A0A096LZA6_POEFO Loading...

Zgc:92313

AlphaFold DB , UniProt , Accession A0A096LZA6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 306 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	46.3	Very low	40.9	Very low	223 Å²	223	133.4 Å²	133.4	100%	1.099	71%	0.709	S	S	*	*				0	-26.2	0	-97.7	171	176.6	0	0	114
2	A	43.6	Very low	40.7	Very low	78 Å²	78	134.3 Å²	134.3	65%	0.645	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-26.1	-179.5	0	0	0	0	0	115.5
3	T	40.6	Very low	40.6	Very low	119 Å²	119	132.8 Å²	132.8	73%	0.73	72%	0.718	S	S	*	*	H	α-helix	trans	-82.6	-17.3	-172.8	-6.8	0	0	0	0	114.7
4	K	41	Very low	40.8	Very low	180 Å²	180	131.8 Å²	131.8	78%	0.783	72%	0.718	S	S	*	*	H	α-helix	trans	-85.1	-21.2	177.6	-78.5	-171.7	175.1	-176.1	0	113.3	S8	K4-S8 PolarHBondContact O-OG 3.07Å
5	V	45.3	Very low	41.1	Very low	93 Å²	93	131.2 Å²	131.2	56%	0.564	72%	0.72	S	S	*	*	H	α-helix	trans	-78.2	-32.9	179.6	-179.1	0	0	0	0	111.4	L7 S8 V9	V5-L7 PolarHBondContact O-N 3.08Å; V5-S8 PolarHBondContact O-N 3.45Å; V5-V9 WeakPolarHBondContact O-CG2 3.37Å
6	L	39.1	Very low	41.2	Very low	131 Å²	131	126.3 Å²	126.3	69%	0.686	71%	0.709	S	S	*	*	H	α-helix	trans	-68.7	-33.5	179.5	-99.2	89.3	0	0	0	113.9	S8 F10	L6-S8 VanDerWaalsContact C-N 3.33Å; L6-S8 PolarHBondContact O-N 3.31Å; L6-F10 PolarHBondContact O-N 3.04Å
7	L	37.8	Very low	41.1	Very low	136 Å²	136	128.9 Å²	128.9	71%	0.712	72%	0.72	S	S	*	*	H	α-helix	trans	-71	-29.1	179.4	-105.5	87.6	0	0	0	112.8	V5	V5-L7 PolarHBondContact O-N 3.08Å
8	S	38.9	Very low	41.1	Very low	72 Å²	72	134.2 Å²	134.2	50%	0.503	73%	0.727	S	S	.	*	H	α-helix	trans	-75.2	-31.1	179.1	-45.9	0	0	0	0	112.5	K4 V5 L6	K4-S8 PolarHBondContact O-OG 3.07Å; V5-S8 PolarHBondContact O-N 3.45Å; L6-S8 VanDerWaalsContact C-N 3.33Å; L6-S8 PolarHBondContact O-N 3.31Å
9	V	43.1	Very low	41	Very low	100 Å²	100	133.3 Å²	133.3	61%	0.606	73%	0.726	S	S	*	*	H	α-helix	trans	-77.3	-31.5	179.7	178.6	0	0	0	0	111.4	V5	V5-V9 WeakPolarHBondContact O-CG2 3.37Å
10	F	38.5	Very low	41.3	Very low	167 Å²	167	131.4 Å²	131.4	73%	0.732	72%	0.723	S	S	*	*	H	α-helix	trans	-75.3	-29.6	179	-131.4	-95.7	0	0	0	113.3	L6	L6-F10 PolarHBondContact O-N 3.04Å
11	F	36.1	Very low	41.6	Very low	168 Å²	168	132 Å²	132	74%	0.737	73%	0.725	S	S	*	*	H	α-helix	trans	-78.4	-19.4	178.5	-140.7	-93.4	0	0	0	113.4
12	L	38.1	Very low	42.2	Very low	145 Å²	145	124.2 Å²	124.2	76%	0.759	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-5.9	178.6	-102.8	136.4	0	0	0	114.1
13	C	39.4	Very low	43.4	Very low	115 Å²	115	122.8 Å²	122.8	78%	0.777	68%	0.676	S	S	*	*	S	Bend	trans	-105.3	-1.1	-175.9	-143.8	0	0	0	0	114.5
14	V	43.9	Very low	45.5	Very low	118 Å²	118	121.7 Å²	121.7	72%	0.715	67%	0.669	S	S	*	*	S	Bend	trans	-115.2	-14.1	-173.7	-176.2	0	0	0	0	114.5	G16	V14-G16 PolarHBondContact O-N 3.23Å
15	T	44.7	Very low	48.1	Very low	123 Å²	123	114 Å²	114	76%	0.755	64%	0.638	S	S	*	*	S	Bend	trans	-97.4	88.9	177	55	0	0	0	0	112.4
16	G	42.4	Very low	50.4	Low	52 Å²	52	109.6 Å²	109.6	54%	0.536	61%	0.611	S	S	.	*			trans	101.9	57.6	143.6	0	0	0	0	0	117.1	V14 R18	V14-G16 PolarHBondContact O-N 3.23Å; G16-R18 PolarHBondContact O-N 2.92Å
17	L	41	Very low	52.9	Low	172 Å²	172	108.3 Å²	108.3	90%	0.901	60%	0.597	S	S	*	*			trans	-62.2	84.3	139.7	-81.3	162.5	0	0	0	106.6	V19	L17-V19 PolarHBondContact O-N 3.49Å
18	R	40.8	Very low	55	Low	224 Å²	224	103.7 Å²	103.7	85%	0.845	57%	0.573	S	S	*	*			trans	-61.1	96.2	156.2	-75.1	-96.8	-176.4	166.2	-0.8	103.7	G16 S20	G16-R18 PolarHBondContact O-N 2.92Å; R18-S20 PolarHBondContact O-N 2.82Å
19	V	39.4	Very low	56.5	Low	116 Å²	116	106.1 Å²	106.1	70%	0.703	58%	0.576	S	S	*	*			trans	-62.5	88.9	161.4	179.9	0	0	0	0	104.1	L17 N21	L17-V19 PolarHBondContact O-N 3.49Å; V19-N21 PolarHBondContact O-N 3.41Å
20	S	45.6	Very low	57.6	Low	95 Å²	95	105.3 Å²	105.3	66%	0.664	57%	0.567	S	S	*	*			trans	-63.7	96.1	164.1	-70	0	0	0	0	104.5	R18 A22	R18-S20 PolarHBondContact O-N 2.82Å; S20-A22 PolarHBondContact O-N 3.47Å
21	N	48.4	Very low	58.5	Low	145 Å²	145	106.5 Å²	106.5	78%	0.775	57%	0.572	S	S	*	*			trans	-58.3	99.1	165.1	-87.2	-32.5	0	0	0	105.8	V19 Q23	V19-N21 PolarHBondContact O-N 3.41Å; N21-Q23 PolarHBondContact O-N 2.94Å; N21-Q23 VanDerWaalsContact O-N 3.16Å
22	A	57.8	Low	59.3	Low	59 Å²	59	105.3 Å²	105.3	49%	0.488	57%	0.573	S	S	.	*			trans	-63.2	118.3	172.3	0	0	0	0	0	106.6	S20 V24	S20-A22 PolarHBondContact O-N 3.47Å; A22-V24 PolarHBondContact O-N 3.01Å
23	Q	69.3	Low	60.2	Low	49 Å²	49	101.5 Å²	101.5	23%	0.229	55%	0.548	C	S	.	.			trans	-62.9	111	175.6	-175.7	-179	-68	0	0	107.4	N21 C25 I64 W135 P141	N21-Q23 PolarHBondContact O-N 2.94Å; N21-Q23 VanDerWaalsContact O-N 3.16Å; Q23-C25 PolarHBondContact O-N 3.04Å; Q23-I64 PolarHBondContact NE2-O 3.24Å; Q23-W135 HydrophobicContact CG-CZ2 4.19Å; Q23-P141 HydrophobicContact CG-CG 3.81Å
24	V	86	Confident	60.6	Low	95 Å²	95	101.8 Å²	101.8	58%	0.576	54%	0.541	S	S	*	.			trans	-74.9	110	174.8	-179.7	0	0	0	0	107.4	A22 R27	A22-V24 PolarHBondContact O-N 3.01Å; V24-R27 HydrophobicContact CG1-CB 4.42Å; V24-R27 HydrophobicContact CG1-CG 3.49Å; V24-R27 VanDerWaalsContact CG1-CG 3.49Å
25	C	94.1	Very high	60.5	Low	19 Å²	19	99.9 Å²	99.9	13%	0.128	53%	0.53	C	S	.	.			trans	-109	165.4	179	59.4	0	0	0	0	111.8	Q23 R27 P141 C143	Q23-C25 PolarHBondContact O-N 3.04Å; C25-R27 PolarHBondContact O-N 2.67Å; C25-R27 VanDerWaalsContact O-N 3.14Å; C25-P141 CarbonylContact C-O 3.51Å; C25-P141 WeakPolarHBondContact CA-O 3.44Å; C25-P141 HydrophobicContact CB-CB 4.41Å; C25-P141 HydrophobicContact CB-CG 4.1Å; C25-C143 HydrophobicContact CB-CB 4.02Å; C25-C143 WeakPolarHBondContact CB-SG 3.23Å; C25-C143 PolarHBondContact O-SG 3.45Å; C25-C143 WeakPolarHBondContact SG-CA 3.5Å; C25-C143 WeakPolarHBondContact SG-CB 3.41Å; C25-C143 CovalentContact SG-SG 2.04Å; C25-C143 PolarHBondContact SG-SG 3Å
26	G	93.8	Very high	60.4	Low	0 Å²	0	95.4 Å²	95.4	0%	0	51%	0.508	C	S	.	.	S	Bend	trans	62.5	26.3	168	0	0	0	0	0	113.9	P141 W238	G26-P141 PolarHBondContact N-O 3.48Å; G26-W238 VanDerWaalsContact CA-O 3.29Å; G26-W238 WeakPolarHBondContact CA-O 3.49Å; G26-W238 PolarHBondContact O-N 3.2Å
27	R	90.9	Very high	61.1	Low	105 Å²	105	94.8 Å²	94.8	40%	0.396	50%	0.502	S	S	.	.			trans	-106.3	126.4	176.8	-62.1	-53.9	-175.1	-178.8	-1.3	109.5	V24 C25 N235 T237	V24-R27 HydrophobicContact CG1-CB 4.42Å; V24-R27 HydrophobicContact CG1-CG 3.49Å; V24-R27 VanDerWaalsContact CG1-CG 3.49Å; C25-R27 PolarHBondContact O-N 2.67Å; C25-R27 VanDerWaalsContact O-N 3.14Å; R27-N235 PolarHBondContact NH1-O 3.28Å; R27-T237 PolarHBondContact NH1-OG1 2.91Å; R27-T237 PolarHBondContact NH2-OG1 3.49Å
28	L	83.3	Confident	62.8	Low	38 Å²	38	89.3 Å²	89.3	20%	0.199	48%	0.475	C	S	.	.			trans	-96.4	123.7	173.4	-61.7	177.8	0	0	0	108.9	A44 P46 W47 W238	L28-A44 WeakPolarHBondContact CD2-O 3.26Å; L28-P46 HydrophobicContact CD2-CG 4.1Å; L28-W47 HydrophobicContact CD2-CH2 3.41Å; L28-W47 VanDerWaalsContact CD2-CH2 3.41Å; L28-W47 HydrophobicContact CD2-CZ2 4.26Å; L28-W47 HydrophobicContact CD2-CZ3 3.64Å; L28-W47 HydrophobicContact CG-CH2 4.02Å; L28-W47 HydrophobicContact CG-CZ3 4.45Å; L28-W238 HydrophobicContact CD1-CD2 4.2Å; L28-W238 HydrophobicContact CD1-CG 4.24Å; L28-W238 HydrophobicContact CD1-CZ2 4.22Å; L28-W238 HydrophobicContact CG-CG 4.43Å
29	Q	70.8	Confident	65.1	Low	123 Å²	123	82.6 Å²	82.6	58%	0.575	46%	0.456	S	S	*	.	S	Bend	trans	-81.8	-29.7	176.8	-65.6	-85.8	-9.5	0	0	110.9
30	M	65.4	Low	67.5	Low	83 Å²	83	77.1 Å²	77.1	41%	0.409	42%	0.423	S	S	.	.			trans	-99.8	123.4	-176.7	-61	-88.6	-84.6	0	0	109.6	N42	M30-N42 VanDerWaalsContact CE-O 3.29Å; M30-N42 WeakPolarHBondContact CE-O 3.33Å
31	K	56.7	Low	69.6	Low	192 Å²	192	74.5 Å²	74.5	84%	0.835	40%	0.404	S	S	*	.			trans	-100.4	-8.8	-172.4	-72.2	-174.2	179.4	178.4	0	115.1	R33	K31-R33 PolarHBondContact O-N 2.66Å
32	D	52.8	Low	71.7	Confident	144 Å²	144	70.3 Å²	70.3	77%	0.77	38%	0.382	S	S	*	.			trans	-88.3	102.5	-177.5	-62.7	-28.9	0	0	0	109.5	S41	D32-S41 PolarHBondContact O-OG 2.94Å
33	R	57.2	Low	73.3	Confident	64 Å²	64	68.1 Å²	68.1	24%	0.242	37%	0.366	C	S	.	.			trans	-115.6	136.2	171.5	-70.9	-156.6	-159.9	138.4	-17.7	111.3	K31 V35 W45 W238	K31-R33 PolarHBondContact O-N 2.66Å; R33-V35 HydrophobicContact CB-CG2 4.28Å; R33-W45 VanDerWaalsContact NH2-CZ3 3.29Å; R33-W238 VanDerWaalsContact CZ-CZ2 3.43Å; R33-W238 VanDerWaalsContact NH2-CE2 3.26Å
34	I	47.8	Very low	74.4	Confident	121 Å²	121	66 Å²	66	62%	0.621	36%	0.356	S	S	*	.			trans	-102.2	114.1	165.4	-56.7	-176.9	0	0	0	106.8	V38	I34-V38 HydrophobicContact CG2-CG2 4.2Å; I34-V38 WeakPolarHBondContact O-CG2 3.3Å
35	V	41.9	Very low	74.9	Confident	79 Å²	79	61.9 Å²	61.9	48%	0.479	33%	0.33	S	S	.	.			trans	-100	121.4	-170	-178.8	0	0	0	0	110.1	R33 Y158 A181	R33-V35 HydrophobicContact CB-CG2 4.28Å; V35-Y158 HydrophobicContact CG1-CE1 3.97Å; V35-Y158 WeakPolarHBondContact CG1-OH 3.2Å; V35-Y158 HydrophobicContact CG2-CE1 4.39Å; V35-Y158 WeakPolarHBondContact CG2-OH 3.22Å; V35-A181 HydrophobicContact CG1-CB 4.09Å
36	G	44	Very low	75	Confident	28 Å²	28	61.2 Å²	61.2	29%	0.289	33%	0.326	S	S	.	.	S	Bend	trans	176.5	-0.1	178.3	0	0	0	0	0	121.7	K218	G36-K218 WeakPolarHBondContact O-CE 3.42Å; G36-K218 PolarHBondContact O-NZ 3.34Å
37	G	57.3	Low	75.2	Confident	40 Å²	40	61.2 Å²	61.2	41%	0.412	33%	0.326	S	S	.	.	S	Bend	trans	80.9	51.5	-163.2	0	0	0	0	0	109.9	E179	G37-E179 WeakPolarHBondContact CA-O 3.49Å; G37-E179 PolarHBondContact N-O 3.21Å; G37-E179 VanDerWaalsContact N-O 3.16Å
38	V	76.6	Confident	75.5	Confident	57 Å²	57	56.4 Å²	56.4	35%	0.345	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	169.2	-170.8	-66.3	0	0	0	0	108.4	I34 A40 Q178 E179	I34-V38 HydrophobicContact CG2-CG2 4.2Å; I34-V38 WeakPolarHBondContact O-CG2 3.3Å; V38-A40 PolarHBondContact O-N 3.01Å; V38-Q178 VanDerWaalsContact C-OE1 3.31Å; V38-E179 PolarHBondContact N-O 3.18Å; V38-E179 PolarHBondContact O-N 2.89Å
39	D	87.4	Confident	76.3	Confident	83 Å²	83	54.6 Å²	54.6	44%	0.444	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-46.2	122.7	169.7	-72.1	14.3	0	0	0	110.7	T176 Q178	D39-T176 HydrophobicContact CB-CG2 3.73Å; D39-T176 PolarHBondContact OD2-OG1 3Å; D39-Q178 PolarHBondContact OD1-NE2 3.19Å
40	A	89.9	Confident	77.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-65.2	155.9	168.9	0	0	0	0	0	109.3	V38 Y92 L177 E179	V38-A40 PolarHBondContact O-N 3.01Å; A40-Y92 WeakPolarHBondContact O-CE2 3.41Å; A40-Y92 PolarHBondContact O-OH 3.33Å; A40-Y92 VanDerWaalsContact O-OH 3.11Å; A40-L177 HydrophobicContact CB-CB 4.4Å; A40-L177 HydrophobicContact CB-CD2 4.29Å; A40-L177 HydrophobicContact CB-CG 4.15Å; A40-L177 WeakPolarHBondContact CB-O 3.36Å; A40-L177 PolarHBondContact N-O 3.39Å; A40-E179 HydrophobicContact CB-CB 4.2Å; A40-E179 HydrophobicContact CB-CG 4.07Å
41	S	91.1	Very high	79.1	Confident	40 Å²	40	44.8 Å²	44.8	28%	0.28	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-75.6	146.9	169.4	-63.6	0	0	0	0	110.9	D32 G43 A44	D32-S41 PolarHBondContact O-OG 2.94Å; S41-G43 PolarHBondContact O-N 2.86Å; S41-A44 WeakPolarHBondContact O-CB 3.45Å; S41-A44 PolarHBondContact O-N 3.5Å
42	N	92.1	Very high	81.1	Confident	57 Å²	57	36.4 Å²	36.4	31%	0.305	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	123.9	177	-175.1	5.1	0	0	0	110.6	M30 A44 Y92	M30-N42 VanDerWaalsContact CE-O 3.29Å; M30-N42 WeakPolarHBondContact CE-O 3.33Å; N42-A44 VanDerWaalsContact C-N 3.34Å; N42-Y92 HydrophobicContact CB-CD1 3.97Å; N42-Y92 HydrophobicContact CB-CD2 4.07Å; N42-Y92 HydrophobicContact CB-CE1 4.08Å; N42-Y92 HydrophobicContact CB-CE2 4.16Å; N42-Y92 HydrophobicContact CB-CG 3.97Å
43	G	91.6	Very high	83.1	Confident	14 Å²	14	32.5 Å²	32.5	14%	0.144	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	5.2	-176.2	0	0	0	0	0	115.7	S41 W45 Y138	S41-G43 PolarHBondContact O-N 2.86Å; G43-W45 PolarHBondContact O-N 3.26Å; G43-Y138 VanDerWaalsContact CA-CD1 3.48Å
44	A	92.6	Very high	84.7	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.033	21%	0.21	C	C	.	.	S	Bend	trans	-63.7	-27	177.5	0	0	0	0	0	113.3	L28 S41 N42	L28-A44 WeakPolarHBondContact CD2-O 3.26Å; S41-A44 WeakPolarHBondContact O-CB 3.45Å; S41-A44 PolarHBondContact O-N 3.5Å; N42-A44 VanDerWaalsContact C-N 3.34Å
45	W	95.6	Very high	86.6	Confident	8 Å²	8	34.3 Å²	34.3	3%	0.03	21%	0.214	C	C	.	.	S	Bend	trans	-130.8	72.6	-176.7	-57.5	107.9	0	0	0	110.8	R33 G43 W47 Q48 Y158 T160 L177 E179 V230 W238	R33-W45 VanDerWaalsContact NH2-CZ3 3.29Å; G43-W45 PolarHBondContact O-N 3.26Å; W45-W47 AromaticContact CE3-CE2 3.82Å; W45-W47 HydrophobicContact CE3-CH2 4.32Å; W45-W47 AromaticContact CE3-CZ2 3.41Å; W45-W47 HydrophobicContact CE3-CZ2 3.41Å; W45-W47 VanDerWaalsContact CE3-CZ2 3.41Å; W45-W47 AromaticContact CE3-NE1 3.86Å; W45-W47 HydrophobicContact CZ3-CH2 4.49Å; W45-W47 AromaticContact CZ3-CZ2 3.67Å; W45-W47 HydrophobicContact CZ3-CZ2 3.67Å; W45-W47 PolarHBondContact O-N 3.46Å; W45-Q48 HydrophobicContact CB-CB 4.32Å; W45-Q48 WeakPolarHBondContact O-CB 3.28Å; W45-Q48 PolarHBondContact O-N 2.88Å; W45-Y158 VanDerWaalsContact CH2-CB 3.43Å; W45-Y158 HydrophobicContact CH2-CD1 4.02Å; W45-Y158 HydrophobicContact CH2-CD2 4.12Å; W45-Y158 AromaticContact CH2-CG 3.6Å; W45-Y158 HydrophobicContact CH2-CG 3.6Å; W45-Y158 AromaticContact CZ2-CD1 3.65Å; W45-Y158 HydrophobicContact CZ2-CD1 3.65Å; W45-Y158 HydrophobicContact CZ2-CE1 4.42Å; W45-Y158 AromaticContact CZ2-CG 3.73Å; W45-Y158 HydrophobicContact CZ2-CG 3.73Å; W45-T160 HydrophobicContact CB-CG2 4.45Å; W45-T160 VanDerWaalsContact CD1-CG2 3.47Å; W45-T160 HydrophobicContact CD2-CG2 3.62Å; W45-T160 VanDerWaalsContact CE2-CG2 3.45Å; W45-T160 HydrophobicContact CE3-CG2 4.41Å; W45-T160 HydrophobicContact CG-CG2 3.61Å; W45-T160 HydrophobicContact CZ2-CG2 4.07Å; W45-L177 HydrophobicContact CB-CD2 4.2Å; W45-E179 WeakPolarHBondContact CZ2-OE2 3.25Å; W45-E179 PolarHBondContact NE1-OE2 3.13Å; W45-V230 HydrophobicContact CE3-CG2 4Å; W45-V230 HydrophobicContact CH2-CG2 3.82Å; W45-V230 HydrophobicContact CZ3-CG2 3.3Å; W45-W238 HydrophobicContact CH2-CE3 4.08Å; W45-W238 HydrophobicContact CH2-CH2 4Å; W45-W238 AromaticContact CH2-CZ3 3.65Å; W45-W238 HydrophobicContact CH2-CZ3 3.65Å; W45-W238 HydrophobicContact CZ3-CD2 4.28Å; W45-W238 AromaticContact CZ3-CE3 3.78Å; W45-W238 HydrophobicContact CZ3-CE3 3.78Å; W45-W238 HydrophobicContact CZ3-CH2 4.45Å; W45-W238 AromaticContact CZ3-CZ3 3.87Å; W45-W238 HydrophobicContact CZ3-CZ3 3.87Å
46	P	96.3	Very high	89	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.032	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-3.9	-168	30.9	-38.4	0	0	0	114.6	L28 Y138 I139 Q140	L28-P46 HydrophobicContact CD2-CG 4.1Å; P46-Y138 VanDerWaalsContact CA-O 3.32Å; P46-Y138 WeakPolarHBondContact CA-O 3.22Å; P46-Y138 VanDerWaalsContact CB-C 3.48Å; P46-Y138 WeakPolarHBondContact CB-O 3.33Å; P46-I139 WeakPolarHBondContact O-CA 3.36Å; P46-Q140 CarbonylContact C-O 3.55Å; P46-Q140 HydrophobicContact CB-CB 3.92Å; P46-Q140 HydrophobicContact CB-CG 4.22Å; P46-Q140 HydrophobicContact CG-CB 3.8Å; P46-Q140 HydrophobicContact CG-CG 4.26Å; P46-Q140 PolarHBondContact O-N 3.29Å
47	W	97.9	Very high	91.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-9.2	173.3	44.4	77.8	0	0	0	113.1	L28 W45 I49 S62 L63 Q140 V142 V230 W238	L28-W47 HydrophobicContact CD2-CH2 3.41Å; L28-W47 VanDerWaalsContact CD2-CH2 3.41Å; L28-W47 HydrophobicContact CD2-CZ2 4.26Å; L28-W47 HydrophobicContact CD2-CZ3 3.64Å; L28-W47 HydrophobicContact CG-CH2 4.02Å; L28-W47 HydrophobicContact CG-CZ3 4.45Å; W45-W47 AromaticContact CE3-CE2 3.82Å; W45-W47 HydrophobicContact CE3-CH2 4.32Å; W45-W47 AromaticContact CE3-CZ2 3.41Å; W45-W47 HydrophobicContact CE3-CZ2 3.41Å; W45-W47 VanDerWaalsContact CE3-CZ2 3.41Å; W45-W47 AromaticContact CE3-NE1 3.86Å; W45-W47 HydrophobicContact CZ3-CH2 4.49Å; W45-W47 AromaticContact CZ3-CZ2 3.67Å; W45-W47 HydrophobicContact CZ3-CZ2 3.67Å; W45-W47 PolarHBondContact O-N 3.46Å; W47-I49 PolarHBondContact O-N 3.18Å; W47-S62 CarbonylContact O-C 3.58Å; W47-S62 VanDerWaalsContact O-CA 3.29Å; W47-S62 WeakPolarHBondContact O-CA 3.37Å; W47-L63 HydrophobicContact CB-CB 4.3Å; W47-L63 PolarHBondContact O-N 2.93Å; W47-Q140 WeakPolarHBondContact CA-O 3.08Å; W47-Q140 VanDerWaalsContact CB-O 3.26Å; W47-Q140 WeakPolarHBondContact CB-O 3.34Å; W47-Q140 PolarHBondContact N-O 3.22Å; W47-V142 HydrophobicContact CB-CB 3.97Å; W47-V142 HydrophobicContact CB-CG1 4.46Å; W47-V142 HydrophobicContact CD2-CB 3.7Å; W47-V142 HydrophobicContact CD2-CG2 4.05Å; W47-V142 HydrophobicContact CE3-CB 4.06Å; W47-V142 HydrophobicContact CE3-CG2 4.44Å; W47-V142 HydrophobicContact CG-CB 3.68Å; W47-V142 HydrophobicContact CG-CG1 4.44Å; W47-V142 HydrophobicContact CG-CG2 4.36Å; W47-V142 HydrophobicContact CZ2-CG2 4.3Å; W47-V230 HydrophobicContact CZ2-CG1 4.37Å; W47-V230 HydrophobicContact CZ2-CG2 4.33Å; W47-W238 HydrophobicContact CH2-CB 3.45Å; W47-W238 VanDerWaalsContact CH2-CB 3.45Å; W47-W238 HydrophobicContact CH2-CD2 4.45Å; W47-W238 AromaticContact CH2-CG 3.73Å; W47-W238 HydrophobicContact CH2-CG 3.73Å; W47-W238 HydrophobicContact CZ2-CB 3.92Å; W47-W238 HydrophobicContact CZ2-CG 4.25Å; W47-W238 HydrophobicContact CZ3-CB 4.33Å
48	Q	98.1	Very high	93.2	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.019	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	135.2	-176.3	-172.6	70.4	20	0	0	110.8	W45 T160 W162 L177 P228	W45-Q48 HydrophobicContact CB-CB 4.32Å; W45-Q48 WeakPolarHBondContact O-CB 3.28Å; W45-Q48 PolarHBondContact O-N 2.88Å; Q48-T160 PolarHBondContact NE2-O 3.16Å; Q48-T160 VanDerWaalsContact NE2-O 3.1Å; Q48-T160 PolarHBondContact OE1-O 3.48Å; Q48-T160 PolarHBondContact OE1-OG1 2.04Å; Q48-W162 HydrophobicContact CB-CH2 4.39Å; Q48-W162 HydrophobicContact CG-CH2 3.44Å; Q48-W162 VanDerWaalsContact CG-CH2 3.44Å; Q48-W162 HydrophobicContact CG-CZ2 4.38Å; Q48-W162 HydrophobicContact CG-CZ3 3.52Å; Q48-L177 HydrophobicContact CB-CD2 4.35Å; Q48-L177 HydrophobicContact CG-CD1 3.87Å; Q48-L177 HydrophobicContact CG-CD2 4.22Å; Q48-P228 VanDerWaalsContact OE1-CD 3.24Å
49	I	98.4	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.8	177.2	-52.8	-67.8	0	0	0	109.1	W47 I51 G60 G61 L63 V69 L87 I89	W47-I49 PolarHBondContact O-N 3.18Å; I49-I51 HydrophobicContact CG2-CG1 3.92Å; I49-G60 CarbonylContact O-C 3.43Å; I49-G60 WeakPolarHBondContact O-CA 3.26Å; I49-G61 PolarHBondContact N-O 3.06Å; I49-G61 PolarHBondContact O-N 3.42Å; I49-L63 HydrophobicContact CD1-CB 4.14Å; I49-L63 HydrophobicContact CD1-CD1 4.43Å; I49-V69 HydrophobicContact CB-CG1 4.26Å; I49-V69 HydrophobicContact CD1-CG2 3.94Å; I49-V69 HydrophobicContact CG1-CG1 3.87Å; I49-V69 HydrophobicContact CG1-CG2 3.87Å; I49-V69 HydrophobicContact CG2-CG1 4.23Å; I49-L87 HydrophobicContact CG2-CB 4.1Å; I49-L87 HydrophobicContact CG2-CD2 4.25Å; I49-L87 HydrophobicContact CG2-CG 4.03Å; I49-I89 HydrophobicContact CD1-CB 4.06Å; I49-I89 HydrophobicContact CD1-CG1 3.35Å; I49-I89 HydrophobicContact CD1-CG2 3.96Å
50	D	98.1	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	118.6	163.2	168.8	20.9	0	0	0	108.3	Q52 H57 L87 Y88 R91 L94 W162	D50-Q52 PolarHBondContact OD2-NE2 2.93Å; D50-Q52 VanDerWaalsContact OD2-NE2 3.12Å; D50-H57 IonicContact OD1-CE1 2.76Å; D50-H57 IonicContact OD1-CG 3.53Å; D50-H57 IonicContact OD1-ND1 2.73Å; D50-H57 PolarHBondContact OD1-ND1 3.41Å; D50-L87 WeakPolarHBondContact O-CA 3.35Å; D50-Y88 PolarHBondContact N-O 2.92Å; D50-Y88 PolarHBondContact O-N 2.97Å; D50-R91 WeakPolarHBondContact OD2-CD 3.1Å; D50-R91 IonicContact OD2-CZ 3.68Å; D50-R91 IonicContact OD2-NE 3.25Å; D50-R91 IonicContact OD2-NH1 2.7Å; D50-R91 PolarHBondContact OD2-NH1 3.44Å; D50-L94 WeakPolarHBondContact OD2-CD2 3.21Å; D50-W162 HydrophobicContact CB-CE3 4.14Å; D50-W162 HydrophobicContact CB-CH2 4.03Å; D50-W162 HydrophobicContact CB-CZ3 3.64Å
51	I	98.4	Very high	95.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111.4	175.4	-50.4	-173.1	0	0	0	107.3	I49 V58 C59 G60 S71 F76 Y85 L87	I49-I51 HydrophobicContact CG2-CG1 3.92Å; I51-V58 HydrophobicContact CG2-CG2 4.46Å; I51-V58 VanDerWaalsContact O-CG2 3.23Å; I51-V58 WeakPolarHBondContact O-CG2 3.47Å; I51-V58 PolarHBondContact O-N 2.97Å; I51-C59 WeakPolarHBondContact CA-O 3.42Å; I51-C59 HydrophobicContact CB-CB 4.35Å; I51-C59 VanDerWaalsContact CB-O 3.28Å; I51-C59 WeakPolarHBondContact CB-O 3.39Å; I51-C59 PolarHBondContact N-O 3.49Å; I51-C59 PolarHBondContact O-N 3.21Å; I51-G60 VanDerWaalsContact CD1-O 3.25Å; I51-G60 WeakPolarHBondContact CD1-O 3.33Å; I51-S71 WeakPolarHBondContact CD1-OG 3.44Å; I51-F76 HydrophobicContact CD1-CZ 3.83Å; I51-F76 HydrophobicContact CG2-CE1 4.07Å; I51-F76 HydrophobicContact CG2-CZ 4.19Å; I51-Y85 HydrophobicContact CG2-CD1 4.07Å; I51-L87 HydrophobicContact CG1-CG 4.29Å; I51-L87 HydrophobicContact CG2-CD1 4.16Å
52	Q	97.1	Very high	95.4	Very high	17 Å²	17	30.2 Å²	30.2	8%	0.079	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	145	176.4	-64.9	-161.2	-9.3	0	0	111.9	D50 N55 E56 Y85 V86 Y88	D50-Q52 PolarHBondContact OD2-NE2 2.93Å; D50-Q52 VanDerWaalsContact OD2-NE2 3.12Å; Q52-N55 PolarHBondContact OE1-O 3.39Å; Q52-E56 CarbonylContact C-O 3.46Å; Q52-E56 WeakPolarHBondContact CA-O 3.43Å; Q52-E56 WeakPolarHBondContact CB-O 3.29Å; Q52-Y85 VanDerWaalsContact O-CA 3.27Å; Q52-Y85 WeakPolarHBondContact O-CA 3.24Å; Q52-V86 PolarHBondContact N-O 2.67Å; Q52-V86 PolarHBondContact O-N 3.43Å; Q52-Y88 HydrophobicContact CB-CE2 4.28Å; Q52-Y88 VanDerWaalsContact CD-CE2 3.5Å; Q52-Y88 HydrophobicContact CG-CD2 3.96Å; Q52-Y88 HydrophobicContact CG-CE2 3.88Å
53	K	94.8	Very high	95.7	Very high	62 Å²	62	27.5 Å²	27.5	27%	0.27	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.2	165.8	-168.7	-179.3	-177.5	173.9	0	109	N55 E56 V58 S84 Y85	K53-N55 PolarHBondContact O-N 3.04Å; K53-E56 PolarHBondContact N-O 3.46Å; K53-E56 PolarHBondContact O-N 3.14Å; K53-V58 HydrophobicContact CB-CB 4.46Å; K53-V58 HydrophobicContact CB-CG1 3.73Å; K53-V58 HydrophobicContact CB-CG2 3.86Å; K53-S84 VanDerWaalsContact CA-O 3.27Å; K53-S84 WeakPolarHBondContact CA-O 3.5Å; K53-Y85 HydrophobicContact CB-CD1 4.12Å; K53-Y85 HydrophobicContact CB-CE1 4.03Å; K53-Y85 HydrophobicContact CD-CE1 3.94Å; K53-Y85 HydrophobicContact CG-CD1 4.34Å; K53-Y85 HydrophobicContact CG-CE1 4.07Å
54	S	90.6	Very high	96	Very high	89 Å²	89	27 Å²	27	62%	0.622	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	37.4	-179.3	-55.8	0	0	0	0	114.3	E56 S84	S54-E56 VanDerWaalsContact C-N 3.28Å; S54-E56 PolarHBondContact O-N 3.39Å; S54-S84 PolarHBondContact N-O 2.94Å
55	N	89.2	Confident	96.2	Very high	133 Å²	133	27 Å²	27	71%	0.711	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.5	14.4	-176	-48.5	-52.3	0	0	0	115.9	Q52 K53	Q52-N55 PolarHBondContact OE1-O 3.39Å; K53-N55 PolarHBondContact O-N 3.04Å
56	E	92.2	Very high	96.2	Very high	141 Å²	141	30.7 Å²	30.7	66%	0.659	16%	0.161	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.3	174.1	-65.6	-177.3	170.1	0	0	110.2	Q52 K53 S54 V58	Q52-E56 CarbonylContact C-O 3.46Å; Q52-E56 WeakPolarHBondContact CA-O 3.43Å; Q52-E56 WeakPolarHBondContact CB-O 3.29Å; K53-E56 PolarHBondContact N-O 3.46Å; K53-E56 PolarHBondContact O-N 3.14Å; S54-E56 VanDerWaalsContact C-N 3.28Å; S54-E56 PolarHBondContact O-N 3.39Å; E56-V58 PolarHBondContact O-N 3.5Å
57	H	94.5	Very high	96.3	Very high	42 Å²	42	32.5 Å²	32.5	19%	0.194	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	125.1	171.3	176.2	68.6	0	0	0	109.8	D50 C59 L94 G223	D50-H57 IonicContact OD1-CE1 2.76Å; D50-H57 IonicContact OD1-CG 3.53Å; D50-H57 IonicContact OD1-ND1 2.73Å; D50-H57 PolarHBondContact OD1-ND1 3.41Å; H57-C59 PolarHBondContact CE1-O 3.49Å; H57-L94 HydrophobicContact CB-CD1 4.05Å; H57-L94 HydrophobicContact CB-CD2 4.21Å; H57-G223 PolarHBondContact NE2-O 3.25Å
58	V	94.4	Very high	96.3	Very high	52 Å²	52	33.3 Å²	33.3	32%	0.315	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	-33.2	178.4	-66.6	0	0	0	0	113.4	I51 K53 E56 Y85	I51-V58 HydrophobicContact CG2-CG2 4.46Å; I51-V58 VanDerWaalsContact O-CG2 3.23Å; I51-V58 WeakPolarHBondContact O-CG2 3.47Å; I51-V58 PolarHBondContact O-N 2.97Å; K53-V58 HydrophobicContact CB-CB 4.46Å; K53-V58 HydrophobicContact CB-CG1 3.73Å; K53-V58 HydrophobicContact CB-CG2 3.86Å; E56-V58 PolarHBondContact O-N 3.5Å; V58-Y85 HydrophobicContact CG2-CE1 4.48Å
59	C	97.1	Very high	96.3	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.034	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	161.6	-179.7	-82.1	0	0	0	0	111.5	I51 H57 C75 S225	I51-C59 WeakPolarHBondContact CA-O 3.42Å; I51-C59 HydrophobicContact CB-CB 4.35Å; I51-C59 VanDerWaalsContact CB-O 3.28Å; I51-C59 WeakPolarHBondContact CB-O 3.39Å; I51-C59 PolarHBondContact N-O 3.49Å; I51-C59 PolarHBondContact O-N 3.21Å; H57-C59 PolarHBondContact CE1-O 3.49Å; C59-C75 HydrophobicContact CB-CB 3.78Å; C59-C75 WeakPolarHBondContact CB-SG 3.4Å; C59-C75 WeakPolarHBondContact SG-CB 3.16Å; C59-C75 CovalentContact SG-SG 2.03Å; C59-C75 PolarHBondContact SG-SG 3.49Å; C59-S225 CarbonylContact C-O 3.56Å; C59-S225 WeakPolarHBondContact CA-O 3.34Å; C59-S225 WeakPolarHBondContact CB-O 3.49Å
60	G	97.9	Very high	96.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	175.9	163.6	0	0	0	0	0	113.5	I49 I51 S71 S225 G226	I49-G60 CarbonylContact O-C 3.43Å; I49-G60 WeakPolarHBondContact O-CA 3.26Å; I51-G60 VanDerWaalsContact CD1-O 3.25Å; I51-G60 WeakPolarHBondContact CD1-O 3.33Å; G60-S71 PolarHBondContact O-OG 2.92Å; G60-S225 PolarHBondContact N-O 3.25Å; G60-G226 CarbonylContact O-C 3.5Å; G60-G226 VanDerWaalsContact O-C 3.25Å
61	G	98.5	Very high	96.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	-177.5	171.2	0	0	0	0	0	111.4	I49 L70 G226	I49-G61 PolarHBondContact N-O 3.06Å; I49-G61 PolarHBondContact O-N 3.42Å; G61-L70 CarbonylContact C-O 3.53Å; G61-L70 VanDerWaalsContact CA-O 3.25Å; G61-L70 WeakPolarHBondContact CA-O 3.42Å; G61-G226 WeakPolarHBondContact CA-O 3.1Å
62	S	98.7	Very high	96.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	130.5	-179.1	44.2	0	0	0	0	111.2	W47 I64 V69 L70 Q240	W47-S62 CarbonylContact O-C 3.58Å; W47-S62 VanDerWaalsContact O-CA 3.29Å; W47-S62 WeakPolarHBondContact O-CA 3.37Å; S62-I64 PolarHBondContact O-N 3.43Å; S62-V69 CarbonylContact O-C 3.46Å; S62-V69 VanDerWaalsContact O-CA 3.29Å; S62-V69 WeakPolarHBondContact O-CA 3.48Å; S62-L70 PolarHBondContact N-O 3.48Å; S62-L70 PolarHBondContact O-N 2.84Å; S62-L70 WeakPolarHBondContact OG-CB 3.11Å; S62-L70 PolarHBondContact OG-O 2.89Å; S62-L70 VanDerWaalsContact OG-O 3.13Å; S62-Q240 VanDerWaalsContact CB-OE1 3.32Å; S62-Q240 PolarHBondContact OG-NE2 3.02Å; S62-Q240 PolarHBondContact OG-OE1 3Å
63	L	98.3	Very high	96.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	124.7	174	-163.3	61.9	0	0	0	109.9	W47 I49 T65 V69 I89 L129 V133 W135 I139 P141 V142	W47-L63 HydrophobicContact CB-CB 4.3Å; W47-L63 PolarHBondContact O-N 2.93Å; I49-L63 HydrophobicContact CD1-CB 4.14Å; I49-L63 HydrophobicContact CD1-CD1 4.43Å; L63-T65 WeakPolarHBondContact CD1-O 3.41Å; L63-T65 WeakPolarHBondContact CG-O 3.31Å; L63-V69 HydrophobicContact CD1-CG2 3.9Å; L63-I89 HydrophobicContact CD2-CG2 4.14Å; L63-L129 HydrophobicContact CD1-CD1 4.26Å; L63-V133 HydrophobicContact CD2-CG2 3.86Å; L63-W135 HydrophobicContact CD2-CH2 4.42Å; L63-W135 HydrophobicContact CD2-CZ3 3.65Å; L63-W135 HydrophobicContact CG-CZ3 4.32Å; L63-I139 HydrophobicContact CD2-CG2 3.74Å; L63-P141 CarbonylContact O-C 3.53Å; L63-P141 VanDerWaalsContact O-CA 3.25Å; L63-P141 WeakPolarHBondContact O-CA 3.32Å; L63-V142 PolarHBondContact O-N 2.53Å
64	I	97.8	Very high	96.6	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.015	17%	0.168	C	C	.	.			trans	-117.2	-25.4	-176.8	60.2	163.3	0	0	0	112.8	Q23 S62 W68 L70 L126 V142 L144 I269 V273	Q23-I64 PolarHBondContact NE2-O 3.24Å; S62-I64 PolarHBondContact O-N 3.43Å; I64-W68 HydrophobicContact CD1-CB 4.01Å; I64-W68 HydrophobicContact CG1-CB 3.75Å; I64-W68 VanDerWaalsContact CG1-O 3.22Å; I64-W68 WeakPolarHBondContact CG1-O 3.19Å; I64-W68 PolarHBondContact N-O 3.1Å; I64-L70 HydrophobicContact CD1-CB 4.31Å; I64-L70 HydrophobicContact CG2-CB 3.71Å; I64-L70 HydrophobicContact CG2-CD2 4.26Å; I64-L126 HydrophobicContact CD1-CD2 3.66Å; I64-V142 HydrophobicContact CG2-CG1 4.16Å; I64-L144 HydrophobicContact CB-CD1 3.96Å; I64-L144 HydrophobicContact CB-CG 4.38Å; I64-L144 HydrophobicContact CD1-CD1 3.96Å; I64-L144 HydrophobicContact CG2-CD1 3.81Å; I64-L144 HydrophobicContact CG2-CD2 3.81Å; I64-L144 HydrophobicContact CG2-CG 3.97Å; I64-I269 HydrophobicContact CD1-CG2 4.48Å; I64-V273 HydrophobicContact CD1-CG2 4.23Å
65	T	96.5	Very high	96.9	Very high	6 Å²	6	28 Å²	28	4%	0.037	14%	0.142	C	C	.	.	S	Bend	trans	-142.3	-175.3	167.4	74	0	0	0	0	109.5	L63 D67 W68 W135 V273	L63-T65 WeakPolarHBondContact CD1-O 3.41Å; L63-T65 WeakPolarHBondContact CG-O 3.31Å; T65-D67 PolarHBondContact O-N 3.21Å; T65-D67 PolarHBondContact OG1-N 2.82Å; T65-D67 PolarHBondContact OG1-OD1 2.87Å; T65-W68 HydrophobicContact CG2-CB 4.48Å; T65-W68 PolarHBondContact N-O 2.93Å; T65-W68 VanDerWaalsContact OG1-CB 3.32Å; T65-W68 WeakPolarHBondContact OG1-CB 3.38Å; T65-W68 PolarHBondContact OG1-N 3.23Å; T65-W135 VanDerWaalsContact C-CH2 3.43Å; T65-V273 HydrophobicContact CG2-CG1 3.67Å
66	Q	96.4	Very high	97.3	Very high	84 Å²	84	21.8 Å²	21.8	39%	0.393	11%	0.108	S	C	.	.	S	Bend	trans	-60.5	-26.9	176.4	-66.3	-175.5	-88.2	0	0	113.3	P132 V133 W135	Q66-P132 HydrophobicContact CB-CB 3.84Å; Q66-P132 CarbonylContact O-C 3.56Å; Q66-P132 VanDerWaalsContact O-CA 3.27Å; Q66-P132 WeakPolarHBondContact O-CA 3.29Å; Q66-V133 PolarHBondContact NE2-O 2.97Å; Q66-V133 VanDerWaalsContact NE2-O 3.15Å; Q66-V133 WeakPolarHBondContact O-CG2 3.08Å; Q66-V133 PolarHBondContact O-N 3.1Å; Q66-W135 HydrophobicContact CB-CH2 4.33Å; Q66-W135 HydrophobicContact CB-CZ2 4.14Å; Q66-W135 HydrophobicContact CG-CD2 4.36Å; Q66-W135 VanDerWaalsContact CG-CE2 3.46Å; Q66-W135 HydrophobicContact CG-CH2 3.75Å; Q66-W135 HydrophobicContact CG-CZ2 3.13Å
67	D	97.2	Very high	97.3	Very high	44 Å²	44	20.3 Å²	20.3	24%	0.235	11%	0.111	C	C	.	.	S	Bend	trans	-132.2	9	-172	69.9	-38.7	0	0	0	113.4	T65 Q128 L129 P132	T65-D67 PolarHBondContact O-N 3.21Å; T65-D67 PolarHBondContact OG1-N 2.82Å; T65-D67 PolarHBondContact OG1-OD1 2.87Å; D67-Q128 CarbonylContact O-C 3.5Å; D67-Q128 WeakPolarHBondContact O-CA 3.38Å; D67-Q128 PolarHBondContact OD2-NE2 2.95Å; D67-Q128 VanDerWaalsContact OD2-NE2 3.11Å; D67-L129 PolarHBondContact O-N 3.45Å; D67-P132 HydrophobicContact CB-CB 4.32Å
68	W	98.5	Very high	97.4	Very high	17 Å²	17	22.1 Å²	22.1	6%	0.064	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.5	178	-72.1	90.3	0	0	0	112.7	I64 T65 V110 L126 L127 Q128 T272 V273	I64-W68 HydrophobicContact CD1-CB 4.01Å; I64-W68 HydrophobicContact CG1-CB 3.75Å; I64-W68 VanDerWaalsContact CG1-O 3.22Å; I64-W68 WeakPolarHBondContact CG1-O 3.19Å; I64-W68 PolarHBondContact N-O 3.1Å; T65-W68 HydrophobicContact CG2-CB 4.48Å; T65-W68 PolarHBondContact N-O 2.93Å; T65-W68 VanDerWaalsContact OG1-CB 3.32Å; T65-W68 WeakPolarHBondContact OG1-CB 3.38Å; T65-W68 PolarHBondContact OG1-N 3.23Å; W68-V110 HydrophobicContact CH2-CG2 4.37Å; W68-V110 HydrophobicContact CZ3-CG2 4.43Å; W68-L126 HydrophobicContact CE3-CB 3.93Å; W68-L126 HydrophobicContact CZ3-CB 3.78Å; W68-L127 WeakPolarHBondContact CA-O 3.36Å; W68-Q128 HydrophobicContact CD2-CB 4.18Å; W68-Q128 HydrophobicContact CD2-CG 4.3Å; W68-Q128 HydrophobicContact CE3-CB 4.08Å; W68-Q128 HydrophobicContact CH2-CB 3.79Å; W68-Q128 HydrophobicContact CH2-CG 4.37Å; W68-Q128 HydrophobicContact CZ2-CB 3.86Å; W68-Q128 HydrophobicContact CZ2-CG 3.92Å; W68-Q128 HydrophobicContact CZ3-CB 3.89Å; W68-T272 HydrophobicContact CH2-CG2 3.64Å; W68-T272 HydrophobicContact CZ2-CG2 4.41Å; W68-T272 HydrophobicContact CZ3-CG2 3.83Å; W68-V273 HydrophobicContact CB-CG1 4.29Å; W68-V273 HydrophobicContact CB-CG2 4.26Å; W68-V273 HydrophobicContact CD2-CG1 4.42Å; W68-V273 HydrophobicContact CD2-CG2 3.63Å; W68-V273 HydrophobicContact CE3-CG2 3.91Å; W68-V273 HydrophobicContact CG-CB 4.45Å; W68-V273 HydrophobicContact CG-CG1 3.85Å; W68-V273 HydrophobicContact CG-CG2 3.79Å; W68-V273 HydrophobicContact CZ3-CG2 4.49Å
69	V	98.8	Very high	97.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.3	173.8	169.2	0	0	0	0	109.6	I49 S62 L63 L87 L126 L127 L129	I49-V69 HydrophobicContact CB-CG1 4.26Å; I49-V69 HydrophobicContact CD1-CG2 3.94Å; I49-V69 HydrophobicContact CG1-CG1 3.87Å; I49-V69 HydrophobicContact CG1-CG2 3.87Å; I49-V69 HydrophobicContact CG2-CG1 4.23Å; S62-V69 CarbonylContact O-C 3.46Å; S62-V69 VanDerWaalsContact O-CA 3.29Å; S62-V69 WeakPolarHBondContact O-CA 3.48Å; L63-V69 HydrophobicContact CD1-CG2 3.9Å; V69-L87 HydrophobicContact CB-CD2 4.12Å; V69-L87 HydrophobicContact CG1-CD2 4.26Å; V69-L87 HydrophobicContact CG2-CD2 4Å; V69-L126 WeakPolarHBondContact O-CA 3.49Å; V69-L127 HydrophobicContact CB-CB 4.26Å; V69-L127 PolarHBondContact N-O 2.03Å; V69-L127 PolarHBondContact O-N 2.82Å; V69-L129 HydrophobicContact CG2-CD2 3.95Å; V69-L129 HydrophobicContact CG2-CG 4.44Å
70	L	98.8	Very high	97.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.5	173.8	173	67.6	0	0	0	109.6	G61 S62 I64 I124 L126 L144 V243 L262	G61-L70 CarbonylContact C-O 3.53Å; G61-L70 VanDerWaalsContact CA-O 3.25Å; G61-L70 WeakPolarHBondContact CA-O 3.42Å; S62-L70 PolarHBondContact N-O 3.48Å; S62-L70 PolarHBondContact O-N 2.84Å; S62-L70 WeakPolarHBondContact OG-CB 3.11Å; S62-L70 PolarHBondContact OG-O 2.89Å; S62-L70 VanDerWaalsContact OG-O 3.13Å; I64-L70 HydrophobicContact CD1-CB 4.31Å; I64-L70 HydrophobicContact CG2-CB 3.71Å; I64-L70 HydrophobicContact CG2-CD2 4.26Å; L70-I124 HydrophobicContact CD1-CD1 3.63Å; L70-I124 HydrophobicContact CD1-CG1 3.55Å; L70-L126 HydrophobicContact CB-CD2 4.38Å; L70-L126 HydrophobicContact CD1-CD2 3.95Å; L70-L144 HydrophobicContact CD2-CD2 3.69Å; L70-V243 HydrophobicContact CD1-CG2 4.29Å; L70-V243 HydrophobicContact CD2-CG2 4.07Å; L70-V243 HydrophobicContact CG-CG2 3.98Å; L70-L262 HydrophobicContact CD1-CD2 4.3Å; L70-L262 HydrophobicContact CD2-CD1 3.79Å; L70-L262 HydrophobicContact CD2-CD2 3.73Å; L70-L262 HydrophobicContact CD2-CG 4.44Å
71	S	98.8	Very high	97.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	-168.2	179.8	-172	0	0	0	0	110.3	I51 G60 I124 A125 G226	I51-S71 WeakPolarHBondContact CD1-OG 3.44Å; G60-S71 PolarHBondContact O-OG 2.92Å; S71-I124 CarbonylContact O-C 3.58Å; S71-A125 PolarHBondContact N-O 3.13Å; S71-A125 PolarHBondContact O-N 2.78Å; S71-G226 WeakPolarHBondContact OG-CA 3.24Å
72	A	98.6	Very high	97.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.173	C	C	.	.			trans	-96	151.7	178.6	0	0	0	0	0	111.6	C75 F76 A125 V243	A72-C75 WeakPolarHBondContact O-CB 3.41Å; A72-F76 WeakPolarHBondContact O-CD2 3.47Å; A72-F76 VanDerWaalsContact O-CE2 3.24Å; A72-F76 WeakPolarHBondContact O-CE2 3.41Å; A72-A125 WeakPolarHBondContact O-CB 2.98Å; A72-V243 HydrophobicContact CB-CG1 3.99Å
73	A	98.5	Very high	97.1	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.008	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-71.6	-35.1	-179.8	0	0	0	0	0	112.1	C75 F76 I111 Y115 D123	A73-C75 PolarHBondContact O-N 3.44Å; A73-C75 VanDerWaalsContact O-N 3.15Å; A73-F76 PolarHBondContact O-N 3.18Å; A73-I111 HydrophobicContact CB-CB 4.33Å; A73-I111 HydrophobicContact CB-CG2 3.92Å; A73-Y115 HydrophobicContact CB-CD1 3.61Å; A73-Y115 HydrophobicContact CB-CD2 3.91Å; A73-Y115 HydrophobicContact CB-CE1 3.65Å; A73-Y115 HydrophobicContact CB-CE2 3.95Å; A73-Y115 HydrophobicContact CB-CG 3.76Å; A73-D123 WeakPolarHBondContact CA-OD1 3.44Å; A73-D123 PolarHBondContact N-OD1 3.06Å
74	H	97.1	Very high	96.9	Very high	49 Å²	49	37.2 Å²	37.2	23%	0.227	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-62.4	-21.7	179.7	74.5	-102.5	0	0	0	113.9	F76 Y115 P118 D123 S225 S245	H74-F76 PolarHBondContact O-N 2.89Å; H74-Y115 WeakPolarHBondContact CA-OH 3.4Å; H74-Y115 WeakPolarHBondContact CB-OH 3.39Å; H74-Y115 PolarHBondContact N-OH 2.98Å; H74-P118 HydrophobicContact CB-CG 3.92Å; H74-D123 IonicContact CE1-OD2 2.63Å; H74-D123 IonicContact CG-OD1 3.85Å; H74-D123 IonicContact CG-OD2 3.23Å; H74-D123 PolarHBondContact N-OD1 3.26Å; H74-D123 IonicContact ND1-OD1 2.78Å; H74-D123 PolarHBondContact ND1-OD1 3.06Å; H74-D123 IonicContact ND1-OD2 3.04Å; H74-D123 PolarHBondContact ND1-OD2 3.28Å; H74-S225 PolarHBondContact CE1-OG 2.87Å; H74-S225 WeakPolarHBondContact NE2-CB 3.29Å; H74-S225 PolarHBondContact NE2-OG 3.1Å; H74-S245 PolarHBondContact CE1-O 3.04Å
75	C	97.1	Very high	96.9	Very high	11 Å²	11	37.2 Å²	37.2	7%	0.074	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-65.7	-18.3	173.1	-63.5	0	0	0	0	112.9	C59 A72 A73 P77 Y85	C59-C75 HydrophobicContact CB-CB 3.78Å; C59-C75 WeakPolarHBondContact CB-SG 3.4Å; C59-C75 WeakPolarHBondContact SG-CB 3.16Å; C59-C75 CovalentContact SG-SG 2.03Å; C59-C75 PolarHBondContact SG-SG 3.49Å; A72-C75 WeakPolarHBondContact O-CB 3.41Å; A73-C75 PolarHBondContact O-N 3.44Å; A73-C75 VanDerWaalsContact O-N 3.15Å; C75-P77 VanDerWaalsContact C-CD 3.49Å; C75-P77 WeakPolarHBondContact O-CD 3.45Å; C75-Y85 PolarHBondContact O-OH 2.84Å
76	F	96.9	Very high	97	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.009	23%	0.231	C	C	.	.			trans	-126.9	66.6	-173.1	-49.1	-74.1	0	0	0	111.5	I51 A72 A73 H74 N78 Y85 I109 A125 L127	I51-F76 HydrophobicContact CD1-CZ 3.83Å; I51-F76 HydrophobicContact CG2-CE1 4.07Å; I51-F76 HydrophobicContact CG2-CZ 4.19Å; A72-F76 WeakPolarHBondContact O-CD2 3.47Å; A72-F76 VanDerWaalsContact O-CE2 3.24Å; A72-F76 WeakPolarHBondContact O-CE2 3.41Å; A73-F76 PolarHBondContact O-N 3.18Å; H74-F76 PolarHBondContact O-N 2.89Å; F76-N78 PolarHBondContact O-N 2.94Å; F76-N78 VanDerWaalsContact O-N 3.11Å; F76-Y85 HydrophobicContact CD1-CD1 4.24Å; F76-Y85 HydrophobicContact CD1-CD2 4.41Å; F76-Y85 AromaticContact CD1-CE1 3.82Å; F76-Y85 HydrophobicContact CD1-CE1 3.82Å; F76-Y85 HydrophobicContact CD1-CE2 4.01Å; F76-Y85 AromaticContact CD1-CZ 3.71Å; F76-Y85 AromaticContact CE1-CD1 3.98Å; F76-Y85 HydrophobicContact CE1-CD1 3.98Å; F76-Y85 AromaticContact CE1-CE1 3.91Å; F76-Y85 HydrophobicContact CE1-CE1 3.91Å; F76-Y85 HydrophobicContact CE1-CG 4.37Å; F76-I109 HydrophobicContact CB-CD1 4.31Å; F76-I109 HydrophobicContact CB-CG2 4.22Å; F76-I109 HydrophobicContact CD1-CD1 3.64Å; F76-I109 HydrophobicContact CD2-CG2 4.32Å; F76-I109 HydrophobicContact CE1-CD1 4.29Å; F76-I109 HydrophobicContact CG-CD1 4.06Å; F76-I109 HydrophobicContact CG-CG2 4.13Å; F76-A125 HydrophobicContact CD2-CB 3.66Å; F76-A125 HydrophobicContact CE2-CB 3.76Å; F76-L127 HydrophobicContact CE1-CD2 3.64Å; F76-L127 HydrophobicContact CE2-CD1 3.69Å; F76-L127 HydrophobicContact CE2-CD2 4.28Å; F76-L127 HydrophobicContact CE2-CG 4.41Å; F76-L127 HydrophobicContact CZ-CD1 3.68Å; F76-L127 HydrophobicContact CZ-CD2 3.49Å; F76-L127 VanDerWaalsContact CZ-CD2 3.49Å; F76-L127 HydrophobicContact CZ-CG 4.09Å
77	P	93.9	Very high	97.1	Very high	109 Å²	109	34.8 Å²	34.8	71%	0.708	21%	0.212	S	C	*	.	S	Bend	trans	-60.1	-26	-178.5	24.8	-35	0	0	0	113.1	C75	C75-P77 VanDerWaalsContact C-CD 3.49Å; C75-P77 WeakPolarHBondContact O-CD 3.45Å
78	N	95.3	Very high	97.2	Very high	81 Å²	81	34.6 Å²	34.6	43%	0.433	21%	0.209	S	C	.	.	S	Bend	trans	-122.7	92.9	168	-176.4	2.6	0	0	0	109.7	F76 S80 D81	F76-N78 PolarHBondContact O-N 2.94Å; F76-N78 VanDerWaalsContact O-N 3.11Å; N78-S80 PolarHBondContact O-N 3.37Å; N78-S80 VanDerWaalsContact O-N 3.16Å; N78-S80 WeakPolarHBondContact OD1-CB 3.26Å; N78-S80 PolarHBondContact OD1-N 3.36Å; N78-D81 HydrophobicContact CB-CB 4.14Å; N78-D81 PolarHBondContact O-N 2.93Å; N78-D81 VanDerWaalsContact O-N 3.13Å
79	P	94.6	Very high	97.2	Very high	39 Å²	39	33.8 Å²	33.8	25%	0.253	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9	-177.7	28.8	-35.6	0	0	0	113.6	L82 I109 I111	P79-L82 VanDerWaalsContact O-CD2 3.3Å; P79-L82 WeakPolarHBondContact O-CD2 3.48Å; P79-I109 HydrophobicContact CB-CB 4.11Å; P79-I109 HydrophobicContact CB-CG2 3.93Å; P79-I111 HydrophobicContact CG-CD1 4.03Å
80	S	96.8	Very high	97.1	Very high	102 Å²	102	34.2 Å²	34.2	71%	0.713	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-18	173.9	-57.6	0	0	0	0	112.9	N78 L82	N78-S80 PolarHBondContact O-N 3.37Å; N78-S80 VanDerWaalsContact O-N 3.16Å; N78-S80 WeakPolarHBondContact OD1-CB 3.26Å; N78-S80 PolarHBondContact OD1-N 3.36Å; S80-L82 VanDerWaalsContact C-N 3.29Å; S80-L82 PolarHBondContact O-N 3.19Å
81	D	96.1	Very high	97	Very high	37 Å²	37	35.4 Å²	35.4	20%	0.198	21%	0.214	C	C	.	.			trans	-83.4	70.5	178.9	176.6	20.8	0	0	0	110.8	N78 S84 Y85	N78-D81 HydrophobicContact CB-CB 4.14Å; N78-D81 PolarHBondContact O-N 2.93Å; N78-D81 VanDerWaalsContact O-N 3.13Å; D81-S84 WeakPolarHBondContact OD1-CB 3.37Å; D81-S84 PolarHBondContact OD1-N 2.96Å; D81-S84 PolarHBondContact OD1-OG 3.31Å; D81-S84 WeakPolarHBondContact OD2-CB 3.29Å; D81-S84 PolarHBondContact OD2-OG 3.03Å; D81-Y85 WeakPolarHBondContact O-CD2 3.33Å; D81-Y85 WeakPolarHBondContact O-CE2 3.29Å
82	L	96.4	Very high	96.8	Very high	50 Å²	50	37.6 Å²	37.6	26%	0.262	22%	0.223	S	C	.	.			trans	-72.8	-34.3	-175.9	-54.4	-178.9	0	0	0	112.7	P79 S80 S84 Y85 V106 K107 I109	P79-L82 VanDerWaalsContact O-CD2 3.3Å; P79-L82 WeakPolarHBondContact O-CD2 3.48Å; S80-L82 VanDerWaalsContact C-N 3.29Å; S80-L82 PolarHBondContact O-N 3.19Å; L82-S84 PolarHBondContact O-N 3.34Å; L82-Y85 PolarHBondContact O-N 3.27Å; L82-V106 HydrophobicContact CD2-CG1 4.08Å; L82-K107 WeakPolarHBondContact CD1-O 3.12Å; L82-I109 HydrophobicContact CD2-CB 4.31Å; L82-I109 HydrophobicContact CD2-CD1 3.78Å; L82-I109 HydrophobicContact CD2-CG1 3.68Å
83	S	96.1	Very high	96.6	Very high	113 Å²	113	39.5 Å²	39.5	79%	0.79	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.3	-173.7	46.1	0	0	0	0	113.7	Y85	S83-Y85 PolarHBondContact O-N 3.45Å
84	S	95.8	Very high	96.4	Very high	34 Å²	34	41 Å²	41	24%	0.238	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.6	179.2	-64.1	0	0	0	0	113.2	K53 S54 D81 L82	K53-S84 VanDerWaalsContact CA-O 3.27Å; K53-S84 WeakPolarHBondContact CA-O 3.5Å; S54-S84 PolarHBondContact N-O 2.94Å; D81-S84 WeakPolarHBondContact OD1-CB 3.37Å; D81-S84 PolarHBondContact OD1-N 2.96Å; D81-S84 PolarHBondContact OD1-OG 3.31Å; D81-S84 WeakPolarHBondContact OD2-CB 3.29Å; D81-S84 PolarHBondContact OD2-OG 3.03Å; L82-S84 PolarHBondContact O-N 3.34Å
85	Y	97.9	Very high	96.1	Very high	3 Å²	3	44.9 Å²	44.9	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.6	-174.1	-59.3	-82.7	0	0	0	113.7	I51 Q52 K53 V58 C75 F76 D81 L82 S83 I109	I51-Y85 HydrophobicContact CG2-CD1 4.07Å; Q52-Y85 VanDerWaalsContact O-CA 3.27Å; Q52-Y85 WeakPolarHBondContact O-CA 3.24Å; K53-Y85 HydrophobicContact CB-CD1 4.12Å; K53-Y85 HydrophobicContact CB-CE1 4.03Å; K53-Y85 HydrophobicContact CD-CE1 3.94Å; K53-Y85 HydrophobicContact CG-CD1 4.34Å; K53-Y85 HydrophobicContact CG-CE1 4.07Å; V58-Y85 HydrophobicContact CG2-CE1 4.48Å; C75-Y85 PolarHBondContact O-OH 2.84Å; F76-Y85 HydrophobicContact CD1-CD1 4.24Å; F76-Y85 HydrophobicContact CD1-CD2 4.41Å; F76-Y85 AromaticContact CD1-CE1 3.82Å; F76-Y85 HydrophobicContact CD1-CE1 3.82Å; F76-Y85 HydrophobicContact CD1-CE2 4.01Å; F76-Y85 AromaticContact CD1-CZ 3.71Å; F76-Y85 AromaticContact CE1-CD1 3.98Å; F76-Y85 HydrophobicContact CE1-CD1 3.98Å; F76-Y85 AromaticContact CE1-CE1 3.91Å; F76-Y85 HydrophobicContact CE1-CE1 3.91Å; F76-Y85 HydrophobicContact CE1-CG 4.37Å; D81-Y85 WeakPolarHBondContact O-CD2 3.33Å; D81-Y85 WeakPolarHBondContact O-CE2 3.29Å; L82-Y85 PolarHBondContact O-N 3.27Å; S83-Y85 PolarHBondContact O-N 3.45Å; Y85-I109 HydrophobicContact CD2-CD1 4.32Å; Y85-I109 HydrophobicContact CE2-CD1 4.4Å
86	V	98.3	Very high	95.9	Very high	39 Å²	39	45.7 Å²	45.7	24%	0.236	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	130.6	169.6	-177.7	0	0	0	0	108.5	Q52 Y88	Q52-V86 PolarHBondContact N-O 2.67Å; Q52-V86 PolarHBondContact O-N 3.43Å; V86-Y88 HydrophobicContact CB-CE2 4.23Å; V86-Y88 HydrophobicContact CG1-CD2 4.25Å; V86-Y88 HydrophobicContact CG1-CE2 3.74Å
87	L	98.5	Very high	95.7	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.8	179.6	-80	61.2	0	0	0	109	I49 D50 I51 V69 I89 S103 R104 V106 L127 L129	I49-L87 HydrophobicContact CG2-CB 4.1Å; I49-L87 HydrophobicContact CG2-CD2 4.25Å; I49-L87 HydrophobicContact CG2-CG 4.03Å; D50-L87 WeakPolarHBondContact O-CA 3.35Å; I51-L87 HydrophobicContact CG1-CG 4.29Å; I51-L87 HydrophobicContact CG2-CD1 4.16Å; V69-L87 HydrophobicContact CB-CD2 4.12Å; V69-L87 HydrophobicContact CG1-CD2 4.26Å; V69-L87 HydrophobicContact CG2-CD2 4Å; L87-I89 HydrophobicContact CB-CD1 4.36Å; L87-S103 CarbonylContact O-C 3.51Å; L87-S103 VanDerWaalsContact O-CA 3.29Å; L87-S103 WeakPolarHBondContact O-CA 3.46Å; L87-R104 PolarHBondContact N-O 2.03Å; L87-R104 PolarHBondContact O-N 2.96Å; L87-V106 HydrophobicContact CD1-CG2 3.35Å; L87-L127 HydrophobicContact CD1-CD2 4.17Å; L87-L127 HydrophobicContact CD2-CB 4.36Å; L87-L127 HydrophobicContact CD2-CD2 4.09Å; L87-L129 HydrophobicContact CB-CD2 4.38Å; L87-L129 HydrophobicContact CD2-CD2 3.49Å; L87-L129 VanDerWaalsContact CD2-CD2 3.49Å
88	Y	98.4	Very high	95.8	Very high	40 Å²	40	49 Å²	49	16%	0.157	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.6	173.7	-66.2	-91.3	0	0	0	110.2	D50 Q52 V86 R91 E101 L102	D50-Y88 PolarHBondContact N-O 2.92Å; D50-Y88 PolarHBondContact O-N 2.97Å; Q52-Y88 HydrophobicContact CB-CE2 4.28Å; Q52-Y88 VanDerWaalsContact CD-CE2 3.5Å; Q52-Y88 HydrophobicContact CG-CD2 3.96Å; Q52-Y88 HydrophobicContact CG-CE2 3.88Å; V86-Y88 HydrophobicContact CB-CE2 4.23Å; V86-Y88 HydrophobicContact CG1-CD2 4.25Å; V86-Y88 HydrophobicContact CG1-CE2 3.74Å; Y88-R91 VanDerWaalsContact CG-NH1 3.26Å; Y88-E101 HydrophobicContact CD1-CG 3.9Å; Y88-E101 VanDerWaalsContact CD1-OE1 3.26Å; Y88-E101 WeakPolarHBondContact CD1-OE1 3.36Å; Y88-E101 WeakPolarHBondContact CE1-OE1 3.47Å; Y88-L102 WeakPolarHBondContact CA-O 3.27Å
89	I	98.3	Very high	95.8	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.2	-173.6	-54.5	101.5	0	0	0	108	I49 L63 L87 R91 E101 L102 R104 I139	I49-I89 HydrophobicContact CD1-CB 4.06Å; I49-I89 HydrophobicContact CD1-CG1 3.35Å; I49-I89 HydrophobicContact CD1-CG2 3.96Å; L63-I89 HydrophobicContact CD2-CG2 4.14Å; L87-I89 HydrophobicContact CB-CD1 4.36Å; I89-R91 PolarHBondContact O-N 2.92Å; I89-E101 CarbonylContact O-C 3.57Å; I89-E101 VanDerWaalsContact O-CA 3.31Å; I89-E101 WeakPolarHBondContact O-CA 3.34Å; I89-L102 HydrophobicContact CB-CD1 3.78Å; I89-L102 HydrophobicContact CB-CG 4.18Å; I89-L102 HydrophobicContact CD1-CD1 3.45Å; I89-L102 VanDerWaalsContact CD1-CD1 3.45Å; I89-L102 HydrophobicContact CG1-CD1 4.12Å; I89-L102 PolarHBondContact N-O 2.93Å; I89-L102 PolarHBondContact O-N 3.15Å; I89-R104 HydrophobicContact CD1-CB 4.16Å; I89-R104 HydrophobicContact CD1-CG 3.91Å; I89-I139 HydrophobicContact CG2-CB 4.44Å; I89-I139 HydrophobicContact CG2-CD1 4.28Å; I89-I139 HydrophobicContact CG2-CG1 4.07Å; I89-I139 HydrophobicContact CG2-CG2 3.71Å
90	G	96.7	Very high	95.8	Very high	9 Å²	9	53.9 Å²	53.9	9%	0.093	30%	0.299	C	S	.	.	S	Bend	trans	72.3	14.1	-174	0	0	0	0	0	113.8
91	R	96.4	Very high	95.8	Very high	24 Å²	24	51.9 Å²	51.9	9%	0.091	28%	0.279	C	S	.	.			trans	-75.6	138.3	175.6	174.2	166.4	-76.5	179.5	-6.5	110.4	D50 Y88 I89 E101 W162	D50-R91 WeakPolarHBondContact OD2-CD 3.1Å; D50-R91 IonicContact OD2-CZ 3.68Å; D50-R91 IonicContact OD2-NE 3.25Å; D50-R91 IonicContact OD2-NH1 2.7Å; D50-R91 PolarHBondContact OD2-NH1 3.44Å; Y88-R91 VanDerWaalsContact CG-NH1 3.26Å; I89-R91 PolarHBondContact O-N 2.92Å; R91-E101 IonicContact CZ-OE1 3.7Å; R91-E101 IonicContact CZ-OE2 2.66Å; R91-E101 VanDerWaalsContact CZ-OE2 3.23Å; R91-E101 IonicContact NE-OE1 3.82Å; R91-E101 IonicContact NE-OE2 3.64Å; R91-E101 PolarHBondContact NE-OE2 3.34Å; R91-E101 IonicContact NH2-OE1 3.82Å; R91-E101 PolarHBondContact NH2-OE1 3.19Å; R91-E101 IonicContact NH2-OE2 3.87Å; R91-E101 PolarHBondContact NH2-OE2 2.82Å; R91-W162 HydrophobicContact CB-CZ2 4.43Å; R91-W162 HydrophobicContact CG-CZ2 4.08Å; R91-W162 WeakPolarHBondContact O-CZ2 3.33Å
92	Y	94.9	Very high	95.8	Very high	46 Å²	46	51.8 Å²	51.8	18%	0.18	28%	0.278	C	S	.	.			trans	-113.2	-41.9	177.1	175.4	-126.1	0	0	0	111.9	A40 N42 N98 W162 T176 L177	A40-Y92 WeakPolarHBondContact O-CE2 3.41Å; A40-Y92 PolarHBondContact O-OH 3.33Å; A40-Y92 VanDerWaalsContact O-OH 3.11Å; N42-Y92 HydrophobicContact CB-CD1 3.97Å; N42-Y92 HydrophobicContact CB-CD2 4.07Å; N42-Y92 HydrophobicContact CB-CE1 4.08Å; N42-Y92 HydrophobicContact CB-CE2 4.16Å; N42-Y92 HydrophobicContact CB-CG 3.97Å; Y92-N98 WeakPolarHBondContact CA-OD1 3.34Å; Y92-N98 PolarHBondContact N-OD1 3.19Å; Y92-W162 PolarHBondContact O-NE1 3.02Å; Y92-T176 HydrophobicContact CD2-CG2 4.43Å; Y92-T176 HydrophobicContact CE1-CG2 4.2Å; Y92-T176 HydrophobicContact CE2-CG2 3.57Å; Y92-T176 VanDerWaalsContact CZ-CG2 3.43Å; Y92-T176 VanDerWaalsContact OH-CG2 3.3Å; Y92-T176 WeakPolarHBondContact OH-CG2 3.37Å; Y92-L177 HydrophobicContact CD2-CB 4.36Å; Y92-L177 PolarHBondContact O-N 3.34Å
93	Q	95.4	Very high	95.9	Very high	40 Å²	40	52.4 Å²	52.4	19%	0.187	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-121.8	134.4	-179.1	-70.2	173.9	-18.3	0	0	110.8	N98 V174 G175	Q93-N98 PolarHBondContact N-OD1 3.28Å; Q93-N98 PolarHBondContact O-ND2 3.33Å; Q93-N98 PolarHBondContact O-OD1 3.31Å; Q93-V174 HydrophobicContact CB-CG2 4.42Å; Q93-V174 VanDerWaalsContact CD-CG2 3.48Å; Q93-V174 HydrophobicContact CG-CG2 3.95Å; Q93-G175 CarbonylContact C-O 3.56Å; Q93-G175 VanDerWaalsContact CA-O 3.31Å; Q93-G175 WeakPolarHBondContact CA-O 3.09Å
94	L	93.8	Very high	96	Very high	32 Å²	32	49.6 Å²	49.6	17%	0.168	26%	0.259	C	S	.	.	S	Bend	trans	-65.3	-41.8	178.4	-70.1	-175	0	0	0	112.8	D50 H57 W162 V174 G175	D50-L94 WeakPolarHBondContact OD2-CD2 3.21Å; H57-L94 HydrophobicContact CB-CD1 4.05Å; H57-L94 HydrophobicContact CB-CD2 4.21Å; L94-W162 HydrophobicContact CD1-CB 3.59Å; L94-W162 HydrophobicContact CD1-CG 4.02Å; L94-W162 HydrophobicContact CD2-CB 4.04Å; L94-W162 HydrophobicContact CD2-CD2 3.88Å; L94-W162 HydrophobicContact CD2-CE3 4.39Å; L94-W162 HydrophobicContact CD2-CG 3.72Å; L94-W162 HydrophobicContact CG-CB 3.83Å; L94-W162 HydrophobicContact CG-CD2 4.32Å; L94-W162 HydrophobicContact CG-CG 3.67Å; L94-V174 PolarHBondContact N-O 2.89Å; L94-G175 PolarHBondContact N-O 3.25Å
95	N	91.6	Very high	96.1	Very high	132 Å²	132	51.7 Å²	51.7	71%	0.706	27%	0.27	S	S	*	.	S	Bend	trans	-118.2	17.8	-173	-58.5	-48.3	0	0	0	112.2	V174	N95-V174 PolarHBondContact N-O 2.95Å
96	G	91.3	Very high	96.1	Very high	28 Å²	28	52.1 Å²	52.1	29%	0.289	27%	0.273	S	S	.	.	S	Bend	trans	-110.2	-174.6	-177.9	0	0	0	0	0	113.6
97	I	92.7	Very high	96.1	Very high	152 Å²	152	56.3 Å²	56.3	78%	0.779	29%	0.288	S	S	*	.			trans	-88.1	123.2	173.7	-61.5	174.4	0	0	0	108.3
98	N	96.1	Very high	96.1	Very high	28 Å²	28	63 Å²	63	15%	0.15	31%	0.313	C	S	.	.			trans	-115.3	101.8	178.8	-61.1	-73.1	0	0	0	110.6	Y92 Q93 H100 E101	Y92-N98 WeakPolarHBondContact CA-OD1 3.34Å; Y92-N98 PolarHBondContact N-OD1 3.19Å; Q93-N98 PolarHBondContact N-OD1 3.28Å; Q93-N98 PolarHBondContact O-ND2 3.33Å; Q93-N98 PolarHBondContact O-OD1 3.31Å; N98-H100 VanDerWaalsContact C-N 3.26Å; N98-H100 PolarHBondContact O-N 3.1Å; N98-E101 HydrophobicContact CB-CB 3.52Å; N98-E101 HydrophobicContact CB-CG 4.44Å; N98-E101 WeakPolarHBondContact CB-OE2 3.08Å; N98-E101 PolarHBondContact ND2-OE2 2.77Å; N98-E101 VanDerWaalsContact ND2-OE2 3.07Å; N98-E101 PolarHBondContact O-N 2.86Å
99	E	95.4	Very high	96.1	Very high	167 Å²	167	61.8 Å²	61.8	78%	0.78	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-24.3	-176.1	-63.4	-175.9	173.4	0	0	114.3
100	H	95	Very high	96.2	Very high	56 Å²	56	62.7 Å²	62.7	26%	0.259	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	4.5	-174.1	-50.7	-49.5	0	0	0	113.2	N98 Y138	N98-H100 VanDerWaalsContact C-N 3.26Å; N98-H100 PolarHBondContact O-N 3.1Å; H100-Y138 HydrophobicContact CB-CD1 4.4Å; H100-Y138 HydrophobicContact CB-CD2 4.02Å; H100-Y138 HydrophobicContact CB-CG 3.81Å; H100-Y138 AromaticContact CD2-CD1 3.33Å; H100-Y138 WeakPolarHBondContact CD2-CD1 3.38Å; H100-Y138 AromaticContact CD2-CD2 3.41Å; H100-Y138 VanDerWaalsContact CD2-CD2 3.41Å; H100-Y138 WeakPolarHBondContact CD2-CD2 3.29Å; H100-Y138 AromaticContact CD2-CE1 3.32Å; H100-Y138 WeakPolarHBondContact CD2-CE1 3.5Å; H100-Y138 AromaticContact CD2-CE2 3.42Å; H100-Y138 VanDerWaalsContact CD2-CE2 3.42Å; H100-Y138 WeakPolarHBondContact CD2-CE2 3.35Å; H100-Y138 AromaticContact CD2-CG 3.38Å; H100-Y138 AromaticContact CD2-CZ 3.37Å; H100-Y138 AromaticContact CE1-CE2 3.61Å; H100-Y138 AromaticContact CE1-CZ 3.93Å; H100-Y138 AromaticContact CG-CD2 3.45Å; H100-Y138 VanDerWaalsContact CG-CD2 3.45Å; H100-Y138 AromaticContact CG-CE2 3.8Å; H100-Y138 AromaticContact CG-CG 3.58Å; H100-Y138 AromaticContact ND1-CD2 3.85Å; H100-Y138 AromaticContact ND1-CE2 3.91Å; H100-Y138 AromaticContact NE2-CD2 3.79Å; H100-Y138 AromaticContact NE2-CE1 3.57Å; H100-Y138 AromaticContact NE2-CE2 3.28Å; H100-Y138 VanDerWaalsContact NE2-CE2 3.28Å; H100-Y138 WeakPolarHBondContact NE2-CE2 3.07Å; H100-Y138 AromaticContact NE2-CZ 3.15Å; H100-Y138 PolarHBondContact NE2-OH 3.5Å
101	E	96.5	Very high	96.2	Very high	60 Å²	60	64.7 Å²	64.7	28%	0.28	32%	0.323	S	S	.	.			trans	-72.8	143.9	-176.2	169.5	177.2	123.6	0	0	112.3	Y88 I89 R91 N98	Y88-E101 HydrophobicContact CD1-CG 3.9Å; Y88-E101 VanDerWaalsContact CD1-OE1 3.26Å; Y88-E101 WeakPolarHBondContact CD1-OE1 3.36Å; Y88-E101 WeakPolarHBondContact CE1-OE1 3.47Å; I89-E101 CarbonylContact O-C 3.57Å; I89-E101 VanDerWaalsContact O-CA 3.31Å; I89-E101 WeakPolarHBondContact O-CA 3.34Å; R91-E101 IonicContact CZ-OE1 3.7Å; R91-E101 IonicContact CZ-OE2 2.66Å; R91-E101 VanDerWaalsContact CZ-OE2 3.23Å; R91-E101 IonicContact NE-OE1 3.82Å; R91-E101 IonicContact NE-OE2 3.64Å; R91-E101 PolarHBondContact NE-OE2 3.34Å; R91-E101 IonicContact NH2-OE1 3.82Å; R91-E101 PolarHBondContact NH2-OE1 3.19Å; R91-E101 IonicContact NH2-OE2 3.87Å; R91-E101 PolarHBondContact NH2-OE2 2.82Å; N98-E101 HydrophobicContact CB-CB 3.52Å; N98-E101 HydrophobicContact CB-CG 4.44Å; N98-E101 WeakPolarHBondContact CB-OE2 3.08Å; N98-E101 PolarHBondContact ND2-OE2 2.77Å; N98-E101 VanDerWaalsContact ND2-OE2 3.07Å; N98-E101 PolarHBondContact O-N 2.86Å
102	L	97.1	Very high	96.3	Very high	35 Å²	35	64.3 Å²	64.3	18%	0.183	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.6	160.6	60.4	85.8	0	0	0	110	Y88 I89 R104 V133 I139	Y88-L102 WeakPolarHBondContact CA-O 3.27Å; I89-L102 HydrophobicContact CB-CD1 3.78Å; I89-L102 HydrophobicContact CB-CG 4.18Å; I89-L102 HydrophobicContact CD1-CD1 3.45Å; I89-L102 VanDerWaalsContact CD1-CD1 3.45Å; I89-L102 HydrophobicContact CG1-CD1 4.12Å; I89-L102 PolarHBondContact N-O 2.93Å; I89-L102 PolarHBondContact O-N 3.15Å; L102-R104 HydrophobicContact CD1-CG 4Å; L102-V133 HydrophobicContact CD1-CG1 3.74Å; L102-V133 HydrophobicContact CD2-CB 4.35Å; L102-V133 HydrophobicContact CD2-CG1 4.32Å; L102-I139 HydrophobicContact CD2-CD1 3.49Å; L102-I139 VanDerWaalsContact CD2-CD1 3.49Å; L102-I139 HydrophobicContact CG-CD1 3.99Å
103	S	97.6	Very high	96.3	Very high	63 Å²	63	67.3 Å²	67.3	44%	0.441	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	149.2	174.3	65	0	0	0	0	111.7	L87	L87-S103 CarbonylContact O-C 3.51Å; L87-S103 VanDerWaalsContact O-CA 3.29Å; L87-S103 WeakPolarHBondContact O-CA 3.46Å
104	R	98.4	Very high	96.2	Very high	53 Å²	53	67.9 Å²	67.9	20%	0.2	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.8	174.4	-67.5	-64	-176.9	-92.7	3.8	110.2	L87 I89 L102 L129 S131 P132	L87-R104 PolarHBondContact N-O 2.03Å; L87-R104 PolarHBondContact O-N 2.96Å; I89-R104 HydrophobicContact CD1-CB 4.16Å; I89-R104 HydrophobicContact CD1-CG 3.91Å; L102-R104 HydrophobicContact CD1-CG 4Å; R104-L129 HydrophobicContact CB-CB 4.27Å; R104-L129 HydrophobicContact CB-CD2 4.05Å; R104-L129 HydrophobicContact CG-CB 4.39Å; R104-L129 HydrophobicContact CG-CD1 4.24Å; R104-S131 WeakPolarHBondContact CD-O 3.43Å; R104-S131 VanDerWaalsContact CD-OG 3.32Å; R104-S131 WeakPolarHBondContact CD-OG 3.44Å; R104-S131 PolarHBondContact NE-O 2.93Å; R104-S131 VanDerWaalsContact NE-O 3.16Å; R104-S131 PolarHBondContact NE-OG 3.15Å; R104-P132 PolarHBondContact NH2-O 3.16Å
105	T	98.3	Very high	96.4	Very high	79 Å²	79	68.4 Å²	68.4	49%	0.485	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	162	165.6	51.9	0	0	0	0	110.6	S130	T105-S130 PolarHBondContact N-OG 3.33Å; T105-S130 WeakPolarHBondContact O-CB 3.21Å; T105-S130 PolarHBondContact O-N 2.83Å; T105-S130 PolarHBondContact O-OG 2.9Å; T105-S130 WeakPolarHBondContact OG1-CB 3.33Å; T105-S130 PolarHBondContact OG1-OG 3.11Å
106	V	98.4	Very high	96.6	Very high	11 Å²	11	69.5 Å²	69.5	7%	0.067	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	127.2	-179.9	-172.9	0	0	0	0	110.6	L82 L87 I109 L127	L82-V106 HydrophobicContact CD2-CG1 4.08Å; L87-V106 HydrophobicContact CD1-CG2 3.35Å; V106-I109 HydrophobicContact CG1-CD1 4.32Å; V106-I109 HydrophobicContact CG1-CG1 3.67Å; V106-L127 HydrophobicContact CG1-CD2 4.34Å; V106-L127 HydrophobicContact CG2-CD2 4.11Å
107	K	98.4	Very high	96.8	Very high	127 Å²	127	71.3 Å²	71.3	55%	0.552	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	-36.3	174.1	-177.4	175.4	176.7	-176.5	0	112.3	L82 Q128	L82-K107 WeakPolarHBondContact CD1-O 3.12Å; K107-Q128 HydrophobicContact CB-CB 4.36Å; K107-Q128 HydrophobicContact CB-CG 4.48Å; K107-Q128 WeakPolarHBondContact CB-O 3.42Å; K107-Q128 HydrophobicContact CD-CG 4.42Å; K107-Q128 PolarHBondContact N-O 3.45Å
108	R	98.1	Very high	96.9	Very high	141 Å²	141	65.3 Å²	65.3	53%	0.532	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	143.8	-178.3	-177.4	177.9	179.4	-165.8	-3.3	110.5	V110 L127 Q128	R108-V110 HydrophobicContact CG-CG2 3.96Å; R108-L127 WeakPolarHBondContact O-CA 3.41Å; R108-Q128 HydrophobicContact CB-CB 4.24Å; R108-Q128 PolarHBondContact O-N 3.05Å
109	I	98.6	Very high	96.8	Very high	15 Å²	15	67.7 Å²	67.7	8%	0.077	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.3	167.5	-57.9	171.2	0	0	0	108	F76 P79 L82 Y85 V106 I111 L126 L127	F76-I109 HydrophobicContact CB-CD1 4.31Å; F76-I109 HydrophobicContact CB-CG2 4.22Å; F76-I109 HydrophobicContact CD1-CD1 3.64Å; F76-I109 HydrophobicContact CD2-CG2 4.32Å; F76-I109 HydrophobicContact CE1-CD1 4.29Å; F76-I109 HydrophobicContact CG-CD1 4.06Å; F76-I109 HydrophobicContact CG-CG2 4.13Å; P79-I109 HydrophobicContact CB-CB 4.11Å; P79-I109 HydrophobicContact CB-CG2 3.93Å; L82-I109 HydrophobicContact CD2-CB 4.31Å; L82-I109 HydrophobicContact CD2-CD1 3.78Å; L82-I109 HydrophobicContact CD2-CG1 3.68Å; Y85-I109 HydrophobicContact CD2-CD1 4.32Å; Y85-I109 HydrophobicContact CE2-CD1 4.4Å; V106-I109 HydrophobicContact CG1-CD1 4.32Å; V106-I109 HydrophobicContact CG1-CG1 3.67Å; I109-I111 HydrophobicContact CG2-CG2 4.25Å; I109-L126 CarbonylContact C-O 3.43Å; I109-L127 HydrophobicContact CG1-CD2 4.34Å; I109-L127 HydrophobicContact CG1-CG 4.23Å
110	V	98.6	Very high	96.7	Very high	18 Å²	18	62 Å²	62	11%	0.109	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.9	176.8	-171.6	0	0	0	0	108.8	W68 R108 A125 L126 F268 T272	W68-V110 HydrophobicContact CH2-CG2 4.37Å; W68-V110 HydrophobicContact CZ3-CG2 4.43Å; R108-V110 HydrophobicContact CG-CG2 3.96Å; V110-A125 WeakPolarHBondContact O-CA 3.32Å; V110-L126 HydrophobicContact CB-CB 4.39Å; V110-L126 PolarHBondContact N-O 2.82Å; V110-L126 PolarHBondContact O-N 2.85Å; V110-F268 HydrophobicContact CG1-CE2 3.98Å; V110-F268 HydrophobicContact CG1-CZ 3.97Å; V110-T272 HydrophobicContact CB-CG2 4.05Å; V110-T272 HydrophobicContact CG1-CG2 4.06Å; V110-T272 HydrophobicContact CG2-CG2 3.93Å
111	I	98.3	Very high	96.8	Very high	52 Å²	52	59.4 Å²	59.4	27%	0.267	32%	0.322	S	S	.	.			trans	-119.4	149.8	174.7	60.2	174.2	0	0	0	109.7	A73 P79 I109 A125	A73-I111 HydrophobicContact CB-CB 4.33Å; A73-I111 HydrophobicContact CB-CG2 3.92Å; P79-I111 HydrophobicContact CG-CD1 4.03Å; I109-I111 HydrophobicContact CG2-CG2 4.25Å; I111-A125 HydrophobicContact CG2-CB 3.87Å
112	P	97	Very high	96.9	Very high	16 Å²	16	60.5 Å²	60.5	10%	0.104	33%	0.326	C	S	.	.			trans	-59.5	144.8	175.1	-23.1	32	0	0	0	112.4	G114 Y115 K122 I124 Y265 F268	P112-G114 PolarHBondContact O-N 2.85Å; P112-Y115 PolarHBondContact O-N 3.45Å; P112-K122 HydrophobicContact CB-CB 4.18Å; P112-K122 HydrophobicContact CB-CD 4.44Å; P112-K122 HydrophobicContact CB-CG 4.49Å; P112-K122 HydrophobicContact CG-CB 4.4Å; P112-I124 WeakPolarHBondContact CD-O 3.01Å; P112-I124 HydrophobicContact CG-CG2 3.42Å; P112-I124 VanDerWaalsContact CG-CG2 3.42Å; P112-Y265 HydrophobicContact CG-CE1 4.22Å; P112-F268 HydrophobicContact CG-CD1 4.31Å; P112-F268 HydrophobicContact CG-CD2 4.35Å; P112-F268 HydrophobicContact CG-CE1 4.04Å; P112-F268 HydrophobicContact CG-CE2 4.1Å; P112-F268 HydrophobicContact CG-CG 4.45Å; P112-F268 HydrophobicContact CG-CZ 3.94Å
113	S	95.4	Very high	96.9	Very high	109 Å²	109	58.9 Å²	58.9	76%	0.762	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	137.2	174.2	57.3	0	0	0	0	111.6	Y115 K122	S113-Y115 VanDerWaalsContact C-N 3.33Å; S113-K122 PolarHBondContact O-NZ 3.25Å
114	G	94.6	Very high	97	Very high	51 Å²	51	55.9 Å²	55.9	53%	0.526	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	15	179.1	0	0	0	0	0	115	P112	P112-G114 PolarHBondContact O-N 2.85Å
115	Y	97.2	Very high	97	Very high	43 Å²	43	53.3 Å²	53.3	17%	0.169	29%	0.287	C	S	.	.			trans	-60.5	136.4	159.8	172	-103.6	0	0	0	109.7	A73 H74 P112 S113 N117 P118 G121 K122 D123	A73-Y115 HydrophobicContact CB-CD1 3.61Å; A73-Y115 HydrophobicContact CB-CD2 3.91Å; A73-Y115 HydrophobicContact CB-CE1 3.65Å; A73-Y115 HydrophobicContact CB-CE2 3.95Å; A73-Y115 HydrophobicContact CB-CG 3.76Å; H74-Y115 WeakPolarHBondContact CA-OH 3.4Å; H74-Y115 WeakPolarHBondContact CB-OH 3.39Å; H74-Y115 PolarHBondContact N-OH 2.98Å; P112-Y115 PolarHBondContact O-N 3.45Å; S113-Y115 VanDerWaalsContact C-N 3.33Å; Y115-N117 WeakPolarHBondContact CE2-O 3.17Å; Y115-N117 WeakPolarHBondContact OH-CA 3.19Å; Y115-P118 WeakPolarHBondContact OH-CD 3.42Å; Y115-G121 WeakPolarHBondContact CD2-O 3.3Å; Y115-K122 HydrophobicContact CD2-CB 4.23Å; Y115-K122 VanDerWaalsContact CD2-O 3.25Å; Y115-K122 WeakPolarHBondContact CD2-O 3.4Å; Y115-D123 HydrophobicContact CD2-CB 4.44Å; Y115-D123 HydrophobicContact CE2-CB 3.83Å
116	Q	95.9	Very high	97	Very high	155 Å²	155	49.6 Å²	49.6	72%	0.724	26%	0.264	S	S	*	.			trans	-128.2	-49.8	178.9	-63.1	-179.9	33.8	0	0	111.8
117	N	95.2	Very high	97	Very high	66 Å²	66	49 Å²	49	35%	0.353	26%	0.261	S	S	.	.			trans	-157.3	165.6	177.9	63	71.6	0	0	0	110	Y115 N119 S120	Y115-N117 WeakPolarHBondContact CE2-O 3.17Å; Y115-N117 WeakPolarHBondContact OH-CA 3.19Å; N117-N119 VanDerWaalsContact C-N 3.33Å; N117-N119 PolarHBondContact O-N 3.07Å; N117-N119 WeakPolarHBondContact OD1-CB 3.41Å; N117-N119 PolarHBondContact OD1-N 3.19Å; N117-N119 VanDerWaalsContact OD1-N 3.14Å; N117-S120 PolarHBondContact N-OG 3.31Å; N117-S120 VanDerWaalsContact N-OG 3.14Å; N117-S120 PolarHBondContact O-N 2.88Å; N117-S120 PolarHBondContact O-OG 2.74Å; N117-S120 PolarHBondContact OD1-N 3.22Å; N117-S120 VanDerWaalsContact OD1-N 3.1Å
118	P	93.9	Very high	97.1	Very high	26 Å²	26	44.7 Å²	44.7	17%	0.169	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-55.3	-42.5	-177.1	-28.4	37.2	0	0	0	114.2	H74 Y115 S120 G121 M208 F246	H74-P118 HydrophobicContact CB-CG 3.92Å; Y115-P118 WeakPolarHBondContact OH-CD 3.42Å; P118-S120 PolarHBondContact O-N 2.85Å; P118-G121 PolarHBondContact O-N 2.93Å; P118-G121 VanDerWaalsContact O-N 3.12Å; P118-M208 WeakPolarHBondContact O-CE 3.44Å; P118-F246 HydrophobicContact CB-CB 3.99Å; P118-F246 HydrophobicContact CB-CD1 3.59Å; P118-F246 HydrophobicContact CB-CE1 4.45Å; P118-F246 HydrophobicContact CB-CG 4.09Å
119	N	94	Very high	97.1	Very high	79 Å²	79	38.1 Å²	38.1	42%	0.422	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-67	-18.7	-178.3	-60.3	43.6	0	0	0	113.2	N117 G121	N117-N119 VanDerWaalsContact C-N 3.33Å; N117-N119 PolarHBondContact O-N 3.07Å; N117-N119 WeakPolarHBondContact OD1-CB 3.41Å; N117-N119 PolarHBondContact OD1-N 3.19Å; N117-N119 VanDerWaalsContact OD1-N 3.14Å; N119-G121 VanDerWaalsContact C-N 3.32Å
120	S	95	Very high	97.1	Very high	47 Å²	47	40 Å²	40	33%	0.329	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-87.5	3	177.1	68.3	0	0	0	0	114.2	N117 P118	N117-S120 PolarHBondContact N-OG 3.31Å; N117-S120 VanDerWaalsContact N-OG 3.14Å; N117-S120 PolarHBondContact O-N 2.88Å; N117-S120 PolarHBondContact O-OG 2.74Å; N117-S120 PolarHBondContact OD1-N 3.22Å; N117-S120 VanDerWaalsContact OD1-N 3.1Å; P118-S120 PolarHBondContact O-N 2.85Å
121	G	96.7	Very high	97	Very high	2 Å²	2	41.5 Å²	41.5	2%	0.021	24%	0.244	C	C	.	.	S	Bend	trans	75.9	-169.9	-174.5	0	0	0	0	0	112.4	Y115 P118 N119 D123 D207	Y115-G121 WeakPolarHBondContact CD2-O 3.3Å; P118-G121 PolarHBondContact O-N 2.93Å; P118-G121 VanDerWaalsContact O-N 3.12Å; N119-G121 VanDerWaalsContact C-N 3.32Å; G121-D123 PolarHBondContact O-N 3.03Å; G121-D207 WeakPolarHBondContact CA-OD2 3.4Å
122	K	97.8	Very high	97	Very high	82 Å²	82	42.8 Å²	42.8	36%	0.357	26%	0.255	S	S	.	.			trans	59.8	23.1	-178.9	-57.7	175.9	178.8	179.9	0	115.2	P112 S113 Y115 I124 D207 Y265	P112-K122 HydrophobicContact CB-CB 4.18Å; P112-K122 HydrophobicContact CB-CD 4.44Å; P112-K122 HydrophobicContact CB-CG 4.49Å; P112-K122 HydrophobicContact CG-CB 4.4Å; S113-K122 PolarHBondContact O-NZ 3.25Å; Y115-K122 HydrophobicContact CD2-CB 4.23Å; Y115-K122 VanDerWaalsContact CD2-O 3.25Å; Y115-K122 WeakPolarHBondContact CD2-O 3.4Å; K122-I124 VanDerWaalsContact C-N 3.25Å; K122-I124 PolarHBondContact O-N 3.41Å; K122-D207 PolarHBondContact N-OD2 3.37Å; K122-Y265 WeakPolarHBondContact CA-OH 3.31Å; K122-Y265 WeakPolarHBondContact CG-OH 3.41Å; K122-Y265 PolarHBondContact N-OH 3.44Å; K122-Y265 VanDerWaalsContact N-OH 3.13Å
123	D	98.4	Very high	97	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.251	C	S	.	.			trans	-83.4	69	-178.1	-168	20.5	0	0	0	111.8	A73 H74 Y115 G121 S245 T260	A73-D123 WeakPolarHBondContact CA-OD1 3.44Å; A73-D123 PolarHBondContact N-OD1 3.06Å; H74-D123 IonicContact CE1-OD2 2.63Å; H74-D123 IonicContact CG-OD1 3.85Å; H74-D123 IonicContact CG-OD2 3.23Å; H74-D123 PolarHBondContact N-OD1 3.26Å; H74-D123 IonicContact ND1-OD1 2.78Å; H74-D123 PolarHBondContact ND1-OD1 3.06Å; H74-D123 IonicContact ND1-OD2 3.04Å; H74-D123 PolarHBondContact ND1-OD2 3.28Å; Y115-D123 HydrophobicContact CD2-CB 4.44Å; Y115-D123 HydrophobicContact CE2-CB 3.83Å; G121-D123 PolarHBondContact O-N 3.03Å; D123-S245 WeakPolarHBondContact CB-OG 3.47Å; D123-S245 WeakPolarHBondContact OD2-CB 3.45Å; D123-S245 PolarHBondContact OD2-OG 3.42Å; D123-T260 WeakPolarHBondContact O-CB 3.28Å; D123-T260 PolarHBondContact O-OG1 3.43Å
124	I	98.7	Very high	97	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	25%	0.246	C	C	.	.			trans	-142	139.9	-179.5	-175.8	174.7	0	0	0	110	L70 S71 P112 K122 T260 L262 Y265 F268 I269	L70-I124 HydrophobicContact CD1-CD1 3.63Å; L70-I124 HydrophobicContact CD1-CG1 3.55Å; S71-I124 CarbonylContact O-C 3.58Å; P112-I124 WeakPolarHBondContact CD-O 3.01Å; P112-I124 HydrophobicContact CG-CG2 3.42Å; P112-I124 VanDerWaalsContact CG-CG2 3.42Å; K122-I124 VanDerWaalsContact C-N 3.25Å; K122-I124 PolarHBondContact O-N 3.41Å; I124-T260 HydrophobicContact CB-CG2 4.13Å; I124-L262 HydrophobicContact CD1-CD2 3.8Å; I124-Y265 HydrophobicContact CD1-CD1 4.38Å; I124-Y265 HydrophobicContact CD1-CD2 4.41Å; I124-Y265 HydrophobicContact CD1-CG 3.89Å; I124-Y265 HydrophobicContact CG2-CD1 3.62Å; I124-Y265 HydrophobicContact CG2-CD2 4.41Å; I124-Y265 HydrophobicContact CG2-CE1 3.74Å; I124-Y265 HydrophobicContact CG2-CG 4Å; I124-F268 HydrophobicContact CD1-CD1 4.32Å; I124-F268 HydrophobicContact CG1-CE1 4.45Å; I124-F268 HydrophobicContact CG2-CD1 4.26Å; I124-F268 HydrophobicContact CG2-CE1 4.12Å; I124-I269 HydrophobicContact CD1-CD1 4.14Å; I124-I269 HydrophobicContact CD1-CG1 4.26Å
125	A	98.7	Very high	97	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.2	176.5	0	0	0	0	0	110.9	S71 A72 F76 V110 I111 L127	S71-A125 PolarHBondContact N-O 3.13Å; S71-A125 PolarHBondContact O-N 2.78Å; A72-A125 WeakPolarHBondContact O-CB 2.98Å; F76-A125 HydrophobicContact CD2-CB 3.66Å; F76-A125 HydrophobicContact CE2-CB 3.76Å; V110-A125 WeakPolarHBondContact O-CA 3.32Å; I111-A125 HydrophobicContact CG2-CB 3.87Å; A125-L127 HydrophobicContact CB-CD1 4.2Å
126	L	98.8	Very high	96.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.4	170.9	-68.8	164.9	0	0	0	109	I64 W68 V69 L70 I109 V110 F268 I269 T272 V273	I64-L126 HydrophobicContact CD1-CD2 3.66Å; W68-L126 HydrophobicContact CE3-CB 3.93Å; W68-L126 HydrophobicContact CZ3-CB 3.78Å; V69-L126 WeakPolarHBondContact O-CA 3.49Å; L70-L126 HydrophobicContact CB-CD2 4.38Å; L70-L126 HydrophobicContact CD1-CD2 3.95Å; I109-L126 CarbonylContact C-O 3.43Å; V110-L126 HydrophobicContact CB-CB 4.39Å; V110-L126 PolarHBondContact N-O 2.82Å; V110-L126 PolarHBondContact O-N 2.85Å; L126-F268 HydrophobicContact CD1-CD1 4.01Å; L126-F268 HydrophobicContact CD1-CE1 3.55Å; L126-F268 HydrophobicContact CD1-CZ 4.03Å; L126-F268 HydrophobicContact CG-CE1 4Å; L126-I269 HydrophobicContact CD1-CG1 4.32Å; L126-T272 HydrophobicContact CB-CG2 4.31Å; L126-T272 HydrophobicContact CD1-CG2 3.71Å; L126-V273 HydrophobicContact CD1-CG2 4.28Å; L126-V273 HydrophobicContact CD2-CG2 4.33Å
127	L	98.8	Very high	96.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	-179.4	-66.7	86.9	0	0	0	108.9	W68 V69 F76 L87 V106 R108 I109 A125	W68-L127 WeakPolarHBondContact CA-O 3.36Å; V69-L127 HydrophobicContact CB-CB 4.26Å; V69-L127 PolarHBondContact N-O 2.03Å; V69-L127 PolarHBondContact O-N 2.82Å; F76-L127 HydrophobicContact CE1-CD2 3.64Å; F76-L127 HydrophobicContact CE2-CD1 3.69Å; F76-L127 HydrophobicContact CE2-CD2 4.28Å; F76-L127 HydrophobicContact CE2-CG 4.41Å; F76-L127 HydrophobicContact CZ-CD1 3.68Å; F76-L127 HydrophobicContact CZ-CD2 3.49Å; F76-L127 VanDerWaalsContact CZ-CD2 3.49Å; F76-L127 HydrophobicContact CZ-CG 4.09Å; L87-L127 HydrophobicContact CD1-CD2 4.17Å; L87-L127 HydrophobicContact CD2-CB 4.36Å; L87-L127 HydrophobicContact CD2-CD2 4.09Å; V106-L127 HydrophobicContact CG1-CD2 4.34Å; V106-L127 HydrophobicContact CG2-CD2 4.11Å; R108-L127 WeakPolarHBondContact O-CA 3.41Å; I109-L127 HydrophobicContact CG1-CD2 4.34Å; I109-L127 HydrophobicContact CG1-CG 4.23Å; A125-L127 HydrophobicContact CB-CD1 4.2Å
128	Q	98.6	Very high	96.7	Very high	35 Å²	35	39.2 Å²	39.2	16%	0.164	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.8	169.7	-165.5	174.3	26.4	0	0	109.6	D67 W68 K107 R108	D67-Q128 CarbonylContact O-C 3.5Å; D67-Q128 WeakPolarHBondContact O-CA 3.38Å; D67-Q128 PolarHBondContact OD2-NE2 2.95Å; D67-Q128 VanDerWaalsContact OD2-NE2 3.11Å; W68-Q128 HydrophobicContact CD2-CB 4.18Å; W68-Q128 HydrophobicContact CD2-CG 4.3Å; W68-Q128 HydrophobicContact CE3-CB 4.08Å; W68-Q128 HydrophobicContact CH2-CB 3.79Å; W68-Q128 HydrophobicContact CH2-CG 4.37Å; W68-Q128 HydrophobicContact CZ2-CB 3.86Å; W68-Q128 HydrophobicContact CZ2-CG 3.92Å; W68-Q128 HydrophobicContact CZ3-CB 3.89Å; K107-Q128 HydrophobicContact CB-CB 4.36Å; K107-Q128 HydrophobicContact CB-CG 4.48Å; K107-Q128 WeakPolarHBondContact CB-O 3.42Å; K107-Q128 HydrophobicContact CD-CG 4.42Å; K107-Q128 PolarHBondContact N-O 3.45Å; R108-Q128 HydrophobicContact CB-CB 4.24Å; R108-Q128 PolarHBondContact O-N 3.05Å
129	L	98.6	Very high	96.8	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	151	174.9	-54.6	-177.3	0	0	0	110.7	L63 D67 V69 L87 R104 S131 V133	L63-L129 HydrophobicContact CD1-CD1 4.26Å; D67-L129 PolarHBondContact O-N 3.45Å; V69-L129 HydrophobicContact CG2-CD2 3.95Å; V69-L129 HydrophobicContact CG2-CG 4.44Å; L87-L129 HydrophobicContact CB-CD2 4.38Å; L87-L129 HydrophobicContact CD2-CD2 3.49Å; L87-L129 VanDerWaalsContact CD2-CD2 3.49Å; R104-L129 HydrophobicContact CB-CB 4.27Å; R104-L129 HydrophobicContact CB-CD2 4.05Å; R104-L129 HydrophobicContact CG-CB 4.39Å; R104-L129 HydrophobicContact CG-CD1 4.24Å; L129-S131 PolarHBondContact O-N 3.43Å; L129-V133 HydrophobicContact CD1-CG1 3.87Å
130	S	98.3	Very high	96.9	Very high	55 Å²	55	35.9 Å²	35.9	39%	0.385	20%	0.204	S	C	.	.	S	Bend	trans	-65.1	-25.8	175.5	57.3	0	0	0	0	114	T105	T105-S130 PolarHBondContact N-OG 3.33Å; T105-S130 WeakPolarHBondContact O-CB 3.21Å; T105-S130 PolarHBondContact O-N 2.83Å; T105-S130 PolarHBondContact O-OG 2.9Å; T105-S130 WeakPolarHBondContact OG1-CB 3.33Å; T105-S130 PolarHBondContact OG1-OG 3.11Å
131	S	97.8	Very high	97	Very high	50 Å²	50	33.7 Å²	33.7	35%	0.35	19%	0.188	S	C	.	.	S	Bend	trans	-152.4	149.9	172	54.8	0	0	0	0	110.8	R104 L129	R104-S131 WeakPolarHBondContact CD-O 3.43Å; R104-S131 VanDerWaalsContact CD-OG 3.32Å; R104-S131 WeakPolarHBondContact CD-OG 3.44Å; R104-S131 PolarHBondContact NE-O 2.93Å; R104-S131 VanDerWaalsContact NE-O 3.16Å; R104-S131 PolarHBondContact NE-OG 3.15Å; L129-S131 PolarHBondContact O-N 3.43Å
132	P	97.5	Very high	97	Very high	78 Å²	78	33.7 Å²	33.7	51%	0.506	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-63.2	155	-179.5	26	-34.3	0	0	0	112.3	Q66 D67 R104	Q66-P132 HydrophobicContact CB-CB 3.84Å; Q66-P132 CarbonylContact O-C 3.56Å; Q66-P132 VanDerWaalsContact O-CA 3.27Å; Q66-P132 WeakPolarHBondContact O-CA 3.29Å; D67-P132 HydrophobicContact CB-CB 4.32Å; R104-P132 PolarHBondContact NH2-O 3.16Å
133	V	97.1	Very high	97	Very high	2 Å²	2	30 Å²	30	1%	0.012	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-91.6	157.9	171	-52.3	0	0	0	0	111.3	L63 Q66 L102 L129 W135 I139	L63-V133 HydrophobicContact CD2-CG2 3.86Å; Q66-V133 PolarHBondContact NE2-O 2.97Å; Q66-V133 VanDerWaalsContact NE2-O 3.15Å; Q66-V133 WeakPolarHBondContact O-CG2 3.08Å; Q66-V133 PolarHBondContact O-N 3.1Å; L102-V133 HydrophobicContact CD1-CG1 3.74Å; L102-V133 HydrophobicContact CD2-CB 4.35Å; L102-V133 HydrophobicContact CD2-CG1 4.32Å; L129-V133 HydrophobicContact CD1-CG1 3.87Å; V133-W135 HydrophobicContact CG2-CE3 4.12Å; V133-W135 HydrophobicContact CG2-CZ3 3.84Å; V133-I139 HydrophobicContact CB-CG2 4.25Å; V133-I139 HydrophobicContact CG2-CG2 3.76Å
134	S	95.6	Very high	97	Very high	94 Å²	94	30.1 Å²	30.1	66%	0.657	17%	0.173	S	C	*	.	P	Polyproline II helix	trans	-97.3	135.9	168.6	-63.6	0	0	0	0	109.4
135	W	94.6	Very high	96.9	Very high	86 Å²	86	30.1 Å²	30.1	33%	0.326	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-67.6	139.2	178.7	-55.3	134.6	0	0	0	111.6	Q23 L63 T65 Q66 V133 I139 P141	Q23-W135 HydrophobicContact CG-CZ2 4.19Å; L63-W135 HydrophobicContact CD2-CH2 4.42Å; L63-W135 HydrophobicContact CD2-CZ3 3.65Å; L63-W135 HydrophobicContact CG-CZ3 4.32Å; T65-W135 VanDerWaalsContact C-CH2 3.43Å; Q66-W135 HydrophobicContact CB-CH2 4.33Å; Q66-W135 HydrophobicContact CB-CZ2 4.14Å; Q66-W135 HydrophobicContact CG-CD2 4.36Å; Q66-W135 VanDerWaalsContact CG-CE2 3.46Å; Q66-W135 HydrophobicContact CG-CH2 3.75Å; Q66-W135 HydrophobicContact CG-CZ2 3.13Å; V133-W135 HydrophobicContact CG2-CE3 4.12Å; V133-W135 HydrophobicContact CG2-CZ3 3.84Å; W135-I139 WeakPolarHBondContact CA-O 3.36Å; W135-I139 HydrophobicContact CE3-CG2 4.36Å; W135-P141 HydrophobicContact CH2-CB 3.92Å; W135-P141 HydrophobicContact CH2-CG 3.69Å; W135-P141 HydrophobicContact CZ2-CG 4.02Å; W135-P141 HydrophobicContact CZ3-CB 4.32Å; W135-P141 HydrophobicContact CZ3-CG 4.08Å
136	S	93.9	Very high	96.8	Very high	44 Å²	44	30.7 Å²	30.7	31%	0.308	18%	0.177	S	C	.	.	B	Isolated β-bridge	trans	-147.7	177.8	176	80.1	0	0	0	0	110	Y138 I139 Q140	S136-Y138 PolarHBondContact O-N 2.97Å; S136-Y138 VanDerWaalsContact O-N 3.12Å; S136-Y138 PolarHBondContact OG-N 3.44Å; S136-Y138 VanDerWaalsContact OG-N 3.15Å; S136-I139 PolarHBondContact N-O 3.4Å; S136-I139 CarbonylContact O-C 3.6Å; S136-I139 PolarHBondContact O-N 3.16Å; S136-I139 PolarHBondContact OG-N 3.38Å; S136-Q140 WeakPolarHBondContact O-CG 3.37Å; S136-Q140 PolarHBondContact O-NE2 3.13Å
137	N	92	Very high	96.6	Very high	88 Å²	88	34.4 Å²	34.4	47%	0.471	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.4	175.2	-67.9	-18.2	0	0	0	113.6
138	Y	95.4	Very high	96.3	Very high	52 Å²	52	37.5 Å²	37.5	20%	0.204	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-6.3	-177	-57.6	-91.9	0	0	0	112.9	G43 P46 H100 S136	G43-Y138 VanDerWaalsContact CA-CD1 3.48Å; P46-Y138 VanDerWaalsContact CA-O 3.32Å; P46-Y138 WeakPolarHBondContact CA-O 3.22Å; P46-Y138 VanDerWaalsContact CB-C 3.48Å; P46-Y138 WeakPolarHBondContact CB-O 3.33Å; H100-Y138 HydrophobicContact CB-CD1 4.4Å; H100-Y138 HydrophobicContact CB-CD2 4.02Å; H100-Y138 HydrophobicContact CB-CG 3.81Å; H100-Y138 AromaticContact CD2-CD1 3.33Å; H100-Y138 WeakPolarHBondContact CD2-CD1 3.38Å; H100-Y138 AromaticContact CD2-CD2 3.41Å; H100-Y138 VanDerWaalsContact CD2-CD2 3.41Å; H100-Y138 WeakPolarHBondContact CD2-CD2 3.29Å; H100-Y138 AromaticContact CD2-CE1 3.32Å; H100-Y138 WeakPolarHBondContact CD2-CE1 3.5Å; H100-Y138 AromaticContact CD2-CE2 3.42Å; H100-Y138 VanDerWaalsContact CD2-CE2 3.42Å; H100-Y138 WeakPolarHBondContact CD2-CE2 3.35Å; H100-Y138 AromaticContact CD2-CG 3.38Å; H100-Y138 AromaticContact CD2-CZ 3.37Å; H100-Y138 AromaticContact CE1-CE2 3.61Å; H100-Y138 AromaticContact CE1-CZ 3.93Å; H100-Y138 AromaticContact CG-CD2 3.45Å; H100-Y138 VanDerWaalsContact CG-CD2 3.45Å; H100-Y138 AromaticContact CG-CE2 3.8Å; H100-Y138 AromaticContact CG-CG 3.58Å; H100-Y138 AromaticContact ND1-CD2 3.85Å; H100-Y138 AromaticContact ND1-CE2 3.91Å; H100-Y138 AromaticContact NE2-CD2 3.79Å; H100-Y138 AromaticContact NE2-CE1 3.57Å; H100-Y138 AromaticContact NE2-CE2 3.28Å; H100-Y138 VanDerWaalsContact NE2-CE2 3.28Å; H100-Y138 WeakPolarHBondContact NE2-CE2 3.07Å; H100-Y138 AromaticContact NE2-CZ 3.15Å; H100-Y138 PolarHBondContact NE2-OH 3.5Å; S136-Y138 PolarHBondContact O-N 2.97Å; S136-Y138 VanDerWaalsContact O-N 3.12Å; S136-Y138 PolarHBondContact OG-N 3.44Å; S136-Y138 VanDerWaalsContact OG-N 3.15Å
139	I	96.4	Very high	96.2	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.031	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-134.5	99.3	-177	-56.7	176	0	0	0	107.7	P46 L63 I89 L102 V133 W135 S136	P46-I139 WeakPolarHBondContact O-CA 3.36Å; L63-I139 HydrophobicContact CD2-CG2 3.74Å; I89-I139 HydrophobicContact CG2-CB 4.44Å; I89-I139 HydrophobicContact CG2-CD1 4.28Å; I89-I139 HydrophobicContact CG2-CG1 4.07Å; I89-I139 HydrophobicContact CG2-CG2 3.71Å; L102-I139 HydrophobicContact CD2-CD1 3.49Å; L102-I139 VanDerWaalsContact CD2-CD1 3.49Å; L102-I139 HydrophobicContact CG-CD1 3.99Å; V133-I139 HydrophobicContact CB-CG2 4.25Å; V133-I139 HydrophobicContact CG2-CG2 3.76Å; W135-I139 WeakPolarHBondContact CA-O 3.36Å; W135-I139 HydrophobicContact CE3-CG2 4.36Å; S136-I139 PolarHBondContact N-O 3.4Å; S136-I139 CarbonylContact O-C 3.6Å; S136-I139 PolarHBondContact O-N 3.16Å; S136-I139 PolarHBondContact OG-N 3.38Å
140	Q	96.1	Very high	96.1	Very high	29 Å²	29	43.3 Å²	43.3	14%	0.136	27%	0.266	C	S	.	.			trans	-142.9	150.9	-179.1	-67.6	-65.9	-39.7	0	0	109.6	P46 W47 S136	P46-Q140 CarbonylContact C-O 3.55Å; P46-Q140 HydrophobicContact CB-CB 3.92Å; P46-Q140 HydrophobicContact CB-CG 4.22Å; P46-Q140 HydrophobicContact CG-CB 3.8Å; P46-Q140 HydrophobicContact CG-CG 4.26Å; P46-Q140 PolarHBondContact O-N 3.29Å; W47-Q140 WeakPolarHBondContact CA-O 3.08Å; W47-Q140 VanDerWaalsContact CB-O 3.26Å; W47-Q140 WeakPolarHBondContact CB-O 3.34Å; W47-Q140 PolarHBondContact N-O 3.22Å; S136-Q140 WeakPolarHBondContact O-CG 3.37Å; S136-Q140 PolarHBondContact O-NE2 3.13Å
141	P	97.1	Very high	96	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-81.3	146.9	177.8	30.8	-28.6	0	0	0	111.7	Q23 C25 G26 L63 W135	Q23-P141 HydrophobicContact CG-CG 3.81Å; C25-P141 CarbonylContact C-O 3.51Å; C25-P141 WeakPolarHBondContact CA-O 3.44Å; C25-P141 HydrophobicContact CB-CB 4.41Å; C25-P141 HydrophobicContact CB-CG 4.1Å; G26-P141 PolarHBondContact N-O 3.48Å; L63-P141 CarbonylContact O-C 3.53Å; L63-P141 VanDerWaalsContact O-CA 3.25Å; L63-P141 WeakPolarHBondContact O-CA 3.32Å; W135-P141 HydrophobicContact CH2-CB 3.92Å; W135-P141 HydrophobicContact CH2-CG 3.69Å; W135-P141 HydrophobicContact CZ2-CG 4.02Å; W135-P141 HydrophobicContact CZ3-CB 4.32Å; W135-P141 HydrophobicContact CZ3-CG 4.08Å
142	V	97.8	Very high	96	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.012	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-81.2	150.6	166.3	69.7	0	0	0	0	110.4	W47 L63 I64 L144 V230 Q240	W47-V142 HydrophobicContact CB-CB 3.97Å; W47-V142 HydrophobicContact CB-CG1 4.46Å; W47-V142 HydrophobicContact CD2-CB 3.7Å; W47-V142 HydrophobicContact CD2-CG2 4.05Å; W47-V142 HydrophobicContact CE3-CB 4.06Å; W47-V142 HydrophobicContact CE3-CG2 4.44Å; W47-V142 HydrophobicContact CG-CB 3.68Å; W47-V142 HydrophobicContact CG-CG1 4.44Å; W47-V142 HydrophobicContact CG-CG2 4.36Å; W47-V142 HydrophobicContact CZ2-CG2 4.3Å; L63-V142 PolarHBondContact O-N 2.53Å; I64-V142 HydrophobicContact CG2-CG1 4.16Å; V142-L144 HydrophobicContact CG1-CD2 4.47Å; V142-V230 HydrophobicContact CG2-CG1 3.85Å; V142-Q240 HydrophobicContact CG1-CB 4.21Å; V142-Q240 VanDerWaalsContact CG1-OE1 3.24Å; V142-Q240 HydrophobicContact CG2-CB 4Å
143	C	97.5	Very high	96	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.034	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-79.3	141.9	173	-64.7	0	0	0	0	111.5	C25 T237 W238 V239 Q240	C25-C143 HydrophobicContact CB-CB 4.02Å; C25-C143 WeakPolarHBondContact CB-SG 3.23Å; C25-C143 PolarHBondContact O-SG 3.45Å; C25-C143 WeakPolarHBondContact SG-CA 3.5Å; C25-C143 WeakPolarHBondContact SG-CB 3.41Å; C25-C143 CovalentContact SG-SG 2.04Å; C25-C143 PolarHBondContact SG-SG 3Å; C143-T237 HydrophobicContact CB-CG2 4.1Å; C143-T237 WeakPolarHBondContact SG-CG2 3Å; C143-W238 WeakPolarHBondContact CB-O 3.04Å; C143-W238 PolarHBondContact N-O 2.81Å; C143-V239 HydrophobicContact CB-CG2 4.01Å; C143-V239 WeakPolarHBondContact O-CA 3.32Å; C143-Q240 PolarHBondContact O-N 3.46Å
144	L	97.5	Very high	96	Very high	3 Å²	3	46 Å²	46	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	143.6	174.8	-62.3	-177.1	0	0	0	111.3	I64 L70 V142 Q240 L262 I269 V276 L278 Y279	I64-L144 HydrophobicContact CB-CD1 3.96Å; I64-L144 HydrophobicContact CB-CG 4.38Å; I64-L144 HydrophobicContact CD1-CD1 3.96Å; I64-L144 HydrophobicContact CG2-CD1 3.81Å; I64-L144 HydrophobicContact CG2-CD2 3.81Å; I64-L144 HydrophobicContact CG2-CG 3.97Å; L70-L144 HydrophobicContact CD2-CD2 3.69Å; V142-L144 HydrophobicContact CG1-CD2 4.47Å; L144-Q240 HydrophobicContact CD2-CB 4.25Å; L144-L262 HydrophobicContact CD2-CD1 4.14Å; L144-I269 HydrophobicContact CD1-CD1 4.26Å; L144-I269 HydrophobicContact CD1-CG2 3.74Å; L144-V276 HydrophobicContact CD1-CG2 3.94Å; L144-L278 HydrophobicContact CB-CD2 3.83Å; L144-L278 CarbonylContact O-C 3.6Å; L144-L278 WeakPolarHBondContact O-CA 3.24Å; L144-Y279 WeakPolarHBondContact O-CB 3.32Å; L144-Y279 PolarHBondContact O-N 3.14Å
145	P	96.9	Very high	96.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	143	-175.3	29.9	-33.3	0	0	0	112	T149 F151 V239 Q240 L262 T263 S266	P145-T149 HydrophobicContact CB-CG2 3.95Å; P145-F151 HydrophobicContact CB-CE2 4.02Å; P145-F151 HydrophobicContact CB-CZ 4.02Å; P145-F151 HydrophobicContact CG-CE2 4.2Å; P145-F151 HydrophobicContact CG-CZ 4.32Å; P145-V239 HydrophobicContact CB-CG1 3.96Å; P145-V239 HydrophobicContact CG-CG1 4.41Å; P145-Q240 WeakPolarHBondContact CD-O 3.24Å; P145-Q240 WeakPolarHBondContact CG-O 3.38Å; P145-L262 HydrophobicContact CG-CB 3.69Å; P145-T263 HydrophobicContact CB-CG2 3.94Å; P145-T263 HydrophobicContact CG-CG2 4.05Å; P145-S266 PolarHBondContact O-OG 2.76Å
146	A	95.8	Very high	96.1	Very high	11 Å²	11	42.7 Å²	42.7	9%	0.091	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-69.9	159.3	159.4	0	0	0	0	0	110.6	G148 T149 L278 Y279	A146-G148 PolarHBondContact O-N 2.86Å; A146-T149 PolarHBondContact N-OG1 3.19Å; A146-T149 VanDerWaalsContact N-OG1 3.13Å; A146-T149 VanDerWaalsContact O-CB 3.31Å; A146-T149 WeakPolarHBondContact O-CB 3.41Å; A146-T149 PolarHBondContact O-N 3.02Å; A146-T149 PolarHBondContact O-OG1 3.14Å; A146-L278 HydrophobicContact CB-CB 4.17Å; A146-Y279 WeakPolarHBondContact CB-O 3.22Å; A146-Y279 PolarHBondContact N-O 3.34Å
147	P	94.9	Very high	96.2	Very high	78 Å²	78	40.6 Å²	40.6	51%	0.506	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-32.4	-176.6	-28.9	34.8	0	0	0	115.2	T149 S266	P147-T149 VanDerWaalsContact C-N 3.35Å; P147-S266 WeakPolarHBondContact CD-OG 3.28Å
148	G	93.6	Very high	96.4	Very high	66 Å²	66	37.8 Å²	37.8	68%	0.68	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	3.9	179.2	0	0	0	0	0	115.2	A146 L150	A146-G148 PolarHBondContact O-N 2.86Å; G148-L150 PolarHBondContact O-N 3.29Å
149	T	96.2	Very high	96.4	Very high	16 Å²	16	35.4 Å²	35.4	10%	0.098	23%	0.228	C	C	.	.			trans	-69.6	129.5	179.5	-51.1	0	0	0	0	109.7	P145 A146 P147 F151 M233 T263 Y279	P145-T149 HydrophobicContact CB-CG2 3.95Å; A146-T149 PolarHBondContact N-OG1 3.19Å; A146-T149 VanDerWaalsContact N-OG1 3.13Å; A146-T149 VanDerWaalsContact O-CB 3.31Å; A146-T149 WeakPolarHBondContact O-CB 3.41Å; A146-T149 PolarHBondContact O-N 3.02Å; A146-T149 PolarHBondContact O-OG1 3.14Å; P147-T149 VanDerWaalsContact C-N 3.35Å; T149-F151 HydrophobicContact CG2-CE1 4.39Å; T149-F151 HydrophobicContact CG2-CE2 4.03Å; T149-F151 HydrophobicContact CG2-CZ 3.84Å; T149-M233 HydrophobicContact CG2-CE 3.95Å; T149-T263 WeakPolarHBondContact O-CG2 3.45Å; T149-Y279 HydrophobicContact CG2-CD1 4.09Å; T149-Y279 HydrophobicContact CG2-CE1 4.35Å; T149-Y279 PolarHBondContact OG1-O 2.88Å
150	L	95.4	Very high	96.3	Very high	143 Å²	143	35.2 Å²	35.2	75%	0.749	23%	0.227	S	C	*	.			trans	-102	132.4	-178.1	-60.7	178.5	0	0	0	111.3	G148	G148-L150 PolarHBondContact O-N 3.29Å
151	F	97.3	Very high	96.3	Very high	21 Å²	21	33.9 Å²	33.9	9%	0.092	22%	0.222	C	C	.	.			trans	-117.4	90.8	168.8	-57.5	-77.1	0	0	0	107.5	P145 T149 M155 I184 I209 C231 M233 V239 A241 T263	P145-F151 HydrophobicContact CB-CE2 4.02Å; P145-F151 HydrophobicContact CB-CZ 4.02Å; P145-F151 HydrophobicContact CG-CE2 4.2Å; P145-F151 HydrophobicContact CG-CZ 4.32Å; T149-F151 HydrophobicContact CG2-CE1 4.39Å; T149-F151 HydrophobicContact CG2-CE2 4.03Å; T149-F151 HydrophobicContact CG2-CZ 3.84Å; F151-M155 HydrophobicContact CB-SD 4.43Å; F151-M155 HydrophobicContact CD1-SD 4.02Å; F151-I184 HydrophobicContact CB-CG1 4.4Å; F151-I209 HydrophobicContact CB-CD1 4.39Å; F151-C231 HydrophobicContact CD1-CB 3.96Å; F151-C231 HydrophobicContact CE1-CB 4.04Å; F151-M233 HydrophobicContact CD1-SD 4.49Å; F151-M233 HydrophobicContact CE1-SD 4.03Å; F151-V239 HydrophobicContact CE1-CB 4.33Å; F151-V239 HydrophobicContact CE1-CG1 4.29Å; F151-V239 HydrophobicContact CZ-CB 4.37Å; F151-V239 HydrophobicContact CZ-CG1 3.83Å; F151-A241 HydrophobicContact CD1-CB 3.72Å; F151-A241 HydrophobicContact CD2-CB 3.74Å; F151-A241 HydrophobicContact CE1-CB 3.72Å; F151-A241 HydrophobicContact CE2-CB 3.73Å; F151-A241 HydrophobicContact CG-CB 3.72Å; F151-A241 HydrophobicContact CZ-CB 3.71Å; F151-T263 HydrophobicContact CD2-CG2 4.49Å; F151-T263 HydrophobicContact CE2-CG2 4.04Å
152	P	97.2	Very high	96.1	Very high	80 Å²	80	34.2 Å²	34.2	52%	0.519	22%	0.223	S	C	.	.			trans	-68.2	152.7	-173.1	26.2	-33.2	0	0	0	112.1	G154 M155	P152-G154 PolarHBondContact O-N 2.85Å; P152-M155 HydrophobicContact CG-CB 4.24Å; P152-M155 WeakPolarHBondContact O-CB 3.39Å; P152-M155 PolarHBondContact O-N 2.87Å
153	T	97.8	Very high	95.4	Very high	94 Å²	94	34.3 Å²	34.3	58%	0.577	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	138.1	172.9	-59.6	0	0	0	0	111.1	M155 I184 S186	T153-M155 VanDerWaalsContact C-N 3.25Å; T153-M155 PolarHBondContact O-N 2.9Å; T153-I184 WeakPolarHBondContact CA-O 3.24Å; T153-S186 WeakPolarHBondContact OG1-CB 3.43Å; T153-S186 PolarHBondContact OG1-N 3.2Å
154	G	96.9	Very high	94.6	Very high	46 Å²	46	35.9 Å²	35.9	47%	0.474	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.1	-10.5	-175.8	0	0	0	0	0	114.5	P152 T156 I184	P152-G154 PolarHBondContact O-N 2.85Å; G154-T156 PolarHBondContact O-N 3.38Å; G154-I184 PolarHBondContact N-O 2.83Å
155	M	97.2	Very high	93.2	Very high	35 Å²	35	39.8 Å²	39.8	17%	0.172	25%	0.252	C	S	.	.			trans	-58.9	123.7	173.5	-175.1	178	-168.7	0	0	109.8	F151 P152 T153 C157 P183 I184 C231 S232 M233	F151-M155 HydrophobicContact CB-SD 4.43Å; F151-M155 HydrophobicContact CD1-SD 4.02Å; P152-M155 HydrophobicContact CG-CB 4.24Å; P152-M155 WeakPolarHBondContact O-CB 3.39Å; P152-M155 PolarHBondContact O-N 2.87Å; T153-M155 VanDerWaalsContact C-N 3.25Å; T153-M155 PolarHBondContact O-N 2.9Å; M155-C157 PolarHBondContact O-N 2.83Å; M155-P183 CarbonylContact O-C 3.54Å; M155-P183 WeakPolarHBondContact O-CA 3.34Å; M155-I184 HydrophobicContact CB-CG1 4.21Å; M155-I184 PolarHBondContact O-N 2.75Å; M155-C231 HydrophobicContact CE-CB 3.61Å; M155-C231 HydrophobicContact SD-CB 3.97Å; M155-S232 WeakPolarHBondContact CE-O 3.32Å; M155-M233 HydrophobicContact CE-SD 3.9Å
156	T	95.6	Very high	91.9	Very high	77 Å²	77	48.6 Å²	48.6	47%	0.472	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	123.3	176.2	-52.7	0	0	0	0	110.2	G154 Y158 A181	G154-T156 PolarHBondContact O-N 3.38Å; T156-Y158 HydrophobicContact CG2-CE2 4.41Å; T156-A181 HydrophobicContact CG2-CB 3.97Å
157	C	96.6	Very high	91	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	171.3	174.7	-56	0	0	0	0	109	M155 A181 V182 I184 L229 V230 C231	M155-C157 PolarHBondContact O-N 2.83Å; C157-A181 CarbonylContact O-C 3.48Å; C157-A181 WeakPolarHBondContact O-CA 3.39Å; C157-V182 PolarHBondContact N-O 3.1Å; C157-V182 PolarHBondContact O-N 3.12Å; C157-V182 VanDerWaalsContact O-O 3.1Å; C157-I184 HydrophobicContact CB-CD1 4.48Å; C157-L229 HydrophobicContact CB-CD1 3.69Å; C157-L229 HydrophobicContact CB-CG 4.19Å; C157-V230 CarbonylContact C-O 3.59Å; C157-V230 VanDerWaalsContact CA-O 3.24Å; C157-V230 WeakPolarHBondContact CA-O 3.19Å; C157-V230 VanDerWaalsContact CB-O 3.32Å; C157-V230 WeakPolarHBondContact CB-O 3.36Å; C157-C231 HydrophobicContact CB-CB 4.05Å; C157-C231 WeakPolarHBondContact CB-SG 3.25Å; C157-C231 WeakPolarHBondContact SG-CB 3.42Å; C157-C231 CovalentContact SG-SG 2.03Å; C157-C231 PolarHBondContact SG-SG 3.2Å
158	Y	95.8	Very high	90.1	Very high	28 Å²	28	54.1 Å²	54.1	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	141.3	-177.4	-74.4	-104.4	0	0	0	110.1	V35 W45 T156 V180 A181 L229 V230 W238	V35-Y158 HydrophobicContact CG1-CE1 3.97Å; V35-Y158 WeakPolarHBondContact CG1-OH 3.2Å; V35-Y158 HydrophobicContact CG2-CE1 4.39Å; V35-Y158 WeakPolarHBondContact CG2-OH 3.22Å; W45-Y158 VanDerWaalsContact CH2-CB 3.43Å; W45-Y158 HydrophobicContact CH2-CD1 4.02Å; W45-Y158 HydrophobicContact CH2-CD2 4.12Å; W45-Y158 AromaticContact CH2-CG 3.6Å; W45-Y158 HydrophobicContact CH2-CG 3.6Å; W45-Y158 AromaticContact CZ2-CD1 3.65Å; W45-Y158 HydrophobicContact CZ2-CD1 3.65Å; W45-Y158 HydrophobicContact CZ2-CE1 4.42Å; W45-Y158 AromaticContact CZ2-CG 3.73Å; W45-Y158 HydrophobicContact CZ2-CG 3.73Å; T156-Y158 HydrophobicContact CG2-CE2 4.41Å; Y158-V180 VanDerWaalsContact CA-O 3.28Å; Y158-V180 WeakPolarHBondContact CA-O 3.24Å; Y158-A181 HydrophobicContact CD1-CB 4.31Å; Y158-A181 HydrophobicContact CE1-CB 3.93Å; Y158-A181 HydrophobicContact CE2-CB 4.45Å; Y158-L229 CarbonylContact O-C 3.54Å; Y158-L229 WeakPolarHBondContact O-CA 3.5Å; Y158-V230 PolarHBondContact N-O 2.93Å; Y158-V230 PolarHBondContact O-N 3.44Å; Y158-W238 AromaticContact CD2-CH2 3.71Å; Y158-W238 HydrophobicContact CD2-CH2 3.71Å; Y158-W238 AromaticContact CD2-CZ3 3.71Å; Y158-W238 HydrophobicContact CD2-CZ3 3.71Å; Y158-W238 AromaticContact CE2-CH2 3.86Å; Y158-W238 HydrophobicContact CE2-CH2 3.86Å; Y158-W238 HydrophobicContact CE2-CZ3 4.32Å; Y158-W238 HydrophobicContact CG-CZ3 4.41Å
159	V	95.2	Very high	89.3	Confident	3 Å²	3	54 Å²	54	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140	168.8	-173	0	0	0	0	108.3	E179 V180 V182 L229 V244 Y259	V159-E179 WeakPolarHBondContact O-CA 3.5Å; V159-V180 HydrophobicContact CB-CG1 3.96Å; V159-V180 PolarHBondContact N-O 3.2Å; V159-V180 PolarHBondContact O-N 2.84Å; V159-V182 HydrophobicContact CG2-CG2 3.81Å; V159-L229 HydrophobicContact CG2-CB 4.43Å; V159-L229 HydrophobicContact CG2-CD1 3.47Å; V159-L229 VanDerWaalsContact CG2-CD1 3.47Å; V159-V244 HydrophobicContact CG1-CG2 3.72Å; V159-Y259 HydrophobicContact CG1-CE1 4.39Å; V159-Y259 HydrophobicContact CG2-CE1 3.72Å; V159-Y259 WeakPolarHBondContact CG2-OH 3.48Å
160	T	94.8	Very high	88.6	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.8	-173.7	51	0	0	0	0	110.9	W45 Q48 Q178 E179	W45-T160 HydrophobicContact CB-CG2 4.45Å; W45-T160 VanDerWaalsContact CD1-CG2 3.47Å; W45-T160 HydrophobicContact CD2-CG2 3.62Å; W45-T160 VanDerWaalsContact CE2-CG2 3.45Å; W45-T160 HydrophobicContact CE3-CG2 4.41Å; W45-T160 HydrophobicContact CG-CG2 3.61Å; W45-T160 HydrophobicContact CZ2-CG2 4.07Å; Q48-T160 PolarHBondContact NE2-O 3.16Å; Q48-T160 VanDerWaalsContact NE2-O 3.1Å; Q48-T160 PolarHBondContact OE1-O 3.48Å; Q48-T160 PolarHBondContact OE1-OG1 2.04Å; T160-Q178 WeakPolarHBondContact CA-O 3.29Å; T160-E179 HydrophobicContact CG2-CB 3.95Å
161	G	94.7	Very high	87.9	Confident	2 Å²	2	52 Å²	52	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.1	-177.7	179.6	0	0	0	0	0	113.4	L177 Q178 D224	G161-L177 WeakPolarHBondContact O-CD1 3.37Å; G161-Q178 PolarHBondContact N-O 3.38Å; G161-Q178 PolarHBondContact O-N 2.9Å; G161-D224 VanDerWaalsContact C-OD1 3.32Å; G161-D224 VanDerWaalsContact CA-OD1 3.22Å; G161-D224 WeakPolarHBondContact CA-OD1 2.99Å
162	W	93.5	Very high	86.9	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.027	31%	0.313	C	S	.	.	S	Bend	trans	-115.1	20.3	178	-60.8	-87	0	0	0	111.7	Q48 D50 R91 Y92 L94 L171 G175 L177 D224	Q48-W162 HydrophobicContact CB-CH2 4.39Å; Q48-W162 HydrophobicContact CG-CH2 3.44Å; Q48-W162 VanDerWaalsContact CG-CH2 3.44Å; Q48-W162 HydrophobicContact CG-CZ2 4.38Å; Q48-W162 HydrophobicContact CG-CZ3 3.52Å; D50-W162 HydrophobicContact CB-CE3 4.14Å; D50-W162 HydrophobicContact CB-CH2 4.03Å; D50-W162 HydrophobicContact CB-CZ3 3.64Å; R91-W162 HydrophobicContact CB-CZ2 4.43Å; R91-W162 HydrophobicContact CG-CZ2 4.08Å; R91-W162 WeakPolarHBondContact O-CZ2 3.33Å; Y92-W162 PolarHBondContact O-NE1 3.02Å; L94-W162 HydrophobicContact CD1-CB 3.59Å; L94-W162 HydrophobicContact CD1-CG 4.02Å; L94-W162 HydrophobicContact CD2-CB 4.04Å; L94-W162 HydrophobicContact CD2-CD2 3.88Å; L94-W162 HydrophobicContact CD2-CE3 4.39Å; L94-W162 HydrophobicContact CD2-CG 3.72Å; L94-W162 HydrophobicContact CG-CB 3.83Å; L94-W162 HydrophobicContact CG-CD2 4.32Å; L94-W162 HydrophobicContact CG-CG 3.67Å; W162-L171 HydrophobicContact CB-CD2 4.04Å; W162-L171 HydrophobicContact CG-CD2 4.47Å; W162-G175 PolarHBondContact NE1-O 3.37Å; W162-L177 HydrophobicContact CD2-CD1 3.92Å; W162-L177 HydrophobicContact CE3-CD1 4.2Å; W162-L177 HydrophobicContact CH2-CD1 4.07Å; W162-L177 HydrophobicContact CZ2-CB 3.99Å; W162-L177 HydrophobicContact CZ2-CD1 3.76Å; W162-L177 HydrophobicContact CZ2-CD2 4.45Å; W162-L177 HydrophobicContact CZ2-CG 4.28Å; W162-L177 HydrophobicContact CZ3-CD1 4.27Å; W162-L177 VanDerWaalsContact NE1-CA 3.28Å; W162-D224 PolarHBondContact N-OD1 2.94Å
163	G	84	Confident	86.2	Confident	4 Å²	4	55.1 Å²	55.1	4%	0.041	32%	0.324	C	S	.	.	S	Bend	trans	-64.6	177.2	174.2	0	0	0	0	0	113	Q222 D224	G163-Q222 CarbonylContact C-O 3.36Å; G163-Q222 WeakPolarHBondContact CA-O 3.33Å; G163-D224 WeakPolarHBondContact CA-OD1 3.49Å; G163-D224 PolarHBondContact N-OD1 2.81Å
164	N	80.4	Confident	85.7	Confident	38 Å²	38	53.6 Å²	53.6	20%	0.203	32%	0.315	C	S	.	.			trans	-52.5	139.1	175.1	-74.1	-2.5	0	0	0	110.9	R166 V169 P170 C221 Q222	N164-R166 VanDerWaalsContact C-N 3.28Å; N164-R166 VanDerWaalsContact CB-O 3.32Å; N164-R166 WeakPolarHBondContact CB-O 3.1Å; N164-R166 PolarHBondContact O-N 2.77Å; N164-V169 CarbonylContact C-O 3.46Å; N164-V169 VanDerWaalsContact CA-O 3.22Å; N164-V169 WeakPolarHBondContact CA-O 3.32Å; N164-V169 VanDerWaalsContact CB-O 3.24Å; N164-V169 WeakPolarHBondContact CB-O 3.41Å; N164-P170 WeakPolarHBondContact OD1-CA 3.41Å; N164-C221 HydrophobicContact CB-CB 4.17Å; N164-C221 WeakPolarHBondContact O-CB 3.35Å; N164-Q222 PolarHBondContact N-O 2.84Å
165	I	68.4	Low	85.4	Confident	84 Å²	84	51.6 Å²	51.6	43%	0.431	29%	0.294	S	S	.	.	S	Bend	trans	-77.9	-18.3	179	57	172.2	0	0	0	112.4	V169 L171	I165-V169 HydrophobicContact CD1-CG1 3.85Å; I165-V169 HydrophobicContact CG1-CB 4.12Å; I165-V169 HydrophobicContact CG1-CG1 3.63Å; I165-V169 PolarHBondContact N-O 2.86Å; I165-L171 HydrophobicContact CG2-CD1 3.48Å; I165-L171 VanDerWaalsContact CG2-CD1 3.48Å
166	R	67.9	Low	85.2	Confident	186 Å²	186	50.6 Å²	50.6	70%	0.702	29%	0.29	S	S	*	.	B	Isolated β-bridge	trans	-153.2	166.6	171.2	-58.1	-176.6	-178.9	173.9	-0.2	108.4	N164 D168 V169 C221	N164-R166 VanDerWaalsContact C-N 3.28Å; N164-R166 VanDerWaalsContact CB-O 3.32Å; N164-R166 WeakPolarHBondContact CB-O 3.1Å; N164-R166 PolarHBondContact O-N 2.77Å; R166-D168 PolarHBondContact O-N 2.83Å; R166-D168 VanDerWaalsContact O-N 3.14Å; R166-V169 HydrophobicContact CB-CB 3.98Å; R166-V169 HydrophobicContact CB-CG2 3.92Å; R166-V169 PolarHBondContact O-N 3.26Å; R166-C221 VanDerWaalsContact C-SG 3.51Å
167	E	76.8	Confident	85.1	Confident	73 Å²	73	47.2 Å²	47.2	34%	0.341	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	124.5	173.5	-172.6	173.3	-151.8	0	0	110.5	V169 G249 C250 K252	E167-V169 PolarHBondContact O-N 3.37Å; E167-V169 VanDerWaalsContact O-N 3.08Å; E167-G249 WeakPolarHBondContact OE1-CA 3.21Å; E167-C250 HydrophobicContact CB-CB 4.22Å; E167-K252 IonicContact OE1-NZ 2.82Å; E167-K252 PolarHBondContact OE1-NZ 3.42Å; E167-K252 WeakPolarHBondContact OE2-CE 3.37Å; E167-K252 IonicContact OE2-NZ 2.99Å; E167-K252 PolarHBondContact OE2-NZ 2.97Å
168	D	77.8	Confident	84.9	Confident	133 Å²	133	48.9 Å²	48.9	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	17.1	-177	-53.3	-42.3	0	0	0	116.4	R166	R166-D168 PolarHBondContact O-N 2.83Å; R166-D168 VanDerWaalsContact O-N 3.14Å
169	V	76.6	Confident	84.7	Confident	62 Å²	62	47.7 Å²	47.7	38%	0.376	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-111.6	102.5	174.7	-174.9	0	0	0	0	109.6	N164 I165 R166 E167	N164-V169 CarbonylContact C-O 3.46Å; N164-V169 VanDerWaalsContact CA-O 3.22Å; N164-V169 WeakPolarHBondContact CA-O 3.32Å; N164-V169 VanDerWaalsContact CB-O 3.24Å; N164-V169 WeakPolarHBondContact CB-O 3.41Å; I165-V169 HydrophobicContact CD1-CG1 3.85Å; I165-V169 HydrophobicContact CG1-CB 4.12Å; I165-V169 HydrophobicContact CG1-CG1 3.63Å; I165-V169 PolarHBondContact N-O 2.86Å; R166-V169 HydrophobicContact CB-CB 3.98Å; R166-V169 HydrophobicContact CB-CG2 3.92Å; R166-V169 PolarHBondContact O-N 3.26Å; E167-V169 PolarHBondContact O-N 3.37Å; E167-V169 VanDerWaalsContact O-N 3.08Å
170	P	80	Confident	84.4	Confident	84 Å²	84	48.4 Å²	48.4	55%	0.545	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-66.9	157.5	-179.4	28.6	-34.6	0	0	0	111.8	N164 S172	N164-P170 WeakPolarHBondContact OD1-CA 3.41Å; P170-S172 PolarHBondContact O-N 2.78Å
171	L	81.1	Confident	84.4	Confident	35 Å²	35	48.8 Å²	48.8	18%	0.183	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-59.9	132.9	172	-166.6	65.8	0	0	0	110	W162 I165 T176 Q178	W162-L171 HydrophobicContact CB-CD2 4.04Å; W162-L171 HydrophobicContact CG-CD2 4.47Å; I165-L171 HydrophobicContact CG2-CD1 3.48Å; I165-L171 VanDerWaalsContact CG2-CD1 3.48Å; L171-T176 WeakPolarHBondContact CD2-O 3.38Å; L171-Q178 HydrophobicContact CD1-CG 3.62Å
172	S	76.9	Confident	84.3	Confident	93 Å²	93	48.7 Å²	48.7	65%	0.65	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-92.5	163.1	-175.8	63.9	0	0	0	0	112.6	P170 G175	P170-S172 PolarHBondContact O-N 2.78Å; S172-G175 PolarHBondContact O-N 3.08Å
173	G	83.3	Confident	84.5	Confident	73 Å²	73	49.5 Å²	49.5	75%	0.753	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	-135.5	173.6	0	0	0	0	0	113.9	G175	G173-G175 PolarHBondContact O-N 3.31Å
174	V	85.9	Confident	85.2	Confident	62 Å²	62	49.6 Å²	49.6	38%	0.376	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-0.5	-178.6	-65	0	0	0	0	113.5	Q93 L94 N95	Q93-V174 HydrophobicContact CB-CG2 4.42Å; Q93-V174 VanDerWaalsContact CD-CG2 3.48Å; Q93-V174 HydrophobicContact CG-CG2 3.95Å; L94-V174 PolarHBondContact N-O 2.89Å; N95-V174 PolarHBondContact N-O 2.95Å
175	G	90.4	Very high	86	Confident	3 Å²	3	48.6 Å²	48.6	3%	0.031	28%	0.279	C	S	.	.			trans	68.8	60.7	179.1	0	0	0	0	0	113	Q93 L94 W162 S172 G173	Q93-G175 CarbonylContact C-O 3.56Å; Q93-G175 VanDerWaalsContact CA-O 3.31Å; Q93-G175 WeakPolarHBondContact CA-O 3.09Å; L94-G175 PolarHBondContact N-O 3.25Å; W162-G175 PolarHBondContact NE1-O 3.37Å; S172-G175 PolarHBondContact O-N 3.08Å; G173-G175 PolarHBondContact O-N 3.31Å
176	T	93.1	Very high	87.4	Confident	14 Å²	14	46.1 Å²	46.1	9%	0.086	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-67.6	138.1	175.5	-56.1	0	0	0	0	111.3	D39 Y92 L171 Q178	D39-T176 HydrophobicContact CB-CG2 3.73Å; D39-T176 PolarHBondContact OD2-OG1 3Å; Y92-T176 HydrophobicContact CD2-CG2 4.43Å; Y92-T176 HydrophobicContact CE1-CG2 4.2Å; Y92-T176 HydrophobicContact CE2-CG2 3.57Å; Y92-T176 VanDerWaalsContact CZ-CG2 3.43Å; Y92-T176 VanDerWaalsContact OH-CG2 3.3Å; Y92-T176 WeakPolarHBondContact OH-CG2 3.37Å; L171-T176 WeakPolarHBondContact CD2-O 3.38Å; T176-Q178 PolarHBondContact O-N 3.25Å; T176-Q178 PolarHBondContact O-NE2 3.44Å
177	L	93.8	Very high	88.7	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.037	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-53.1	129.4	174.5	178.9	63.8	0	0	0	110.9	A40 W45 Q48 Y92 G161 W162	A40-L177 HydrophobicContact CB-CB 4.4Å; A40-L177 HydrophobicContact CB-CD2 4.29Å; A40-L177 HydrophobicContact CB-CG 4.15Å; A40-L177 WeakPolarHBondContact CB-O 3.36Å; A40-L177 PolarHBondContact N-O 3.39Å; W45-L177 HydrophobicContact CB-CD2 4.2Å; Q48-L177 HydrophobicContact CB-CD2 4.35Å; Q48-L177 HydrophobicContact CG-CD1 3.87Å; Q48-L177 HydrophobicContact CG-CD2 4.22Å; Y92-L177 HydrophobicContact CD2-CB 4.36Å; Y92-L177 PolarHBondContact O-N 3.34Å; G161-L177 WeakPolarHBondContact O-CD1 3.37Å; W162-L177 HydrophobicContact CD2-CD1 3.92Å; W162-L177 HydrophobicContact CE3-CD1 4.2Å; W162-L177 HydrophobicContact CH2-CD1 4.07Å; W162-L177 HydrophobicContact CZ2-CB 3.99Å; W162-L177 HydrophobicContact CZ2-CD1 3.76Å; W162-L177 HydrophobicContact CZ2-CD2 4.45Å; W162-L177 HydrophobicContact CZ2-CG 4.28Å; W162-L177 HydrophobicContact CZ3-CD1 4.27Å; W162-L177 VanDerWaalsContact NE1-CA 3.28Å
178	Q	92.4	Very high	89.7	Confident	35 Å²	35	40.2 Å²	40.2	16%	0.164	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	152.2	178.1	-58.8	-60	-64	0	0	111.1	V38 D39 T160 G161 L171 T176	V38-Q178 VanDerWaalsContact C-OE1 3.31Å; D39-Q178 PolarHBondContact OD1-NE2 3.19Å; T160-Q178 WeakPolarHBondContact CA-O 3.29Å; G161-Q178 PolarHBondContact N-O 3.38Å; G161-Q178 PolarHBondContact O-N 2.9Å; L171-Q178 HydrophobicContact CD1-CG 3.62Å; T176-Q178 PolarHBondContact O-N 3.25Å; T176-Q178 PolarHBondContact O-NE2 3.44Å
179	E	91.4	Very high	90.6	Very high	3 Å²	3	35.9 Å²	35.9	1%	0.014	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	137.9	169.8	66.6	178.9	159.4	0	0	112.5	G37 V38 A40 W45 V159 T160	G37-E179 WeakPolarHBondContact CA-O 3.49Å; G37-E179 PolarHBondContact N-O 3.21Å; G37-E179 VanDerWaalsContact N-O 3.16Å; V38-E179 PolarHBondContact N-O 3.18Å; V38-E179 PolarHBondContact O-N 2.89Å; A40-E179 HydrophobicContact CB-CB 4.2Å; A40-E179 HydrophobicContact CB-CG 4.07Å; W45-E179 WeakPolarHBondContact CZ2-OE2 3.25Å; W45-E179 PolarHBondContact NE1-OE2 3.13Å; V159-E179 WeakPolarHBondContact O-CA 3.5Å; T160-E179 HydrophobicContact CG2-CB 3.95Å
180	V	90.1	Very high	91.5	Very high	17 Å²	17	33 Å²	33	10%	0.103	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.7	176.9	67.6	0	0	0	0	111.3	Y158 V159 V182 K218	Y158-V180 VanDerWaalsContact CA-O 3.28Å; Y158-V180 WeakPolarHBondContact CA-O 3.24Å; V159-V180 HydrophobicContact CB-CG1 3.96Å; V159-V180 PolarHBondContact N-O 3.2Å; V159-V180 PolarHBondContact O-N 2.84Å; V180-V182 HydrophobicContact CG1-CG1 4.39Å; V180-V182 HydrophobicContact CG2-CG1 4.36Å; V180-K218 HydrophobicContact CG2-CB 3.75Å; V180-K218 HydrophobicContact CG2-CD 4.02Å; V180-K218 HydrophobicContact CG2-CG 4.01Å
181	A	93	Very high	92.3	Very high	9 Å²	9	30.6 Å²	30.6	7%	0.074	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.1	172.7	0	0	0	0	0	109.9	V35 T156 C157 Y158 Y213	V35-A181 HydrophobicContact CG1-CB 4.09Å; T156-A181 HydrophobicContact CG2-CB 3.97Å; C157-A181 CarbonylContact O-C 3.48Å; C157-A181 WeakPolarHBondContact O-CA 3.39Å; Y158-A181 HydrophobicContact CD1-CB 4.31Å; Y158-A181 HydrophobicContact CE1-CB 3.93Å; Y158-A181 HydrophobicContact CE2-CB 4.45Å; A181-Y213 WeakPolarHBondContact O-CE2 3.37Å; A181-Y213 PolarHBondContact O-OH 3.48Å
182	V	94.1	Very high	93	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.5	-179.8	-69.4	0	0	0	0	110.5	C157 V159 V180 A211 Y213 L229	C157-V182 PolarHBondContact N-O 3.1Å; C157-V182 PolarHBondContact O-N 3.12Å; C157-V182 VanDerWaalsContact O-O 3.1Å; V159-V182 HydrophobicContact CG2-CG2 3.81Å; V180-V182 HydrophobicContact CG1-CG1 4.39Å; V180-V182 HydrophobicContact CG2-CG1 4.36Å; V182-A211 HydrophobicContact CB-CB 4.27Å; V182-A211 HydrophobicContact CG2-CB 3.79Å; V182-Y213 HydrophobicContact CG1-CE2 4.48Å; V182-L229 HydrophobicContact CG2-CD1 3.76Å
183	P	96.9	Very high	93.8	Very high	25 Å²	25	31 Å²	31	16%	0.162	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	146.8	175.8	32.6	-33	0	0	0	111.3	M155 A211 G212 Y213	M155-P183 CarbonylContact O-C 3.54Å; M155-P183 WeakPolarHBondContact O-CA 3.34Å; P183-A211 CarbonylContact O-C 3.57Å; P183-A211 WeakPolarHBondContact O-CA 3.48Å; P183-G212 WeakPolarHBondContact CD-O 3.47Å; P183-G212 VanDerWaalsContact CG-O 3.27Å; P183-G212 WeakPolarHBondContact CG-O 3.35Å; P183-G212 PolarHBondContact O-N 2.87Å; P183-Y213 HydrophobicContact CG-CD1 4.22Å; P183-Y213 HydrophobicContact CG-CE1 4.05Å
184	I	98.3	Very high	94.3	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.031	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	134.5	168.9	-63.2	-57.6	0	0	0	110.3	F151 T153 G154 M155 C157 I209 A211 L229	F151-I184 HydrophobicContact CB-CG1 4.4Å; T153-I184 WeakPolarHBondContact CA-O 3.24Å; G154-I184 PolarHBondContact N-O 2.83Å; M155-I184 HydrophobicContact CB-CG1 4.21Å; M155-I184 PolarHBondContact O-N 2.75Å; C157-I184 HydrophobicContact CB-CD1 4.48Å; I184-I209 HydrophobicContact CD1-CD1 3.91Å; I184-I209 HydrophobicContact CD1-CG1 4.39Å; I184-I209 HydrophobicContact CG2-CD1 4.29Å; I184-I209 HydrophobicContact CG2-CG1 4.45Å; I184-A211 HydrophobicContact CD1-CB 4.24Å; I184-L229 HydrophobicContact CD1-CD2 3.93Å
185	I	97.8	Very high	94.6	Very high	16 Å²	16	29.3 Å²	29.3	8%	0.082	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	140.4	174.4	-55.5	173.9	0	0	0	108.6	C190 M193 C210 G212 P256	I185-C190 HydrophobicContact CG2-CB 4.15Å; I185-M193 HydrophobicContact CD1-SD 4.47Å; I185-M193 HydrophobicContact CG2-CE 4.25Å; I185-C210 HydrophobicContact CB-CB 4.09Å; I185-C210 PolarHBondContact N-O 3.07Å; I185-G212 WeakPolarHBondContact CD1-O 3.13Å; I185-P256 HydrophobicContact CD1-CB 3.38Å; I185-P256 HydrophobicContact CD1-CG 3.87Å
186	S	97.4	Very high	94.6	Very high	33 Å²	33	34.3 Å²	34.3	23%	0.231	19%	0.187	C	C	.	.			trans	-62	147.6	173.7	90.6	0	0	0	0	110.5	T153 A188 S189 C190	T153-S186 WeakPolarHBondContact OG1-CB 3.43Å; T153-S186 PolarHBondContact OG1-N 3.2Å; S186-A188 VanDerWaalsContact C-N 3.28Å; S186-A188 PolarHBondContact O-N 2.77Å; S186-S189 PolarHBondContact O-N 3.43Å; S186-S189 WeakPolarHBondContact OG-CB 3.2Å; S186-S189 PolarHBondContact OG-N 3.13Å; S186-S189 PolarHBondContact OG-OG 2.68Å; S186-C190 WeakPolarHBondContact O-CB 3.42Å; S186-C190 PolarHBondContact O-N 2.87Å
187	Q	96	Very high	94.2	Very high	71 Å²	71	36.4 Å²	36.4	33%	0.332	20%	0.198	S	C	.	.	H	α-helix	trans	-59.8	-40.6	-179.9	-168.6	-176.5	0.8	0	0	111.8	C190 Q191 I204 L205	Q187-C190 PolarHBondContact O-N 3.32Å; Q187-Q191 WeakPolarHBondContact O-CB 3.13Å; Q187-Q191 PolarHBondContact O-N 3.42Å; Q187-I204 HydrophobicContact CG-CG2 3.77Å; Q187-I204 PolarHBondContact NE2-O 3.33Å; Q187-L205 PolarHBondContact NE2-O 2.81Å
188	A	96.9	Very high	93.5	Very high	63 Å²	63	41 Å²	41	52%	0.521	23%	0.229	S	C	.	.	H	α-helix	trans	-62.3	-49.4	177.6	0	0	0	0	0	111.8	S186 C190 Q191 E192	S186-A188 VanDerWaalsContact C-N 3.28Å; S186-A188 PolarHBondContact O-N 2.77Å; A188-C190 VanDerWaalsContact C-N 3.29Å; A188-C190 PolarHBondContact O-N 2.99Å; A188-Q191 WeakPolarHBondContact O-CB 3.22Å; A188-Q191 PolarHBondContact O-N 3.13Å; A188-E192 WeakPolarHBondContact O-CG 3.19Å; A188-E192 PolarHBondContact O-N 3.23Å
189	S	96.9	Very high	93.1	Very high	43 Å²	43	45.3 Å²	45.3	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-63.7	-36.3	177.8	-54	0	0	0	0	112.1	S186 E192 M193	S186-S189 PolarHBondContact O-N 3.43Å; S186-S189 WeakPolarHBondContact OG-CB 3.2Å; S186-S189 PolarHBondContact OG-N 3.13Å; S186-S189 PolarHBondContact OG-OG 2.68Å; S189-E192 PolarHBondContact O-N 2.96Å; S189-M193 VanDerWaalsContact O-CG 3.26Å; S189-M193 WeakPolarHBondContact O-CG 3.47Å; S189-M193 PolarHBondContact O-N 3.14Å
190	C	96.4	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-45.4	175	-170.5	0	0	0	0	111.3	I185 S186 Q187 A188 E192 M193 Y194 I204 C210	I185-C190 HydrophobicContact CG2-CB 4.15Å; S186-C190 WeakPolarHBondContact O-CB 3.42Å; S186-C190 PolarHBondContact O-N 2.87Å; Q187-C190 PolarHBondContact O-N 3.32Å; A188-C190 VanDerWaalsContact C-N 3.29Å; A188-C190 PolarHBondContact O-N 2.99Å; C190-E192 VanDerWaalsContact C-N 3.35Å; C190-E192 PolarHBondContact O-N 3.05Å; C190-M193 PolarHBondContact O-N 2.94Å; C190-Y194 WeakPolarHBondContact O-CD2 3.25Å; C190-Y194 PolarHBondContact O-N 2.96Å; C190-I204 HydrophobicContact CB-CG1 4.48Å; C190-C210 HydrophobicContact CB-CB 3.56Å; C190-C210 WeakPolarHBondContact CB-SG 3.43Å; C190-C210 WeakPolarHBondContact SG-CB 3.01Å; C190-C210 CovalentContact SG-SG 2.03Å; C190-C210 PolarHBondContact SG-SG 3.29Å
191	Q	96.3	Very high	92.3	Very high	35 Å²	35	55.2 Å²	55.2	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-44.7	175.9	-178.8	62.4	75.9	0	0	112.1	Q187 A188 Y194 Q195 V202 I204	Q187-Q191 WeakPolarHBondContact O-CB 3.13Å; Q187-Q191 PolarHBondContact O-N 3.42Å; A188-Q191 WeakPolarHBondContact O-CB 3.22Å; A188-Q191 PolarHBondContact O-N 3.13Å; Q191-Y194 PolarHBondContact O-N 3.2Å; Q191-Q195 WeakPolarHBondContact O-CB 3.32Å; Q191-Q195 VanDerWaalsContact O-CG 3.29Å; Q191-Q195 WeakPolarHBondContact O-CG 3.26Å; Q191-Q195 PolarHBondContact O-N 3.12Å; Q191-V202 PolarHBondContact NE2-O 3.18Å; Q191-I204 HydrophobicContact CB-CB 4.42Å; Q191-I204 HydrophobicContact CB-CG1 4.39Å
192	E	95.6	Very high	92.1	Very high	117 Å²	117	55.1 Å²	55.1	55%	0.547	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-45.7	176.5	-72.8	169.9	-176.2	0	0	111.5	A188 S189 C190 Y194 Q195 M196	A188-E192 WeakPolarHBondContact O-CG 3.19Å; A188-E192 PolarHBondContact O-N 3.23Å; S189-E192 PolarHBondContact O-N 2.96Å; C190-E192 VanDerWaalsContact C-N 3.35Å; C190-E192 PolarHBondContact O-N 3.05Å; E192-Y194 PolarHBondContact O-N 3.07Å; E192-Q195 PolarHBondContact O-N 3.1Å; E192-Q195 VanDerWaalsContact O-N 3.15Å; E192-M196 WeakPolarHBondContact O-CG 3.29Å; E192-M196 PolarHBondContact O-N 3.28Å
193	M	94.4	Very high	92.2	Very high	18 Å²	18	60.3 Å²	60.3	9%	0.089	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-45.6	177.2	-72.3	176.8	-160.6	0	0	111.8	I185 S189 C190 Q195 M196 Q214 N254 P256	I185-M193 HydrophobicContact CD1-SD 4.47Å; I185-M193 HydrophobicContact CG2-CE 4.25Å; S189-M193 VanDerWaalsContact O-CG 3.26Å; S189-M193 WeakPolarHBondContact O-CG 3.47Å; S189-M193 PolarHBondContact O-N 3.14Å; C190-M193 PolarHBondContact O-N 2.94Å; M193-Q195 VanDerWaalsContact C-N 3.27Å; M193-Q195 PolarHBondContact O-N 3.5Å; M193-M196 WeakPolarHBondContact O-CB 3.22Å; M193-M196 PolarHBondContact O-N 3.14Å; M193-Q214 HydrophobicContact CE-CB 3.88Å; M193-Q214 HydrophobicContact CE-CG 3.79Å; M193-Q214 HydrophobicContact SD-CB 4.35Å; M193-Q214 HydrophobicContact SD-CG 4.1Å; M193-N254 CarbonylContact C-O 3.54Å; M193-N254 HydrophobicContact CB-CB 4.13Å; M193-N254 HydrophobicContact CG-CB 4.42Å; M193-P256 HydrophobicContact SD-CG 4.17Å
194	Y	92.8	Very high	92.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.4	-23.9	177.8	-86.2	-73.8	0	0	0	114	C190 Q191 E192 V202 I204 L248 R255 P256 V258	C190-Y194 WeakPolarHBondContact O-CD2 3.25Å; C190-Y194 PolarHBondContact O-N 2.96Å; Q191-Y194 PolarHBondContact O-N 3.2Å; E192-Y194 PolarHBondContact O-N 3.07Å; Y194-V202 HydrophobicContact CD1-CB 3.7Å; Y194-V202 HydrophobicContact CD1-CG2 3.77Å; Y194-V202 HydrophobicContact CE1-CB 4.21Å; Y194-V202 HydrophobicContact CE1-CG2 4.01Å; Y194-V202 HydrophobicContact CG-CB 4.01Å; Y194-I204 HydrophobicContact CD2-CD1 3.63Å; Y194-I204 HydrophobicContact CD2-CG1 4.04Å; Y194-I204 HydrophobicContact CE2-CD1 3.84Å; Y194-I204 HydrophobicContact CG-CD1 4.36Å; Y194-L248 HydrophobicContact CD1-CD1 4.02Å; Y194-L248 HydrophobicContact CE1-CB 4.34Å; Y194-L248 HydrophobicContact CE1-CD1 3.8Å; Y194-L248 HydrophobicContact CE1-CG 3.93Å; Y194-R255 PolarHBondContact O-NH1 3.45Å; Y194-P256 HydrophobicContact CE2-CG 4.02Å; Y194-P256 PolarHBondContact OH-O 2.82Å; Y194-V258 HydrophobicContact CE2-CG2 3.64Å; Y194-V258 WeakPolarHBondContact OH-CG2 3.11Å
195	Q	92.9	Very high	92.2	Very high	100 Å²	100	62 Å²	62	47%	0.467	34%	0.336	S	S	.	.	H	α-helix	trans	-83.2	-11.1	175.2	-73.9	172.7	1	0	0	113.6	Q191 E192 M193 N197	Q191-Q195 WeakPolarHBondContact O-CB 3.32Å; Q191-Q195 VanDerWaalsContact O-CG 3.29Å; Q191-Q195 WeakPolarHBondContact O-CG 3.26Å; Q191-Q195 PolarHBondContact O-N 3.12Å; E192-Q195 PolarHBondContact O-N 3.1Å; E192-Q195 VanDerWaalsContact O-N 3.15Å; M193-Q195 VanDerWaalsContact C-N 3.27Å; M193-Q195 PolarHBondContact O-N 3.5Å; Q195-N197 PolarHBondContact O-N 2.75Å
196	M	89.1	Confident	92.1	Very high	108 Å²	108	68.6 Å²	68.6	53%	0.532	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-23.9	178.9	-67.7	-167.4	179.3	0	0	113.4	E192 M193 N254	E192-M196 WeakPolarHBondContact O-CG 3.29Å; E192-M196 PolarHBondContact O-N 3.28Å; M193-M196 WeakPolarHBondContact O-CB 3.22Å; M193-M196 PolarHBondContact O-N 3.14Å; M196-N254 HydrophobicContact SD-CB 4.3Å; M196-N254 PolarHBondContact SD-ND2 3.34Å; M196-N254 VanDerWaalsContact SD-ND2 3.43Å
197	N	84.8	Confident	92.2	Very high	59 Å²	59	67.3 Å²	67.3	32%	0.316	35%	0.354	S	S	.	.			trans	-101.6	114.3	175.3	-172.7	-27.6	0	0	0	110.1	Q195 V199 R255	Q195-N197 PolarHBondContact O-N 2.75Å; N197-V199 PolarHBondContact O-N 3.49Å; N197-V199 WeakPolarHBondContact OD1-CB 3.49Å; N197-V199 PolarHBondContact OD1-N 3.16Å; N197-R255 PolarHBondContact ND2-NH2 3.11Å
198	P	80.8	Confident	92.3	Very high	104 Å²	104	64 Å²	64	68%	0.675	34%	0.339	S	S	*	.	S	Bend	trans	-72.7	-13.8	-176.1	29.8	-35.3	0	0	0	114.1
199	V	82.6	Confident	92.3	Very high	124 Å²	124	61.1 Å²	61.1	75%	0.752	32%	0.315	S	S	*	.	S	Bend	trans	-90.6	-31	-175.8	-175.7	0	0	0	0	112	N197	N197-V199 PolarHBondContact O-N 3.49Å; N197-V199 WeakPolarHBondContact OD1-CB 3.49Å; N197-V199 PolarHBondContact OD1-N 3.16Å
200	E	80.6	Confident	92.4	Very high	102 Å²	102	59 Å²	59	48%	0.477	30%	0.3	S	S	.	.	S	Bend	trans	-134.5	84.7	-174.6	-81.5	177.9	-178.3	0	0	108.8	L248 R255	E200-L248 HydrophobicContact CB-CD1 4.19Å; E200-R255 PolarHBondContact O-NH1 3.47Å; E200-R255 PolarHBondContact O-NH2 2.87Å; E200-R255 IonicContact OE2-CZ 3.83Å; E200-R255 IonicContact OE2-NH2 3.99Å; E200-R255 PolarHBondContact OE2-NH2 2.79Å
201	Q	83.8	Confident	92.4	Very high	126 Å²	126	59 Å²	59	59%	0.589	30%	0.3	S	S	*	.			trans	-93.5	142.2	177.5	-64.2	-177.8	-1.1	0	0	110.4
202	V	90.6	Very high	92.3	Very high	7 Å²	7	57.5 Å²	57.5	4%	0.042	29%	0.294	C	S	.	.			trans	-130.4	131.1	175.3	177.1	0	0	0	0	107.8	Q191 Y194 I204 F246 L248	Q191-V202 PolarHBondContact NE2-O 3.18Å; Y194-V202 HydrophobicContact CD1-CB 3.7Å; Y194-V202 HydrophobicContact CD1-CG2 3.77Å; Y194-V202 HydrophobicContact CE1-CB 4.21Å; Y194-V202 HydrophobicContact CE1-CG2 4.01Å; Y194-V202 HydrophobicContact CG-CB 4.01Å; V202-I204 HydrophobicContact CG1-CD1 3.94Å; V202-F246 HydrophobicContact CG1-CE2 3.69Å; V202-F246 HydrophobicContact CG1-CZ 3.8Å; V202-L248 HydrophobicContact CG2-CD1 3.78Å; V202-L248 HydrophobicContact CG2-CG 4.28Å
203	D	95	Very high	92	Very high	109 Å²	109	55.9 Å²	55.9	58%	0.583	28%	0.283	S	S	*	.			trans	-85.9	124.5	170.7	-66.8	-31.2	0	0	0	109.8	L205	D203-L205 HydrophobicContact CB-CD2 4.46Å; D203-L205 PolarHBondContact O-N 2.83Å
204	I	97.2	Very high	91.8	Very high	9 Å²	9	59 Å²	59	5%	0.046	30%	0.298	C	S	.	.			trans	-93	102.9	179.5	-55.5	-57.7	0	0	0	109.2	Q187 C190 Q191 Y194 V202 M208 V258	Q187-I204 HydrophobicContact CG-CG2 3.77Å; Q187-I204 PolarHBondContact NE2-O 3.33Å; C190-I204 HydrophobicContact CB-CG1 4.48Å; Q191-I204 HydrophobicContact CB-CB 4.42Å; Q191-I204 HydrophobicContact CB-CG1 4.39Å; Y194-I204 HydrophobicContact CD2-CD1 3.63Å; Y194-I204 HydrophobicContact CD2-CG1 4.04Å; Y194-I204 HydrophobicContact CE2-CD1 3.84Å; Y194-I204 HydrophobicContact CG-CD1 4.36Å; V202-I204 HydrophobicContact CG1-CD1 3.94Å; I204-M208 HydrophobicContact CG2-CB 4.17Å; I204-V258 HydrophobicContact CD1-CG2 3.89Å
205	L	97.8	Very high	91.5	Very high	59 Å²	59	65.8 Å²	65.8	31%	0.309	33%	0.329	S	S	.	.			trans	-76	160.6	-175.2	-54.5	-175.3	0	0	0	113	Q187 D203 D207 M208	Q187-L205 PolarHBondContact NE2-O 2.81Å; D203-L205 HydrophobicContact CB-CD2 4.46Å; D203-L205 PolarHBondContact O-N 2.83Å; L205-D207 WeakPolarHBondContact CB-OD1 3.5Å; L205-D207 PolarHBondContact O-N 2.93Å; L205-D207 VanDerWaalsContact O-N 3.16Å; L205-M208 HydrophobicContact CB-CE 4.04Å; L205-M208 HydrophobicContact CB-CG 4.2Å; L205-M208 HydrophobicContact CB-SD 4.01Å; L205-M208 HydrophobicContact CD1-CE 3.88Å; L205-M208 HydrophobicContact CG-CE 3.85Å; L205-M208 HydrophobicContact CG-SD 4.22Å; L205-M208 PolarHBondContact N-SD 2.94Å; L205-M208 VanDerWaalsContact N-SD 3.44Å; L205-M208 WeakPolarHBondContact O-CB 3.47Å; L205-M208 PolarHBondContact O-N 2.69Å
206	F	97	Very high	91.2	Very high	154 Å²	154	61.5 Å²	61.5	68%	0.675	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.1	-177.3	75.7	-87.7	0	0	0	113.8	M208	F206-M208 VanDerWaalsContact C-N 3.26Å
207	D	97.7	Very high	90.8	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.027	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	12.2	177.8	74.3	-39.8	0	0	0	112.6	G121 K122 L205 R261 Y265	G121-D207 WeakPolarHBondContact CA-OD2 3.4Å; K122-D207 PolarHBondContact N-OD2 3.37Å; L205-D207 WeakPolarHBondContact CB-OD1 3.5Å; L205-D207 PolarHBondContact O-N 2.93Å; L205-D207 VanDerWaalsContact O-N 3.16Å; D207-R261 VanDerWaalsContact O-CB 3.3Å; D207-R261 WeakPolarHBondContact O-CB 3.32Å; D207-R261 PolarHBondContact O-N 3.26Å; D207-Y265 HydrophobicContact CB-CE2 3.79Å; D207-Y265 PolarHBondContact OD2-OH 2.92Å
208	M	98.4	Very high	90.4	Very high	3 Å²	3	60.4 Å²	60.4	2%	0.015	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	150.4	174.8	-59	174.8	179.7	0	0	111.6	P118 I204 L205 F206 F246 V258 Y259 R261	P118-M208 WeakPolarHBondContact O-CE 3.44Å; I204-M208 HydrophobicContact CG2-CB 4.17Å; L205-M208 HydrophobicContact CB-CE 4.04Å; L205-M208 HydrophobicContact CB-CG 4.2Å; L205-M208 HydrophobicContact CB-SD 4.01Å; L205-M208 HydrophobicContact CD1-CE 3.88Å; L205-M208 HydrophobicContact CG-CE 3.85Å; L205-M208 HydrophobicContact CG-SD 4.22Å; L205-M208 PolarHBondContact N-SD 2.94Å; L205-M208 VanDerWaalsContact N-SD 3.44Å; L205-M208 WeakPolarHBondContact O-CB 3.47Å; L205-M208 PolarHBondContact O-N 2.69Å; F206-M208 VanDerWaalsContact C-N 3.26Å; M208-F246 HydrophobicContact CE-CE1 3.87Å; M208-F246 HydrophobicContact CE-CZ 4.33Å; M208-F246 HydrophobicContact SD-CE1 4.02Å; M208-F246 HydrophobicContact SD-CZ 4.13Å; M208-V258 HydrophobicContact CB-CG1 3.89Å; M208-V258 HydrophobicContact CG-CG1 4.04Å; M208-V258 HydrophobicContact SD-CG1 3.81Å; M208-Y259 CarbonylContact C-O 3.54Å; M208-Y259 WeakPolarHBondContact CA-O 3.4Å; M208-R261 PolarHBondContact O-NE 3.48Å; M208-R261 PolarHBondContact O-NH2 2.85Å
209	I	98.3	Very high	90.1	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.9	171.7	-171.3	171.7	0	0	0	108.4	F151 I184 L229 A241 Y259 R261	F151-I209 HydrophobicContact CB-CD1 4.39Å; I184-I209 HydrophobicContact CD1-CD1 3.91Å; I184-I209 HydrophobicContact CD1-CG1 4.39Å; I184-I209 HydrophobicContact CG2-CD1 4.29Å; I184-I209 HydrophobicContact CG2-CG1 4.45Å; I209-L229 HydrophobicContact CG2-CD2 4.47Å; I209-A241 HydrophobicContact CD1-CB 4.42Å; I209-Y259 PolarHBondContact N-O 2.96Å; I209-Y259 WeakPolarHBondContact O-CB 3.49Å; I209-Y259 WeakPolarHBondContact O-CD2 2.83Å; I209-Y259 PolarHBondContact O-N 2.86Å; I209-R261 HydrophobicContact CB-CB 4.1Å; I209-R261 HydrophobicContact CB-CG 4.37Å; I209-R261 HydrophobicContact CG2-CB 4.2Å
210	C	97.7	Very high	89.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146.4	-179.5	-57	0	0	0	0	110.8	I185 C190 G257	I185-C210 HydrophobicContact CB-CB 4.09Å; I185-C210 PolarHBondContact N-O 3.07Å; C190-C210 HydrophobicContact CB-CB 3.56Å; C190-C210 WeakPolarHBondContact CB-SG 3.43Å; C190-C210 WeakPolarHBondContact SG-CB 3.01Å; C190-C210 CovalentContact SG-SG 2.03Å; C190-C210 PolarHBondContact SG-SG 3.29Å; C210-G257 WeakPolarHBondContact CA-O 3.45Å
211	A	96.9	Very high	89.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	147.3	173.3	0	0	0	0	0	110.2	V182 P183 I184 L229 G257 Y259	V182-A211 HydrophobicContact CB-CB 4.27Å; V182-A211 HydrophobicContact CG2-CB 3.79Å; P183-A211 CarbonylContact O-C 3.57Å; P183-A211 WeakPolarHBondContact O-CA 3.48Å; I184-A211 HydrophobicContact CD1-CB 4.24Å; A211-L229 HydrophobicContact CB-CD1 4.07Å; A211-L229 HydrophobicContact CB-CD2 3.97Å; A211-G257 PolarHBondContact N-O 3.02Å; A211-G257 PolarHBondContact O-N 3.33Å; A211-Y259 HydrophobicContact CB-CD2 4.33Å; A211-Y259 HydrophobicContact CB-CE2 3.81Å
212	G	94.2	Very high	89.1	Confident	3 Å²	3	44.8 Å²	44.8	3%	0.031	23%	0.233	C	C	.	.	S	Bend	trans	141.1	-174.7	180	0	0	0	0	0	112.6	P183 I185	P183-G212 WeakPolarHBondContact CD-O 3.47Å; P183-G212 VanDerWaalsContact CG-O 3.27Å; P183-G212 WeakPolarHBondContact CG-O 3.35Å; P183-G212 PolarHBondContact O-N 2.87Å; I185-G212 WeakPolarHBondContact CD1-O 3.13Å
213	Y	90.1	Very high	88.2	Confident	82 Å²	82	45.3 Å²	45.3	32%	0.322	24%	0.24	S	C	.	.			trans	-105.5	135.8	179.2	-62.4	-88.2	0	0	0	109.8	A181 V182 P183 Q215 G216 K218	A181-Y213 WeakPolarHBondContact O-CE2 3.37Å; A181-Y213 PolarHBondContact O-OH 3.48Å; V182-Y213 HydrophobicContact CG1-CE2 4.48Å; P183-Y213 HydrophobicContact CG-CD1 4.22Å; P183-Y213 HydrophobicContact CG-CE1 4.05Å; Y213-Q215 PolarHBondContact O-N 3.23Å; Y213-G216 WeakPolarHBondContact O-CA 3.29Å; Y213-G216 PolarHBondContact O-N 3.13Å; Y213-K218 HydrophobicContact CD2-CB 3.82Å; Y213-K218 HydrophobicContact CE2-CB 3.85Å; Y213-K218 HydrophobicContact CE2-CD 4Å; Y213-K218 HydrophobicContact CE2-CG 4.49Å
214	Q	88.8	Confident	87.8	Confident	84 Å²	84	40.9 Å²	40.9	39%	0.393	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-36.1	178.5	-175.5	178.1	2.5	0	0	111.9	M193 G216 Q253 N254	M193-Q214 HydrophobicContact CE-CB 3.88Å; M193-Q214 HydrophobicContact CE-CG 3.79Å; M193-Q214 HydrophobicContact SD-CB 4.35Å; M193-Q214 HydrophobicContact SD-CG 4.1Å; Q214-G216 PolarHBondContact O-N 2.96Å; Q214-Q253 CarbonylContact O-C 3.58Å; Q214-Q253 WeakPolarHBondContact O-CA 3.38Å; Q214-Q253 WeakPolarHBondContact O-CG 3.44Å; Q214-N254 WeakPolarHBondContact CG-OD1 3.48Å; Q214-N254 PolarHBondContact NE2-OD1 2.89Å; Q214-N254 PolarHBondContact O-N 2.82Å
215	Q	88.2	Confident	87.6	Confident	142 Å²	142	41.6 Å²	41.6	66%	0.664	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-9.1	177.9	-56.7	77.7	17.8	0	0	113	Y213	Y213-Q215 PolarHBondContact O-N 3.23Å
216	G	85.7	Confident	87.6	Confident	11 Å²	11	38.8 Å²	38.8	11%	0.113	21%	0.208	C	C	.	.			trans	77.8	-151.1	-170	0	0	0	0	0	112.6	Y213 Q214 K218 A251	Y213-G216 WeakPolarHBondContact O-CA 3.29Å; Y213-G216 PolarHBondContact O-N 3.13Å; Q214-G216 PolarHBondContact O-N 2.96Å; G216-K218 VanDerWaalsContact C-N 3.31Å; G216-K218 PolarHBondContact O-N 2.9Å; G216-A251 CarbonylContact C-O 3.5Å; G216-A251 WeakPolarHBondContact CA-O 3.12Å
217	G	80.6	Confident	87.6	Confident	66 Å²	66	31.5 Å²	31.5	68%	0.68	18%	0.176	S	C	*	.	S	Bend	trans	86	-31.1	177.3	0	0	0	0	0	116	A251	G217-A251 PolarHBondContact N-O 3.23Å
218	K	77.6	Confident	87.7	Confident	78 Å²	78	31.2 Å²	31.2	34%	0.339	18%	0.175	S	C	.	.			trans	-136.5	125.6	175.7	-73	-178.2	176.9	-176.2	0	110.9	G36 V180 Y213 G216	G36-K218 WeakPolarHBondContact O-CE 3.42Å; G36-K218 PolarHBondContact O-NZ 3.34Å; V180-K218 HydrophobicContact CG2-CB 3.75Å; V180-K218 HydrophobicContact CG2-CD 4.02Å; V180-K218 HydrophobicContact CG2-CG 4.01Å; Y213-K218 HydrophobicContact CD2-CB 3.82Å; Y213-K218 HydrophobicContact CE2-CB 3.85Å; Y213-K218 HydrophobicContact CE2-CD 4Å; Y213-K218 HydrophobicContact CE2-CG 4.49Å; G216-K218 VanDerWaalsContact C-N 3.31Å; G216-K218 PolarHBondContact O-N 2.9Å
219	D	73.9	Confident	87.7	Confident	23 Å²	23	31.1 Å²	31.1	12%	0.123	17%	0.174	C	C	.	.			trans	-163.9	168.3	-177.3	-158.2	2.3	0	0	0	110.9	A251 G257	D219-A251 HydrophobicContact CB-CB 3.77Å; D219-A251 VanDerWaalsContact CB-N 3.32Å; D219-A251 PolarHBondContact OD2-N 2.91Å; D219-G257 WeakPolarHBondContact OD1-CA 3.49Å; D219-G257 PolarHBondContact OD1-N 3.19Å
220	S	72.1	Confident	87.7	Confident	10 Å²	10	31 Å²	31	7%	0.07	17%	0.174	C	C	.	.			trans	-69.6	155.8	158.9	58.1	0	0	0	0	110.8	Y259	S220-Y259 PolarHBondContact OG-OH 2.03Å
221	C	81	Confident	87.6	Confident	12 Å²	12	31 Å²	31	8%	0.081	17%	0.174	C	C	.	.			trans	-139.4	-175.9	179.7	-157.2	0	0	0	0	112.9	N164 R166 G223 D224 C250	N164-C221 HydrophobicContact CB-CB 4.17Å; N164-C221 WeakPolarHBondContact O-CB 3.35Å; R166-C221 VanDerWaalsContact C-SG 3.51Å; C221-G223 PolarHBondContact O-N 2.9Å; C221-D224 PolarHBondContact N-OD2 2.73Å; C221-D224 WeakPolarHBondContact O-CB 3.38Å; C221-D224 PolarHBondContact O-N 2.76Å; C221-C250 WeakPolarHBondContact CA-SG 3.36Å; C221-C250 HydrophobicContact CB-CB 3.77Å; C221-C250 WeakPolarHBondContact CB-SG 3.48Å; C221-C250 WeakPolarHBondContact SG-CB 3.32Å; C221-C250 CovalentContact SG-SG 2.03Å; C221-C250 PolarHBondContact SG-SG 2.82Å
222	Q	72.4	Confident	87.5	Confident	82 Å²	82	33.5 Å²	33.5	38%	0.383	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	127.6	-177.7	-69.3	73.8	36.7	0	0	110.9	G163 N164 C250	G163-Q222 CarbonylContact C-O 3.36Å; G163-Q222 WeakPolarHBondContact CA-O 3.33Å; N164-Q222 PolarHBondContact N-O 2.84Å; Q222-C250 PolarHBondContact NE2-SG 2.83Å; Q222-C250 PolarHBondContact OE1-SG 3.44Å
223	G	71.8	Confident	87.6	Confident	18 Å²	18	34.6 Å²	34.6	19%	0.186	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.6	-19.8	-174.1	0	0	0	0	0	113.9	H57 C221 S225	H57-G223 PolarHBondContact NE2-O 3.25Å; C221-G223 PolarHBondContact O-N 2.9Å; G223-S225 PolarHBondContact O-N 2.57Å
224	D	86.9	Confident	87.5	Confident	16 Å²	16	38.5 Å²	38.5	9%	0.086	23%	0.227	C	C	.	.			trans	-79.7	-9.3	171.8	-60.7	-38.7	0	0	0	112.9	G161 W162 G163 C221 G226 G227 V244	G161-D224 VanDerWaalsContact C-OD1 3.32Å; G161-D224 VanDerWaalsContact CA-OD1 3.22Å; G161-D224 WeakPolarHBondContact CA-OD1 2.99Å; W162-D224 PolarHBondContact N-OD1 2.94Å; G163-D224 WeakPolarHBondContact CA-OD1 3.49Å; G163-D224 PolarHBondContact N-OD1 2.81Å; C221-D224 PolarHBondContact N-OD2 2.73Å; C221-D224 WeakPolarHBondContact O-CB 3.38Å; C221-D224 PolarHBondContact O-N 2.76Å; D224-G226 PolarHBondContact O-N 2.87Å; D224-G227 VanDerWaalsContact O-CA 3.32Å; D224-G227 WeakPolarHBondContact O-CA 3.22Å; D224-G227 PolarHBondContact O-N 2.79Å; D224-V244 HydrophobicContact CB-CG1 4.38Å; D224-V244 WeakPolarHBondContact O-CB 3.49Å; D224-V244 WeakPolarHBondContact O-CG2 3.25Å
225	S	92.9	Very high	87.5	Confident	25 Å²	25	38.5 Å²	38.5	18%	0.175	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.5	131.9	175.8	-82	0	0	0	0	113	C59 G60 H74 G223 G227	C59-S225 CarbonylContact C-O 3.56Å; C59-S225 WeakPolarHBondContact CA-O 3.34Å; C59-S225 WeakPolarHBondContact CB-O 3.49Å; G60-S225 PolarHBondContact N-O 3.25Å; H74-S225 PolarHBondContact CE1-OG 2.87Å; H74-S225 WeakPolarHBondContact NE2-CB 3.29Å; H74-S225 PolarHBondContact NE2-OG 3.1Å; G223-S225 PolarHBondContact O-N 2.57Å; S225-G227 PolarHBondContact O-N 3.48Å
226	G	97.5	Very high	87.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	-12.3	-175.8	0	0	0	0	0	115	G60 G61 S71 D224 V244	G60-G226 CarbonylContact O-C 3.5Å; G60-G226 VanDerWaalsContact O-C 3.25Å; G61-G226 WeakPolarHBondContact CA-O 3.1Å; S71-G226 WeakPolarHBondContact OG-CA 3.24Å; D224-G226 PolarHBondContact O-N 2.87Å; G226-V244 PolarHBondContact N-O 2.97Å
227	G	97.9	Very high	88	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	21%	0.213	C	C	.	.			trans	-65.1	164.1	173	0	0	0	0	0	113	D224 S225 V243 V244	D224-G227 VanDerWaalsContact O-CA 3.32Å; D224-G227 WeakPolarHBondContact O-CA 3.22Å; D224-G227 PolarHBondContact O-N 2.79Å; S225-G227 PolarHBondContact O-N 3.48Å; G227-V243 WeakPolarHBondContact O-CA 3.34Å; G227-V244 WeakPolarHBondContact O-CG2 3.27Å; G227-V244 PolarHBondContact O-N 2.65Å
228	P	98.3	Very high	88.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	141.8	-171.4	37.3	-36.5	0	0	0	113	Q48 V230 Q240	Q48-P228 VanDerWaalsContact OE1-CD 3.24Å; P228-V230 HydrophobicContact CB-CG1 3.86Å; P228-V230 HydrophobicContact CG-CG1 4.36Å; P228-Q240 HydrophobicContact CB-CG 3.9Å
229	L	98.4	Very high	89.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	106.6	160	175.9	70.1	0	0	0	108.2	C157 Y158 V159 V182 I184 I209 A211 Q240 A241 G242 Y259	C157-L229 HydrophobicContact CB-CD1 3.69Å; C157-L229 HydrophobicContact CB-CG 4.19Å; Y158-L229 CarbonylContact O-C 3.54Å; Y158-L229 WeakPolarHBondContact O-CA 3.5Å; V159-L229 HydrophobicContact CG2-CB 4.43Å; V159-L229 HydrophobicContact CG2-CD1 3.47Å; V159-L229 VanDerWaalsContact CG2-CD1 3.47Å; V182-L229 HydrophobicContact CG2-CD1 3.76Å; I184-L229 HydrophobicContact CD1-CD2 3.93Å; I209-L229 HydrophobicContact CG2-CD2 4.47Å; A211-L229 HydrophobicContact CB-CD1 4.07Å; A211-L229 HydrophobicContact CB-CD2 3.97Å; L229-Q240 CarbonylContact O-C 3.52Å; L229-Q240 WeakPolarHBondContact O-CA 3.33Å; L229-A241 HydrophobicContact CD2-CB 4.45Å; L229-A241 PolarHBondContact O-N 3.29Å; L229-G242 PolarHBondContact N-O 3.24Å; L229-G242 PolarHBondContact O-N 2.96Å; L229-Y259 HydrophobicContact CB-CD1 3.64Å; L229-Y259 HydrophobicContact CB-CE1 3.88Å; L229-Y259 HydrophobicContact CB-CG 4.32Å; L229-Y259 HydrophobicContact CD1-CE1 4.28Å; L229-Y259 HydrophobicContact CD2-CD1 4.04Å; L229-Y259 HydrophobicContact CD2-CD2 4.06Å; L229-Y259 HydrophobicContact CD2-CE1 4.35Å; L229-Y259 HydrophobicContact CD2-CE2 4.43Å; L229-Y259 HydrophobicContact CD2-CG 3.91Å; L229-Y259 HydrophobicContact CG-CD1 4.33Å; L229-Y259 HydrophobicContact CG-CE1 4.4Å
230	V	98	Very high	91	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.6	-173.4	-63.1	0	0	0	0	112.7	W45 W47 V142 C157 Y158 P228 W238 Q240	W45-V230 HydrophobicContact CE3-CG2 4Å; W45-V230 HydrophobicContact CH2-CG2 3.82Å; W45-V230 HydrophobicContact CZ3-CG2 3.3Å; W47-V230 HydrophobicContact CZ2-CG1 4.37Å; W47-V230 HydrophobicContact CZ2-CG2 4.33Å; V142-V230 HydrophobicContact CG2-CG1 3.85Å; C157-V230 CarbonylContact C-O 3.59Å; C157-V230 VanDerWaalsContact CA-O 3.24Å; C157-V230 WeakPolarHBondContact CA-O 3.19Å; C157-V230 VanDerWaalsContact CB-O 3.32Å; C157-V230 WeakPolarHBondContact CB-O 3.36Å; Y158-V230 PolarHBondContact N-O 2.93Å; Y158-V230 PolarHBondContact O-N 3.44Å; P228-V230 HydrophobicContact CB-CG1 3.86Å; P228-V230 HydrophobicContact CG-CG1 4.36Å; V230-W238 HydrophobicContact CB-CE3 4.09Å; V230-W238 HydrophobicContact CG2-CE3 3.85Å; V230-W238 HydrophobicContact CG2-CZ3 4.14Å; V230-Q240 HydrophobicContact CG1-CB 4.14Å; V230-Q240 HydrophobicContact CG1-CG 4.13Å
231	C	97.4	Very high	92.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.6	-176.4	-50	0	0	0	0	110.1	F151 M155 C157 W238 V239 A241	F151-C231 HydrophobicContact CD1-CB 3.96Å; F151-C231 HydrophobicContact CE1-CB 4.04Å; M155-C231 HydrophobicContact CE-CB 3.61Å; M155-C231 HydrophobicContact SD-CB 3.97Å; C157-C231 HydrophobicContact CB-CB 4.05Å; C157-C231 WeakPolarHBondContact CB-SG 3.25Å; C157-C231 WeakPolarHBondContact SG-CB 3.42Å; C157-C231 CovalentContact SG-SG 2.03Å; C157-C231 PolarHBondContact SG-SG 3.2Å; C231-W238 WeakPolarHBondContact O-CA 3.08Å; C231-V239 PolarHBondContact N-O 3.15Å; C231-V239 PolarHBondContact O-N 3.3Å; C231-A241 VanDerWaalsContact SG-CB 3.56Å
232	S	94.9	Very high	93	Very high	51 Å²	51	25.2 Å²	25.2	36%	0.357	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.2	175.1	-173.8	0	0	0	0	110.1	M155	M155-S232 WeakPolarHBondContact CE-O 3.32Å
233	M	94.3	Very high	94.3	Very high	27 Å²	27	21.3 Å²	21.3	13%	0.133	14%	0.137	C	C	.	.			trans	-77.9	164.5	176.2	-55.1	-56.2	-80.2	0	0	111.2	T149 F151 M155 N235 G236 T237 V239 Y279	T149-M233 HydrophobicContact CG2-CE 3.95Å; F151-M233 HydrophobicContact CD1-SD 4.49Å; F151-M233 HydrophobicContact CE1-SD 4.03Å; M155-M233 HydrophobicContact CE-SD 3.9Å; M233-N235 PolarHBondContact O-N 3.02Å; M233-N235 VanDerWaalsContact O-N 3.14Å; M233-G236 WeakPolarHBondContact O-CA 3.32Å; M233-G236 PolarHBondContact O-N 2.99Å; M233-T237 WeakPolarHBondContact CB-O 3.38Å; M233-T237 WeakPolarHBondContact CG-O 3.37Å; M233-T237 PolarHBondContact N-O 3.15Å; M233-V239 HydrophobicContact CG-CB 4.08Å; M233-V239 HydrophobicContact CG-CG2 3.44Å; M233-V239 VanDerWaalsContact CG-CG2 3.44Å; M233-V239 HydrophobicContact SD-CB 4.34Å; M233-V239 HydrophobicContact SD-CG2 4.25Å; M233-Y279 HydrophobicContact CE-CE1 3.7Å; M233-Y279 HydrophobicContact CG-CE1 4.12Å; M233-Y279 HydrophobicContact CG-CE2 4.37Å
234	V	89.8	Confident	95.6	Very high	163 Å²	163	20.7 Å²	20.7	99%	0.988	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.1	-177.6	-179.3	0	0	0	0	113	G236	V234-G236 PolarHBondContact O-N 2.76Å
235	N	88.7	Confident	96	Very high	85 Å²	85	20.2 Å²	20.2	46%	0.455	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	12	177.2	66.2	-0.7	0	0	0	114	R27 M233 T237 Y279	R27-N235 PolarHBondContact NH1-O 3.28Å; M233-N235 PolarHBondContact O-N 3.02Å; M233-N235 VanDerWaalsContact O-N 3.14Å; N235-T237 VanDerWaalsContact C-N 3.25Å; N235-T237 PolarHBondContact O-N 3.12Å; N235-T237 VanDerWaalsContact OD1-CB 3.29Å; N235-T237 WeakPolarHBondContact OD1-CB 3.33Å; N235-T237 PolarHBondContact OD1-N 3.17Å; N235-T237 VanDerWaalsContact OD1-N 3.1Å; N235-T237 PolarHBondContact OD1-OG1 3.19Å; N235-Y279 PolarHBondContact ND2-OH 3.21Å; N235-Y279 PolarHBondContact OD1-OH 2.89Å
236	G	90.1	Very high	95.9	Very high	36 Å²	36	20.3 Å²	20.3	37%	0.371	12%	0.124	S	C	.	.	S	Bend	trans	72.4	10.5	-179.4	0	0	0	0	0	114.9	M233 V234	M233-G236 WeakPolarHBondContact O-CA 3.32Å; M233-G236 PolarHBondContact O-N 2.99Å; V234-G236 PolarHBondContact O-N 2.76Å
237	T	94.3	Very high	95.2	Very high	7 Å²	7	21.8 Å²	21.8	4%	0.043	14%	0.14	C	C	.	.			trans	-82.8	133.3	172.3	-62.8	0	0	0	0	110.3	R27 C143 M233 N235 V239 Y279	R27-T237 PolarHBondContact NH1-OG1 2.91Å; R27-T237 PolarHBondContact NH2-OG1 3.49Å; C143-T237 HydrophobicContact CB-CG2 4.1Å; C143-T237 WeakPolarHBondContact SG-CG2 3Å; M233-T237 WeakPolarHBondContact CB-O 3.38Å; M233-T237 WeakPolarHBondContact CG-O 3.37Å; M233-T237 PolarHBondContact N-O 3.15Å; N235-T237 VanDerWaalsContact C-N 3.25Å; N235-T237 PolarHBondContact O-N 3.12Å; N235-T237 VanDerWaalsContact OD1-CB 3.29Å; N235-T237 WeakPolarHBondContact OD1-CB 3.33Å; N235-T237 PolarHBondContact OD1-N 3.17Å; N235-T237 VanDerWaalsContact OD1-N 3.1Å; N235-T237 PolarHBondContact OD1-OG1 3.19Å; T237-V239 HydrophobicContact CG2-CG2 4.09Å; T237-Y279 HydrophobicContact CG2-CD2 3.92Å; T237-Y279 HydrophobicContact CG2-CE2 3.97Å
238	W	96.8	Very high	94.3	Very high	20 Å²	20	23.8 Å²	23.8	8%	0.076	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121.7	171.8	-70.6	81.9	0	0	0	110.7	G26 L28 R33 W45 W47 C143 Y158 V230 C231	G26-W238 VanDerWaalsContact CA-O 3.29Å; G26-W238 WeakPolarHBondContact CA-O 3.49Å; G26-W238 PolarHBondContact O-N 3.2Å; L28-W238 HydrophobicContact CD1-CD2 4.2Å; L28-W238 HydrophobicContact CD1-CG 4.24Å; L28-W238 HydrophobicContact CD1-CZ2 4.22Å; L28-W238 HydrophobicContact CG-CG 4.43Å; R33-W238 VanDerWaalsContact CZ-CZ2 3.43Å; R33-W238 VanDerWaalsContact NH2-CE2 3.26Å; W45-W238 HydrophobicContact CH2-CE3 4.08Å; W45-W238 HydrophobicContact CH2-CH2 4Å; W45-W238 AromaticContact CH2-CZ3 3.65Å; W45-W238 HydrophobicContact CH2-CZ3 3.65Å; W45-W238 HydrophobicContact CZ3-CD2 4.28Å; W45-W238 AromaticContact CZ3-CE3 3.78Å; W45-W238 HydrophobicContact CZ3-CE3 3.78Å; W45-W238 HydrophobicContact CZ3-CH2 4.45Å; W45-W238 AromaticContact CZ3-CZ3 3.87Å; W45-W238 HydrophobicContact CZ3-CZ3 3.87Å; W47-W238 HydrophobicContact CH2-CB 3.45Å; W47-W238 VanDerWaalsContact CH2-CB 3.45Å; W47-W238 HydrophobicContact CH2-CD2 4.45Å; W47-W238 AromaticContact CH2-CG 3.73Å; W47-W238 HydrophobicContact CH2-CG 3.73Å; W47-W238 HydrophobicContact CZ2-CB 3.92Å; W47-W238 HydrophobicContact CZ2-CG 4.25Å; W47-W238 HydrophobicContact CZ3-CB 4.33Å; C143-W238 WeakPolarHBondContact CB-O 3.04Å; C143-W238 PolarHBondContact N-O 2.81Å; Y158-W238 AromaticContact CD2-CH2 3.71Å; Y158-W238 HydrophobicContact CD2-CH2 3.71Å; Y158-W238 AromaticContact CD2-CZ3 3.71Å; Y158-W238 HydrophobicContact CD2-CZ3 3.71Å; Y158-W238 AromaticContact CE2-CH2 3.86Å; Y158-W238 HydrophobicContact CE2-CH2 3.86Å; Y158-W238 HydrophobicContact CE2-CZ3 4.32Å; Y158-W238 HydrophobicContact CG-CZ3 4.41Å; V230-W238 HydrophobicContact CB-CE3 4.09Å; V230-W238 HydrophobicContact CG2-CE3 3.85Å; V230-W238 HydrophobicContact CG2-CZ3 4.14Å; C231-W238 WeakPolarHBondContact O-CA 3.08Å
239	V	98.1	Very high	93.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.9	-179.4	-175.4	0	0	0	0	108.8	C143 P145 F151 C231 M233 T237 A241 Y279	C143-V239 HydrophobicContact CB-CG2 4.01Å; C143-V239 WeakPolarHBondContact O-CA 3.32Å; P145-V239 HydrophobicContact CB-CG1 3.96Å; P145-V239 HydrophobicContact CG-CG1 4.41Å; F151-V239 HydrophobicContact CE1-CB 4.33Å; F151-V239 HydrophobicContact CE1-CG1 4.29Å; F151-V239 HydrophobicContact CZ-CB 4.37Å; F151-V239 HydrophobicContact CZ-CG1 3.83Å; C231-V239 PolarHBondContact N-O 3.15Å; C231-V239 PolarHBondContact O-N 3.3Å; M233-V239 HydrophobicContact CG-CB 4.08Å; M233-V239 HydrophobicContact CG-CG2 3.44Å; M233-V239 VanDerWaalsContact CG-CG2 3.44Å; M233-V239 HydrophobicContact SD-CB 4.34Å; M233-V239 HydrophobicContact SD-CG2 4.25Å; T237-V239 HydrophobicContact CG2-CG2 4.09Å; V239-A241 PolarHBondContact O-N 2.83Å; V239-Y279 HydrophobicContact CG1-CG 4.49Å; V239-Y279 HydrophobicContact CG2-CD1 3.84Å; V239-Y279 HydrophobicContact CG2-CD2 3.67Å; V239-Y279 HydrophobicContact CG2-CE1 4.23Å; V239-Y279 HydrophobicContact CG2-CE2 4.04Å; V239-Y279 HydrophobicContact CG2-CG 3.55Å
240	Q	98.4	Very high	92.6	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	115.6	176.3	-164.6	177.2	-18.3	0	0	109.9	S62 V142 C143 L144 P145 P228 L229 V230 G242 L262	S62-Q240 VanDerWaalsContact CB-OE1 3.32Å; S62-Q240 PolarHBondContact OG-NE2 3.02Å; S62-Q240 PolarHBondContact OG-OE1 3Å; V142-Q240 HydrophobicContact CG1-CB 4.21Å; V142-Q240 VanDerWaalsContact CG1-OE1 3.24Å; V142-Q240 HydrophobicContact CG2-CB 4Å; C143-Q240 PolarHBondContact O-N 3.46Å; L144-Q240 HydrophobicContact CD2-CB 4.25Å; P145-Q240 WeakPolarHBondContact CD-O 3.24Å; P145-Q240 WeakPolarHBondContact CG-O 3.38Å; P228-Q240 HydrophobicContact CB-CG 3.9Å; L229-Q240 CarbonylContact O-C 3.52Å; L229-Q240 WeakPolarHBondContact O-CA 3.33Å; V230-Q240 HydrophobicContact CG1-CB 4.14Å; V230-Q240 HydrophobicContact CG1-CG 4.13Å; Q240-G242 VanDerWaalsContact CG-O 3.24Å; Q240-G242 WeakPolarHBondContact CG-O 3.46Å; Q240-G242 PolarHBondContact NE2-O 2.78Å; Q240-G242 VanDerWaalsContact NE2-O 3.08Å; Q240-L262 HydrophobicContact CB-CD1 3.72Å; Q240-L262 HydrophobicContact CG-CD1 3.47Å; Q240-L262 VanDerWaalsContact CG-CD1 3.47Å; Q240-L262 WeakPolarHBondContact O-CD1 3.45Å
241	A	98.4	Very high	91.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-31.7	177.2	0	0	0	0	0	111.9	F151 I209 L229 C231 V239 L262	F151-A241 HydrophobicContact CD1-CB 3.72Å; F151-A241 HydrophobicContact CD2-CB 3.74Å; F151-A241 HydrophobicContact CE1-CB 3.72Å; F151-A241 HydrophobicContact CE2-CB 3.73Å; F151-A241 HydrophobicContact CG-CB 3.72Å; F151-A241 HydrophobicContact CZ-CB 3.71Å; I209-A241 HydrophobicContact CD1-CB 4.42Å; L229-A241 HydrophobicContact CD2-CB 4.45Å; L229-A241 PolarHBondContact O-N 3.29Å; C231-A241 VanDerWaalsContact SG-CB 3.56Å; V239-A241 PolarHBondContact O-N 2.83Å; A241-L262 PolarHBondContact O-N 3.42Å
242	G	98.5	Very high	91.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	177.2	-178.3	0	0	0	0	0	116	L229 Q240 T260	L229-G242 PolarHBondContact N-O 3.24Å; L229-G242 PolarHBondContact O-N 2.96Å; Q240-G242 VanDerWaalsContact CG-O 3.24Å; Q240-G242 WeakPolarHBondContact CG-O 3.46Å; Q240-G242 PolarHBondContact NE2-O 2.78Å; Q240-G242 VanDerWaalsContact NE2-O 3.08Å; G242-T260 CarbonylContact C-O 3.53Å; G242-T260 WeakPolarHBondContact CA-O 3.42Å
243	V	98.8	Very high	90.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.7	176.3	177.6	0	0	0	0	107.6	L70 A72 G227 S245 Y259 T260 L262	L70-V243 HydrophobicContact CD1-CG2 4.29Å; L70-V243 HydrophobicContact CD2-CG2 4.07Å; L70-V243 HydrophobicContact CG-CG2 3.98Å; A72-V243 HydrophobicContact CB-CG1 3.99Å; G227-V243 WeakPolarHBondContact O-CA 3.34Å; V243-S245 PolarHBondContact O-N 2.83Å; V243-Y259 CarbonylContact O-C 3.25Å; V243-Y259 WeakPolarHBondContact O-CA 3.49Å; V243-Y259 VanDerWaalsContact O-CB 3.32Å; V243-Y259 WeakPolarHBondContact O-CB 3.44Å; V243-T260 PolarHBondContact N-O 3.48Å; V243-T260 VanDerWaalsContact N-O 3.13Å; V243-T260 PolarHBondContact O-N 2.85Å; V243-L262 HydrophobicContact CG2-CD1 4.39Å; V243-L262 HydrophobicContact CG2-CD2 3.93Å; V243-L262 HydrophobicContact CG2-CG 4.35Å
244	V	98.3	Very high	90.6	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.03	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	121.8	178.5	179.1	0	0	0	0	109.1	V159 D224 G226 G227 Y259	V159-V244 HydrophobicContact CG1-CG2 3.72Å; D224-V244 HydrophobicContact CB-CG1 4.38Å; D224-V244 WeakPolarHBondContact O-CB 3.49Å; D224-V244 WeakPolarHBondContact O-CG2 3.25Å; G226-V244 PolarHBondContact N-O 2.97Å; G227-V244 WeakPolarHBondContact O-CG2 3.27Å; G227-V244 PolarHBondContact O-N 2.65Å; V244-Y259 HydrophobicContact CB-CD1 4.29Å; V244-Y259 HydrophobicContact CB-CE1 4.3Å; V244-Y259 HydrophobicContact CG2-CD1 3.9Å; V244-Y259 HydrophobicContact CG2-CE1 3.56Å
245	S	96.1	Very high	90.7	Very high	5 Å²	5	27.7 Å²	27.7	4%	0.035	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	-64.1	-174.8	-179.9	0	0	0	0	111.3	H74 D123 V243 V258	H74-S245 PolarHBondContact CE1-O 3.04Å; D123-S245 WeakPolarHBondContact CB-OG 3.47Å; D123-S245 WeakPolarHBondContact OD2-CB 3.45Å; D123-S245 PolarHBondContact OD2-OG 3.42Å; V243-S245 PolarHBondContact O-N 2.83Å; S245-V258 WeakPolarHBondContact CB-O 3Å; S245-V258 PolarHBondContact N-O 3.17Å; S245-V258 VanDerWaalsContact N-O 3.12Å
246	F	90.7	Very high	90.9	Very high	28 Å²	28	23.8 Å²	23.8	12%	0.123	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	172.3	179.9	69.5	-89.2	0	0	0	112.9	P118 V202 M208 V258	P118-F246 HydrophobicContact CB-CB 3.99Å; P118-F246 HydrophobicContact CB-CD1 3.59Å; P118-F246 HydrophobicContact CB-CE1 4.45Å; P118-F246 HydrophobicContact CB-CG 4.09Å; V202-F246 HydrophobicContact CG1-CE2 3.69Å; V202-F246 HydrophobicContact CG1-CZ 3.8Å; M208-F246 HydrophobicContact CE-CE1 3.87Å; M208-F246 HydrophobicContact CE-CZ 4.33Å; M208-F246 HydrophobicContact SD-CE1 4.02Å; M208-F246 HydrophobicContact SD-CZ 4.13Å; F246-V258 HydrophobicContact CD1-CB 4.11Å; F246-V258 HydrophobicContact CD1-CG1 4.19Å; F246-V258 HydrophobicContact CD2-CB 4.19Å; F246-V258 HydrophobicContact CD2-CG2 4.33Å; F246-V258 HydrophobicContact CE1-CB 3.78Å; F246-V258 HydrophobicContact CE1-CG1 3.49Å; F246-V258 VanDerWaalsContact CE1-CG1 3.49Å; F246-V258 HydrophobicContact CE1-CG2 4.43Å; F246-V258 HydrophobicContact CE2-CB 3.84Å; F246-V258 HydrophobicContact CE2-CG1 4.26Å; F246-V258 HydrophobicContact CE2-CG2 3.7Å; F246-V258 HydrophobicContact CG-CB 4.31Å; F246-V258 HydrophobicContact CZ-CB 3.64Å; F246-V258 HydrophobicContact CZ-CG1 3.54Å; F246-V258 HydrophobicContact CZ-CG2 3.78Å; F246-V258 PolarHBondContact N-O 2.75Å; F246-V258 VanDerWaalsContact N-O 3.1Å; F246-V258 PolarHBondContact O-N 2.82Å
247	G	83.4	Confident	91.2	Very high	31 Å²	31	22 Å²	22	32%	0.32	12%	0.122	S	C	.	.			trans	-161.6	163.6	172.8	0	0	0	0	0	109.8
248	L	79.6	Confident	91.3	Very high	42 Å²	42	21.7 Å²	21.7	22%	0.22	12%	0.12	C	C	.	.	S	Bend	trans	-100	91.8	172.6	-70	-178.9	0	0	0	109	Y194 E200 V202 R255	Y194-L248 HydrophobicContact CD1-CD1 4.02Å; Y194-L248 HydrophobicContact CE1-CB 4.34Å; Y194-L248 HydrophobicContact CE1-CD1 3.8Å; Y194-L248 HydrophobicContact CE1-CG 3.93Å; E200-L248 HydrophobicContact CB-CD1 4.19Å; V202-L248 HydrophobicContact CG2-CD1 3.78Å; V202-L248 HydrophobicContact CG2-CG 4.28Å; L248-R255 HydrophobicContact CB-CB 4.4Å; L248-R255 HydrophobicContact CB-CG 4.2Å
249	G	79.6	Confident	91.4	Very high	14 Å²	14	20.8 Å²	20.8	14%	0.144	12%	0.116	C	C	.	.	S	Bend	trans	72.4	-173	-164.6	0	0	0	0	0	111.9	E167	E167-G249 WeakPolarHBondContact OE1-CA 3.21Å
250	C	79.5	Confident	91.4	Very high	12 Å²	12	21 Å²	21	8%	0.081	12%	0.117	C	C	.	.	S	Bend	trans	-113.8	128.7	176.4	-53.9	0	0	0	0	110.2	E167 C221 Q222 K252	E167-C250 HydrophobicContact CB-CB 4.22Å; C221-C250 WeakPolarHBondContact CA-SG 3.36Å; C221-C250 HydrophobicContact CB-CB 3.77Å; C221-C250 WeakPolarHBondContact CB-SG 3.48Å; C221-C250 WeakPolarHBondContact SG-CB 3.32Å; C221-C250 CovalentContact SG-SG 2.03Å; C221-C250 PolarHBondContact SG-SG 2.82Å; Q222-C250 PolarHBondContact NE2-SG 2.83Å; Q222-C250 PolarHBondContact OE1-SG 3.44Å; C250-K252 PolarHBondContact O-N 3.1Å
251	A	79.7	Confident	91.4	Very high	30 Å²	30	23.4 Å²	23.4	25%	0.248	13%	0.127	C	C	.	.	S	Bend	trans	58.6	32.2	171.8	0	0	0	0	0	114.1	G216 G217 D219	G216-A251 CarbonylContact C-O 3.5Å; G216-A251 WeakPolarHBondContact CA-O 3.12Å; G217-A251 PolarHBondContact N-O 3.23Å; D219-A251 HydrophobicContact CB-CB 3.77Å; D219-A251 VanDerWaalsContact CB-N 3.32Å; D219-A251 PolarHBondContact OD2-N 2.91Å
252	K	84.8	Confident	91.4	Very high	89 Å²	89	23.4 Å²	23.4	39%	0.387	13%	0.127	S	C	.	.	B	Isolated β-bridge	trans	-83.7	149.1	175.6	-74.3	-177.8	-178.1	157.6	0	111.3	E167 C250 N254 R255	E167-K252 IonicContact OE1-NZ 2.82Å; E167-K252 PolarHBondContact OE1-NZ 3.42Å; E167-K252 WeakPolarHBondContact OE2-CE 3.37Å; E167-K252 IonicContact OE2-NZ 2.99Å; E167-K252 PolarHBondContact OE2-NZ 2.97Å; C250-K252 PolarHBondContact O-N 3.1Å; K252-N254 PolarHBondContact O-N 2.84Å; K252-R255 HydrophobicContact CB-CB 3.92Å; K252-R255 HydrophobicContact CB-CG 4.02Å; K252-R255 PolarHBondContact O-N 2.88Å
253	Q	89.4	Confident	91.4	Very high	134 Å²	134	24.5 Å²	24.5	63%	0.626	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	135	175.4	-174.8	-179.8	1.2	0	0	110.7	Q214 R255	Q214-Q253 CarbonylContact O-C 3.58Å; Q214-Q253 WeakPolarHBondContact O-CA 3.38Å; Q214-Q253 WeakPolarHBondContact O-CG 3.44Å; Q253-R255 PolarHBondContact O-N 2.03Å; Q253-R255 VanDerWaalsContact O-N 3.13Å
254	N	90.1	Very high	91.3	Very high	27 Å²	27	26.9 Å²	26.9	14%	0.144	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	20.7	-177.6	-56.6	-45.4	0	0	0	114.5	M193 M196 Q214 K252 P256	M193-N254 CarbonylContact C-O 3.54Å; M193-N254 HydrophobicContact CB-CB 4.13Å; M193-N254 HydrophobicContact CG-CB 4.42Å; M196-N254 HydrophobicContact SD-CB 4.3Å; M196-N254 PolarHBondContact SD-ND2 3.34Å; M196-N254 VanDerWaalsContact SD-ND2 3.43Å; Q214-N254 WeakPolarHBondContact CG-OD1 3.48Å; Q214-N254 PolarHBondContact NE2-OD1 2.89Å; Q214-N254 PolarHBondContact O-N 2.82Å; K252-N254 PolarHBondContact O-N 2.84Å; N254-P256 VanDerWaalsContact C-CD 3.49Å
255	R	91.4	Very high	91.3	Very high	16 Å²	16	27.7 Å²	27.7	6%	0.06	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-127	66.9	175.2	-58.8	-59.4	-152.9	-175.2	7.5	109.4	Y194 N197 E200 L248 K252 Q253	Y194-R255 PolarHBondContact O-NH1 3.45Å; N197-R255 PolarHBondContact ND2-NH2 3.11Å; E200-R255 PolarHBondContact O-NH1 3.47Å; E200-R255 PolarHBondContact O-NH2 2.87Å; E200-R255 IonicContact OE2-CZ 3.83Å; E200-R255 IonicContact OE2-NH2 3.99Å; E200-R255 PolarHBondContact OE2-NH2 2.79Å; L248-R255 HydrophobicContact CB-CB 4.4Å; L248-R255 HydrophobicContact CB-CG 4.2Å; K252-R255 HydrophobicContact CB-CB 3.92Å; K252-R255 HydrophobicContact CB-CG 4.02Å; K252-R255 PolarHBondContact O-N 2.88Å; Q253-R255 PolarHBondContact O-N 2.03Å; Q253-R255 VanDerWaalsContact O-N 3.13Å
256	P	93.8	Very high	91.2	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.019	15%	0.151	C	C	.	.			trans	-67.7	153.5	-179.9	31.2	-36	0	0	0	111.3	I185 M193 Y194 N254	I185-P256 HydrophobicContact CD1-CB 3.38Å; I185-P256 HydrophobicContact CD1-CG 3.87Å; M193-P256 HydrophobicContact SD-CG 4.17Å; Y194-P256 HydrophobicContact CE2-CG 4.02Å; Y194-P256 PolarHBondContact OH-O 2.82Å; N254-P256 VanDerWaalsContact C-CD 3.49Å
257	G	94.8	Very high	91.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	140.3	172.4	0	0	0	0	0	112.6	C210 A211 D219 Y259	C210-G257 WeakPolarHBondContact CA-O 3.45Å; A211-G257 PolarHBondContact N-O 3.02Å; A211-G257 PolarHBondContact O-N 3.33Å; D219-G257 WeakPolarHBondContact OD1-CA 3.49Å; D219-G257 PolarHBondContact OD1-N 3.19Å; G257-Y259 VanDerWaalsContact C-CE2 3.43Å; G257-Y259 WeakPolarHBondContact O-CD2 3.24Å; G257-Y259 VanDerWaalsContact O-CE2 3.24Å; G257-Y259 WeakPolarHBondContact O-CE2 3.21Å
258	V	97.1	Very high	92	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.1	175.8	-174.8	0	0	0	0	109.4	Y194 I204 M208 S245 F246	Y194-V258 HydrophobicContact CE2-CG2 3.64Å; Y194-V258 WeakPolarHBondContact OH-CG2 3.11Å; I204-V258 HydrophobicContact CD1-CG2 3.89Å; M208-V258 HydrophobicContact CB-CG1 3.89Å; M208-V258 HydrophobicContact CG-CG1 4.04Å; M208-V258 HydrophobicContact SD-CG1 3.81Å; S245-V258 WeakPolarHBondContact CB-O 3Å; S245-V258 PolarHBondContact N-O 3.17Å; S245-V258 VanDerWaalsContact N-O 3.12Å; F246-V258 HydrophobicContact CD1-CB 4.11Å; F246-V258 HydrophobicContact CD1-CG1 4.19Å; F246-V258 HydrophobicContact CD2-CB 4.19Å; F246-V258 HydrophobicContact CD2-CG2 4.33Å; F246-V258 HydrophobicContact CE1-CB 3.78Å; F246-V258 HydrophobicContact CE1-CG1 3.49Å; F246-V258 VanDerWaalsContact CE1-CG1 3.49Å; F246-V258 HydrophobicContact CE1-CG2 4.43Å; F246-V258 HydrophobicContact CE2-CB 3.84Å; F246-V258 HydrophobicContact CE2-CG1 4.26Å; F246-V258 HydrophobicContact CE2-CG2 3.7Å; F246-V258 HydrophobicContact CG-CB 4.31Å; F246-V258 HydrophobicContact CZ-CB 3.64Å; F246-V258 HydrophobicContact CZ-CG1 3.54Å; F246-V258 HydrophobicContact CZ-CG2 3.78Å; F246-V258 PolarHBondContact N-O 2.75Å; F246-V258 VanDerWaalsContact N-O 3.1Å; F246-V258 PolarHBondContact O-N 2.82Å
259	Y	98.5	Very high	92.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.7	-174.5	-54	-106.7	0	0	0	109.1	V159 M208 I209 A211 S220 L229 V243 V244 G257 R261	V159-Y259 HydrophobicContact CG1-CE1 4.39Å; V159-Y259 HydrophobicContact CG2-CE1 3.72Å; V159-Y259 WeakPolarHBondContact CG2-OH 3.48Å; M208-Y259 CarbonylContact C-O 3.54Å; M208-Y259 WeakPolarHBondContact CA-O 3.4Å; I209-Y259 PolarHBondContact N-O 2.96Å; I209-Y259 WeakPolarHBondContact O-CB 3.49Å; I209-Y259 WeakPolarHBondContact O-CD2 2.83Å; I209-Y259 PolarHBondContact O-N 2.86Å; A211-Y259 HydrophobicContact CB-CD2 4.33Å; A211-Y259 HydrophobicContact CB-CE2 3.81Å; S220-Y259 PolarHBondContact OG-OH 2.03Å; L229-Y259 HydrophobicContact CB-CD1 3.64Å; L229-Y259 HydrophobicContact CB-CE1 3.88Å; L229-Y259 HydrophobicContact CB-CG 4.32Å; L229-Y259 HydrophobicContact CD1-CE1 4.28Å; L229-Y259 HydrophobicContact CD2-CD1 4.04Å; L229-Y259 HydrophobicContact CD2-CD2 4.06Å; L229-Y259 HydrophobicContact CD2-CE1 4.35Å; L229-Y259 HydrophobicContact CD2-CE2 4.43Å; L229-Y259 HydrophobicContact CD2-CG 3.91Å; L229-Y259 HydrophobicContact CG-CD1 4.33Å; L229-Y259 HydrophobicContact CG-CE1 4.4Å; V243-Y259 CarbonylContact O-C 3.25Å; V243-Y259 WeakPolarHBondContact O-CA 3.49Å; V243-Y259 VanDerWaalsContact O-CB 3.32Å; V243-Y259 WeakPolarHBondContact O-CB 3.44Å; V244-Y259 HydrophobicContact CB-CD1 4.29Å; V244-Y259 HydrophobicContact CB-CE1 4.3Å; V244-Y259 HydrophobicContact CG2-CD1 3.9Å; V244-Y259 HydrophobicContact CG2-CE1 3.56Å; G257-Y259 VanDerWaalsContact C-CE2 3.43Å; G257-Y259 WeakPolarHBondContact O-CD2 3.24Å; G257-Y259 VanDerWaalsContact O-CE2 3.24Å; G257-Y259 WeakPolarHBondContact O-CE2 3.21Å; Y259-R261 PolarHBondContact O-N 3.14Å
260	T	98.6	Very high	93.6	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.025	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.6	169.3	-60.2	0	0	0	0	109.6	D123 I124 G242 V243 L262 Y265	D123-T260 WeakPolarHBondContact O-CB 3.28Å; D123-T260 PolarHBondContact O-OG1 3.43Å; I124-T260 HydrophobicContact CB-CG2 4.13Å; G242-T260 CarbonylContact C-O 3.53Å; G242-T260 WeakPolarHBondContact CA-O 3.42Å; V243-T260 PolarHBondContact N-O 3.48Å; V243-T260 VanDerWaalsContact N-O 3.13Å; V243-T260 PolarHBondContact O-N 2.85Å; T260-L262 PolarHBondContact O-N 2.81Å; T260-Y265 HydrophobicContact CG2-CD2 3.51Å; T260-Y265 HydrophobicContact CG2-CE2 3.33Å
261	R	98.6	Very high	94.4	Very high	52 Å²	52	39.7 Å²	39.7	20%	0.196	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	110.1	-176.9	179.8	-175.1	-66.2	-89.5	-2.8	111.3	D207 M208 I209 Y259 T263 S264 Y265	D207-R261 VanDerWaalsContact O-CB 3.3Å; D207-R261 WeakPolarHBondContact O-CB 3.32Å; D207-R261 PolarHBondContact O-N 3.26Å; M208-R261 PolarHBondContact O-NE 3.48Å; M208-R261 PolarHBondContact O-NH2 2.85Å; I209-R261 HydrophobicContact CB-CB 4.1Å; I209-R261 HydrophobicContact CB-CG 4.37Å; I209-R261 HydrophobicContact CG2-CB 4.2Å; Y259-R261 PolarHBondContact O-N 3.14Å; R261-T263 VanDerWaalsContact C-N 3.31Å; R261-T263 WeakPolarHBondContact CD-OG1 3.48Å; R261-T263 VanDerWaalsContact CG-OG1 3.24Å; R261-T263 WeakPolarHBondContact CG-OG1 3.21Å; R261-T263 PolarHBondContact O-N 2.96Å; R261-S264 WeakPolarHBondContact CD-OG 3.3Å; R261-S264 WeakPolarHBondContact O-CB 3.41Å; R261-S264 PolarHBondContact O-N 3.28Å; R261-Y265 WeakPolarHBondContact O-CD2 3.33Å
262	L	98.3	Very high	95.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-69.1	-24.1	-172.9	-71.9	174.8	0	0	0	115.1	L70 I124 L144 P145 Q240 A241 V243 T260 S264 Y265 S266 I269	L70-L262 HydrophobicContact CD1-CD2 4.3Å; L70-L262 HydrophobicContact CD2-CD1 3.79Å; L70-L262 HydrophobicContact CD2-CD2 3.73Å; L70-L262 HydrophobicContact CD2-CG 4.44Å; I124-L262 HydrophobicContact CD1-CD2 3.8Å; L144-L262 HydrophobicContact CD2-CD1 4.14Å; P145-L262 HydrophobicContact CG-CB 3.69Å; Q240-L262 HydrophobicContact CB-CD1 3.72Å; Q240-L262 HydrophobicContact CG-CD1 3.47Å; Q240-L262 VanDerWaalsContact CG-CD1 3.47Å; Q240-L262 WeakPolarHBondContact O-CD1 3.45Å; A241-L262 PolarHBondContact O-N 3.42Å; V243-L262 HydrophobicContact CG2-CD1 4.39Å; V243-L262 HydrophobicContact CG2-CD2 3.93Å; V243-L262 HydrophobicContact CG2-CG 4.35Å; T260-L262 PolarHBondContact O-N 2.81Å; L262-S264 PolarHBondContact O-N 3.47Å; L262-Y265 PolarHBondContact O-N 3.15Å; L262-S266 PolarHBondContact O-N 3.11Å; L262-I269 HydrophobicContact CD2-CD1 4.07Å
263	T	97.8	Very high	95.7	Very high	22 Å²	22	35.5 Å²	35.5	14%	0.135	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-63.4	-24.1	172.6	57.2	0	0	0	0	112.5	P145 T149 F151 R261 Y265	P145-T263 HydrophobicContact CB-CG2 3.94Å; P145-T263 HydrophobicContact CG-CG2 4.05Å; T149-T263 WeakPolarHBondContact O-CG2 3.45Å; F151-T263 HydrophobicContact CD2-CG2 4.49Å; F151-T263 HydrophobicContact CE2-CG2 4.04Å; R261-T263 VanDerWaalsContact C-N 3.31Å; R261-T263 WeakPolarHBondContact CD-OG1 3.48Å; R261-T263 VanDerWaalsContact CG-OG1 3.24Å; R261-T263 WeakPolarHBondContact CG-OG1 3.21Å; R261-T263 PolarHBondContact O-N 2.96Å; T263-Y265 VanDerWaalsContact C-N 3.34Å
264	S	98.1	Very high	95.4	Very high	50 Å²	50	33.6 Å²	33.6	35%	0.35	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-82.7	-11.6	176.2	-57.7	0	0	0	0	113	R261 L262	R261-S264 WeakPolarHBondContact CD-OG 3.3Å; R261-S264 WeakPolarHBondContact O-CB 3.41Å; R261-S264 PolarHBondContact O-N 3.28Å; L262-S264 PolarHBondContact O-N 3.47Å
265	Y	97.8	Very high	95	Very high	22 Å²	22	39 Å²	39	9%	0.086	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	5.9	-174.9	-72.9	-76.8	0	0	0	114.4	P112 K122 I124 D207 T260 R261 L262 T263 D267 F268 I269	P112-Y265 HydrophobicContact CG-CE1 4.22Å; K122-Y265 WeakPolarHBondContact CA-OH 3.31Å; K122-Y265 WeakPolarHBondContact CG-OH 3.41Å; K122-Y265 PolarHBondContact N-OH 3.44Å; K122-Y265 VanDerWaalsContact N-OH 3.13Å; I124-Y265 HydrophobicContact CD1-CD1 4.38Å; I124-Y265 HydrophobicContact CD1-CD2 4.41Å; I124-Y265 HydrophobicContact CD1-CG 3.89Å; I124-Y265 HydrophobicContact CG2-CD1 3.62Å; I124-Y265 HydrophobicContact CG2-CD2 4.41Å; I124-Y265 HydrophobicContact CG2-CE1 3.74Å; I124-Y265 HydrophobicContact CG2-CG 4Å; D207-Y265 HydrophobicContact CB-CE2 3.79Å; D207-Y265 PolarHBondContact OD2-OH 2.92Å; T260-Y265 HydrophobicContact CG2-CD2 3.51Å; T260-Y265 HydrophobicContact CG2-CE2 3.33Å; R261-Y265 WeakPolarHBondContact O-CD2 3.33Å; L262-Y265 PolarHBondContact O-N 3.15Å; T263-Y265 VanDerWaalsContact C-N 3.34Å; Y265-D267 PolarHBondContact O-N 2.85Å; Y265-D267 VanDerWaalsContact O-N 3.16Å; Y265-F268 HydrophobicContact CD1-CB 4.3Å; Y265-F268 HydrophobicContact CD1-CD1 4.4Å; Y265-F268 PolarHBondContact O-N 3.33Å; Y265-F268 VanDerWaalsContact O-N 3.15Å; Y265-I269 VanDerWaalsContact O-CG1 3.29Å; Y265-I269 WeakPolarHBondContact O-CG1 3.44Å; Y265-I269 PolarHBondContact O-N 3.11Å
266	S	94.1	Very high	94.8	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-54.1	-37.2	179.8	-54.6	0	0	0	0	113.2	P145 P147 L262 R270	P145-S266 PolarHBondContact O-OG 2.76Å; P147-S266 WeakPolarHBondContact CD-OG 3.28Å; L262-S266 PolarHBondContact O-N 3.11Å; S266-R270 WeakPolarHBondContact O-CB 2.98Å; S266-R270 PolarHBondContact O-N 3.18Å
267	D	94.2	Very high	94.4	Very high	99 Å²	99	42.2 Å²	42.2	53%	0.529	23%	0.233	S	C	.	.	H	α-helix	trans	-69.8	-45.3	178.6	-77.8	-20.8	0	0	0	112.5	Y265 I269 R270 S271	Y265-D267 PolarHBondContact O-N 2.85Å; Y265-D267 VanDerWaalsContact O-N 3.16Å; D267-I269 VanDerWaalsContact C-N 3.3Å; D267-I269 PolarHBondContact O-N 2.94Å; D267-R270 PolarHBondContact O-N 3.42Å; D267-R270 IonicContact OD1-CZ 3.63Å; D267-R270 IonicContact OD1-NE 3.62Å; D267-R270 IonicContact OD1-NH2 2.67Å; D267-R270 PolarHBondContact OD1-NH2 3.05Å; D267-S271 WeakPolarHBondContact O-CB 3.47Å; D267-S271 PolarHBondContact O-N 2.91Å; D267-S271 PolarHBondContact O-OG 3.39Å; D267-S271 VanDerWaalsContact O-OG 3.11Å
268	F	97.2	Very high	94.2	Very high	39 Å²	39	43.9 Å²	43.9	17%	0.171	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-43.6	174.8	168.9	-107.5	0	0	0	111.6	V110 P112 I124 L126 Y265 S271 T272	V110-F268 HydrophobicContact CG1-CE2 3.98Å; V110-F268 HydrophobicContact CG1-CZ 3.97Å; P112-F268 HydrophobicContact CG-CD1 4.31Å; P112-F268 HydrophobicContact CG-CD2 4.35Å; P112-F268 HydrophobicContact CG-CE1 4.04Å; P112-F268 HydrophobicContact CG-CE2 4.1Å; P112-F268 HydrophobicContact CG-CG 4.45Å; P112-F268 HydrophobicContact CG-CZ 3.94Å; I124-F268 HydrophobicContact CD1-CD1 4.32Å; I124-F268 HydrophobicContact CG1-CE1 4.45Å; I124-F268 HydrophobicContact CG2-CD1 4.26Å; I124-F268 HydrophobicContact CG2-CE1 4.12Å; L126-F268 HydrophobicContact CD1-CD1 4.01Å; L126-F268 HydrophobicContact CD1-CE1 3.55Å; L126-F268 HydrophobicContact CD1-CZ 4.03Å; L126-F268 HydrophobicContact CG-CE1 4Å; Y265-F268 HydrophobicContact CD1-CB 4.3Å; Y265-F268 HydrophobicContact CD1-CD1 4.4Å; Y265-F268 PolarHBondContact O-N 3.33Å; Y265-F268 VanDerWaalsContact O-N 3.15Å; F268-S271 PolarHBondContact O-OG 3.33Å; F268-T272 WeakPolarHBondContact O-CB 3.45Å; F268-T272 PolarHBondContact O-N 2.97Å; F268-T272 PolarHBondContact O-OG1 2.7Å
269	I	97.5	Very high	93.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-50.1	178	-63.4	164.9	0	0	0	110.1	I64 I124 L126 L144 L262 Y265 D267 S271 T272 V273 V276	I64-I269 HydrophobicContact CD1-CG2 4.48Å; I124-I269 HydrophobicContact CD1-CD1 4.14Å; I124-I269 HydrophobicContact CD1-CG1 4.26Å; L126-I269 HydrophobicContact CD1-CG1 4.32Å; L144-I269 HydrophobicContact CD1-CD1 4.26Å; L144-I269 HydrophobicContact CD1-CG2 3.74Å; L262-I269 HydrophobicContact CD2-CD1 4.07Å; Y265-I269 VanDerWaalsContact O-CG1 3.29Å; Y265-I269 WeakPolarHBondContact O-CG1 3.44Å; Y265-I269 PolarHBondContact O-N 3.11Å; D267-I269 VanDerWaalsContact C-N 3.3Å; D267-I269 PolarHBondContact O-N 2.94Å; I269-S271 PolarHBondContact O-N 2.84Å; I269-T272 PolarHBondContact O-N 3.22Å; I269-T272 VanDerWaalsContact O-N 3.13Å; I269-V273 PolarHBondContact O-N 2.91Å; I269-V276 HydrophobicContact CG2-CG1 4.2Å; I269-V276 HydrophobicContact CG2-CG2 4.21Å
270	R	94.9	Very high	92.9	Very high	145 Å²	145	49.5 Å²	49.5	55%	0.547	28%	0.284	S	S	.	.	H	α-helix	trans	-65.4	-35.3	-179.3	-177.9	173.9	56.3	146.8	-1.7	113.4	S266 D267 T272 V276	S266-R270 WeakPolarHBondContact O-CB 2.98Å; S266-R270 PolarHBondContact O-N 3.18Å; D267-R270 PolarHBondContact O-N 3.42Å; D267-R270 IonicContact OD1-CZ 3.63Å; D267-R270 IonicContact OD1-NE 3.62Å; D267-R270 IonicContact OD1-NH2 2.67Å; D267-R270 PolarHBondContact OD1-NH2 3.05Å; R270-T272 PolarHBondContact O-N 3.16Å; R270-V276 HydrophobicContact CB-CG1 4.32Å
271	S	95.1	Very high	91.5	Very high	98 Å²	98	51.1 Å²	51.1	69%	0.685	30%	0.301	S	S	*	.	H	α-helix	trans	-70.2	-22.4	175.9	62.4	0	0	0	0	112.9	D267 F268 I269	D267-S271 WeakPolarHBondContact O-CB 3.47Å; D267-S271 PolarHBondContact O-N 2.91Å; D267-S271 PolarHBondContact O-OG 3.39Å; D267-S271 VanDerWaalsContact O-OG 3.11Å; F268-S271 PolarHBondContact O-OG 3.33Å; I269-S271 PolarHBondContact O-N 2.84Å
272	T	97	Very high	89.3	Confident	30 Å²	30	53.3 Å²	53.3	18%	0.184	33%	0.33	C	S	.	.	H	α-helix	trans	-96.9	-39.7	-177.2	-55.1	0	0	0	0	111.8	W68 V110 L126 F268 I269 R270	W68-T272 HydrophobicContact CH2-CG2 3.64Å; W68-T272 HydrophobicContact CZ2-CG2 4.41Å; W68-T272 HydrophobicContact CZ3-CG2 3.83Å; V110-T272 HydrophobicContact CB-CG2 4.05Å; V110-T272 HydrophobicContact CG1-CG2 4.06Å; V110-T272 HydrophobicContact CG2-CG2 3.93Å; L126-T272 HydrophobicContact CB-CG2 4.31Å; L126-T272 HydrophobicContact CD1-CG2 3.71Å; F268-T272 WeakPolarHBondContact O-CB 3.45Å; F268-T272 PolarHBondContact O-N 2.97Å; F268-T272 PolarHBondContact O-OG1 2.7Å; I269-T272 PolarHBondContact O-N 3.22Å; I269-T272 VanDerWaalsContact O-N 3.13Å; R270-T272 PolarHBondContact O-N 3.16Å
273	V	95.3	Very high	87.1	Confident	2 Å²	2	60 Å²	60	1%	0.012	36%	0.361	C	S	.	.			trans	-112.4	93	-175.4	-171.1	0	0	0	0	108.9	I64 T65 W68 L126 I269 D275 V276	I64-V273 HydrophobicContact CD1-CG2 4.23Å; T65-V273 HydrophobicContact CG2-CG1 3.67Å; W68-V273 HydrophobicContact CB-CG1 4.29Å; W68-V273 HydrophobicContact CB-CG2 4.26Å; W68-V273 HydrophobicContact CD2-CG1 4.42Å; W68-V273 HydrophobicContact CD2-CG2 3.63Å; W68-V273 HydrophobicContact CE3-CG2 3.91Å; W68-V273 HydrophobicContact CG-CB 4.45Å; W68-V273 HydrophobicContact CG-CG1 3.85Å; W68-V273 HydrophobicContact CG-CG2 3.79Å; W68-V273 HydrophobicContact CZ3-CG2 4.49Å; L126-V273 HydrophobicContact CD1-CG2 4.28Å; L126-V273 HydrophobicContact CD2-CG2 4.33Å; I269-V273 PolarHBondContact O-N 2.91Å; V273-D275 VanDerWaalsContact C-N 3.27Å; V273-D275 PolarHBondContact O-N 2.74Å; V273-V276 HydrophobicContact CB-CB 4.02Å; V273-V276 HydrophobicContact CB-CG1 4.3Å; V273-V276 HydrophobicContact CG1-CB 3.85Å; V273-V276 WeakPolarHBondContact O-CG1 3.39Å; V273-V276 PolarHBondContact O-N 3.08Å
274	A	83.3	Confident	84.6	Confident	93 Å²	93	70.2 Å²	70.2	77%	0.769	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-34.1	-169.9	0	0	0	0	0	114.4
275	D	81	Confident	82	Confident	142 Å²	142	70.9 Å²	70.9	76%	0.759	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	9	-174.7	-62.1	-47	0	0	0	113.7	V273 Q277	V273-D275 VanDerWaalsContact C-N 3.27Å; V273-D275 PolarHBondContact O-N 2.74Å; D275-Q277 PolarHBondContact O-N 2.9Å
276	V	88.5	Confident	79.6	Confident	19 Å²	19	75 Å²	75	12%	0.115	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-68	127.9	-178.8	75.1	0	0	0	0	111.2	L144 I269 R270 V273 L278	L144-V276 HydrophobicContact CD1-CG2 3.94Å; I269-V276 HydrophobicContact CG2-CG1 4.2Å; I269-V276 HydrophobicContact CG2-CG2 4.21Å; R270-V276 HydrophobicContact CB-CG1 4.32Å; V273-V276 HydrophobicContact CB-CB 4.02Å; V273-V276 HydrophobicContact CB-CG1 4.3Å; V273-V276 HydrophobicContact CG1-CB 3.85Å; V273-V276 WeakPolarHBondContact O-CG1 3.39Å; V273-V276 PolarHBondContact O-N 3.08Å; V276-L278 HydrophobicContact CG1-CD2 4.45Å; V276-L278 HydrophobicContact CG2-CD2 4.35Å
277	Q	85.8	Confident	77.4	Confident	66 Å²	66	78.5 Å²	78.5	31%	0.308	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-99.1	123.3	173	-64.3	-171	-7.6	0	0	109.6	D275	D275-Q277 PolarHBondContact O-N 2.9Å
278	L	90.2	Very high	75.1	Confident	35 Å²	35	75.5 Å²	75.5	18%	0.183	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.7	179.2	-58.3	-178.1	0	0	0	110.6	L144 A146 V276 G280 G281	L144-L278 HydrophobicContact CB-CD2 3.83Å; L144-L278 CarbonylContact O-C 3.6Å; L144-L278 WeakPolarHBondContact O-CA 3.24Å; A146-L278 HydrophobicContact CB-CB 4.17Å; V276-L278 HydrophobicContact CG1-CD2 4.45Å; V276-L278 HydrophobicContact CG2-CD2 4.35Å; L278-G280 PolarHBondContact O-N 3.3Å; L278-G281 PolarHBondContact O-N 3Å; L278-G281 VanDerWaalsContact O-N 3.1Å
279	Y	88.5	Confident	72.7	Confident	53 Å²	53	77.8 Å²	77.8	21%	0.208	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	132.8	172.1	179.5	-88.2	0	0	0	110.9	L144 A146 T149 M233 N235 T237 V239 G281	L144-Y279 WeakPolarHBondContact O-CB 3.32Å; L144-Y279 PolarHBondContact O-N 3.14Å; A146-Y279 WeakPolarHBondContact CB-O 3.22Å; A146-Y279 PolarHBondContact N-O 3.34Å; T149-Y279 HydrophobicContact CG2-CD1 4.09Å; T149-Y279 HydrophobicContact CG2-CE1 4.35Å; T149-Y279 PolarHBondContact OG1-O 2.88Å; M233-Y279 HydrophobicContact CE-CE1 3.7Å; M233-Y279 HydrophobicContact CG-CE1 4.12Å; M233-Y279 HydrophobicContact CG-CE2 4.37Å; N235-Y279 PolarHBondContact ND2-OH 3.21Å; N235-Y279 PolarHBondContact OD1-OH 2.89Å; T237-Y279 HydrophobicContact CG2-CD2 3.92Å; T237-Y279 HydrophobicContact CG2-CE2 3.97Å; V239-Y279 HydrophobicContact CG1-CG 4.49Å; V239-Y279 HydrophobicContact CG2-CD1 3.84Å; V239-Y279 HydrophobicContact CG2-CD2 3.67Å; V239-Y279 HydrophobicContact CG2-CE1 4.23Å; V239-Y279 HydrophobicContact CG2-CE2 4.04Å; V239-Y279 HydrophobicContact CG2-CG 3.55Å; Y279-G281 PolarHBondContact O-N 2.8Å
280	G	79.1	Confident	70.6	Confident	66 Å²	66	81.3 Å²	81.3	68%	0.68	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	2.2	-178	0	0	0	0	0	114.3	L278	L278-G280 PolarHBondContact O-N 3.3Å
281	G	69	Low	68.7	Low	37 Å²	37	78.3 Å²	78.3	38%	0.381	48%	0.484	S	S	.	.			trans	-74.7	130.1	173	0	0	0	0	0	111.3	L278 Y279 H283	L278-G281 PolarHBondContact O-N 3Å; L278-G281 VanDerWaalsContact O-N 3.1Å; Y279-G281 PolarHBondContact O-N 2.8Å; G281-H283 PolarHBondContact O-N 3.41Å
282	A	53.8	Low	66.8	Low	98 Å²	98	77.8 Å²	77.8	81%	0.81	48%	0.477	S	S	*	.			trans	-64.2	120	166.4	0	0	0	0	0	108.6	R284	A282-R284 PolarHBondContact O-N 3.13Å
283	H	50.7	Low	64.8	Low	140 Å²	140	82 Å²	82	65%	0.648	50%	0.497	S	S	*	.			trans	-57.7	103	169.1	-102.5	-81.4	0	0	0	108.1	G281 S285	G281-H283 PolarHBondContact O-N 3.41Å; H283-S285 PolarHBondContact O-N 3.16Å
284	R	45	Very low	63.1	Low	238 Å²	238	85.6 Å²	85.6	90%	0.898	52%	0.52	S	S	*	.			trans	-71.4	72.6	156.7	-79.5	-170.8	179	-163.1	0.9	107	A282 V286	A282-R284 PolarHBondContact O-N 3.13Å; R284-V286 VanDerWaalsContact C-N 3.29Å; R284-V286 PolarHBondContact O-N 3.23Å
285	S	44.2	Very low	61.9	Low	64 Å²	64	83.5 Å²	83.5	45%	0.448	50%	0.499	S	S	.	.			trans	-68.7	96.7	168.8	-165.8	0	0	0	0	106.4	H283 C287 G288	H283-S285 PolarHBondContact O-N 3.16Å; S285-C287 PolarHBondContact O-N 3.48Å; S285-C287 VanDerWaalsContact O-N 3.1Å; S285-G288 PolarHBondContact O-N 3.3Å
286	V	47.5	Very low	60.9	Low	108 Å²	108	80.2 Å²	80.2	66%	0.655	49%	0.486	S	S	*	.	H	α-helix	trans	-52.1	-29.6	171.5	177.2	0	0	0	0	109.9	R284 G288 C289 V290	R284-V286 VanDerWaalsContact C-N 3.29Å; R284-V286 PolarHBondContact O-N 3.23Å; V286-G288 VanDerWaalsContact C-N 3.34Å; V286-G288 PolarHBondContact O-N 2.84Å; V286-C289 PolarHBondContact O-N 3.48Å; V286-V290 HydrophobicContact CG1-CG2 4.11Å; V286-V290 WeakPolarHBondContact O-CB 3.01Å; V286-V290 VanDerWaalsContact O-CG2 3.29Å; V286-V290 WeakPolarHBondContact O-CG2 3.45Å; V286-V290 PolarHBondContact O-N 2.86Å
287	C	48.1	Very low	59.9	Low	75 Å²	75	84.9 Å²	84.9	51%	0.507	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-39.3	174.1	-158.7	0	0	0	0	112.5	S285 V291	S285-C287 PolarHBondContact O-N 3.48Å; S285-C287 VanDerWaalsContact O-N 3.1Å; C287-V291 VanDerWaalsContact O-CB 3.29Å; C287-V291 WeakPolarHBondContact O-CB 3.32Å; C287-V291 WeakPolarHBondContact O-CG2 3.15Å; C287-V291 PolarHBondContact O-N 3.07Å
288	G	44.7	Very low	58.8	Low	37 Å²	37	84.2 Å²	84.2	38%	0.381	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-46.4	176.7	0	0	0	0	0	112.8	S285 V286 V291 V292	S285-G288 PolarHBondContact O-N 3.3Å; V286-G288 VanDerWaalsContact C-N 3.34Å; V286-G288 PolarHBondContact O-N 2.84Å; G288-V291 PolarHBondContact O-N 3.04Å; G288-V292 WeakPolarHBondContact O-CB 3.13Å; G288-V292 WeakPolarHBondContact O-CG2 3.43Å; G288-V292 PolarHBondContact O-N 2.63Å
289	C	48.5	Very low	57.6	Low	86 Å²	86	87.2 Å²	87.2	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-65.9	-40.4	177.2	-78.5	0	0	0	0	112.3	V286 V292 L293	V286-C289 PolarHBondContact O-N 3.48Å; C289-V292 PolarHBondContact O-N 2.79Å; C289-L293 VanDerWaalsContact O-CB 3.26Å; C289-L293 WeakPolarHBondContact O-CB 3.36Å; C289-L293 WeakPolarHBondContact O-CD1 3.46Å; C289-L293 WeakPolarHBondContact O-CG 3.28Å; C289-L293 PolarHBondContact O-N 2.78Å
290	V	52.4	Low	56.6	Low	75 Å²	75	91.3 Å²	91.3	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-68.4	-40.9	179	173.9	0	0	0	0	111	V286 L293 T294	V286-V290 HydrophobicContact CG1-CG2 4.11Å; V286-V290 WeakPolarHBondContact O-CB 3.01Å; V286-V290 VanDerWaalsContact O-CG2 3.29Å; V286-V290 WeakPolarHBondContact O-CG2 3.45Å; V286-V290 PolarHBondContact O-N 2.86Å; V290-L293 PolarHBondContact O-N 2.92Å; V290-T294 HydrophobicContact CG1-CG2 4.19Å; V290-T294 WeakPolarHBondContact O-CB 3.3Å; V290-T294 VanDerWaalsContact O-CG2 3.24Å; V290-T294 WeakPolarHBondContact O-CG2 3.23Å; V290-T294 PolarHBondContact O-N 3.23Å; V290-T294 PolarHBondContact O-OG1 3.32Å
291	V	54.2	Low	55.7	Low	83 Å²	83	93 Å²	93	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-65.4	-40.6	176.3	171.5	0	0	0	0	111.4	C287 G288 T294 S295	C287-V291 VanDerWaalsContact O-CB 3.29Å; C287-V291 WeakPolarHBondContact O-CB 3.32Å; C287-V291 WeakPolarHBondContact O-CG2 3.15Å; C287-V291 PolarHBondContact O-N 3.07Å; G288-V291 PolarHBondContact O-N 3.04Å; V291-T294 PolarHBondContact O-OG1 3.38Å; V291-S295 VanDerWaalsContact O-CB 3.3Å; V291-S295 WeakPolarHBondContact O-CB 3.45Å; V291-S295 PolarHBondContact O-N 2.89Å; V291-S295 PolarHBondContact O-OG 3.45Å
292	V	55.2	Low	55.5	Low	87 Å²	87	98.2 Å²	98.2	53%	0.527	56%	0.557	S	S	.	*	H	α-helix	trans	-67.6	-41.2	175.6	172.8	0	0	0	0	111.3	G288 C289 S295 C296	G288-V292 WeakPolarHBondContact O-CB 3.13Å; G288-V292 WeakPolarHBondContact O-CG2 3.43Å; G288-V292 PolarHBondContact O-N 2.63Å; C289-V292 PolarHBondContact O-N 2.79Å; V292-S295 WeakPolarHBondContact CA-OG 3.41Å; V292-S295 PolarHBondContact O-OG 3.03Å; V292-C296 VanDerWaalsContact O-CB 3.28Å; V292-C296 WeakPolarHBondContact O-CB 3.31Å; V292-C296 PolarHBondContact O-N 2.83Å; V292-C296 PolarHBondContact O-SG 2.84Å
293	L	55.6	Low	55.7	Low	117 Å²	117	99.6 Å²	99.6	61%	0.613	55%	0.55	S	S	*	.	H	α-helix	trans	-68.1	-41.4	178.4	-74.2	165.9	0	0	0	112.1	C289 V290 C296 L297	C289-L293 VanDerWaalsContact O-CB 3.26Å; C289-L293 WeakPolarHBondContact O-CB 3.36Å; C289-L293 WeakPolarHBondContact O-CD1 3.46Å; C289-L293 WeakPolarHBondContact O-CG 3.28Å; C289-L293 PolarHBondContact O-N 2.78Å; V290-L293 PolarHBondContact O-N 2.92Å; L293-C296 PolarHBondContact O-N 2.66Å; L293-L297 WeakPolarHBondContact O-CB 3.35Å; L293-L297 PolarHBondContact O-N 3.41Å
294	T	60.2	Low	56.3	Low	79 Å²	79	96.7 Å²	96.7	49%	0.485	54%	0.542	S	S	.	.	H	α-helix	trans	-71.1	-36.9	178.8	56.3	0	0	0	0	112.3	V290 V291 L297 S298	V290-T294 HydrophobicContact CG1-CG2 4.19Å; V290-T294 WeakPolarHBondContact O-CB 3.3Å; V290-T294 VanDerWaalsContact O-CG2 3.24Å; V290-T294 WeakPolarHBondContact O-CG2 3.23Å; V290-T294 PolarHBondContact O-N 3.23Å; V290-T294 PolarHBondContact O-OG1 3.32Å; V291-T294 PolarHBondContact O-OG1 3.38Å; T294-L297 PolarHBondContact O-N 2.85Å; T294-S298 WeakPolarHBondContact O-CB 3.13Å; T294-S298 PolarHBondContact O-N 3Å; T294-S298 PolarHBondContact O-OG 2.84Å
295	S	57.9	Low	56.6	Low	48 Å²	48	96.8 Å²	96.8	34%	0.336	54%	0.542	S	S	.	.	H	α-helix	trans	-66.9	-42	172.9	52.1	0	0	0	0	112	V291 V292 S298 I299	V291-S295 VanDerWaalsContact O-CB 3.3Å; V291-S295 WeakPolarHBondContact O-CB 3.45Å; V291-S295 PolarHBondContact O-N 2.89Å; V291-S295 PolarHBondContact O-OG 3.45Å; V292-S295 WeakPolarHBondContact CA-OG 3.41Å; V292-S295 PolarHBondContact O-OG 3.03Å; S295-S298 WeakPolarHBondContact CA-OG 3.27Å; S295-S298 PolarHBondContact O-N 2.89Å; S295-S298 PolarHBondContact O-OG 3.34Å; S295-I299 WeakPolarHBondContact O-CB 3.41Å; S295-I299 WeakPolarHBondContact O-CD1 3.27Å; S295-I299 VanDerWaalsContact O-CG1 3.23Å; S295-I299 WeakPolarHBondContact O-CG1 3.11Å; S295-I299 PolarHBondContact O-N 3.23Å
296	C	60.9	Low	56.8	Low	73 Å²	73	108 Å²	108	49%	0.493	58%	0.575	S	S	.	*	H	α-helix	trans	-63.5	-42.2	173.2	-74.9	0	0	0	0	112.6	V292 L293 I299 F300	V292-C296 VanDerWaalsContact O-CB 3.28Å; V292-C296 WeakPolarHBondContact O-CB 3.31Å; V292-C296 PolarHBondContact O-N 2.83Å; V292-C296 PolarHBondContact O-SG 2.84Å; L293-C296 PolarHBondContact O-N 2.66Å; C296-I299 PolarHBondContact O-N 3.12Å; C296-F300 WeakPolarHBondContact O-CB 3.44Å; C296-F300 PolarHBondContact O-N 3.44Å
297	L	65.5	Low	57.2	Low	117 Å²	117	108.1 Å²	108.1	61%	0.613	57%	0.571	S	S	*	*	H	α-helix	trans	-65.4	-40.4	178.9	-136.7	87.1	0	0	0	111.8	L293 T294 F300 L301	L293-L297 WeakPolarHBondContact O-CB 3.35Å; L293-L297 PolarHBondContact O-N 3.41Å; T294-L297 PolarHBondContact O-N 2.85Å; L297-F300 PolarHBondContact O-N 3.27Å; L297-L301 HydrophobicContact CD2-CD1 4.5Å; L297-L301 WeakPolarHBondContact O-CB 3.32Å; L297-L301 WeakPolarHBondContact O-CD1 3.47Å; L297-L301 VanDerWaalsContact O-CG 3.26Å; L297-L301 WeakPolarHBondContact O-CG 3.29Å; L297-L301 PolarHBondContact O-N 3.26Å
298	S	63.5	Low	57.7	Low	53 Å²	53	109.8 Å²	109.8	37%	0.371	57%	0.574	S	S	.	*	H	α-helix	trans	-70.9	-36.3	179.1	45	0	0	0	0	112.5	T294 S295 M302	T294-S298 WeakPolarHBondContact O-CB 3.13Å; T294-S298 PolarHBondContact O-N 3Å; T294-S298 PolarHBondContact O-OG 2.84Å; S295-S298 WeakPolarHBondContact CA-OG 3.27Å; S295-S298 PolarHBondContact O-N 2.89Å; S295-S298 PolarHBondContact O-OG 3.34Å; S298-M302 WeakPolarHBondContact O-CG 3.35Å; S298-M302 PolarHBondContact O-N 2.7Å
299	I	66	Low	58.4	Low	98 Å²	98	113.8 Å²	113.8	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-65.3	-43.9	170.9	-67.8	165.3	0	0	0	110.8	S295 C296 M302 L303	S295-I299 WeakPolarHBondContact O-CB 3.41Å; S295-I299 WeakPolarHBondContact O-CD1 3.27Å; S295-I299 VanDerWaalsContact O-CG1 3.23Å; S295-I299 WeakPolarHBondContact O-CG1 3.11Å; S295-I299 PolarHBondContact O-N 3.23Å; C296-I299 PolarHBondContact O-N 3.12Å; I299-M302 PolarHBondContact O-N 2.87Å; I299-L303 HydrophobicContact CG2-CD1 3.81Å; I299-L303 WeakPolarHBondContact O-CG 3.42Å; I299-L303 PolarHBondContact O-N 3.48Å
300	F	65.8	Low	59	Low	138 Å²	138	115.5 Å²	115.5	61%	0.605	59%	0.585	S	S	*	*	H	α-helix	trans	-64.8	-40.5	179.3	-165.2	-95.4	0	0	0	112.6	C296 L297 M302 L303 T304	C296-F300 WeakPolarHBondContact O-CB 3.44Å; C296-F300 PolarHBondContact O-N 3.44Å; L297-F300 PolarHBondContact O-N 3.27Å; F300-M302 VanDerWaalsContact C-N 3.34Å; F300-L303 PolarHBondContact O-N 3.19Å; F300-T304 HydrophobicContact CD1-CG2 4.11Å; F300-T304 HydrophobicContact CE1-CG2 3.79Å; F300-T304 HydrophobicContact CZ-CG2 4.11Å; F300-T304 WeakPolarHBondContact O-CG2 3.37Å; F300-T304 PolarHBondContact O-N 3.45Å; F300-T304 VanDerWaalsContact O-N 3.08Å; F300-T304 PolarHBondContact O-OG1 3.5Å
301	L	61.7	Low	59.4	Low	102 Å²	102	118 Å²	118	53%	0.534	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-34.5	174.4	-75.2	164.3	0	0	0	112.1	L297 T304 W305	L297-L301 HydrophobicContact CD2-CD1 4.5Å; L297-L301 WeakPolarHBondContact O-CB 3.32Å; L297-L301 WeakPolarHBondContact O-CD1 3.47Å; L297-L301 VanDerWaalsContact O-CG 3.26Å; L297-L301 WeakPolarHBondContact O-CG 3.29Å; L297-L301 PolarHBondContact O-N 3.26Å; L301-T304 PolarHBondContact O-OG1 3.04Å; L301-W305 WeakPolarHBondContact O-CB 3.26Å; L301-W305 PolarHBondContact O-N 2.98Å
302	M	63.3	Low	59.8	Low	147 Å²	147	120.3 Å²	120.3	72%	0.724	60%	0.599	S	S	*	*	H	α-helix	trans	-71.8	-28.7	174.7	-77.8	-155	-101.6	0	0	113.5	S298 I299 F300	S298-M302 WeakPolarHBondContact O-CG 3.35Å; S298-M302 PolarHBondContact O-N 2.7Å; I299-M302 PolarHBondContact O-N 2.87Å; F300-M302 VanDerWaalsContact C-N 3.34Å
303	L	59.1	Low	60.1	Low	127 Å²	127	122.7 Å²	122.7	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-82.8	-27.2	179.2	-72.1	166.7	0	0	0	113.4	I299 F300	I299-L303 HydrophobicContact CG2-CD1 3.81Å; I299-L303 WeakPolarHBondContact O-CG 3.42Å; I299-L303 PolarHBondContact O-N 3.48Å; F300-L303 PolarHBondContact O-N 3.19Å
304	T	63	Low	60.4	Low	78 Å²	78	123.2 Å²	123.2	48%	0.479	60%	0.604	S	S	.	*	H	α-helix	trans	-90.6	-6.4	-179.5	50.9	0	0	0	0	113.7	F300 L301	F300-T304 HydrophobicContact CD1-CG2 4.11Å; F300-T304 HydrophobicContact CE1-CG2 3.79Å; F300-T304 HydrophobicContact CZ-CG2 4.11Å; F300-T304 WeakPolarHBondContact O-CG2 3.37Å; F300-T304 PolarHBondContact O-N 3.45Å; F300-T304 VanDerWaalsContact O-N 3.08Å; F300-T304 PolarHBondContact O-OG1 3.5Å; L301-T304 PolarHBondContact O-OG1 3.04Å
305	W	52.1	Low	60.5	Low	240 Å²	240	126.8 Å²	126.8	91%	0.909	61%	0.614	S	S	*	*			trans	-98.2	38.9	175	-111.2	39.2	0	0	0	113	L301	L301-W305 WeakPolarHBondContact O-CB 3.26Å; L301-W305 PolarHBondContact O-N 2.98Å
306	R	46.8	Very low	60.7	Low	301 Å²	301	134 Å²	134	100%	1.136	64%	0.639	S	S	*	*			trans	-112.2	0	166.8	-89.2	-169.3	170.5	-149.9	-0.9	110.5

Retrieved 306 of 306 residues in 56.8 ms (Link to these results)

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