O-CG 3.28Å; R439-Y443 PolarHBondContact O-N 2.62Å; R439-M541 HydrophobicContact CG-CE 4.4Å; R439-L548 HydrophobicContact CG-CD2 3.98Å
440	C	94.9	Very high	94.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-42.6	175.3	-61.9	0	0	0	0	111.4	V332 I389 A436 W437 Q438 Y442 Y443 A444	V332-C440 WeakPolarHBondContact CB-SG 3.17Å; V332-C440 VanDerWaalsContact CG2-SG 3.54Å; I389-C440 HydrophobicContact CD1-CB 4.45Å; I389-C440 HydrophobicContact CG1-CB 4.02Å; I389-C440 HydrophobicContact CG2-CB 4.28Å; A436-C440 PolarHBondContact O-N 2.93Å; A436-C440 PolarHBondContact O-SG 3.08Å; W437-C440 WeakPolarHBondContact O-CB 3.35Å; W437-C440 PolarHBondContact O-N 3.06Å; W437-C440 VanDerWaalsContact O-N 3.14Å; Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 3.03Å; C440-Y442 VanDerWaalsContact C-N 3.33Å; C440-Y442 PolarHBondContact O-N 3.4Å; C440-Y443 PolarHBondContact O-N 3.01Å; C440-A444 VanDerWaalsContact O-CB 3.3Å; C440-A444 WeakPolarHBondContact O-CB 2.92Å; C440-A444 PolarHBondContact O-N 2.77Å
441	T	94.8	Very high	94.3	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-44.4	176	-51	0	0	0	0	111	I389 W437 Q438 R439 Y443 A444 I445 A534 L537	I389-T441 VanDerWaalsContact CG2-CA 3.46Å; I389-T441 HydrophobicContact CG2-CG2 4.34Å; I389-T441 WeakPolarHBondContact CG2-OG1 3.42Å; W437-T441 PolarHBondContact O-N 2.82Å; W437-T441 PolarHBondContact O-OG1 3.02Å; W437-T441 VanDerWaalsContact O-OG1 3.1Å; Q438-T441 PolarHBondContact O-N 2.98Å; R439-T441 VanDerWaalsContact C-N 3.34Å; T441-Y443 PolarHBondContact O-N 3.14Å; T441-A444 PolarHBondContact O-N 2.9Å; T441-I445 HydrophobicContact CG2-CG1 4.36Å; T441-I445 WeakPolarHBondContact O-CG1 3.03Å; T441-I445 PolarHBondContact O-N 2.84Å; T441-A534 HydrophobicContact CG2-CB 3.76Å; T441-L537 HydrophobicContact CG2-CD2 4.06Å
442	Y	93	Very high	94.4	Very high	53 Å²	53	44.3 Å²	44.3	21%	0.208	21%	0.208	C	C	.	.	H	α-helix	trans	-59.5	-46.2	175.8	175.3	-98.8	0	0	0	112.3	Q438 R439 C440 N446 A538 M541	Q438-Y442 PolarHBondContact O-N 3.48Å; R439-Y442 WeakPolarHBondContact O-CB 3.43Å; R439-Y442 PolarHBondContact O-N 3.2Å; C440-Y442 VanDerWaalsContact C-N 3.33Å; C440-Y442 PolarHBondContact O-N 3.4Å; Y442-N446 WeakPolarHBondContact CD1-ND2 3.49Å; Y442-N446 VanDerWaalsContact CD2-ND2 3.34Å; Y442-N446 WeakPolarHBondContact CD2-ND2 3.23Å; Y442-N446 WeakPolarHBondContact CE1-ND2 3.2Å; Y442-N446 WeakPolarHBondContact CE2-ND2 3.42Å; Y442-N446 WeakPolarHBondContact O-CB 3.5Å; Y442-N446 PolarHBondContact O-N 2.88Å; Y442-N446 PolarHBondContact O-ND2 2.69Å; Y442-N446 PolarHBondContact OH-ND2 3.26Å; Y442-A538 HydrophobicContact CD2-CB 4.37Å; Y442-M541 HydrophobicContact CD2-CB 4.03Å
443	Y	92.5	Very high	94.6	Very high	120 Å²	120	41 Å²	41	47%	0.471	19%	0.193	S	C	.	.	H	α-helix	trans	-65.9	-42.5	177.5	-61	-38.5	0	0	0	112.4	V332 R439 C440 T441 I445 N446 K447	V332-Y443 HydrophobicContact CG2-CD2 4.36Å; V332-Y443 HydrophobicContact CG2-CE2 4.35Å; R439-Y443 HydrophobicContact CB-CE2 4.14Å; R439-Y443 WeakPolarHBondContact O-CD2 3.22Å; R439-Y443 VanDerWaalsContact O-CG 3.28Å; R439-Y443 PolarHBondContact O-N 2.62Å; C440-Y443 PolarHBondContact O-N 3.01Å; T441-Y443 PolarHBondContact O-N 3.14Å; Y443-I445 PolarHBondContact O-N 3.34Å; Y443-N446 PolarHBondContact O-N 3.12Å; Y443-K447 WeakPolarHBondContact O-CB 3.4Å; Y443-K447 PolarHBondContact O-N 2.86Å
444	A	94.5	Very high	94.6	Very high	3 Å²	3	44.6 Å²	44.6	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-47.9	177.5	0	0	0	0	0	111.7	N365 C440 T441 K447 L448	N365-A444 HydrophobicContact CB-CB 3.57Å; C440-A444 VanDerWaalsContact O-CB 3.3Å; C440-A444 WeakPolarHBondContact O-CB 2.92Å; C440-A444 PolarHBondContact O-N 2.77Å; T441-A444 PolarHBondContact O-N 2.9Å; A444-K447 PolarHBondContact O-N 3.39Å; A444-L448 WeakPolarHBondContact O-CG 3.05Å; A444-L448 PolarHBondContact O-N 3.03Å
445	I	95.4	Very high	94.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.7	-40	-179.4	-64.8	-55.8	0	0	0	112.2	Q390 T441 Y443 K447 L448 E449 I468 A534 Y535 A538	Q390-I445 HydrophobicContact CB-CD1 4.1Å; T441-I445 HydrophobicContact CG2-CG1 4.36Å; T441-I445 WeakPolarHBondContact O-CG1 3.03Å; T441-I445 PolarHBondContact O-N 2.84Å; Y443-I445 PolarHBondContact O-N 3.34Å; I445-K447 PolarHBondContact O-N 2.65Å; I445-L448 HydrophobicContact CD1-CD1 4.34Å; I445-L448 PolarHBondContact O-N 2.76Å; I445-E449 PolarHBondContact O-N 2.8Å; I445-I468 HydrophobicContact CG2-CB 4.21Å; I445-I468 HydrophobicContact CG2-CD1 3.83Å; I445-I468 HydrophobicContact CG2-CG1 4.09Å; I445-A534 HydrophobicContact CD1-CB 3.85Å; I445-A534 HydrophobicContact CG1-CB 4.1Å; I445-Y535 HydrophobicContact CD1-CD2 3.83Å; I445-Y535 HydrophobicContact CD1-CE2 3.8Å; I445-Y535 HydrophobicContact CD1-CG 4.32Å; I445-Y535 HydrophobicContact CG2-CD1 3.56Å; I445-Y535 HydrophobicContact CG2-CD2 4.48Å; I445-Y535 HydrophobicContact CG2-CE1 3.59Å; I445-Y535 HydrophobicContact CG2-CE2 4.49Å; I445-Y535 HydrophobicContact CG2-CG 4.03Å; I445-A538 HydrophobicContact CB-CB 3.71Å; I445-A538 HydrophobicContact CG1-CB 4Å; I445-A538 HydrophobicContact CG2-CB 3.78Å
446	N	92.3	Very high	94.6	Very high	53 Å²	53	43.2 Å²	43.2	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-66.9	-27.9	175.7	-75.4	-50.9	0	0	0	113	Y442 Y443 E449	Y442-N446 WeakPolarHBondContact CD1-ND2 3.49Å; Y442-N446 VanDerWaalsContact CD2-ND2 3.34Å; Y442-N446 WeakPolarHBondContact CD2-ND2 3.23Å; Y442-N446 WeakPolarHBondContact CE1-ND2 3.2Å; Y442-N446 WeakPolarHBondContact CE2-ND2 3.42Å; Y442-N446 WeakPolarHBondContact O-CB 3.5Å; Y442-N446 PolarHBondContact O-N 2.88Å; Y442-N446 PolarHBondContact O-ND2 2.69Å; Y442-N446 PolarHBondContact OH-ND2 3.26Å; Y443-N446 PolarHBondContact O-N 3.12Å; N446-E449 VanDerWaalsContact O-CG 3.27Å; N446-E449 WeakPolarHBondContact O-CG 3.2Å
447	K	92.1	Very high	94.4	Very high	116 Å²	116	45.5 Å²	45.5	50%	0.504	23%	0.234	S	C	.	.	H	α-helix	trans	-72.7	-41.5	171.7	177.4	173.9	171.1	166.7	0	111.8	D328 Y443 A444 I445	D328-K447 WeakPolarHBondContact OD2-CE 3.37Å; D328-K447 IonicContact OD2-NZ 3.81Å; D328-K447 PolarHBondContact OD2-NZ 2.86Å; Y443-K447 WeakPolarHBondContact O-CB 3.4Å; Y443-K447 PolarHBondContact O-N 2.86Å; A444-K447 PolarHBondContact O-N 3.39Å; I445-K447 PolarHBondContact O-N 2.65Å
448	L	94.7	Very high	94.1	Very high	60 Å²	60	52.8 Å²	52.8	31%	0.314	27%	0.268	S	S	.	.	H	α-helix	trans	-68	-36.1	178.3	-73.8	171.5	0	0	0	112	Q390 A444 I445 T450 Y531	Q390-L448 HydrophobicContact CG-CD1 4.01Å; A444-L448 WeakPolarHBondContact O-CG 3.05Å; A444-L448 PolarHBondContact O-N 3.03Å; I445-L448 HydrophobicContact CD1-CD1 4.34Å; I445-L448 PolarHBondContact O-N 2.76Å; L448-T450 PolarHBondContact O-N 3.29Å; L448-Y531 HydrophobicContact CD1-CE1 4.16Å
449	E	95.3	Very high	93.8	Very high	84 Å²	84	58.8 Å²	58.8	39%	0.393	30%	0.301	S	S	.	.			trans	57.8	-57.1	-173.9	-62.5	-163.9	135.2	0	0	114.9	I445 N446 D467 I468 R469	I445-E449 PolarHBondContact O-N 2.8Å; N446-E449 VanDerWaalsContact O-CG 3.27Å; N446-E449 WeakPolarHBondContact O-CG 3.2Å; E449-D467 WeakPolarHBondContact O-CA 3.45Å; E449-I468 PolarHBondContact O-N 3.08Å; E449-R469 IonicContact OE1-CZ 3.56Å; E449-R469 IonicContact OE1-NE 3.23Å; E449-R469 IonicContact OE1-NH2 2.72Å; E449-R469 PolarHBondContact OE1-NH2 2.85Å
450	T	97.1	Very high	93.8	Very high	60 Å²	60	62.9 Å²	62.9	37%	0.368	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.9	-178	-51.9	0	0	0	0	110.7	L448 V465 F466 D467 Y535	L448-T450 PolarHBondContact O-N 3.29Å; T450-V465 HydrophobicContact CG2-CG1 3.45Å; T450-V465 VanDerWaalsContact CG2-CG1 3.45Å; T450-F466 CarbonylContact C-O 3.57Å; T450-F466 WeakPolarHBondContact CA-O 3.29Å; T450-F466 WeakPolarHBondContact CG2-O 3.42Å; T450-D467 HydrophobicContact CG2-CB 4.44Å; T450-D467 PolarHBondContact OG1-OD2 3.39Å; T450-Y535 VanDerWaalsContact C-OH 3.31Å
451	F	97.3	Very high	93.8	Very high	56 Å²	56	66.6 Å²	66.6	25%	0.246	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	140.7	171.5	-162.8	-89.9	0	0	0	110.7	F453 F466 Y531 Y535	F451-F453 AromaticContact CD1-CD2 3.91Å; F451-F453 HydrophobicContact CD1-CD2 3.91Å; F451-F453 HydrophobicContact CD1-CE1 4.27Å; F451-F453 AromaticContact CD1-CE2 3.37Å; F451-F453 HydrophobicContact CD1-CE2 3.37Å; F451-F453 AromaticContact CD1-CZ 3.57Å; F451-F453 HydrophobicContact CD1-CZ 3.57Å; F451-F453 HydrophobicContact CE1-CD1 4.23Å; F451-F453 HydrophobicContact CE1-CD2 4.22Å; F451-F453 AromaticContact CE1-CE1 3.69Å; F451-F453 HydrophobicContact CE1-CE1 3.69Å; F451-F453 AromaticContact CE1-CE2 3.69Å; F451-F453 HydrophobicContact CE1-CE2 3.69Å; F451-F453 HydrophobicContact CE1-CG 4.46Å; F451-F453 AromaticContact CE1-CZ 3.37Å; F451-F453 HydrophobicContact CE1-CZ 3.37Å; F451-F466 PolarHBondContact N-O 3.37Å; F451-F466 PolarHBondContact O-N 3.36Å; F451-Y531 HydrophobicContact CB-CD1 4.11Å; F451-Y531 HydrophobicContact CB-CE1 4.29Å; F451-Y531 AromaticContact CD1-CD1 3.72Å; F451-Y531 HydrophobicContact CD1-CD1 3.72Å; F451-Y531 AromaticContact CD1-CE1 3.83Å; F451-Y531 HydrophobicContact CD1-CE1 3.83Å; F451-Y531 HydrophobicContact CD1-CG 4.46Å; F451-Y531 HydrophobicContact CD2-CD1 4.15Å; F451-Y531 AromaticContact CD2-CE1 3.53Å; F451-Y531 HydrophobicContact CD2-CE1 3.53Å; F451-Y531 HydrophobicContact CE1-CD1 4.14Å; F451-Y531 AromaticContact CE1-CE1 3.96Å; F451-Y531 HydrophobicContact CE1-CE1 3.96Å; F451-Y531 AromaticContact CE2-CE1 3.66Å; F451-Y531 HydrophobicContact CE2-CE1 3.66Å; F451-Y531 AromaticContact CG-CD1 3.71Å; F451-Y531 HydrophobicContact CG-CD1 3.71Å; F451-Y531 AromaticContact CG-CE1 3.59Å; F451-Y531 HydrophobicContact CG-CE1 3.59Å; F451-Y531 AromaticContact CZ-CE1 3.88Å; F451-Y531 HydrophobicContact CZ-CE1 3.88Å; F451-Y531 AromaticContact CZ-CZ 4Å; F451-Y535 HydrophobicContact CB-CE2 4.1Å; F451-Y535 PolarHBondContact N-OH 3.27Å
452	T	96.5	Very high	93.8	Very high	79 Å²	79	66.6 Å²	66.6	49%	0.485	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128	-173.6	-59.3	0	0	0	0	111.1	A463 L464 V465	T452-A463 HydrophobicContact CG2-CB 3.73Å; T452-L464 WeakPolarHBondContact CA-O 3.42Å; T452-V465 HydrophobicContact CG2-CG2 4.01Å
453	F	96.3	Very high	93.9	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	135.4	171.9	-70.3	-84.1	0	0	0	110.3	F451 A463 L464 F466 R527 L528 Y531	F451-F453 AromaticContact CD1-CD2 3.91Å; F451-F453 HydrophobicContact CD1-CD2 3.91Å; F451-F453 HydrophobicContact CD1-CE1 4.27Å; F451-F453 AromaticContact CD1-CE2 3.37Å; F451-F453 HydrophobicContact CD1-CE2 3.37Å; F451-F453 AromaticContact CD1-CZ 3.57Å; F451-F453 HydrophobicContact CD1-CZ 3.57Å; F451-F453 HydrophobicContact CE1-CD1 4.23Å; F451-F453 HydrophobicContact CE1-CD2 4.22Å; F451-F453 AromaticContact CE1-CE1 3.69Å; F451-F453 HydrophobicContact CE1-CE1 3.69Å; F451-F453 AromaticContact CE1-CE2 3.69Å; F451-F453 HydrophobicContact CE1-CE2 3.69Å; F451-F453 HydrophobicContact CE1-CG 4.46Å; F451-F453 AromaticContact CE1-CZ 3.37Å; F451-F453 HydrophobicContact CE1-CZ 3.37Å; F453-A463 CarbonylContact O-C 3.59Å; F453-A463 WeakPolarHBondContact O-CA 3.4Å; F453-L464 PolarHBondContact N-O 3.43Å; F453-L464 PolarHBondContact O-N 3.01Å; F453-F466 HydrophobicContact CD2-CD2 4.13Å; F453-F466 AromaticContact CD2-CE2 3.8Å; F453-F466 HydrophobicContact CD2-CE2 3.8Å; F453-F466 HydrophobicContact CD2-CZ 4.45Å; F453-F466 AromaticContact CE2-CD2 3.79Å; F453-F466 HydrophobicContact CE2-CD2 3.79Å; F453-F466 AromaticContact CE2-CE2 3.54Å; F453-F466 HydrophobicContact CE2-CE2 3.54Å; F453-R527 HydrophobicContact CE1-CB 4.17Å; F453-R527 HydrophobicContact CE1-CG 3.98Å; F453-R527 HydrophobicContact CZ-CG 4.22Å; F453-L528 HydrophobicContact CB-CD1 4.02Å; F453-L528 HydrophobicContact CD1-CB 3.91Å; F453-L528 HydrophobicContact CD1-CD1 4.48Å; F453-L528 HydrophobicContact CD1-CG 4.42Å; F453-L528 HydrophobicContact CD2-CB 4.33Å; F453-L528 HydrophobicContact CD2-CD1 4.37Å; F453-L528 HydrophobicContact CD2-CG 4.1Å; F453-L528 HydrophobicContact CE1-CB 3.94Å; F453-L528 HydrophobicContact CE2-CB 4.35Å; F453-L528 HydrophobicContact CE2-CG 4.39Å; F453-L528 HydrophobicContact CG-CB 4.12Å; F453-L528 HydrophobicContact CG-CD1 4.04Å; F453-L528 HydrophobicContact CG-CG 4.12Å; F453-L528 VanDerWaalsContact CZ-CA 3.48Å; F453-L528 HydrophobicContact CZ-CB 4.18Å; F453-Y531 HydrophobicContact CE2-CD1 4.38Å; F453-Y531 HydrophobicContact CE2-CG 4.08Å; F453-Y531 HydrophobicContact CZ-CD1 4.19Å; F453-Y531 AromaticContact CZ-CD2 3.97Å; F453-Y531 HydrophobicContact CZ-CD2 3.97Å; F453-Y531 AromaticContact CZ-CG 3.68Å; F453-Y531 HydrophobicContact CZ-CG 3.68Å
454	A	95.1	Very high	94.1	Very high	75 Å²	75	58.9 Å²	58.9	62%	0.62	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.8	169.5	0	0	0	0	0	109.5
455	C	94.8	Very high	94.2	Very high	11 Å²	11	58.9 Å²	58.9	7%	0.074	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	170.7	-179	-51.5	0	0	0	0	110.7	S462 L520 D521	C455-S462 CarbonylContact C-O 3.54Å; C455-S462 PolarHBondContact N-O 3.38Å; C455-S462 CarbonylContact O-C 3.56Å; C455-S462 WeakPolarHBondContact O-CA 3.45Å; C455-S462 PolarHBondContact O-N 3.49Å; C455-L520 HydrophobicContact CB-CB 4.29Å; C455-D521 CarbonylContact C-O 3.59Å; C455-D521 WeakPolarHBondContact CA-O 3.45Å; C455-D521 WeakPolarHBondContact CB-O 3.23Å
456	A	93.5	Very high	94.3	Very high	25 Å²	25	58.9 Å²	58.9	21%	0.207	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.2	169.4	0	0	0	0	0	110.3	R460 L520 D521	A456-R460 VanDerWaalsContact CA-O 3.29Å; A456-R460 WeakPolarHBondContact CA-O 3.32Å; A456-L520 WeakPolarHBondContact O-CA 3.3Å; A456-D521 HydrophobicContact CB-CB 4.38Å; A456-D521 PolarHBondContact N-O 3.41Å; A456-D521 PolarHBondContact O-N 3.22Å
457	N	91.3	Very high	94.5	Very high	48 Å²	48	57.3 Å²	57.3	26%	0.257	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.6	171.2	179.3	33.3	0	0	0	107.9	D459 R460 F474 N519 L520	N457-D459 VanDerWaalsContact C-N 3.28Å; N457-D459 PolarHBondContact O-N 3.12Å; N457-R460 PolarHBondContact N-O 3.27Å; N457-R460 WeakPolarHBondContact O-CB 3.29Å; N457-R460 PolarHBondContact O-N 3.43Å; N457-F474 HydrophobicContact CB-CE1 4.33Å; N457-F474 HydrophobicContact CB-CZ 3.68Å; N457-N519 PolarHBondContact OD1-O 3.36Å; N457-L520 HydrophobicContact CB-CD2 3.81Å
458	E	88.7	Confident	94.6	Very high	156 Å²	156	52.2 Å²	52.2	73%	0.729	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	51.1	-175.2	-58.6	179.5	167.3	0	0	111.9	R460	E458-R460 PolarHBondContact O-N 2.66Å
459	D	86.9	Confident	94.5	Very high	146 Å²	146	57.8 Å²	57.8	78%	0.781	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	4.2	-176.9	-56.6	-50.8	0	0	0	116.1	N457	N457-D459 VanDerWaalsContact C-N 3.28Å; N457-D459 PolarHBondContact O-N 3.12Å
460	R	92.4	Very high	94.5	Very high	163 Å²	163	59.3 Å²	59.3	62%	0.615	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.3	174.9	-61.3	-175	-177.8	171	4.3	111.3	A456 N457 E458 S462	A456-R460 VanDerWaalsContact CA-O 3.29Å; A456-R460 WeakPolarHBondContact CA-O 3.32Å; N457-R460 PolarHBondContact N-O 3.27Å; N457-R460 WeakPolarHBondContact O-CB 3.29Å; N457-R460 PolarHBondContact O-N 3.43Å; E458-R460 PolarHBondContact O-N 2.66Å; R460-S462 PolarHBondContact O-N 3.16Å; R460-S462 PolarHBondContact O-OG 3.46Å
461	P	94.4	Very high	94.4	Very high	78 Å²	78	56.6 Å²	56.6	51%	0.506	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	123.2	178	27.7	-34.4	0	0	0	110.1	V477	P461-V477 HydrophobicContact CB-CB 4.48Å; P461-V477 WeakPolarHBondContact O-CB 3.44Å; P461-V477 PolarHBondContact O-N 3.42Å
462	S	95.4	Very high	94.4	Very high	6 Å²	6	53.9 Å²	53.9	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	175.4	-176.3	-62	0	0	0	0	109.4	C455 R460 F474 Y475	C455-S462 CarbonylContact C-O 3.54Å; C455-S462 PolarHBondContact N-O 3.38Å; C455-S462 CarbonylContact O-C 3.56Å; C455-S462 WeakPolarHBondContact O-CA 3.45Å; C455-S462 PolarHBondContact O-N 3.49Å; R460-S462 PolarHBondContact O-N 3.16Å; R460-S462 PolarHBondContact O-OG 3.46Å; S462-F474 VanDerWaalsContact CB-CE2 3.41Å; S462-F474 WeakPolarHBondContact OG-CZ 3.06Å; S462-Y475 CarbonylContact C-O 3.54Å; S462-Y475 WeakPolarHBondContact CA-O 3.26Å
463	A	95.5	Very high	94.3	Very high	10 Å²	10	50.1 Å²	50.1	8%	0.083	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135.1	176.9	0	0	0	0	0	110.6	T452 F453 Y475	T452-A463 HydrophobicContact CG2-CB 3.73Å; F453-A463 CarbonylContact O-C 3.59Å; F453-A463 WeakPolarHBondContact O-CA 3.4Å; A463-Y475 HydrophobicContact CB-CD1 4.42Å; A463-Y475 PolarHBondContact N-O 3.28Å; A463-Y475 PolarHBondContact O-N 2.92Å
464	L	96.2	Very high	94.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.5	172.4	-168.1	70.3	0	0	0	108.3	T452 F453 F466 I472 F474 W484 L504 L520 L528	T452-L464 WeakPolarHBondContact CA-O 3.42Å; F453-L464 PolarHBondContact N-O 3.43Å; F453-L464 PolarHBondContact O-N 3.01Å; L464-F466 HydrophobicContact CD2-CE1 3.56Å; L464-F466 HydrophobicContact CD2-CZ 3.69Å; L464-F466 HydrophobicContact CG-CE1 3.86Å; L464-F466 HydrophobicContact CG-CZ 4.36Å; L464-I472 HydrophobicContact CD1-CG2 3.65Å; L464-I472 HydrophobicContact CG-CG2 4.23Å; L464-F474 HydrophobicContact CD1-CD2 4.39Å; L464-W484 HydrophobicContact CD1-CH2 4.32Å; L464-L504 HydrophobicContact CD1-CD1 4.2Å; L464-L504 HydrophobicContact CD2-CD1 3.91Å; L464-L520 HydrophobicContact CB-CD1 4.38Å; L464-L520 HydrophobicContact CD1-CD1 3.92Å; L464-L520 HydrophobicContact CD2-CD1 4.21Å; L464-L520 HydrophobicContact CG-CD1 4.41Å; L464-L528 HydrophobicContact CD2-CD1 3.97Å; L464-L528 HydrophobicContact CD2-CD2 4.48Å; L464-L528 HydrophobicContact CD2-CG 4.46Å
465	V	96.9	Very high	94.4	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.024	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	123.2	-176.1	-175.9	0	0	0	0	108.7	T450 T452 I472 G473 Y482 W485	T450-V465 HydrophobicContact CG2-CG1 3.45Å; T450-V465 VanDerWaalsContact CG2-CG1 3.45Å; T452-V465 HydrophobicContact CG2-CG2 4.01Å; V465-I472 CarbonylContact O-C 3.52Å; V465-I472 WeakPolarHBondContact O-CA 3.27Å; V465-G473 PolarHBondContact N-O 3.22Å; V465-G473 PolarHBondContact O-N 2.87Å; V465-Y482 HydrophobicContact CG2-CE1 4.1Å; V465-W485 HydrophobicContact CB-CH2 4.47Å; V465-W485 HydrophobicContact CG1-CH2 4.17Å
466	F	97.4	Very high	94.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.4	168	-58.3	-32.2	0	0	0	108.6	T450 F451 F453 L464 I472 L528 L532 Y535	T450-F466 CarbonylContact C-O 3.57Å; T450-F466 WeakPolarHBondContact CA-O 3.29Å; T450-F466 WeakPolarHBondContact CG2-O 3.42Å; F451-F466 PolarHBondContact N-O 3.37Å; F451-F466 PolarHBondContact O-N 3.36Å; F453-F466 HydrophobicContact CD2-CD2 4.13Å; F453-F466 AromaticContact CD2-CE2 3.8Å; F453-F466 HydrophobicContact CD2-CE2 3.8Å; F453-F466 HydrophobicContact CD2-CZ 4.45Å; F453-F466 AromaticContact CE2-CD2 3.79Å; F453-F466 HydrophobicContact CE2-CD2 3.79Å; F453-F466 AromaticContact CE2-CE2 3.54Å; F453-F466 HydrophobicContact CE2-CE2 3.54Å; L464-F466 HydrophobicContact CD2-CE1 3.56Å; L464-F466 HydrophobicContact CD2-CZ 3.69Å; L464-F466 HydrophobicContact CG-CE1 3.86Å; L464-F466 HydrophobicContact CG-CZ 4.36Å; F466-I472 HydrophobicContact CD1-CB 4.5Å; F466-I472 HydrophobicContact CD1-CG1 4.02Å; F466-I472 HydrophobicContact CD1-CG2 4.12Å; F466-I472 HydrophobicContact CE1-CD1 4.41Å; F466-I472 HydrophobicContact CE1-CG1 4.25Å; F466-I472 HydrophobicContact CE1-CG2 4.02Å; F466-L528 HydrophobicContact CE2-CG 4.39Å; F466-L528 HydrophobicContact CZ-CD2 4.21Å; F466-L528 HydrophobicContact CZ-CG 4.18Å; F466-L532 HydrophobicContact CE1-CD1 4Å; F466-L532 HydrophobicContact CE2-CB 4.01Å; F466-L532 HydrophobicContact CZ-CB 3.92Å; F466-L532 HydrophobicContact CZ-CD1 3.98Å; F466-L532 HydrophobicContact CZ-CG 4.42Å; F466-Y535 HydrophobicContact CB-CD1 4.11Å; F466-Y535 HydrophobicContact CB-CD2 3.78Å; F466-Y535 HydrophobicContact CB-CE1 4.04Å; F466-Y535 HydrophobicContact CB-CE2 3.72Å; F466-Y535 HydrophobicContact CB-CG 3.99Å; F466-Y535 HydrophobicContact CD2-CD2 4.02Å; F466-Y535 HydrophobicContact CD2-CE2 4.29Å; F466-Y535 HydrophobicContact CG-CD2 4.26Å; F466-Y535 HydrophobicContact CG-CE2 4.49Å
467	D	96.9	Very high	94.3	Very high	19 Å²	19	51.6 Å²	51.6	10%	0.102	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	125.2	177.6	179	-56.3	0	0	0	108.2	E449 T450 R469 H470 G471 W485 F488	E449-D467 WeakPolarHBondContact O-CA 3.45Å; T450-D467 HydrophobicContact CG2-CB 4.44Å; T450-D467 PolarHBondContact OG1-OD2 3.39Å; D467-R469 PolarHBondContact O-N 2.85Å; D467-R469 WeakPolarHBondContact OD1-CA 3.28Å; D467-R469 WeakPolarHBondContact OD1-CB 3.22Å; D467-R469 PolarHBondContact OD1-N 3.18Å; D467-H470 HydrophobicContact CB-CB 4.09Å; D467-H470 IonicContact OD1-CG 3.72Å; D467-H470 PolarHBondContact OD1-N 3.12Å; D467-H470 IonicContact OD1-ND1 3.14Å; D467-H470 PolarHBondContact OD1-ND1 2.74Å; D467-H470 VanDerWaalsContact OD1-ND1 3.14Å; D467-H470 IonicContact OD2-CE1 3.88Å; D467-H470 IonicContact OD2-CG 3.9Å; D467-H470 IonicContact OD2-ND1 2.94Å; D467-H470 PolarHBondContact OD2-ND1 3.37Å; D467-G471 PolarHBondContact N-O 2.88Å; D467-G471 WeakPolarHBondContact O-CA 3.44Å; D467-G471 PolarHBondContact O-N 2.84Å; D467-G471 VanDerWaalsContact O-O 3.13Å; D467-W485 HydrophobicContact CB-CH2 4.2Å; D467-W485 HydrophobicContact CB-CZ3 4.02Å; D467-F488 VanDerWaalsContact O-CE2 3.31Å; D467-F488 WeakPolarHBondContact O-CE2 3.3Å
468	I	94.1	Very high	94.3	Very high	9 Å²	9	53.2 Å²	53.2	5%	0.046	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.3	-174.5	-169.8	55.3	0	0	0	113	I445 E449 Y535 A538 R539	I445-I468 HydrophobicContact CG2-CB 4.21Å; I445-I468 HydrophobicContact CG2-CD1 3.83Å; I445-I468 HydrophobicContact CG2-CG1 4.09Å; E449-I468 PolarHBondContact O-N 3.08Å; I468-Y535 HydrophobicContact CB-CD1 4.34Å; I468-Y535 HydrophobicContact CB-CE1 4.13Å; I468-Y535 HydrophobicContact CD1-CD1 4.33Å; I468-A538 HydrophobicContact CD1-CB 4.13Å; I468-R539 HydrophobicContact CD1-CB 4.36Å
469	R	93.5	Very high	94.5	Very high	177 Å²	177	49.3 Å²	49.3	67%	0.668	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-43.7	-178.7	-55.2	-174.4	-172	-174.7	5.9	111.6	E449 D467	E449-R469 IonicContact OE1-CZ 3.56Å; E449-R469 IonicContact OE1-NE 3.23Å; E449-R469 IonicContact OE1-NH2 2.72Å; E449-R469 PolarHBondContact OE1-NH2 2.85Å; D467-R469 PolarHBondContact O-N 2.85Å; D467-R469 WeakPolarHBondContact OD1-CA 3.28Å; D467-R469 WeakPolarHBondContact OD1-CB 3.22Å; D467-R469 PolarHBondContact OD1-N 3.18Å
470	H	93.8	Very high	94.8	Very high	117 Å²	117	50 Å²	50	54%	0.542	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-29.9	-172.2	-59.6	102.4	0	0	0	113.6	D467 W485	D467-H470 HydrophobicContact CB-CB 4.09Å; D467-H470 IonicContact OD1-CG 3.72Å; D467-H470 PolarHBondContact OD1-N 3.12Å; D467-H470 IonicContact OD1-ND1 3.14Å; D467-H470 PolarHBondContact OD1-ND1 2.74Å; D467-H470 VanDerWaalsContact OD1-ND1 3.14Å; D467-H470 IonicContact OD2-CE1 3.88Å; D467-H470 IonicContact OD2-CG 3.9Å; D467-H470 IonicContact OD2-ND1 2.94Å; D467-H470 PolarHBondContact OD2-ND1 3.37Å; H470-W485 HydrophobicContact CB-CE3 3.91Å; H470-W485 HydrophobicContact CB-CH2 4.3Å; H470-W485 HydrophobicContact CB-CZ3 3.75Å
471	G	95.2	Very high	94.9	Very high	2 Å²	2	49 Å²	49	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.5	-136	-178.5	0	0	0	0	0	113.3	D467 Y486	D467-G471 PolarHBondContact N-O 2.88Å; D467-G471 WeakPolarHBondContact O-CA 3.44Å; D467-G471 PolarHBondContact O-N 2.84Å; D467-G471 VanDerWaalsContact O-O 3.13Å; G471-Y486 CarbonylContact C-O 3.35Å; G471-Y486 WeakPolarHBondContact CA-O 3.49Å
472	I	96.9	Very high	95	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	118.2	-178.3	-54.7	176.4	0	0	0	108.4	L464 V465 F466 W484 W485 Y486 F488 L491 F506 L532	L464-I472 HydrophobicContact CD1-CG2 3.65Å; L464-I472 HydrophobicContact CG-CG2 4.23Å; V465-I472 CarbonylContact O-C 3.52Å; V465-I472 WeakPolarHBondContact O-CA 3.27Å; F466-I472 HydrophobicContact CD1-CB 4.5Å; F466-I472 HydrophobicContact CD1-CG1 4.02Å; F466-I472 HydrophobicContact CD1-CG2 4.12Å; F466-I472 HydrophobicContact CE1-CD1 4.41Å; F466-I472 HydrophobicContact CE1-CG1 4.25Å; F466-I472 HydrophobicContact CE1-CG2 4.02Å; I472-W484 HydrophobicContact CG2-CZ3 4.28Å; I472-W485 WeakPolarHBondContact O-CA 3.19Å; I472-Y486 PolarHBondContact N-O 3.34Å; I472-Y486 PolarHBondContact O-N 2.99Å; I472-F488 HydrophobicContact CD1-CD1 3.95Å; I472-F488 HydrophobicContact CD1-CE1 4Å; I472-F488 HydrophobicContact CG1-CD1 3.8Å; I472-F488 HydrophobicContact CG1-CE1 3.54Å; I472-F488 HydrophobicContact CG1-CZ 4.34Å; I472-L491 HydrophobicContact CD1-CD2 4.06Å; I472-F506 HydrophobicContact CB-CE1 4.39Å; I472-F506 HydrophobicContact CB-CZ 4.4Å; I472-F506 HydrophobicContact CD1-CE1 4.06Å; I472-F506 HydrophobicContact CD1-CZ 4.26Å; I472-F506 HydrophobicContact CG2-CZ 4.17Å; I472-L532 HydrophobicContact CD1-CD1 3.89Å
473	G	96.2	Very high	94.8	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146	178.4	0	0	0	0	0	111.7	V465	V465-G473 PolarHBondContact N-O 3.22Å; V465-G473 PolarHBondContact O-N 2.87Å
474	F	96.2	Very high	94.7	Very high	1 Å²	1	56.5 Å²	56.5	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.2	174	-171.3	-120.6	0	0	0	110.3	N457 S462 L464 Y482 L483 W484 L520	N457-F474 HydrophobicContact CB-CE1 4.33Å; N457-F474 HydrophobicContact CB-CZ 3.68Å; S462-F474 VanDerWaalsContact CB-CE2 3.41Å; S462-F474 WeakPolarHBondContact OG-CZ 3.06Å; L464-F474 HydrophobicContact CD1-CD2 4.39Å; F474-Y482 CarbonylContact O-C 3.59Å; F474-Y482 WeakPolarHBondContact O-CA 3.33Å; F474-L483 HydrophobicContact CD1-CB 4.11Å; F474-L483 HydrophobicContact CD1-CD1 3.66Å; F474-L483 HydrophobicContact CD1-CG 4.29Å; F474-L483 HydrophobicContact CE1-CD1 3.63Å; F474-L483 PolarHBondContact O-N 2.88Å; F474-W484 HydrophobicContact CB-CD2 3.62Å; F474-W484 HydrophobicContact CB-CE3 3.86Å; F474-W484 HydrophobicContact CB-CG 4.36Å; F474-W484 HydrophobicContact CB-CH2 3.57Å; F474-W484 HydrophobicContact CB-CZ2 3.25Å; F474-W484 HydrophobicContact CB-CZ3 3.84Å; F474-W484 AromaticContact CD1-CE2 3.9Å; F474-W484 HydrophobicContact CD1-CZ2 4.04Å; F474-W484 AromaticContact CD1-NE1 3.61Å; F474-W484 HydrophobicContact CD2-CZ2 4.29Å; F474-W484 AromaticContact CG-CE2 3.81Å; F474-W484 HydrophobicContact CG-CH2 4.27Å; F474-W484 AromaticContact CG-CZ2 3.63Å; F474-W484 HydrophobicContact CG-CZ2 3.63Å; F474-W484 PolarHBondContact N-O 3.07Å; F474-L520 HydrophobicContact CD2-CD1 4.38Å; F474-L520 HydrophobicContact CD2-CD2 4.28Å; F474-L520 HydrophobicContact CE2-CD1 4.17Å; F474-L520 HydrophobicContact CE2-CD2 3.42Å; F474-L520 VanDerWaalsContact CE2-CD2 3.42Å; F474-L520 HydrophobicContact CE2-CG 4.46Å; F474-L520 HydrophobicContact CZ-CD2 3.71Å
475	Y	95.8	Very high	94.7	Very high	64 Å²	64	61 Å²	61	25%	0.251	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.8	-175.3	-179.4	-95.4	0	0	0	109.9	S462 A463 V477 K480 Y482	S462-Y475 CarbonylContact C-O 3.54Å; S462-Y475 WeakPolarHBondContact CA-O 3.26Å; A463-Y475 HydrophobicContact CB-CD1 4.42Å; A463-Y475 PolarHBondContact N-O 3.28Å; A463-Y475 PolarHBondContact O-N 2.92Å; Y475-V477 HydrophobicContact CD1-CG2 4.35Å; Y475-V477 HydrophobicContact CE1-CG2 4.45Å; Y475-K480 VanDerWaalsContact OH-CA 3.23Å; Y475-K480 WeakPolarHBondContact OH-CA 3.12Å; Y475-K480 WeakPolarHBondContact OH-CB 3.49Å; Y475-Y482 HydrophobicContact CD2-CD1 4.12Å; Y475-Y482 HydrophobicContact CD2-CD2 4.17Å; Y475-Y482 HydrophobicContact CD2-CE1 4.03Å; Y475-Y482 HydrophobicContact CD2-CE2 4.08Å; Y475-Y482 HydrophobicContact CD2-CG 4.19Å; Y475-Y482 HydrophobicContact CG-CE1 4.39Å
476	D	94.3	Very high	94.6	Very high	11 Å²	11	62.2 Å²	62.2	6%	0.059	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119	173.2	170.9	21.4	0	0	0	109.7	S478 T479 K480 K481 L483	D476-S478 VanDerWaalsContact C-N 3.26Å; D476-S478 VanDerWaalsContact CG-OG 3.24Å; D476-S478 PolarHBondContact O-N 3.36Å; D476-S478 WeakPolarHBondContact OD1-CB 3.19Å; D476-S478 PolarHBondContact OD1-N 2.93Å; D476-S478 PolarHBondContact OD1-OG 3.12Å; D476-S478 PolarHBondContact OD2-OG 2.89Å; D476-S478 VanDerWaalsContact OD2-OG 3.06Å; D476-T479 VanDerWaalsContact CG-OG1 3.3Å; D476-T479 VanDerWaalsContact OD2-CB 3.26Å; D476-T479 WeakPolarHBondContact OD2-CB 3.43Å; D476-T479 WeakPolarHBondContact OD2-CG2 3.18Å; D476-T479 PolarHBondContact OD2-N 2.96Å; D476-T479 PolarHBondContact OD2-OG1 2.71Å; D476-K480 WeakPolarHBondContact O-CA 3.27Å; D476-K480 PolarHBondContact O-N 3.49Å; D476-K481 PolarHBondContact N-O 3.5Å; D476-K481 PolarHBondContact O-N 3.47Å; D476-L483 HydrophobicContact CB-CD1 3.9Å; D476-L483 HydrophobicContact CB-CD2 4.19Å; D476-L483 HydrophobicContact CB-CG 3.92Å
477	V	92.8	Very high	94.3	Very high	72 Å²	72	68.2 Å²	68.2	44%	0.436	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-32.7	-177.3	179.2	0	0	0	0	110.8	P461 Y475	P461-V477 HydrophobicContact CB-CB 4.48Å; P461-V477 WeakPolarHBondContact O-CB 3.44Å; P461-V477 PolarHBondContact O-N 3.42Å; Y475-V477 HydrophobicContact CD1-CG2 4.35Å; Y475-V477 HydrophobicContact CE1-CG2 4.45Å
478	S	91.8	Very high	94.2	Very high	82 Å²	82	68 Å²	68	57%	0.573	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-46.3	-175.4	69.2	0	0	0	0	112.3	D476	D476-S478 VanDerWaalsContact C-N 3.26Å; D476-S478 VanDerWaalsContact CG-OG 3.24Å; D476-S478 PolarHBondContact O-N 3.36Å; D476-S478 WeakPolarHBondContact OD1-CB 3.19Å; D476-S478 PolarHBondContact OD1-N 2.93Å; D476-S478 PolarHBondContact OD1-OG 3.12Å; D476-S478 PolarHBondContact OD2-OG 2.89Å; D476-S478 VanDerWaalsContact OD2-OG 3.06Å
479	T	92.7	Very high	94	Very high	75 Å²	75	72.1 Å²	72.1	46%	0.46	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.4	177.8	62.9	0	0	0	0	113.9	D476 K481	D476-T479 VanDerWaalsContact CG-OG1 3.3Å; D476-T479 VanDerWaalsContact OD2-CB 3.26Å; D476-T479 WeakPolarHBondContact OD2-CB 3.43Å; D476-T479 WeakPolarHBondContact OD2-CG2 3.18Å; D476-T479 PolarHBondContact OD2-N 2.96Å; D476-T479 PolarHBondContact OD2-OG1 2.71Å; T479-K481 VanDerWaalsContact C-N 3.3Å; T479-K481 PolarHBondContact O-N 2.83Å
480	K	93.2	Very high	93.9	Very high	160 Å²	160	64.6 Å²	64.6	70%	0.696	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	40.2	-175.8	-58.8	-176.7	179.7	-179.2	0	113.3	Y475 D476	Y475-K480 VanDerWaalsContact OH-CA 3.23Å; Y475-K480 WeakPolarHBondContact OH-CA 3.12Å; Y475-K480 WeakPolarHBondContact OH-CB 3.49Å; D476-K480 WeakPolarHBondContact O-CA 3.27Å; D476-K480 PolarHBondContact O-N 3.49Å
481	K	94.9	Very high	93.9	Very high	142 Å²	142	60.3 Å²	60.3	62%	0.617	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.3	-176.5	-71.5	178.4	-177.4	179.6	0	111.3	D476 T479 L483	D476-K481 PolarHBondContact N-O 3.5Å; D476-K481 PolarHBondContact O-N 3.47Å; T479-K481 VanDerWaalsContact C-N 3.3Å; T479-K481 PolarHBondContact O-N 2.83Å; K481-L483 PolarHBondContact O-N 3.47Å
482	Y	94.7	Very high	93.7	Very high	116 Å²	116	68.1 Å²	68.1	46%	0.455	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.1	164.4	-67.8	-80.9	0	0	0	109.3	V465 F474 Y475 W485	V465-Y482 HydrophobicContact CG2-CE1 4.1Å; F474-Y482 CarbonylContact O-C 3.59Å; F474-Y482 WeakPolarHBondContact O-CA 3.33Å; Y475-Y482 HydrophobicContact CD2-CD1 4.12Å; Y475-Y482 HydrophobicContact CD2-CD2 4.17Å; Y475-Y482 HydrophobicContact CD2-CE1 4.03Å; Y475-Y482 HydrophobicContact CD2-CE2 4.08Å; Y475-Y482 HydrophobicContact CD2-CG 4.19Å; Y475-Y482 HydrophobicContact CG-CE1 4.39Å; Y482-W485 AromaticContact CD1-CE2 3.65Å; Y482-W485 AromaticContact CD1-CZ2 3.62Å; Y482-W485 HydrophobicContact CD1-CZ2 3.62Å; Y482-W485 AromaticContact CD1-NE1 3.46Å; Y482-W485 HydrophobicContact CD2-CZ2 4.47Å; Y482-W485 AromaticContact CD2-NE1 3.89Å; Y482-W485 AromaticContact CE1-CE2 3.89Å; Y482-W485 HydrophobicContact CE1-CH2 4.13Å; Y482-W485 AromaticContact CE1-CZ2 3.32Å; Y482-W485 HydrophobicContact CE1-CZ2 3.32Å; Y482-W485 HydrophobicContact CE2-CZ2 4.24Å; Y482-W485 AromaticContact CG-CE2 3.99Å; Y482-W485 HydrophobicContact CG-CZ2 4.19Å; Y482-W485 AromaticContact CG-NE1 3.34Å; Y482-W485 VanDerWaalsContact CG-NE1 3.34Å; Y482-W485 AromaticContact CZ-CZ2 3.67Å
483	L	92.4	Very high	93.4	Very high	95 Å²	95	71 Å²	71	50%	0.497	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-38.2	176.1	-64.2	-179.1	0	0	0	110.8	F474 D476 K481	F474-L483 HydrophobicContact CD1-CB 4.11Å; F474-L483 HydrophobicContact CD1-CD1 3.66Å; F474-L483 HydrophobicContact CD1-CG 4.29Å; F474-L483 HydrophobicContact CE1-CD1 3.63Å; F474-L483 PolarHBondContact O-N 2.88Å; D476-L483 HydrophobicContact CB-CD1 3.9Å; D476-L483 HydrophobicContact CB-CD2 4.19Å; D476-L483 HydrophobicContact CB-CG 3.92Å; K481-L483 PolarHBondContact O-N 3.47Å
484	W	93.8	Very high	93.3	Very high	40 Å²	40	74 Å²	74	15%	0.152	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	164	177	47.5	-101.2	0	0	0	111.7	L464 I472 F474 Y486 F506 H516 V518	L464-W484 HydrophobicContact CD1-CH2 4.32Å; I472-W484 HydrophobicContact CG2-CZ3 4.28Å; F474-W484 HydrophobicContact CB-CD2 3.62Å; F474-W484 HydrophobicContact CB-CE3 3.86Å; F474-W484 HydrophobicContact CB-CG 4.36Å; F474-W484 HydrophobicContact CB-CH2 3.57Å; F474-W484 HydrophobicContact CB-CZ2 3.25Å; F474-W484 HydrophobicContact CB-CZ3 3.84Å; F474-W484 AromaticContact CD1-CE2 3.9Å; F474-W484 HydrophobicContact CD1-CZ2 4.04Å; F474-W484 AromaticContact CD1-NE1 3.61Å; F474-W484 HydrophobicContact CD2-CZ2 4.29Å; F474-W484 AromaticContact CG-CE2 3.81Å; F474-W484 HydrophobicContact CG-CH2 4.27Å; F474-W484 AromaticContact CG-CZ2 3.63Å; F474-W484 HydrophobicContact CG-CZ2 3.63Å; F474-W484 PolarHBondContact N-O 3.07Å; W484-Y486 HydrophobicContact CB-CE2 4.29Å; W484-Y486 AromaticContact CD2-CD2 3.96Å; W484-Y486 HydrophobicContact CD2-CD2 3.96Å; W484-Y486 AromaticContact CD2-CE2 3.79Å; W484-Y486 HydrophobicContact CD2-CE2 3.79Å; W484-Y486 AromaticContact CE3-CD2 3.31Å; W484-Y486 HydrophobicContact CE3-CD2 3.31Å; W484-Y486 AromaticContact CE3-CE2 3.65Å; W484-Y486 HydrophobicContact CE3-CE2 3.65Å; W484-Y486 HydrophobicContact CE3-CG 4.44Å; W484-Y486 HydrophobicContact CG-CE2 4.1Å; W484-Y486 HydrophobicContact CH2-CD2 4.48Å; W484-Y486 AromaticContact CZ3-CD2 3.62Å; W484-Y486 HydrophobicContact CZ3-CD2 3.62Å; W484-Y486 HydrophobicContact CZ3-CE2 4.21Å; W484-F506 AromaticContact CH2-CE2 3.78Å; W484-F506 HydrophobicContact CH2-CE2 3.78Å; W484-F506 HydrophobicContact CH2-CZ 4.11Å; W484-F506 HydrophobicContact CZ3-CE2 4.1Å; W484-F506 HydrophobicContact CZ3-CZ 4.13Å; W484-H516 AromaticContact CD1-CE1 3.8Å; W484-H516 AromaticContact NE1-CE1 3.59Å; W484-V518 HydrophobicContact CH2-CG1 4.48Å; W484-V518 HydrophobicContact CH2-CG2 4.17Å; W484-V518 HydrophobicContact CZ2-CB 4.26Å; W484-V518 HydrophobicContact CZ2-CG1 3.82Å; W484-V518 HydrophobicContact CZ2-CG2 3.57Å
485	W	94.6	Very high	93.1	Very high	94 Å²	94	76.1 Å²	76.1	36%	0.356	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.1	171	-78.3	94.1	0	0	0	108.8	V465 D467 H470 I472 Y482	V465-W485 HydrophobicContact CB-CH2 4.47Å; V465-W485 HydrophobicContact CG1-CH2 4.17Å; D467-W485 HydrophobicContact CB-CH2 4.2Å; D467-W485 HydrophobicContact CB-CZ3 4.02Å; H470-W485 HydrophobicContact CB-CE3 3.91Å; H470-W485 HydrophobicContact CB-CH2 4.3Å; H470-W485 HydrophobicContact CB-CZ3 3.75Å; I472-W485 WeakPolarHBondContact O-CA 3.19Å; Y482-W485 AromaticContact CD1-CE2 3.65Å; Y482-W485 AromaticContact CD1-CZ2 3.62Å; Y482-W485 HydrophobicContact CD1-CZ2 3.62Å; Y482-W485 AromaticContact CD1-NE1 3.46Å; Y482-W485 HydrophobicContact CD2-CZ2 4.47Å; Y482-W485 AromaticContact CD2-NE1 3.89Å; Y482-W485 AromaticContact CE1-CE2 3.89Å; Y482-W485 HydrophobicContact CE1-CH2 4.13Å; Y482-W485 AromaticContact CE1-CZ2 3.32Å; Y482-W485 HydrophobicContact CE1-CZ2 3.32Å; Y482-W485 HydrophobicContact CE2-CZ2 4.24Å; Y482-W485 AromaticContact CG-CE2 3.99Å; Y482-W485 HydrophobicContact CG-CZ2 4.19Å; Y482-W485 AromaticContact CG-NE1 3.34Å; Y482-W485 VanDerWaalsContact CG-NE1 3.34Å; Y482-W485 AromaticContact CZ-CZ2 3.67Å
486	Y	94.8	Very high	92.9	Very high	30 Å²	30	77.3 Å²	77.3	12%	0.118	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.2	170.9	-73.3	-74.1	0	0	0	110.2	G471 I472 W484 D490 F506 H516	G471-Y486 CarbonylContact C-O 3.35Å; G471-Y486 WeakPolarHBondContact CA-O 3.49Å; I472-Y486 PolarHBondContact N-O 3.34Å; I472-Y486 PolarHBondContact O-N 2.99Å; W484-Y486 HydrophobicContact CB-CE2 4.29Å; W484-Y486 AromaticContact CD2-CD2 3.96Å; W484-Y486 HydrophobicContact CD2-CD2 3.96Å; W484-Y486 AromaticContact CD2-CE2 3.79Å; W484-Y486 HydrophobicContact CD2-CE2 3.79Å; W484-Y486 AromaticContact CE3-CD2 3.31Å; W484-Y486 HydrophobicContact CE3-CD2 3.31Å; W484-Y486 AromaticContact CE3-CE2 3.65Å; W484-Y486 HydrophobicContact CE3-CE2 3.65Å; W484-Y486 HydrophobicContact CE3-CG 4.44Å; W484-Y486 HydrophobicContact CG-CE2 4.1Å; W484-Y486 HydrophobicContact CH2-CD2 4.48Å; W484-Y486 AromaticContact CZ3-CD2 3.62Å; W484-Y486 HydrophobicContact CZ3-CD2 3.62Å; W484-Y486 HydrophobicContact CZ3-CE2 4.21Å; Y486-D490 HydrophobicContact CD1-CB 4.15Å; Y486-F506 VanDerWaalsContact CB-CD1 3.48Å; Y486-F506 HydrophobicContact CD1-CB 3.95Å; Y486-F506 HydrophobicContact CD1-CD1 4.24Å; Y486-F506 HydrophobicContact CD1-CG 4.24Å; Y486-F506 HydrophobicContact CD2-CB 4Å; Y486-F506 AromaticContact CD2-CD1 3.76Å; Y486-F506 HydrophobicContact CD2-CD1 3.76Å; Y486-F506 AromaticContact CD2-CD2 3.82Å; Y486-F506 HydrophobicContact CD2-CD2 3.82Å; Y486-F506 HydrophobicContact CD2-CE1 4.13Å; Y486-F506 HydrophobicContact CD2-CE2 4.19Å; Y486-F506 AromaticContact CD2-CG 3.58Å; Y486-F506 HydrophobicContact CD2-CG 3.58Å; Y486-F506 HydrophobicContact CD2-CZ 4.34Å; Y486-F506 HydrophobicContact CE1-CB 3.99Å; Y486-F506 HydrophobicContact CE2-CB 4.07Å; Y486-F506 HydrophobicContact CE2-CD2 4.07Å; Y486-F506 HydrophobicContact CE2-CG 4.01Å; Y486-F506 HydrophobicContact CG-CB 3.96Å; Y486-F506 AromaticContact CG-CD1 3.56Å; Y486-F506 HydrophobicContact CG-CD1 3.56Å; Y486-F506 HydrophobicContact CG-CD2 4.43Å; Y486-F506 HydrophobicContact CG-CE1 4.12Å; Y486-F506 AromaticContact CG-CG 3.73Å; Y486-F506 HydrophobicContact CG-CG 3.73Å; Y486-H516 AromaticContact CE2-ND1 3.42Å; Y486-H516 WeakPolarHBondContact CE2-ND1 3.38Å; Y486-H516 AromaticContact CZ-ND1 3.54Å; Y486-H516 PolarHBondContact OH-ND1 3.49Å
487	K	92.9	Very high	92.8	Very high	127 Å²	127	80.6 Å²	80.6	55%	0.552	41%	0.41	S	S	*	.			trans	-71.4	154.2	170.3	-62.4	-176.7	179.2	-175.4	0	109.1	S489 D490	K487-S489 WeakPolarHBondContact CB-OG 3.22Å; K487-S489 PolarHBondContact O-N 3.11Å; K487-S489 VanDerWaalsContact O-N 3.15Å; K487-D490 PolarHBondContact N-OD2 3.32Å; K487-D490 WeakPolarHBondContact O-CB 3.21Å; K487-D490 PolarHBondContact O-N 3.33Å
488	F	93.3	Very high	92.4	Very high	14 Å²	14	79.3 Å²	79.3	6%	0.061	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-55	-32.4	170.9	-68.8	-67.2	0	0	0	112.9	D467 I472 D490 L491 Y535 L536 R539	D467-F488 VanDerWaalsContact O-CE2 3.31Å; D467-F488 WeakPolarHBondContact O-CE2 3.3Å; I472-F488 HydrophobicContact CD1-CD1 3.95Å; I472-F488 HydrophobicContact CD1-CE1 4Å; I472-F488 HydrophobicContact CG1-CD1 3.8Å; I472-F488 HydrophobicContact CG1-CE1 3.54Å; I472-F488 HydrophobicContact CG1-CZ 4.34Å; F488-D490 PolarHBondContact O-N 2.79Å; F488-L491 WeakPolarHBondContact O-CB 3.48Å; F488-L491 PolarHBondContact O-N 3.07Å; F488-Y535 HydrophobicContact CE2-CD1 4.34Å; F488-Y535 AromaticContact CZ-CD1 3.79Å; F488-Y535 HydrophobicContact CZ-CD1 3.79Å; F488-Y535 HydrophobicContact CZ-CG 4.09Å; F488-L536 HydrophobicContact CB-CD2 3.99Å; F488-L536 HydrophobicContact CD1-CD2 3.75Å; F488-L536 HydrophobicContact CD1-CG 4.41Å; F488-L536 HydrophobicContact CG-CD2 4.22Å; F488-R539 HydrophobicContact CB-CG 4.23Å; F488-R539 HydrophobicContact CD2-CB 4.14Å; F488-R539 HydrophobicContact CD2-CG 3.95Å; F488-R539 HydrophobicContact CG-CG 4.43Å
489	S	90.1	Very high	92.2	Very high	96 Å²	96	83.5 Å²	83.5	67%	0.671	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-66.2	-18.8	175	60.8	0	0	0	0	114.3	K487	K487-S489 WeakPolarHBondContact CB-OG 3.22Å; K487-S489 PolarHBondContact O-N 3.11Å; K487-S489 VanDerWaalsContact O-N 3.15Å
490	D	92.2	Very high	92.1	Very high	18 Å²	18	84 Å²	84	10%	0.096	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-89.7	-11.1	-179.2	-57.6	-25.8	0	0	0	111.2	Y486 K487 F488 R492 F506 Y507 K509	Y486-D490 HydrophobicContact CD1-CB 4.15Å; K487-D490 PolarHBondContact N-OD2 3.32Å; K487-D490 WeakPolarHBondContact O-CB 3.21Å; K487-D490 PolarHBondContact O-N 3.33Å; F488-D490 PolarHBondContact O-N 2.79Å; D490-R492 PolarHBondContact O-N 2.88Å; D490-F506 CarbonylContact O-C 3.52Å; D490-F506 WeakPolarHBondContact O-CA 3.31Å; D490-Y507 PolarHBondContact O-N 2.81Å; D490-K509 VanDerWaalsContact CG-NZ 3.3Å; D490-K509 WeakPolarHBondContact OD1-CE 3.23Å; D490-K509 IonicContact OD1-NZ 2.77Å; D490-K509 PolarHBondContact OD1-NZ 3.43Å; D490-K509 IonicContact OD2-NZ 2.63Å; D490-K509 PolarHBondContact OD2-NZ 2.82Å; D490-K509 VanDerWaalsContact OD2-NZ 3.14Å
491	L	93.3	Very high	92.1	Very high	27 Å²	27	83.7 Å²	83.7	14%	0.141	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	115.5	174.3	-175.4	67.7	0	0	0	110	I472 F488 T494 L504 F506 L532 L536	I472-L491 HydrophobicContact CD1-CD2 4.06Å; F488-L491 WeakPolarHBondContact O-CB 3.48Å; F488-L491 PolarHBondContact O-N 3.07Å; L491-T494 HydrophobicContact CD1-CG2 4.04Å; L491-T494 HydrophobicContact CD2-CG2 3.7Å; L491-T494 HydrophobicContact CG-CG2 4.11Å; L491-L504 HydrophobicContact CD1-CB 4.21Å; L491-L504 HydrophobicContact CD1-CD2 4.34Å; L491-F506 HydrophobicContact CB-CD1 4.26Å; L491-F506 HydrophobicContact CB-CE1 4.14Å; L491-F506 HydrophobicContact CD1-CD1 4.04Å; L491-F506 HydrophobicContact CD1-CE1 3.63Å; L491-F506 HydrophobicContact CD1-CZ 3.93Å; L491-F506 HydrophobicContact CG-CE1 4.47Å; L491-L532 HydrophobicContact CD2-CD1 4.27Å; L491-L536 HydrophobicContact CD2-CD1 4.24Å; L491-L536 HydrophobicContact CD2-CD2 4.29Å
492	R	90.4	Very high	92.1	Very high	166 Å²	166	77.1 Å²	77.1	63%	0.626	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	-45.1	-177.5	-77	-75.1	-170.9	164.9	1.6	112.7	D490 V505	D490-R492 PolarHBondContact O-N 2.88Å; R492-V505 HydrophobicContact CB-CG1 4.41Å; R492-V505 PolarHBondContact N-O 2.94Å
493	S	91.8	Very high	92.1	Very high	60 Å²	60	75.1 Å²	75.1	42%	0.42	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	152.9	-178.6	56.9	0	0	0	0	110.7	V505	S493-V505 PolarHBondContact O-N 3.37Å; S493-V505 WeakPolarHBondContact OG-CB 3.37Å; S493-V505 WeakPolarHBondContact OG-CG2 3.21Å
494	T	93.2	Very high	92.2	Very high	64 Å²	64	70.6 Å²	70.6	39%	0.393	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.6	175.6	55.8	0	0	0	0	107.9	L491 Q503 L504 L532	L491-T494 HydrophobicContact CD1-CG2 4.04Å; L491-T494 HydrophobicContact CD2-CG2 3.7Å; L491-T494 HydrophobicContact CG-CG2 4.11Å; T494-Q503 WeakPolarHBondContact CA-O 3.46Å; T494-L504 HydrophobicContact CG2-CD2 3.81Å; T494-L532 HydrophobicContact CG2-CD2 3.82Å
495	A	93	Very high	92.2	Very high	46 Å²	46	69 Å²	69	38%	0.38	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.4	170.7	0	0	0	0	0	109.1	V502 Q503	A495-V502 CarbonylContact O-C 3.58Å; A495-V502 WeakPolarHBondContact O-CA 3.36Å; A495-Q503 HydrophobicContact CB-CB 4.33Å; A495-Q503 PolarHBondContact N-O 3.31Å; A495-Q503 PolarHBondContact O-N 3.47Å
496	D	92	Very high	92.1	Very high	89 Å²	89	64.5 Å²	64.5	48%	0.476	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.9	178.1	69	96.1	0	0	0	110.4	G498 R501 L525	D496-G498 WeakPolarHBondContact OD1-CA 3.49Å; D496-G498 PolarHBondContact OD1-N 3.47Å; D496-R501 VanDerWaalsContact CA-O 3.26Å; D496-R501 WeakPolarHBondContact CA-O 3.08Å; D496-L525 HydrophobicContact CB-CD1 4.27Å; D496-L525 HydrophobicContact CB-CD2 4.24Å
497	D	90.3	Very high	91.8	Very high	79 Å²	79	66.9 Å²	66.9	42%	0.422	34%	0.343	S	S	.	.			trans	-95.7	5.6	176.2	73.3	-7.8	0	0	0	113.4	K499 L500 R501	D497-K499 PolarHBondContact O-N 2.82Å; D497-K499 WeakPolarHBondContact OD1-CA 3.24Å; D497-K499 PolarHBondContact OD1-N 3.33Å; D497-L500 PolarHBondContact OD1-N 3.1Å; D497-R501 HydrophobicContact CB-CB 4.43Å; D497-R501 PolarHBondContact N-O 3.38Å; D497-R501 PolarHBondContact OD1-N 2.96Å; D497-R501 PolarHBondContact OD2-N 3.16Å
498	G	85	Confident	91.3	Very high	46 Å²	46	62.2 Å²	62.2	47%	0.474	32%	0.324	S	S	.	.	S	Bend	trans	66.2	5	-175.1	0	0	0	0	0	115.3	D496	D496-G498 WeakPolarHBondContact OD1-CA 3.49Å; D496-G498 PolarHBondContact OD1-N 3.47Å
499	K	87.2	Confident	90.4	Very high	169 Å²	169	67.6 Å²	67.6	74%	0.735	35%	0.347	S	S	*	.	S	Bend	trans	-125.2	-60.8	-175.8	-65.9	-178.1	-179.3	179.4	0	113.2	D497	D497-K499 PolarHBondContact O-N 2.82Å; D497-K499 WeakPolarHBondContact OD1-CA 3.24Å; D497-K499 PolarHBondContact OD1-N 3.33Å
500	L	91.7	Very high	89.5	Confident	87 Å²	87	74.1 Å²	74.1	46%	0.455	36%	0.357	S	S	.	.	S	Bend	trans	-144.1	-32.4	-169.1	-90.4	153.3	0	0	0	113.1	D497 D521 C522 T523	D497-L500 PolarHBondContact OD1-N 3.1Å; L500-D521 CarbonylContact O-C 3.59Å; L500-D521 WeakPolarHBondContact O-CA 3.42Å; L500-C522 PolarHBondContact O-N 3.3Å; L500-T523 HydrophobicContact CD2-CG2 4.39Å
501	R	93	Very high	88.2	Confident	152 Å²	152	75.5 Å²	75.5	57%	0.574	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.9	-170	-58.6	-154.9	158.6	152	-0.3	111.8	D496 D497 L520 D521	D496-R501 VanDerWaalsContact CA-O 3.26Å; D496-R501 WeakPolarHBondContact CA-O 3.08Å; D497-R501 HydrophobicContact CB-CB 4.43Å; D497-R501 PolarHBondContact N-O 3.38Å; D497-R501 PolarHBondContact OD1-N 2.96Å; D497-R501 PolarHBondContact OD2-N 3.16Å; R501-L520 WeakPolarHBondContact CA-O 3.36Å; R501-D521 WeakPolarHBondContact CD-OD1 3.34Å; R501-D521 VanDerWaalsContact CG-OD1 3.23Å; R501-D521 WeakPolarHBondContact CG-OD1 3.43Å; R501-D521 IonicContact CZ-OD1 2.84Å; R501-D521 IonicContact NE-OD1 3.22Å; R501-D521 PolarHBondContact NE-OD1 3.28Å; R501-D521 IonicContact NH2-OD2 3.49Å
502	V	94.1	Very high	86.7	Confident	4 Å²	4	83 Å²	83	2%	0.024	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	136	167.8	65.4	0	0	0	0	110.2	A495 L504 N519 L520 L525 L528	A495-V502 CarbonylContact O-C 3.58Å; A495-V502 WeakPolarHBondContact O-CA 3.36Å; V502-L504 HydrophobicContact CG2-CD2 3.89Å; V502-L504 HydrophobicContact CG2-CG 4.3Å; V502-N519 WeakPolarHBondContact O-CA 3.37Å; V502-L520 HydrophobicContact CG1-CB 3.9Å; V502-L520 PolarHBondContact N-O 3.19Å; V502-L520 PolarHBondContact O-N 3.44Å; V502-L525 HydrophobicContact CB-CD1 3.68Å; V502-L525 HydrophobicContact CG1-CD1 4.38Å; V502-L525 HydrophobicContact CG2-CD1 4.44Å; V502-L528 HydrophobicContact CG1-CD2 4.5Å; V502-L528 HydrophobicContact CG2-CD2 4.42Å
503	Q	94.6	Very high	85.4	Confident	75 Å²	75	82 Å²	82	35%	0.35	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.6	171.9	178.9	175.2	89.5	0	0	109.4	T494 A495 V505 V517 V518 N519	T494-Q503 WeakPolarHBondContact CA-O 3.46Å; A495-Q503 HydrophobicContact CB-CB 4.33Å; A495-Q503 PolarHBondContact N-O 3.31Å; A495-Q503 PolarHBondContact O-N 3.47Å; Q503-V505 HydrophobicContact CG-CG2 4.31Å; Q503-V517 HydrophobicContact CG-CG1 3.72Å; Q503-V518 CarbonylContact C-O 3.46Å; Q503-V518 WeakPolarHBondContact CA-O 3.41Å; Q503-N519 WeakPolarHBondContact CG-OD1 3.29Å; Q503-N519 PolarHBondContact NE2-OD1 3.48Å
504	L	94.7	Very high	84.8	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.6	176.1	-55.5	177.2	0	0	0	109.1	L464 L491 T494 V502 F506 V518 L532	L464-L504 HydrophobicContact CD1-CD1 4.2Å; L464-L504 HydrophobicContact CD2-CD1 3.91Å; L491-L504 HydrophobicContact CD1-CB 4.21Å; L491-L504 HydrophobicContact CD1-CD2 4.34Å; T494-L504 HydrophobicContact CG2-CD2 3.81Å; V502-L504 HydrophobicContact CG2-CD2 3.89Å; V502-L504 HydrophobicContact CG2-CG 4.3Å; L504-F506 HydrophobicContact CB-CD2 4.38Å; L504-F506 HydrophobicContact CB-CE2 3.54Å; L504-F506 HydrophobicContact CB-CZ 3.88Å; L504-F506 HydrophobicContact CD1-CE2 4.29Å; L504-F506 HydrophobicContact CD1-CZ 4.09Å; L504-V518 HydrophobicContact CB-CB 4.48Å; L504-V518 PolarHBondContact N-O 3.13Å; L504-V518 PolarHBondContact O-N 3.39Å; L504-L532 HydrophobicContact CD2-CD2 4.14Å
505	V	94	Very high	84.4	Confident	6 Å²	6	87.7 Å²	87.7	4%	0.036	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	119.5	179.5	-175.2	0	0	0	0	109.2	R492 S493 Q503 Q515 V517	R492-V505 HydrophobicContact CB-CG1 4.41Å; R492-V505 PolarHBondContact N-O 2.94Å; S493-V505 PolarHBondContact O-N 3.37Å; S493-V505 WeakPolarHBondContact OG-CB 3.37Å; S493-V505 WeakPolarHBondContact OG-CG2 3.21Å; Q503-V505 HydrophobicContact CG-CG2 4.31Å; V505-Q515 HydrophobicContact CG1-CB 3.93Å; V505-Q515 HydrophobicContact CG1-CG 4.22Å; V505-V517 HydrophobicContact CG1-CG2 4.3Å; V505-V517 HydrophobicContact CG2-CG1 4.38Å; V505-V517 HydrophobicContact CG2-CG2 4.23Å
506	F	93.1	Very high	84.3	Confident	0 Å²	0	88.4 Å²	88.4	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	144.2	-179.8	-60.1	-83.5	0	0	0	111.8	I472 W484 Y486 D490 L491 L504 N508 Q515 H516 V518	I472-F506 HydrophobicContact CB-CE1 4.39Å; I472-F506 HydrophobicContact CB-CZ 4.4Å; I472-F506 HydrophobicContact CD1-CE1 4.06Å; I472-F506 HydrophobicContact CD1-CZ 4.26Å; I472-F506 HydrophobicContact CG2-CZ 4.17Å; W484-F506 AromaticContact CH2-CE2 3.78Å; W484-F506 HydrophobicContact CH2-CE2 3.78Å; W484-F506 HydrophobicContact CH2-CZ 4.11Å; W484-F506 HydrophobicContact CZ3-CE2 4.1Å; W484-F506 HydrophobicContact CZ3-CZ 4.13Å; Y486-F506 VanDerWaalsContact CB-CD1 3.48Å; Y486-F506 HydrophobicContact CD1-CB 3.95Å; Y486-F506 HydrophobicContact CD1-CD1 4.24Å; Y486-F506 HydrophobicContact CD1-CG 4.24Å; Y486-F506 HydrophobicContact CD2-CB 4Å; Y486-F506 AromaticContact CD2-CD1 3.76Å; Y486-F506 HydrophobicContact CD2-CD1 3.76Å; Y486-F506 AromaticContact CD2-CD2 3.82Å; Y486-F506 HydrophobicContact CD2-CD2 3.82Å; Y486-F506 HydrophobicContact CD2-CE1 4.13Å; Y486-F506 HydrophobicContact CD2-CE2 4.19Å; Y486-F506 AromaticContact CD2-CG 3.58Å; Y486-F506 HydrophobicContact CD2-CG 3.58Å; Y486-F506 HydrophobicContact CD2-CZ 4.34Å; Y486-F506 HydrophobicContact CE1-CB 3.99Å; Y486-F506 HydrophobicContact CE2-CB 4.07Å; Y486-F506 HydrophobicContact CE2-CD2 4.07Å; Y486-F506 HydrophobicContact CE2-CG 4.01Å; Y486-F506 HydrophobicContact CG-CB 3.96Å; Y486-F506 AromaticContact CG-CD1 3.56Å; Y486-F506 HydrophobicContact CG-CD1 3.56Å; Y486-F506 HydrophobicContact CG-CD2 4.43Å; Y486-F506 HydrophobicContact CG-CE1 4.12Å; Y486-F506 AromaticContact CG-CG 3.73Å; Y486-F506 HydrophobicContact CG-CG 3.73Å; D490-F506 CarbonylContact O-C 3.52Å; D490-F506 WeakPolarHBondContact O-CA 3.31Å; L491-F506 HydrophobicContact CB-CD1 4.26Å; L491-F506 HydrophobicContact CB-CE1 4.14Å; L491-F506 HydrophobicContact CD1-CD1 4.04Å; L491-F506 HydrophobicContact CD1-CE1 3.63Å; L491-F506 HydrophobicContact CD1-CZ 3.93Å; L491-F506 HydrophobicContact CG-CE1 4.47Å; L504-F506 HydrophobicContact CB-CD2 4.38Å; L504-F506 HydrophobicContact CB-CE2 3.54Å; L504-F506 HydrophobicContact CB-CZ 3.88Å; L504-F506 HydrophobicContact CD1-CE2 4.29Å; L504-F506 HydrophobicContact CD1-CZ 4.09Å; F506-N508 PolarHBondContact O-N 2.85Å; F506-Q515 WeakPolarHBondContact O-CA 3.15Å; F506-H516 HydrophobicContact CB-CB 4.44Å; F506-H516 PolarHBondContact N-O 3.24Å; F506-H516 PolarHBondContact O-N 3.46Å; F506-V518 HydrophobicContact CD2-CG2 4.06Å; F506-V518 HydrophobicContact CE2-CG2 4.01Å
507	Y	88.3	Confident	84.2	Confident	79 Å²	79	87.2 Å²	87.2	31%	0.31	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	117.7	167.1	-179.7	-106.2	0	0	0	110	D490 K509	D490-Y507 PolarHBondContact O-N 2.81Å; Y507-K509 HydrophobicContact CD1-CG 4.01Å; Y507-K509 HydrophobicContact CE1-CG 3.89Å; Y507-K509 PolarHBondContact O-N 2.84Å
508	N	82.7	Confident	84.3	Confident	29 Å²	29	83.7 Å²	83.7	16%	0.155	40%	0.397	C	S	.	.			trans	-88.8	108.1	179.2	-169.6	-3.3	0	0	0	110.8	F506 R510 E514	F506-N508 PolarHBondContact O-N 2.85Å; N508-R510 PolarHBondContact O-N 3.41Å; N508-R510 WeakPolarHBondContact OD1-CB 2.81Å; N508-R510 PolarHBondContact OD1-N 3.14Å; N508-E514 VanDerWaalsContact CB-O 3.29Å; N508-E514 WeakPolarHBondContact CB-O 3.48Å; N508-E514 PolarHBondContact N-O 2.8Å
509	K	73.7	Confident	84.7	Confident	127 Å²	127	85.6 Å²	85.6	55%	0.552	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.5	175.9	-70.2	174.5	-177.7	140.3	0	113.8	D490 Y507	D490-K509 VanDerWaalsContact CG-NZ 3.3Å; D490-K509 WeakPolarHBondContact OD1-CE 3.23Å; D490-K509 IonicContact OD1-NZ 2.77Å; D490-K509 PolarHBondContact OD1-NZ 3.43Å; D490-K509 IonicContact OD2-NZ 2.63Å; D490-K509 PolarHBondContact OD2-NZ 2.82Å; D490-K509 VanDerWaalsContact OD2-NZ 3.14Å; Y507-K509 HydrophobicContact CD1-CG 4.01Å; Y507-K509 HydrophobicContact CE1-CG 3.89Å; Y507-K509 PolarHBondContact O-N 2.84Å
510	R	71.7	Confident	85	Confident	234 Å²	234	77.6 Å²	77.6	88%	0.883	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-19.7	-175	-62.9	-178.3	178.1	174.2	0.2	113.2	N508	N508-R510 PolarHBondContact O-N 3.41Å; N508-R510 WeakPolarHBondContact OD1-CB 2.81Å; N508-R510 PolarHBondContact OD1-N 3.14Å
511	C	64.5	Low	85.1	Confident	47 Å²	47	75.7 Å²	75.7	32%	0.318	35%	0.352	S	S	.	.	S	Bend	trans	-127.8	109.9	179	-63.7	0	0	0	0	107.8	N513 E514	C511-N513 PolarHBondContact O-N 3.36Å; C511-E514 HydrophobicContact CB-CB 3.82Å; C511-E514 HydrophobicContact CB-CG 3.94Å; C511-E514 VanDerWaalsContact CB-OE2 3.24Å; C511-E514 WeakPolarHBondContact CB-OE2 3.46Å; C511-E514 PolarHBondContact O-N 3.23Å; C511-E514 PolarHBondContact SG-OE2 2.85Å
512	E	61	Low	85.2	Confident	183 Å²	183	68.6 Å²	68.6	86%	0.855	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	116.9	176.8	-73.7	-175.5	160.6	0	0	109.9
513	N	63.8	Low	84.9	Confident	147 Å²	147	74.5 Å²	74.5	79%	0.786	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	7.4	178.1	-55.3	-32.5	0	0	0	118.8	C511	C511-N513 PolarHBondContact O-N 3.36Å
514	E	78.6	Confident	84.8	Confident	116 Å²	116	73.4 Å²	73.4	54%	0.542	36%	0.359	S	S	.	.			trans	-92.2	136.4	174	-64.9	-174.8	159.2	0	0	112.7	N508 C511	N508-E514 VanDerWaalsContact CB-O 3.29Å; N508-E514 WeakPolarHBondContact CB-O 3.48Å; N508-E514 PolarHBondContact N-O 2.8Å; C511-E514 HydrophobicContact CB-CB 3.82Å; C511-E514 HydrophobicContact CB-CG 3.94Å; C511-E514 VanDerWaalsContact CB-OE2 3.24Å; C511-E514 WeakPolarHBondContact CB-OE2 3.46Å; C511-E514 PolarHBondContact O-N 3.23Å; C511-E514 PolarHBondContact SG-OE2 2.85Å
515	Q	86.3	Confident	84.8	Confident	127 Å²	127	73.6 Å²	73.6	59%	0.593	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.3	170.5	-66	-177.8	-2.2	0	0	109.2	V505 F506	V505-Q515 HydrophobicContact CG1-CB 3.93Å; V505-Q515 HydrophobicContact CG1-CG 4.22Å; F506-Q515 WeakPolarHBondContact O-CA 3.15Å
516	H	89.2	Confident	84.7	Confident	60 Å²	60	77.5 Å²	77.5	28%	0.278	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	108.1	170	-177.7	-163.6	0	0	0	108.6	W484 Y486 F506	W484-H516 AromaticContact CD1-CE1 3.8Å; W484-H516 AromaticContact NE1-CE1 3.59Å; Y486-H516 AromaticContact CE2-ND1 3.42Å; Y486-H516 WeakPolarHBondContact CE2-ND1 3.38Å; Y486-H516 AromaticContact CZ-ND1 3.54Å; Y486-H516 PolarHBondContact OH-ND1 3.49Å; F506-H516 HydrophobicContact CB-CB 4.44Å; F506-H516 PolarHBondContact N-O 3.24Å; F506-H516 PolarHBondContact O-N 3.46Å
517	V	91.2	Very high	84.8	Confident	64 Å²	64	81.4 Å²	81.4	39%	0.388	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.5	177.5	-175.9	0	0	0	0	108.7	Q503 V505	Q503-V517 HydrophobicContact CG-CG1 3.72Å; V505-V517 HydrophobicContact CG1-CG2 4.3Å; V505-V517 HydrophobicContact CG2-CG1 4.38Å; V505-V517 HydrophobicContact CG2-CG2 4.23Å
518	V	91.6	Very high	85.2	Confident	6 Å²	6	77.7 Å²	77.7	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.2	179.8	-174.6	0	0	0	0	107.8	W484 Q503 L504 F506 L520	W484-V518 HydrophobicContact CH2-CG1 4.48Å; W484-V518 HydrophobicContact CH2-CG2 4.17Å; W484-V518 HydrophobicContact CZ2-CB 4.26Å; W484-V518 HydrophobicContact CZ2-CG1 3.82Å; W484-V518 HydrophobicContact CZ2-CG2 3.57Å; Q503-V518 CarbonylContact C-O 3.46Å; Q503-V518 WeakPolarHBondContact CA-O 3.41Å; L504-V518 HydrophobicContact CB-CB 4.48Å; L504-V518 PolarHBondContact N-O 3.13Å; L504-V518 PolarHBondContact O-N 3.39Å; F506-V518 HydrophobicContact CD2-CG2 4.06Å; F506-V518 HydrophobicContact CE2-CG2 4.01Å; V518-L520 HydrophobicContact CG1-CD1 4.14Å; V518-L520 HydrophobicContact CG1-CD2 3.78Å; V518-L520 HydrophobicContact CG1-CG 3.79Å
519	N	93.2	Very high	85.7	Confident	86 Å²	86	77.7 Å²	77.7	46%	0.46	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.7	173.6	-58.3	-61.7	0	0	0	108.6	N457 V502 Q503	N457-N519 PolarHBondContact OD1-O 3.36Å; V502-N519 WeakPolarHBondContact O-CA 3.37Å; Q503-N519 WeakPolarHBondContact CG-OD1 3.29Å; Q503-N519 PolarHBondContact NE2-OD1 3.48Å
520	L	94.4	Very high	86.8	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.1	-177.7	-57.4	174.7	0	0	0	110.1	C455 A456 N457 L464 F474 R501 V502 V518	C455-L520 HydrophobicContact CB-CB 4.29Å; A456-L520 WeakPolarHBondContact O-CA 3.3Å; N457-L520 HydrophobicContact CB-CD2 3.81Å; L464-L520 HydrophobicContact CB-CD1 4.38Å; L464-L520 HydrophobicContact CD1-CD1 3.92Å; L464-L520 HydrophobicContact CD2-CD1 4.21Å; L464-L520 HydrophobicContact CG-CD1 4.41Å; F474-L520 HydrophobicContact CD2-CD1 4.38Å; F474-L520 HydrophobicContact CD2-CD2 4.28Å; F474-L520 HydrophobicContact CE2-CD1 4.17Å; F474-L520 HydrophobicContact CE2-CD2 3.42Å; F474-L520 VanDerWaalsContact CE2-CD2 3.42Å; F474-L520 HydrophobicContact CE2-CG 4.46Å; F474-L520 HydrophobicContact CZ-CD2 3.71Å; R501-L520 WeakPolarHBondContact CA-O 3.36Å; V502-L520 HydrophobicContact CG1-CB 3.9Å; V502-L520 PolarHBondContact N-O 3.19Å; V502-L520 PolarHBondContact O-N 3.44Å; V518-L520 HydrophobicContact CG1-CD1 4.14Å; V518-L520 HydrophobicContact CG1-CD2 3.78Å; V518-L520 HydrophobicContact CG1-CG 3.79Å
521	D	94.5	Very high	88	Confident	47 Å²	47	62 Å²	62	25%	0.251	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.2	168	-64.8	-18.9	0	0	0	108.3	C455 A456 L500 R501	C455-D521 CarbonylContact C-O 3.59Å; C455-D521 WeakPolarHBondContact CA-O 3.45Å; C455-D521 WeakPolarHBondContact CB-O 3.23Å; A456-D521 HydrophobicContact CB-CB 4.38Å; A456-D521 PolarHBondContact N-O 3.41Å; A456-D521 PolarHBondContact O-N 3.22Å; L500-D521 CarbonylContact O-C 3.59Å; L500-D521 WeakPolarHBondContact O-CA 3.42Å; R501-D521 WeakPolarHBondContact CD-OD1 3.34Å; R501-D521 VanDerWaalsContact CG-OD1 3.23Å; R501-D521 WeakPolarHBondContact CG-OD1 3.43Å; R501-D521 IonicContact CZ-OD1 2.84Å; R501-D521 IonicContact NE-OD1 3.22Å; R501-D521 PolarHBondContact NE-OD1 3.28Å; R501-D521 IonicContact NH2-OD2 3.49Å
522	C	93.7	Very high	89.5	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.014	30%	0.304	C	S	.	.			trans	-130.6	123.5	-179.4	-176.3	0	0	0	0	109.8	L500 D524 L528	L500-C522 PolarHBondContact O-N 3.3Å; C522-D524 PolarHBondContact O-N 3.17Å; C522-L528 HydrophobicContact CB-CD1 4.02Å
523	T	88.9	Confident	91.1	Very high	129 Å²	129	53.8 Å²	53.8	79%	0.791	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.5	179.8	52.1	0	0	0	0	113.3	L500	L500-T523 HydrophobicContact CD2-CG2 4.39Å
524	D	92.5	Very high	92.6	Very high	52 Å²	52	47 Å²	47	28%	0.278	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	47.2	177.6	-162.9	5.8	0	0	0	110.9	C522 I526 R527 L528	C522-D524 PolarHBondContact O-N 3.17Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 2.81Å; D524-R527 VanDerWaalsContact CG-CB 3.45Å; D524-R527 PolarHBondContact O-N 2.84Å; D524-R527 WeakPolarHBondContact OD1-CB 3.38Å; D524-R527 IonicContact OD1-NH1 3.59Å; D524-R527 WeakPolarHBondContact OD2-CB 3.17Å; D524-R527 VanDerWaalsContact OD2-CD 3.3Å; D524-R527 WeakPolarHBondContact OD2-CD 3.06Å; D524-R527 IonicContact OD2-CZ 3.94Å; D524-R527 IonicContact OD2-NE 2.67Å; D524-R527 IonicContact OD2-NH1 3.4Å; D524-R527 PolarHBondContact OD2-NH1 3.44Å; D524-L528 PolarHBondContact O-N 3.43Å
525	L	93.3	Very high	93.5	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-56.3	-44.1	-174.2	175.7	65.5	0	0	0	112.4	D496 V502 L528 V529	D496-L525 HydrophobicContact CB-CD1 4.27Å; D496-L525 HydrophobicContact CB-CD2 4.24Å; V502-L525 HydrophobicContact CB-CD1 3.68Å; V502-L525 HydrophobicContact CG1-CD1 4.38Å; V502-L525 HydrophobicContact CG2-CD1 4.44Å; L525-L528 WeakPolarHBondContact O-CB 3.37Å; L525-L528 PolarHBondContact O-N 3.13Å; L525-V529 HydrophobicContact CD1-CG2 4.31Å; L525-V529 WeakPolarHBondContact O-CG2 3.3Å; L525-V529 PolarHBondContact O-N 2.79Å
526	I	93.2	Very high	93.9	Very high	89 Å²	89	37.5 Å²	37.5	46%	0.456	20%	0.197	S	C	.	.	H	α-helix	trans	-60.1	-52.6	-178	-60.8	175.3	0	0	0	109.2	V415 D524 L528 V529 F530	V415-I526 HydrophobicContact CG2-CG2 4.12Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 2.81Å; I526-L528 VanDerWaalsContact C-N 3.28Å; I526-L528 PolarHBondContact O-N 3.19Å; I526-V529 PolarHBondContact O-N 3.4Å; I526-V529 VanDerWaalsContact O-N 3.12Å; I526-F530 HydrophobicContact CG2-CD2 3.92Å; I526-F530 HydrophobicContact CG2-CE2 3.81Å; I526-F530 WeakPolarHBondContact O-CD2 3.42Å; I526-F530 PolarHBondContact O-N 2.87Å; I526-F530 VanDerWaalsContact O-N 3.11Å
527	R	95.1	Very high	94.1	Very high	82 Å²	82	36.6 Å²	36.6	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-59.7	-40	177.6	-171.2	-179.8	-83.9	128.7	-6.3	111.7	E391 V415 F453 D524 V529 F530 Y531	E391-R527 IonicContact OE1-CZ 3.85Å; E391-R527 IonicContact OE1-NE 3.14Å; E391-R527 PolarHBondContact OE1-NE 2.91Å; E391-R527 IonicContact OE1-NH2 3.78Å; E391-R527 PolarHBondContact OE1-NH2 3.49Å; E391-R527 VanDerWaalsContact OE1-NH2 3.11Å; V415-R527 HydrophobicContact CG2-CB 3.84Å; V415-R527 HydrophobicContact CG2-CG 4.27Å; F453-R527 HydrophobicContact CE1-CB 4.17Å; F453-R527 HydrophobicContact CE1-CG 3.98Å; F453-R527 HydrophobicContact CZ-CG 4.22Å; D524-R527 VanDerWaalsContact CG-CB 3.45Å; D524-R527 PolarHBondContact O-N 2.84Å; D524-R527 WeakPolarHBondContact OD1-CB 3.38Å; D524-R527 IonicContact OD1-NH1 3.59Å; D524-R527 WeakPolarHBondContact OD2-CB 3.17Å; D524-R527 VanDerWaalsContact OD2-CD 3.3Å; D524-R527 WeakPolarHBondContact OD2-CD 3.06Å; D524-R527 IonicContact OD2-CZ 3.94Å; D524-R527 IonicContact OD2-NE 2.67Å; D524-R527 IonicContact OD2-NH1 3.4Å; D524-R527 PolarHBondContact OD2-NH1 3.44Å; R527-V529 VanDerWaalsContact C-N 3.32Å; R527-V529 PolarHBondContact O-N 2.75Å; R527-F530 PolarHBondContact O-N 2.78Å; R527-Y531 HydrophobicContact CG-CD2 3.64Å; R527-Y531 HydrophobicContact CG-CE2 3.52Å; R527-Y531 VanDerWaalsContact O-CD2 3.27Å; R527-Y531 WeakPolarHBondContact O-CD2 3.34Å; R527-Y531 PolarHBondContact O-N 3.44Å
528	L	95.4	Very high	94.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-55.8	-46	175.4	-176.8	158.9	0	0	0	111.8	F453 L464 F466 V502 C522 D524 L525 I526 Y531 L532	F453-L528 HydrophobicContact CB-CD1 4.02Å; F453-L528 HydrophobicContact CD1-CB 3.91Å; F453-L528 HydrophobicContact CD1-CD1 4.48Å; F453-L528 HydrophobicContact CD1-CG 4.42Å; F453-L528 HydrophobicContact CD2-CB 4.33Å; F453-L528 HydrophobicContact CD2-CD1 4.37Å; F453-L528 HydrophobicContact CD2-CG 4.1Å; F453-L528 HydrophobicContact CE1-CB 3.94Å; F453-L528 HydrophobicContact CE2-CB 4.35Å; F453-L528 HydrophobicContact CE2-CG 4.39Å; F453-L528 HydrophobicContact CG-CB 4.12Å; F453-L528 HydrophobicContact CG-CD1 4.04Å; F453-L528 HydrophobicContact CG-CG 4.12Å; F453-L528 VanDerWaalsContact CZ-CA 3.48Å; F453-L528 HydrophobicContact CZ-CB 4.18Å; L464-L528 HydrophobicContact CD2-CD1 3.97Å; L464-L528 HydrophobicContact CD2-CD2 4.48Å; L464-L528 HydrophobicContact CD2-CG 4.46Å; F466-L528 HydrophobicContact CE2-CG 4.39Å; F466-L528 HydrophobicContact CZ-CD2 4.21Å; F466-L528 HydrophobicContact CZ-CG 4.18Å; V502-L528 HydrophobicContact CG1-CD2 4.5Å; V502-L528 HydrophobicContact CG2-CD2 4.42Å; C522-L528 HydrophobicContact CB-CD1 4.02Å; D524-L528 PolarHBondContact O-N 3.43Å; L525-L528 WeakPolarHBondContact O-CB 3.37Å; L525-L528 PolarHBondContact O-N 3.13Å; I526-L528 VanDerWaalsContact C-N 3.28Å; I526-L528 PolarHBondContact O-N 3.19Å; L528-Y531 PolarHBondContact O-N 2.59Å; L528-L532 VanDerWaalsContact O-CB 3.3Å; L528-L532 WeakPolarHBondContact O-CB 3.18Å; L528-L532 PolarHBondContact O-N 2.87Å
529	V	94.3	Very high	94.3	Very high	30 Å²	30	38 Å²	38	18%	0.182	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-44	178.5	172.7	0	0	0	0	111.4	L525 I526 R527 L532 H533	L525-V529 HydrophobicContact CD1-CG2 4.31Å; L525-V529 WeakPolarHBondContact O-CG2 3.3Å; L525-V529 PolarHBondContact O-N 2.79Å; I526-V529 PolarHBondContact O-N 3.4Å; I526-V529 VanDerWaalsContact O-N 3.12Å; R527-V529 VanDerWaalsContact C-N 3.32Å; R527-V529 PolarHBondContact O-N 2.75Å; V529-L532 PolarHBondContact O-N 3.34Å; V529-H533 PolarHBondContact O-N 2.75Å
530	F	95.9	Very high	94.1	Very high	22 Å²	22	38.4 Å²	38.4	10%	0.096	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-46.8	176.7	-87	-92.8	0	0	0	112	R393 E413 T414 V415 I526 R527 H533 A534	R393-F530 HydrophobicContact CB-CD1 4.17Å; R393-F530 HydrophobicContact CB-CE1 3.72Å; E413-F530 HydrophobicContact CB-CE1 4.39Å; E413-F530 HydrophobicContact CB-CZ 4.15Å; E413-F530 WeakPolarHBondContact O-CE1 3.48Å; T414-F530 VanDerWaalsContact C-CZ 3.42Å; T414-F530 WeakPolarHBondContact O-CZ 3.38Å; V415-F530 HydrophobicContact CB-CD2 4.44Å; V415-F530 HydrophobicContact CG2-CD2 4.48Å; I526-F530 HydrophobicContact CG2-CD2 3.92Å; I526-F530 HydrophobicContact CG2-CE2 3.81Å; I526-F530 WeakPolarHBondContact O-CD2 3.42Å; I526-F530 PolarHBondContact O-N 2.87Å; I526-F530 VanDerWaalsContact O-N 3.11Å; R527-F530 PolarHBondContact O-N 2.78Å; F530-H533 PolarHBondContact O-N 3.08Å; F530-A534 WeakPolarHBondContact O-CB 3.32Å; F530-A534 PolarHBondContact O-N 2.83Å
531	Y	97	Very high	93.8	Very high	8 Å²	8	38.4 Å²	38.4	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-42.6	177.1	-85.8	-114.3	0	0	0	111.3	Q390 E391 L448 F451 F453 R527 L528 H533 A534 Y535	Q390-Y531 HydrophobicContact CG-CD1 4.35Å; Q390-Y531 HydrophobicContact CG-CD2 4.42Å; Q390-Y531 HydrophobicContact CG-CE1 3.69Å; Q390-Y531 HydrophobicContact CG-CE2 3.81Å; Q390-Y531 WeakPolarHBondContact CG-OH 3.31Å; Q390-Y531 PolarHBondContact NE2-OH 2.79Å; E391-Y531 HydrophobicContact CG-CE2 3.75Å; L448-Y531 HydrophobicContact CD1-CE1 4.16Å; F451-Y531 HydrophobicContact CB-CD1 4.11Å; F451-Y531 HydrophobicContact CB-CE1 4.29Å; F451-Y531 AromaticContact CD1-CD1 3.72Å; F451-Y531 HydrophobicContact CD1-CD1 3.72Å; F451-Y531 AromaticContact CD1-CE1 3.83Å; F451-Y531 HydrophobicContact CD1-CE1 3.83Å; F451-Y531 HydrophobicContact CD1-CG 4.46Å; F451-Y531 HydrophobicContact CD2-CD1 4.15Å; F451-Y531 AromaticContact CD2-CE1 3.53Å; F451-Y531 HydrophobicContact CD2-CE1 3.53Å; F451-Y531 HydrophobicContact CE1-CD1 4.14Å; F451-Y531 AromaticContact CE1-CE1 3.96Å; F451-Y531 HydrophobicContact CE1-CE1 3.96Å; F451-Y531 AromaticContact CE2-CE1 3.66Å; F451-Y531 HydrophobicContact CE2-CE1 3.66Å; F451-Y531 AromaticContact CG-CD1 3.71Å; F451-Y531 HydrophobicContact CG-CD1 3.71Å; F451-Y531 AromaticContact CG-CE1 3.59Å; F451-Y531 HydrophobicContact CG-CE1 3.59Å; F451-Y531 AromaticContact CZ-CE1 3.88Å; F451-Y531 HydrophobicContact CZ-CE1 3.88Å; F451-Y531 AromaticContact CZ-CZ 4Å; F453-Y531 HydrophobicContact CE2-CD1 4.38Å; F453-Y531 HydrophobicContact CE2-CG 4.08Å; F453-Y531 HydrophobicContact CZ-CD1 4.19Å; F453-Y531 AromaticContact CZ-CD2 3.97Å; F453-Y531 HydrophobicContact CZ-CD2 3.97Å; F453-Y531 AromaticContact CZ-CG 3.68Å; F453-Y531 HydrophobicContact CZ-CG 3.68Å; R527-Y531 HydrophobicContact CG-CD2 3.64Å; R527-Y531 HydrophobicContact CG-CE2 3.52Å; R527-Y531 VanDerWaalsContact O-CD2 3.27Å; R527-Y531 WeakPolarHBondContact O-CD2 3.34Å; R527-Y531 PolarHBondContact O-N 3.44Å; L528-Y531 PolarHBondContact O-N 2.59Å; Y531-H533 VanDerWaalsContact C-N 3.32Å; Y531-H533 PolarHBondContact O-N 3.32Å; Y531-A534 PolarHBondContact O-N 2.78Å; Y531-A534 VanDerWaalsContact O-N 3.13Å; Y531-Y535 HydrophobicContact CD1-CE2 4.25Å; Y531-Y535 VanDerWaalsContact O-CD2 3.29Å; Y531-Y535 WeakPolarHBondContact O-CD2 3.33Å; Y531-Y535 PolarHBondContact O-N 2.82Å
532	L	95.6	Very high	93.5	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-57.3	-46.4	176.5	179.7	58.9	0	0	0	111.3	F466 I472 L491 T494 L504 L528 V529 A534 Y535 L536	F466-L532 HydrophobicContact CE1-CD1 4Å; F466-L532 HydrophobicContact CE2-CB 4.01Å; F466-L532 HydrophobicContact CZ-CB 3.92Å; F466-L532 HydrophobicContact CZ-CD1 3.98Å; F466-L532 HydrophobicContact CZ-CG 4.42Å; I472-L532 HydrophobicContact CD1-CD1 3.89Å; L491-L532 HydrophobicContact CD2-CD1 4.27Å; T494-L532 HydrophobicContact CG2-CD2 3.82Å; L504-L532 HydrophobicContact CD2-CD2 4.14Å; L528-L532 VanDerWaalsContact O-CB 3.3Å; L528-L532 WeakPolarHBondContact O-CB 3.18Å; L528-L532 PolarHBondContact O-N 2.87Å; V529-L532 PolarHBondContact O-N 3.34Å; L532-A534 PolarHBondContact O-N 3.3Å; L532-Y535 PolarHBondContact O-N 3.31Å; L532-L536 HydrophobicContact CD1-CD1 4.22Å; L532-L536 HydrophobicContact CD1-CG 4.32Å; L532-L536 HydrophobicContact CG-CD1 4.12Å; L532-L536 WeakPolarHBondContact O-CB 3.18Å; L532-L536 VanDerWaalsContact O-CG 3.25Å; L532-L536 WeakPolarHBondContact O-CG 3.35Å; L532-L536 PolarHBondContact O-N 2.93Å
533	H	94.4	Very high	93	Very high	54 Å²	54	42.9 Å²	42.9	25%	0.25	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-43.4	174.6	-71.6	173.2	0	0	0	112.4	V529 F530 Y531 L536 L537	V529-H533 PolarHBondContact O-N 2.75Å; F530-H533 PolarHBondContact O-N 3.08Å; Y531-H533 VanDerWaalsContact C-N 3.32Å; Y531-H533 PolarHBondContact O-N 3.32Å; H533-L536 PolarHBondContact O-N 3.24Å; H533-L537 WeakPolarHBondContact O-CB 3.44Å; H533-L537 PolarHBondContact O-N 2.91Å
534	A	96.5	Very high	92.3	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-44.3	178.7	0	0	0	0	0	112.1	Q390 T441 I445 F530 Y531 L532 L537 A538	Q390-A534 HydrophobicContact CB-CB 4.06Å; T441-A534 HydrophobicContact CG2-CB 3.76Å; I445-A534 HydrophobicContact CD1-CB 3.85Å; I445-A534 HydrophobicContact CG1-CB 4.1Å; F530-A534 WeakPolarHBondContact O-CB 3.32Å; F530-A534 PolarHBondContact O-N 2.83Å; Y531-A534 PolarHBondContact O-N 2.78Å; Y531-A534 VanDerWaalsContact O-N 3.13Å; L532-A534 PolarHBondContact O-N 3.3Å; A534-L537 PolarHBondContact O-N 2.78Å; A534-A538 WeakPolarHBondContact O-CB 3.5Å; A534-A538 PolarHBondContact O-N 3.04Å
535	Y	97.1	Very high	90.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-43	175.6	-89.3	-88.1	0	0	0	112.2	I445 T450 F451 F466 I468 F488 Y531 L532 A538 R539	I445-Y535 HydrophobicContact CD1-CD2 3.83Å; I445-Y535 HydrophobicContact CD1-CE2 3.8Å; I445-Y535 HydrophobicContact CD1-CG 4.32Å; I445-Y535 HydrophobicContact CG2-CD1 3.56Å; I445-Y535 HydrophobicContact CG2-CD2 4.48Å; I445-Y535 HydrophobicContact CG2-CE1 3.59Å; I445-Y535 HydrophobicContact CG2-CE2 4.49Å; I445-Y535 HydrophobicContact CG2-CG 4.03Å; T450-Y535 VanDerWaalsContact C-OH 3.31Å; F451-Y535 HydrophobicContact CB-CE2 4.1Å; F451-Y535 PolarHBondContact N-OH 3.27Å; F466-Y535 HydrophobicContact CB-CD1 4.11Å; F466-Y535 HydrophobicContact CB-CD2 3.78Å; F466-Y535 HydrophobicContact CB-CE1 4.04Å; F466-Y535 HydrophobicContact CB-CE2 3.72Å; F466-Y535 HydrophobicContact CB-CG 3.99Å; F466-Y535 HydrophobicContact CD2-CD2 4.02Å; F466-Y535 HydrophobicContact CD2-CE2 4.29Å; F466-Y535 HydrophobicContact CG-CD2 4.26Å; F466-Y535 HydrophobicContact CG-CE2 4.49Å; I468-Y535 HydrophobicContact CB-CD1 4.34Å; I468-Y535 HydrophobicContact CB-CE1 4.13Å; I468-Y535 HydrophobicContact CD1-CD1 4.33Å; F488-Y535 HydrophobicContact CE2-CD1 4.34Å; F488-Y535 AromaticContact CZ-CD1 3.79Å; F488-Y535 HydrophobicContact CZ-CD1 3.79Å; F488-Y535 HydrophobicContact CZ-CG 4.09Å; Y531-Y535 HydrophobicContact CD1-CE2 4.25Å; Y531-Y535 VanDerWaalsContact O-CD2 3.29Å; Y531-Y535 WeakPolarHBondContact O-CD2 3.33Å; Y531-Y535 PolarHBondContact O-N 2.82Å; L532-Y535 PolarHBondContact O-N 3.31Å; Y535-A538 PolarHBondContact O-N 2.92Å; Y535-R539 WeakPolarHBondContact O-CB 3.5Å; Y535-R539 PolarHBondContact O-N 2.99Å
536	L	94.6	Very high	89.5	Confident	44 Å²	44	47 Å²	47	23%	0.23	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-45.6	175.8	-73.2	171	0	0	0	111.4	F488 L491 L532 H533 R539 I540	F488-L536 HydrophobicContact CB-CD2 3.99Å; F488-L536 HydrophobicContact CD1-CD2 3.75Å; F488-L536 HydrophobicContact CD1-CG 4.41Å; F488-L536 HydrophobicContact CG-CD2 4.22Å; L491-L536 HydrophobicContact CD2-CD1 4.24Å; L491-L536 HydrophobicContact CD2-CD2 4.29Å; L532-L536 HydrophobicContact CD1-CD1 4.22Å; L532-L536 HydrophobicContact CD1-CG 4.32Å; L532-L536 HydrophobicContact CG-CD1 4.12Å; L532-L536 WeakPolarHBondContact O-CB 3.18Å; L532-L536 VanDerWaalsContact O-CG 3.25Å; L532-L536 WeakPolarHBondContact O-CG 3.35Å; L532-L536 PolarHBondContact O-N 2.93Å; H533-L536 PolarHBondContact O-N 3.24Å; L536-R539 PolarHBondContact O-N 3.43Å; L536-I540 VanDerWaalsContact O-CG1 3.3Å; L536-I540 WeakPolarHBondContact O-CG1 3.14Å; L536-I540 PolarHBondContact O-N 3.01Å
537	L	93.7	Very high	87.7	Confident	41 Å²	41	46.2 Å²	46.2	22%	0.215	24%	0.237	C	C	.	.	H	α-helix	trans	-61.1	-51.1	176.7	177.5	61.1	0	0	0	111.3	Q438 T441 H533 A534 R539 I540 M541	Q438-L537 HydrophobicContact CG-CD1 4.33Å; Q438-L537 HydrophobicContact CG-CD2 4.2Å; T441-L537 HydrophobicContact CG2-CD2 4.06Å; H533-L537 WeakPolarHBondContact O-CB 3.44Å; H533-L537 PolarHBondContact O-N 2.91Å; A534-L537 PolarHBondContact O-N 2.78Å; L537-R539 PolarHBondContact O-N 3.13Å; L537-I540 PolarHBondContact O-N 3.41Å; L537-I540 VanDerWaalsContact O-N 3.16Å; L537-M541 HydrophobicContact CD1-CG 4.35Å; L537-M541 HydrophobicContact CD1-SD 4.19Å; L537-M541 HydrophobicContact CG-SD 4.1Å; L537-M541 VanDerWaalsContact O-CG 3.28Å; L537-M541 WeakPolarHBondContact O-CG 3.4Å; L537-M541 PolarHBondContact O-N 2.87Å
538	A	94	Very high	85.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58	-37.4	177.8	0	0	0	0	0	111.6	Y442 I445 I468 A534 Y535 M541 S542	Y442-A538 HydrophobicContact CD2-CB 4.37Å; I445-A538 HydrophobicContact CB-CB 3.71Å; I445-A538 HydrophobicContact CG1-CB 4Å; I445-A538 HydrophobicContact CG2-CB 3.78Å; I468-A538 HydrophobicContact CD1-CB 4.13Å; A534-A538 WeakPolarHBondContact O-CB 3.5Å; A534-A538 PolarHBondContact O-N 3.04Å; Y535-A538 PolarHBondContact O-N 2.92Å; A538-M541 PolarHBondContact O-N 2.76Å; A538-S542 PolarHBondContact O-N 2.95Å
539	R	92.6	Very high	83.7	Confident	99 Å²	99	50.3 Å²	50.3	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-68.3	-43.6	176.9	-169.7	66.8	-174.3	142.6	-8.9	112.4	I468 F488 Y535 L536 L537 M541 S542 V543	I468-R539 HydrophobicContact CD1-CB 4.36Å; F488-R539 HydrophobicContact CB-CG 4.23Å; F488-R539 HydrophobicContact CD2-CB 4.14Å; F488-R539 HydrophobicContact CD2-CG 3.95Å; F488-R539 HydrophobicContact CG-CG 4.43Å; Y535-R539 WeakPolarHBondContact O-CB 3.5Å; Y535-R539 PolarHBondContact O-N 2.99Å; L536-R539 PolarHBondContact O-N 3.43Å; L537-R539 PolarHBondContact O-N 3.13Å; R539-M541 VanDerWaalsContact C-N 3.27Å; R539-M541 PolarHBondContact O-N 2.97Å; R539-S542 PolarHBondContact NH1-OG 3.48Å; R539-S542 PolarHBondContact O-N 2.84Å; R539-S542 VanDerWaalsContact O-N 3.15Å; R539-S542 PolarHBondContact O-OG 2.9Å; R539-V543 WeakPolarHBondContact O-CG2 3.17Å; R539-V543 PolarHBondContact O-N 3.37Å
540	I	90.2	Very high	81.3	Confident	94 Å²	94	52 Å²	52	48%	0.482	27%	0.272	S	S	.	.	H	α-helix	trans	-56.1	-46.7	174.6	-69.7	163.6	0	0	0	109.9	L536 L537 S542 V543 D544 Y547	L536-I540 VanDerWaalsContact O-CG1 3.3Å; L536-I540 WeakPolarHBondContact O-CG1 3.14Å; L536-I540 PolarHBondContact O-N 3.01Å; L537-I540 PolarHBondContact O-N 3.41Å; L537-I540 VanDerWaalsContact O-N 3.16Å; I540-S542 VanDerWaalsContact C-N 3.31Å; I540-S542 PolarHBondContact O-N 3.03Å; I540-V543 PolarHBondContact O-N 2.73Å; I540-D544 PolarHBondContact O-N 2.62Å; I540-Y547 HydrophobicContact CG2-CD2 4.46Å; I540-Y547 HydrophobicContact CG2-CE2 4.39Å
541	M	87.9	Confident	78.4	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-65.6	-30.7	178.7	-63.9	179.2	68.7	0	0	113.7	Q438 R439 Y442 L537 A538 R539 V543 Y547 L548	Q438-M541 HydrophobicContact CB-CE 3.8Å; Q438-M541 HydrophobicContact CB-SD 3.71Å; Q438-M541 WeakPolarHBondContact O-CE 3.38Å; R439-M541 HydrophobicContact CG-CE 4.4Å; Y442-M541 HydrophobicContact CD2-CB 4.03Å; L537-M541 HydrophobicContact CD1-CG 4.35Å; L537-M541 HydrophobicContact CD1-SD 4.19Å; L537-M541 HydrophobicContact CG-SD 4.1Å; L537-M541 VanDerWaalsContact O-CG 3.28Å; L537-M541 WeakPolarHBondContact O-CG 3.4Å; L537-M541 PolarHBondContact O-N 2.87Å; A538-M541 PolarHBondContact O-N 2.76Å; R539-M541 VanDerWaalsContact C-N 3.27Å; R539-M541 PolarHBondContact O-N 2.97Å; M541-V543 VanDerWaalsContact C-N 3.32Å; M541-Y547 HydrophobicContact CG-CD1 3.63Å; M541-Y547 HydrophobicContact CG-CE1 4.02Å; M541-Y547 HydrophobicContact CG-CG 4.44Å; M541-L548 HydrophobicContact CE-CD2 3.42Å; M541-L548 VanDerWaalsContact CE-CD2 3.42Å; M541-L548 HydrophobicContact CE-CG 4.39Å
542	S	86.5	Confident	75.4	Confident	41 Å²	41	63.1 Å²	63.1	29%	0.287	33%	0.331	S	S	.	.	H	α-helix	trans	-72.2	-25.1	176.6	74.1	0	0	0	0	113.5	A538 R539 I540	A538-S542 PolarHBondContact O-N 2.95Å; R539-S542 PolarHBondContact NH1-OG 3.48Å; R539-S542 PolarHBondContact O-N 2.84Å; R539-S542 VanDerWaalsContact O-N 3.15Å; R539-S542 PolarHBondContact O-OG 2.9Å; I540-S542 VanDerWaalsContact C-N 3.31Å; I540-S542 PolarHBondContact O-N 3.03Å
543	V	83.3	Confident	72.5	Confident	102 Å²	102	67.6 Å²	67.6	62%	0.618	36%	0.36	S	S	*	.	H	α-helix	trans	-92.3	-34.2	-177.6	175.7	0	0	0	0	111.1	R539 I540 M541 P545	R539-V543 WeakPolarHBondContact O-CG2 3.17Å; R539-V543 PolarHBondContact O-N 3.37Å; I540-V543 PolarHBondContact O-N 2.73Å; M541-V543 VanDerWaalsContact C-N 3.32Å; V543-P545 VanDerWaalsContact O-CD 3.22Å; V543-P545 WeakPolarHBondContact O-CD 3.32Å
544	D	75	Confident	69.4	Low	66 Å²	66	74.1 Å²	74.1	35%	0.353	39%	0.387	S	S	.	.			trans	-106.2	93.2	177.4	-175.2	-1.8	0	0	0	110.5	I540 D546 Y547	I540-D544 PolarHBondContact O-N 2.62Å; D544-D546 PolarHBondContact O-N 3.09Å; D544-D546 WeakPolarHBondContact OD1-CA 3.34Å; D544-D546 WeakPolarHBondContact OD1-CB 3.25Å; D544-D546 PolarHBondContact OD1-N 3.27Å; D544-Y547 WeakPolarHBondContact O-CB 3.41Å; D544-Y547 PolarHBondContact O-N 2.86Å; D544-Y547 PolarHBondContact OD1-N 3.28Å
545	P	62.7	Low	66.3	Low	84 Å²	84	79.4 Å²	79.4	55%	0.545	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-22.1	176.2	25.7	-32.7	0	0	0	112.8	V543 Y547 L548	V543-P545 VanDerWaalsContact O-CD 3.22Å; V543-P545 WeakPolarHBondContact O-CD 3.32Å; P545-Y547 PolarHBondContact O-N 3.48Å; P545-L548 PolarHBondContact O-N 3.36Å
546	D	64.6	Low	63.2	Low	119 Å²	119	88.6 Å²	88.6	64%	0.636	46%	0.461	S	S	*	.	H	α-helix	trans	-69.5	-25	173.6	-68.3	-26	0	0	0	110.9	D544 L548 N549	D544-D546 PolarHBondContact O-N 3.09Å; D544-D546 WeakPolarHBondContact OD1-CA 3.34Å; D544-D546 WeakPolarHBondContact OD1-CB 3.25Å; D544-D546 PolarHBondContact OD1-N 3.27Å; D546-L548 VanDerWaalsContact C-N 3.25Å; D546-L548 PolarHBondContact O-N 3.07Å; D546-N549 CarbonylContact O-C 3.42Å; D546-N549 WeakPolarHBondContact O-CA 3.44Å; D546-N549 PolarHBondContact O-N 2.89Å
547	Y	54.6	Low	60.1	Low	73 Å²	73	94 Å²	94	29%	0.286	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-28.9	173.9	-149.5	-83	0	0	0	113	Q438 I540 M541 D544 P545 N549	Q438-Y547 PolarHBondContact NE2-OH 3.48Å; I540-Y547 HydrophobicContact CG2-CD2 4.46Å; I540-Y547 HydrophobicContact CG2-CE2 4.39Å; M541-Y547 HydrophobicContact CG-CD1 3.63Å; M541-Y547 HydrophobicContact CG-CE1 4.02Å; M541-Y547 HydrophobicContact CG-CG 4.44Å; D544-Y547 WeakPolarHBondContact O-CB 3.41Å; D544-Y547 PolarHBondContact O-N 2.86Å; D544-Y547 PolarHBondContact OD1-N 3.28Å; P545-Y547 PolarHBondContact O-N 3.48Å; Y547-N549 VanDerWaalsContact C-N 3.33Å
548	L	53.7	Low	57.2	Low	59 Å²	59	97.7 Å²	97.7	31%	0.309	51%	0.513	S	S	.	.	H	α-helix	trans	-76	-26.4	171.6	-70.7	169.9	0	0	0	112.1	R439 M541 P545 D546 L550	R439-L548 HydrophobicContact CG-CD2 3.98Å; M541-L548 HydrophobicContact CE-CD2 3.42Å; M541-L548 VanDerWaalsContact CE-CD2 3.42Å; M541-L548 HydrophobicContact CE-CG 4.39Å; P545-L548 PolarHBondContact O-N 3.36Å; D546-L548 VanDerWaalsContact C-N 3.25Å; D546-L548 PolarHBondContact O-N 3.07Å; L548-L550 PolarHBondContact O-N 3.21Å
549	N	52.6	Low	54.2	Low	109 Å²	109	103 Å²	103	58%	0.583	55%	0.55	S	S	*	*			trans	-97	62.2	177.4	-67.3	-41.6	0	0	0	110	D546 Y547 K551	D546-N549 CarbonylContact O-C 3.42Å; D546-N549 WeakPolarHBondContact O-CA 3.44Å; D546-N549 PolarHBondContact O-N 2.89Å; Y547-N549 VanDerWaalsContact C-N 3.33Å; N549-K551 PolarHBondContact O-N 3.22Å
550	L	44.4	Very low	51.5	Low	66 Å²	66	102.8 Å²	102.8	35%	0.346	57%	0.57	S	S	.	*			trans	-66	65.7	168.6	-71.6	163.8	0	0	0	110.7	L431 G435 L548	L431-L550 HydrophobicContact CD1-CB 4.31Å; L431-L550 HydrophobicContact CD1-CD1 4.32Å; L431-L550 HydrophobicContact CD1-CD2 4.2Å; G435-L550 VanDerWaalsContact CA-CD1 3.46Å; L548-L550 PolarHBondContact O-N 3.21Å
551	K	34.7	Very low	48.7	Very low	183 Å²	183	101.7 Å²	101.7	80%	0.796	58%	0.582	S	S	*	*			trans	-70.3	131.7	149.9	-68.9	-177	177.6	178.1	0	105.2	N549	N549-K551 PolarHBondContact O-N 3.22Å
552	S	34.6	Very low	46	Very low	80 Å²	80	107 Å²	107	56%	0.559	63%	0.626	S	S	*	*			trans	-27.9	129.3	178.3	54	0	0	0	0	112.3	K554	S552-K554 PolarHBondContact O-N 3.24Å
553	P	33.8	Very low	43.2	Very low	98 Å²	98	109.8 Å²	109.8	64%	0.636	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-54.3	116.4	-177.7	21.3	-31	0	0	0	109
554	K	30.8	Very low	40.6	Very low	191 Å²	191	111.8 Å²	111.8	83%	0.83	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-57.1	129.5	162	-74.2	-177	177.5	179.5	0	105.6	S552 K556	S552-K554 PolarHBondContact O-N 3.24Å; K554-K556 PolarHBondContact O-N 3.21Å
555	P	31.9	Very low	38.8	Very low	116 Å²	116	117.3 Å²	117.3	75%	0.753	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-52	123.7	179.1	19.2	-29.7	0	0	0	108.1	I557	P555-I557 VanDerWaalsContact C-N 3.33Å; P555-I557 PolarHBondContact O-N 2.8Å
556	K	30.2	Very low	37.6	Very low	193 Å²	193	119 Å²	119	84%	0.839	72%	0.721	S	S	*	*			trans	-61.5	103.2	170.6	-79.3	-178.2	176.5	178.9	0	105.7	K554 T558	K554-K556 PolarHBondContact O-N 3.21Å; K556-T558 PolarHBondContact O-N 2.9Å
557	I	30.6	Very low	36.2	Very low	157 Å²	157	118.9 Å²	118.9	81%	0.805	73%	0.726	S	S	*	*			trans	-65.1	89.6	162.2	-59	172.6	0	0	0	104.6	P555 S559	P555-I557 VanDerWaalsContact C-N 3.33Å; P555-I557 PolarHBondContact O-N 2.8Å; I557-S559 VanDerWaalsContact C-N 3.3Å; I557-S559 PolarHBondContact O-N 3.08Å
558	T	33.6	Very low	35.2	Very low	119 Å²	119	121.5 Å²	121.5	73%	0.73	75%	0.75	S	S	*	*			trans	-67.5	100	164.2	46.6	0	0	0	0	105.5	K556 A560	K556-T558 PolarHBondContact O-N 2.9Å; T558-A560 PolarHBondContact O-N 2.96Å
559	S	30.7	Very low	34.1	Very low	111 Å²	111	125.2 Å²	125.2	78%	0.776	78%	0.776	S	S	*	*			trans	-61.5	83.5	160	56	0	0	0	0	107.5	I557 G561	I557-S559 VanDerWaalsContact C-N 3.3Å; I557-S559 PolarHBondContact O-N 3.08Å; S559-G561 PolarHBondContact O-N 2.94Å
560	A	35.8	Very low	32.9	Very low	95 Å²	95	126.2 Å²	126.2	79%	0.785	79%	0.788	S	S	*	*			trans	-65.8	123.2	166.2	0	0	0	0	0	106.9	T558	T558-A560 PolarHBondContact O-N 2.96Å
561	G	30.9	Very low	32.1	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	82%	0.818	S	S	*	*			trans	-57.9	136.5	-163.5	0	0	0	0	0	114.9	S559	S559-G561 PolarHBondContact O-N 2.94Å
562	A	32	Very low	32	Very low	113 Å²	113	126.4 Å²	126.4	93%	0.934	82%	0.819	S	S	*	*			trans	-93.8	82	149.6	0	0	0	0	0	107.7
563	S	26.6	Very low	31.8	Very low	100 Å²	100	130 Å²	130	70%	0.699	84%	0.839	S	S	*	*			trans	-148.5	99	158.4	72.1	0	0	0	0	109.2
564	T	30.1	Very low	31.6	Very low	144 Å²	144	132.7 Å²	132.7	88%	0.883	86%	0.856	S	S	*	*			trans	164.4	95.9	131.6	49.5	0	0	0	0	109.7
565	A	36	Very low	31.7	Very low	182 Å²	182	127.4 Å²	127.4	100%	1.504	86%	0.858	S	S	*	*			trans	-168.7	0	134.1	0	0	0	0	0	107.3

Retrieved 565 of 565 residues in 151.6 ms (Link to these results)

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