A0A087Y5Z1_POEFO Loading...

Hypoxia-inducible factor 1-alpha inhibitor

AlphaFold DB , UniProt , Accession A0A087Y5Z1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 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	T	36.4	Very low	30.1	Very low	193 Å²	193	135.5 Å²	135.5	100%	1.184	86%	0.86	S	S	*	*				0	99	0	-15.3	0	0	0	0	105.9
2	T	31.1	Very low	29.7	Very low	135 Å²	135	136.9 Å²	136.9	83%	0.828	86%	0.856	S	S	*	*			cis	-153.7	128.1	22.3	14.8	0	0	0	0	105.3
3	M	27.3	Very low	30	Very low	198 Å²	198	134.8 Å²	134.8	98%	0.975	86%	0.86	S	S	*	*			trans	-71.3	131.5	172.6	-71.6	-168.8	-167.9	0	0	109.1	A5	M3-A5 PolarHBondContact O-N 3.36Å
4	A	28.8	Very low	29.8	Very low	104 Å²	104	131.1 Å²	131.1	86%	0.86	85%	0.848	S	S	*	*			trans	-85.8	105.3	167	0	0	0	0	0	108.2
5	A	30.2	Very low	29.9	Very low	93 Å²	93	132.2 Å²	132.2	77%	0.769	85%	0.852	S	S	*	*			trans	-70.4	128.9	171.5	0	0	0	0	0	109.5	M3 T7	M3-A5 PolarHBondContact O-N 3.36Å; A5-T7 PolarHBondContact O-N 3.4Å
6	A	31.5	Very low	29.7	Very low	92 Å²	92	130.9 Å²	130.9	76%	0.76	85%	0.847	S	S	*	*			trans	-70.8	117.1	165.6	0	0	0	0	0	108	V8	A6-V8 PolarHBondContact O-N 3.07Å; A6-V8 VanDerWaalsContact O-N 3.13Å
7	T	28.4	Very low	29.9	Very low	142 Å²	142	132.5 Å²	132.5	87%	0.871	85%	0.847	S	S	*	*			trans	-62.1	107.8	173.7	25.8	0	0	0	0	110.2	A5	A5-T7 PolarHBondContact O-N 3.4Å
8	V	32	Very low	29.8	Very low	123 Å²	123	133.9 Å²	133.9	75%	0.745	85%	0.847	S	S	*	*			trans	-77.2	128.8	161.5	177.8	0	0	0	0	106.7	A6 E10	A6-V8 PolarHBondContact O-N 3.07Å; A6-V8 VanDerWaalsContact O-N 3.13Å; V8-E10 PolarHBondContact O-N 3.03Å; V8-E10 VanDerWaalsContact O-N 3.1Å
9	V	28.4	Very low	30.1	Very low	140 Å²	140	131.4 Å²	131.4	85%	0.848	85%	0.849	S	S	*	*			trans	-73	100.2	167.2	-179.1	0	0	0	0	106.3	A11	V9-A11 PolarHBondContact O-N 3.32Å
10	E	27.3	Very low	29.9	Very low	172 Å²	172	129 Å²	129	80%	0.804	84%	0.841	S	S	*	*			trans	-63.2	119.4	166.3	-78.3	177.4	148	0	0	108.3	V8	V8-E10 PolarHBondContact O-N 3.03Å; V8-E10 VanDerWaalsContact O-N 3.1Å
11	A	29.8	Very low	30.1	Very low	99 Å²	99	126.9 Å²	126.9	82%	0.818	83%	0.834	S	S	*	*			trans	-86.9	111.8	161.2	0	0	0	0	0	107	V9	V9-A11 PolarHBondContact O-N 3.32Å
12	D	25.7	Very low	30	Very low	152 Å²	152	127 Å²	127	81%	0.813	82%	0.819	S	S	*	*			trans	-50.3	135.2	179	-92.7	-38.9	0	0	0	112.7	A14	D12-A14 PolarHBondContact O-N 3.38Å; D12-A14 VanDerWaalsContact O-N 3.15Å
13	A	33.4	Very low	30.1	Very low	109 Å²	109	124.9 Å²	124.9	90%	0.901	81%	0.809	S	S	*	*			trans	-73.8	96	163.3	0	0	0	0	0	108.9
14	A	27.3	Very low	30.4	Very low	84 Å²	84	122.4 Å²	122.4	69%	0.694	80%	0.8	S	S	*	*			trans	-131.3	120	166.1	0	0	0	0	0	110	D12 S16	D12-A14 PolarHBondContact O-N 3.38Å; D12-A14 VanDerWaalsContact O-N 3.15Å; A14-S16 PolarHBondContact O-N 3.03Å
15	T	31	Very low	30.7	Very low	147 Å²	147	123.9 Å²	123.9	90%	0.902	80%	0.798	S	S	*	*			trans	-54.1	120.5	168.8	45.4	0	0	0	0	111.6
16	S	27.2	Very low	31.2	Very low	112 Å²	112	127.4 Å²	127.4	78%	0.783	80%	0.798	S	S	*	*			trans	-151.8	110.1	150.9	58.6	0	0	0	0	110	A14 D18	A14-S16 PolarHBondContact O-N 3.03Å; S16-D18 PolarHBondContact O-N 2.84Å
17	D	32.9	Very low	31.9	Very low	158 Å²	158	128 Å²	128	85%	0.845	80%	0.797	S	S	*	*			trans	-43.1	115.4	155.8	-163.5	16.6	0	0	0	110.1
18	D	27.3	Very low	33.6	Very low	157 Å²	157	129.5 Å²	129.5	84%	0.84	79%	0.786	S	S	*	*			trans	-169.9	104.4	149	-99.7	-23.9	0	0	0	108.6	S16 A20	S16-D18 PolarHBondContact O-N 2.84Å; D18-A20 PolarHBondContact O-N 2.9Å
19	G	35.1	Very low	36.1	Very low	86 Å²	86	130.2 Å²	130.2	89%	0.887	78%	0.781	S	S	*	*			trans	-62.9	104.5	174	0	0	0	0	0	111.2
20	A	27	Very low	39.2	Very low	84 Å²	84	126 Å²	126	69%	0.694	75%	0.751	S	S	*	*			trans	-104.1	89.1	156.4	0	0	0	0	0	107.8	D18 F22	D18-A20 PolarHBondContact O-N 2.9Å; A20-F22 PolarHBondContact O-N 3Å
21	A	35	Very low	42.4	Very low	84 Å²	84	121.9 Å²	121.9	69%	0.694	73%	0.734	S	S	*	*			trans	-57.1	103.9	171.4	0	0	0	0	0	110.3	S23	A21-S23 PolarHBondContact O-N 2.53Å
22	F	32.8	Very low	45.4	Very low	197 Å²	197	123.8 Å²	123.8	86%	0.864	73%	0.726	S	S	*	*			trans	-87.2	65	150.2	-79.7	-81.8	0	0	0	108	A20	A20-F22 PolarHBondContact O-N 3Å
23	S	34.4	Very low	48.8	Very low	89 Å²	89	120.9 Å²	120.9	62%	0.622	72%	0.718	S	S	*	*			trans	-91.3	81.6	159.8	60.8	0	0	0	0	106.9	A21 V25	A21-S23 PolarHBondContact O-N 2.53Å; S23-V25 PolarHBondContact O-N 2.82Å
24	D	33	Very low	51.8	Low	146 Å²	146	116.7 Å²	116.7	78%	0.781	68%	0.679	S	S	*	*			trans	-66.2	129.3	162.9	-95.2	-29.7	0	0	0	108.5	H26	D24-H26 VanDerWaalsContact C-N 3.27Å; D24-H26 PolarHBondContact O-N 3.15Å
25	V	34.5	Very low	55.2	Low	136 Å²	136	114.1 Å²	114.1	82%	0.824	65%	0.653	S	S	*	*	S	Bend	trans	-68.9	78.1	-170.5	-179.1	0	0	0	0	110	S23	S23-V25 PolarHBondContact O-N 2.82Å
26	H	41	Very low	58.4	Low	166 Å²	166	109.3 Å²	109.3	77%	0.769	62%	0.618	S	S	*	*			trans	-128.4	116.2	149	-80.9	-74.5	0	0	0	105.5	D24 R28	D24-H26 VanDerWaalsContact C-N 3.27Å; D24-H26 PolarHBondContact O-N 3.15Å; H26-R28 PolarHBondContact O-N 3.1Å
27	S	46.7	Very low	61.8	Low	104 Å²	104	113.4 Å²	113.4	73%	0.727	62%	0.621	S	S	*	*			trans	-47.6	120.9	165.4	49.9	0	0	0	0	106.6	E29	S27-E29 PolarHBondContact O-N 3.17Å
28	R	63.2	Low	64.9	Low	175 Å²	175	107.6 Å²	107.6	66%	0.66	59%	0.588	S	S	*	*			trans	-52.9	116.1	175	-71	-176.6	173.8	175.8	-3.5	106	H26 W30	H26-R28 PolarHBondContact O-N 3.1Å; R28-W30 WeakPolarHBondContact CB-O 3.14Å; R28-W30 PolarHBondContact O-N 3.21Å
29	E	85.3	Confident	68.3	Low	137 Å²	137	103.3 Å²	103.3	64%	0.64	57%	0.57	S	S	*	*	S	Bend	trans	-68.9	4.8	178.6	-65.5	-170.5	168.8	0	0	111.8	S27 H216	S27-E29 PolarHBondContact O-N 3.17Å; E29-H216 IonicContact OE2-CE1 3.21Å; E29-H216 PolarHBondContact OE2-CE1 3.31Å; E29-H216 IonicContact OE2-NE2 3.77Å
30	W	93.3	Very high	71.3	Confident	53 Å²	53	100.2 Å²	100.2	20%	0.201	53%	0.532	C	S	.	.	S	Bend	trans	-147.1	161.7	177.2	56.6	-93	0	0	0	110.5	R28 F35 H216 V267 L287	R28-W30 WeakPolarHBondContact CB-O 3.14Å; R28-W30 PolarHBondContact O-N 3.21Å; W30-F35 HydrophobicContact CD2-CE1 4.36Å; W30-F35 HydrophobicContact CD2-CZ 4.33Å; W30-F35 AromaticContact CE3-CE1 3.65Å; W30-F35 HydrophobicContact CE3-CE1 3.65Å; W30-F35 HydrophobicContact CE3-CE2 4.46Å; W30-F35 AromaticContact CE3-CZ 3.47Å; W30-F35 HydrophobicContact CE3-CZ 3.47Å; W30-F35 VanDerWaalsContact CE3-CZ 3.47Å; W30-F35 HydrophobicContact CH2-CE2 4.37Å; W30-F35 AromaticContact CH2-CZ 3.69Å; W30-F35 HydrophobicContact CH2-CZ 3.69Å; W30-F35 HydrophobicContact CZ2-CZ 4.48Å; W30-F35 AromaticContact CZ3-CE1 3.83Å; W30-F35 HydrophobicContact CZ3-CE1 3.83Å; W30-F35 AromaticContact CZ3-CE2 3.82Å; W30-F35 HydrophobicContact CZ3-CE2 3.82Å; W30-F35 AromaticContact CZ3-CZ 3.11Å; W30-F35 HydrophobicContact CZ3-CZ 3.11Å; W30-H216 AromaticContact CD1-CD2 3.63Å; W30-H216 AromaticContact CD1-CG 3.95Å; W30-H216 AromaticContact CD1-NE2 3.9Å; W30-V267 HydrophobicContact CD2-CG1 4.35Å; W30-V267 HydrophobicContact CD2-CG2 4.38Å; W30-V267 HydrophobicContact CG-CG1 4.4Å; W30-V267 HydrophobicContact CH2-CG2 4.07Å; W30-V267 HydrophobicContact CZ2-CB 3.81Å; W30-V267 HydrophobicContact CZ2-CG1 4.35Å; W30-V267 HydrophobicContact CZ2-CG2 3.82Å; W30-V267 HydrophobicContact CZ3-CG2 4.46Å; W30-L287 HydrophobicContact CB-CD1 3.45Å; W30-L287 VanDerWaalsContact CB-CD1 3.45Å; W30-L287 HydrophobicContact CD2-CD1 4.37Å; W30-L287 HydrophobicContact CG-CD1 3.78Å
31	D	93.9	Very high	74.7	Confident	85 Å²	85	100 Å²	100	46%	0.455	52%	0.524	S	S	.	.			trans	-132.8	166.6	172	73.5	72.9	0	0	0	112	S33 Q34	D31-S33 PolarHBondContact O-N 3.49Å; D31-S33 WeakPolarHBondContact OD1-CA 3.42Å; D31-S33 WeakPolarHBondContact OD1-CB 3.4Å; D31-S33 PolarHBondContact OD1-N 3.11Å; D31-S33 PolarHBondContact OD1-OG 3.26Å; D31-Q34 WeakPolarHBondContact O-CB 3.08Å; D31-Q34 PolarHBondContact O-N 3.2Å; D31-Q34 VanDerWaalsContact O-N 3.1Å
32	E	93.9	Very high	77.7	Confident	138 Å²	138	98.5 Å²	98.5	65%	0.645	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-65.6	-17.6	-173.6	-67.1	178.7	-171.7	0	0	113.8	Q34 F35	E32-Q34 PolarHBondContact O-N 2.85Å; E32-F35 HydrophobicContact CG-CE2 4.42Å; E32-F35 WeakPolarHBondContact O-CB 3.42Å; E32-F35 PolarHBondContact O-N 2.92Å
33	S	96.3	Very high	80.8	Confident	92 Å²	92	94.7 Å²	94.7	64%	0.643	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.1	174.8	77.5	0	0	0	0	112.6	D31 F35	D31-S33 PolarHBondContact O-N 3.49Å; D31-S33 WeakPolarHBondContact OD1-CA 3.42Å; D31-S33 WeakPolarHBondContact OD1-CB 3.4Å; D31-S33 PolarHBondContact OD1-N 3.11Å; D31-S33 PolarHBondContact OD1-OG 3.26Å; S33-F35 VanDerWaalsContact C-N 3.27Å; S33-F35 PolarHBondContact O-N 3.21Å
34	Q	97.4	Very high	83.9	Confident	21 Å²	21	95.7 Å²	95.7	10%	0.098	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-81.7	-6.5	178	-59.1	179.4	-92.3	0	0	113.3	D31 E32 L287 L288	D31-Q34 WeakPolarHBondContact O-CB 3.08Å; D31-Q34 PolarHBondContact O-N 3.2Å; D31-Q34 VanDerWaalsContact O-N 3.1Å; E32-Q34 PolarHBondContact O-N 2.85Å; Q34-L287 HydrophobicContact CB-CB 4.21Å; Q34-L288 HydrophobicContact CB-CB 4.48Å; Q34-L288 WeakPolarHBondContact CB-O 3.25Å; Q34-L288 VanDerWaalsContact CG-O 3.31Å; Q34-L288 WeakPolarHBondContact CG-O 3.36Å; Q34-L288 PolarHBondContact NE2-O 3.47Å; Q34-L288 WeakPolarHBondContact O-CB 3.47Å; Q34-L288 WeakPolarHBondContact O-CG 3.39Å; Q34-L288 PolarHBondContact O-N 3.05Å; Q34-L288 VanDerWaalsContact O-N 3.11Å
35	F	97.9	Very high	87	Confident	30 Å²	30	89 Å²	89	13%	0.132	46%	0.458	C	S	.	.	S	Bend	trans	-88.8	138.8	-178.4	-65.7	-3.7	0	0	0	111.2	W30 E32 S33 V267 L287	W30-F35 HydrophobicContact CD2-CE1 4.36Å; W30-F35 HydrophobicContact CD2-CZ 4.33Å; W30-F35 AromaticContact CE3-CE1 3.65Å; W30-F35 HydrophobicContact CE3-CE1 3.65Å; W30-F35 HydrophobicContact CE3-CE2 4.46Å; W30-F35 AromaticContact CE3-CZ 3.47Å; W30-F35 HydrophobicContact CE3-CZ 3.47Å; W30-F35 VanDerWaalsContact CE3-CZ 3.47Å; W30-F35 HydrophobicContact CH2-CE2 4.37Å; W30-F35 AromaticContact CH2-CZ 3.69Å; W30-F35 HydrophobicContact CH2-CZ 3.69Å; W30-F35 HydrophobicContact CZ2-CZ 4.48Å; W30-F35 AromaticContact CZ3-CE1 3.83Å; W30-F35 HydrophobicContact CZ3-CE1 3.83Å; W30-F35 AromaticContact CZ3-CE2 3.82Å; W30-F35 HydrophobicContact CZ3-CE2 3.82Å; W30-F35 AromaticContact CZ3-CZ 3.11Å; W30-F35 HydrophobicContact CZ3-CZ 3.11Å; E32-F35 HydrophobicContact CG-CE2 4.42Å; E32-F35 WeakPolarHBondContact O-CB 3.42Å; E32-F35 PolarHBondContact O-N 2.92Å; S33-F35 VanDerWaalsContact C-N 3.27Å; S33-F35 PolarHBondContact O-N 3.21Å; F35-V267 HydrophobicContact CE1-CG2 3.65Å; F35-V267 HydrophobicContact CE2-CG2 4.44Å; F35-V267 HydrophobicContact CZ-CG2 3.36Å; F35-L287 HydrophobicContact CD1-CD2 3.7Å; F35-L287 HydrophobicContact CE1-CD1 4.11Å; F35-L287 HydrophobicContact CE1-CD2 3.62Å
36	R	98.2	Very high	90.1	Very high	46 Å²	46	85.4 Å²	85.4	17%	0.174	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-69	146.8	165.6	-64.7	-177.9	-179.8	-78.4	-3.2	109.7	Y38 H101 G196 R218 E285 L288	R36-Y38 HydrophobicContact CB-CE1 4.34Å; R36-Y38 HydrophobicContact CB-CE2 3.94Å; R36-Y38 WeakPolarHBondContact CD-OH 3.44Å; R36-H101 VanDerWaalsContact CZ-CD2 3.41Å; R36-H101 VanDerWaalsContact NH2-CB 3.32Å; R36-G196 PolarHBondContact NH2-O 3.2Å; R36-R218 PolarHBondContact O-NH1 3.22Å; R36-E285 PolarHBondContact N-OE1 3.37Å; R36-L288 HydrophobicContact CG-CD1 4.45Å
37	K	98	Very high	92.8	Very high	197 Å²	197	83 Å²	83	86%	0.857	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-93.2	130	179.6	-65.7	-176.7	179.5	-179.5	0	109.8
38	Y	98.4	Very high	95.3	Very high	37 Å²	37	79 Å²	79	15%	0.145	39%	0.391	C	S	.	.			trans	-124.9	160.4	179.5	-62.5	-56.5	0	0	0	110.9	R36 F40 I220 F247 H283 E285	R36-Y38 HydrophobicContact CB-CE1 4.34Å; R36-Y38 HydrophobicContact CB-CE2 3.94Å; R36-Y38 WeakPolarHBondContact CD-OH 3.44Å; Y38-F40 VanDerWaalsContact C-N 3.34Å; Y38-F40 HydrophobicContact CD2-CZ 4.1Å; Y38-F40 HydrophobicContact CG-CE1 4.13Å; Y38-F40 AromaticContact CG-CZ 3.86Å; Y38-F40 HydrophobicContact CG-CZ 3.86Å; Y38-F40 PolarHBondContact O-N 3.35Å; Y38-I220 HydrophobicContact CD2-CD1 3.71Å; Y38-I220 HydrophobicContact CE2-CD1 3.84Å; Y38-F247 HydrophobicContact CD1-CB 3.83Å; Y38-F247 HydrophobicContact CE1-CB 3.8Å; Y38-H283 AromaticContact CE2-NE2 3.56Å; Y38-H283 AromaticContact CZ-CE1 3.78Å; Y38-H283 AromaticContact CZ-NE2 3.38Å; Y38-H283 PolarHBondContact OH-CE1 3.24Å; Y38-H283 VanDerWaalsContact OH-CE1 3.25Å; Y38-H283 PolarHBondContact OH-NE2 3.38Å; Y38-E285 WeakPolarHBondContact CE2-OE2 3.31Å; Y38-E285 PolarHBondContact OH-OE2 3.28Å
39	S	98.3	Very high	97	Very high	66 Å²	66	72 Å²	72	46%	0.462	37%	0.369	S	S	.	.	S	Bend	trans	-84.8	-1.3	-171.4	63.1	0	0	0	0	115.3	Y252	S39-Y252 VanDerWaalsContact CB-OH 3.25Å; S39-Y252 WeakPolarHBondContact CB-OH 3.33Å; S39-Y252 PolarHBondContact OG-OH 3.5Å
40	F	98.4	Very high	97.5	Very high	21 Å²	21	68.8 Å²	68.8	9%	0.092	35%	0.352	C	S	.	.	S	Bend	trans	-115.7	150.6	-173.6	51	-101.8	0	0	0	112	Y38 T42 I220 F222 F247 F258 V261	Y38-F40 VanDerWaalsContact C-N 3.34Å; Y38-F40 HydrophobicContact CD2-CZ 4.1Å; Y38-F40 HydrophobicContact CG-CE1 4.13Å; Y38-F40 AromaticContact CG-CZ 3.86Å; Y38-F40 HydrophobicContact CG-CZ 3.86Å; Y38-F40 PolarHBondContact O-N 3.35Å; F40-T42 HydrophobicContact CD2-CG2 4.07Å; F40-T42 HydrophobicContact CE2-CG2 4.02Å; F40-I220 HydrophobicContact CE2-CD1 4.3Å; F40-I220 HydrophobicContact CE2-CG2 3.86Å; F40-I220 HydrophobicContact CZ-CD1 4.36Å; F40-I220 HydrophobicContact CZ-CG2 4.37Å; F40-F222 HydrophobicContact CD2-CE1 4.2Å; F40-F222 HydrophobicContact CD2-CZ 4.33Å; F40-F222 HydrophobicContact CE1-CZ 4.35Å; F40-F222 HydrophobicContact CE2-CE1 4.14Å; F40-F222 AromaticContact CE2-CZ 3.82Å; F40-F222 HydrophobicContact CE2-CZ 3.82Å; F40-F222 HydrophobicContact CZ-CE1 4.48Å; F40-F222 AromaticContact CZ-CZ 3.83Å; F40-F222 HydrophobicContact CZ-CZ 3.83Å; F40-F247 AromaticContact CE1-CD2 3.51Å; F40-F247 HydrophobicContact CE1-CD2 3.51Å; F40-F247 AromaticContact CE1-CE2 3.64Å; F40-F247 HydrophobicContact CE1-CE2 3.64Å; F40-F247 HydrophobicContact CE1-CG 4.11Å; F40-F247 HydrophobicContact CE1-CZ 4.34Å; F40-F247 AromaticContact CZ-CD2 3.69Å; F40-F247 HydrophobicContact CZ-CD2 3.69Å; F40-F247 AromaticContact CZ-CE2 3.71Å; F40-F247 HydrophobicContact CZ-CE2 3.71Å; F40-F258 HydrophobicContact CD1-CE1 4.04Å; F40-F258 HydrophobicContact CD1-CE2 4.46Å; F40-F258 AromaticContact CD1-CZ 3.62Å; F40-F258 HydrophobicContact CD1-CZ 3.62Å; F40-F258 HydrophobicContact CE1-CE1 4.47Å; F40-F258 AromaticContact CE1-CZ 3.78Å; F40-F258 HydrophobicContact CE1-CZ 3.78Å; F40-V261 HydrophobicContact CB-CG1 3.41Å; F40-V261 VanDerWaalsContact CB-CG1 3.41Å; F40-V261 HydrophobicContact CD1-CG1 3.79Å; F40-V261 HydrophobicContact CG-CG1 3.69Å
41	P	98.5	Very high	97.7	Very high	81 Å²	81	71 Å²	71	53%	0.526	37%	0.371	S	S	.	.			trans	-75.8	156	174.2	32.9	-35.1	0	0	0	111.3	V262 G263	P41-V262 HydrophobicContact CG-CG1 4.39Å; P41-V262 HydrophobicContact CG-CG2 4.14Å; P41-G263 PolarHBondContact O-N 3.37Å
42	T	98.6	Very high	97.9	Very high	51 Å²	51	68.4 Å²	68.4	31%	0.313	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	154.9	173.6	60.7	0	0	0	0	111.5	F40 I220 G263 E265	F40-T42 HydrophobicContact CD2-CG2 4.07Å; F40-T42 HydrophobicContact CE2-CG2 4.02Å; T42-I220 HydrophobicContact CG2-CG2 4.1Å; T42-G263 CarbonylContact C-O 3.59Å; T42-G263 WeakPolarHBondContact CA-O 3.24Å; T42-E265 WeakPolarHBondContact CB-OE2 3.08Å; T42-E265 HydrophobicContact CG2-CB 4.16Å; T42-E265 WeakPolarHBondContact CG2-OE2 3.37Å; T42-E265 PolarHBondContact OG1-OE2 2.91Å
43	K	98.3	Very high	98.1	Very high	117 Å²	117	66.6 Å²	66.6	51%	0.509	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147	168.2	-65.4	179.6	-178	176.2	0	109.1	G263 Y264 E265	K43-G263 PolarHBondContact N-O 3.47Å; K43-Y264 HydrophobicContact CB-CD1 4.39Å; K43-Y264 CarbonylContact O-C 3.53Å; K43-Y264 VanDerWaalsContact O-CA 3.23Å; K43-Y264 WeakPolarHBondContact O-CA 3.37Å; K43-E265 PolarHBondContact O-N 3.44Å
44	P	98.5	Very high	98.3	Very high	111 Å²	111	69.2 Å²	69.2	72%	0.721	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	137.3	178.6	27.7	-34.1	0	0	0	111.7	E265	P44-E265 CarbonylContact C-O 3.58Å; P44-E265 WeakPolarHBondContact CA-O 3.47Å
45	I	98.8	Very high	98.3	Very high	6 Å²	6	68.2 Å²	68.2	3%	0.031	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-73.7	131.6	165.2	-64.2	166	0	0	0	107.9	R47 P64 V66 L221 E265 A266 L274	I45-R47 PolarHBondContact O-N 2.94Å; I45-P64 HydrophobicContact CD1-CB 4.23Å; I45-P64 HydrophobicContact CD1-CG 4.48Å; I45-P64 HydrophobicContact CG1-CB 4.43Å; I45-P64 HydrophobicContact CG1-CG 4.32Å; I45-P64 HydrophobicContact CG2-CB 4.19Å; I45-V66 HydrophobicContact CG2-CG2 4.12Å; I45-L221 HydrophobicContact CD1-CB 4.4Å; I45-L221 HydrophobicContact CD1-CD1 4.3Å; I45-L221 HydrophobicContact CD1-CD2 4.24Å; I45-E265 PolarHBondContact N-O 3.44Å; I45-A266 HydrophobicContact CB-CB 3.96Å; I45-A266 HydrophobicContact CD1-CB 4.25Å; I45-L274 HydrophobicContact CD1-CD1 4.12Å; I45-L274 HydrophobicContact CG2-CD1 4.27Å
46	P	98.6	Very high	98.3	Very high	59 Å²	59	69.2 Å²	69.2	38%	0.383	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-57.6	133.8	177.7	-25.1	34.8	0	0	0	112.2	L48 L58 V66	P46-L48 HydrophobicContact CB-CD1 4.21Å; P46-L48 HydrophobicContact CB-CG 4.18Å; P46-L58 HydrophobicContact CB-CD1 4.15Å; P46-L58 HydrophobicContact CG-CD1 4.04Å; P46-V66 PolarHBondContact O-N 3.48Å
47	R	98.7	Very high	98.3	Very high	117 Å²	117	72 Å²	72	44%	0.442	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	116.4	170.4	-63.1	-179.9	61.6	85.9	8.3	108.3	I45 V66 T68 V267 D272	I45-R47 PolarHBondContact O-N 2.94Å; R47-V66 CarbonylContact C-O 3.59Å; R47-V66 WeakPolarHBondContact CA-O 3.01Å; R47-V66 HydrophobicContact CB-CB 4.48Å; R47-V66 HydrophobicContact CG-CB 3.95Å; R47-V66 HydrophobicContact CG-CG1 4.23Å; R47-V66 HydrophobicContact CG-CG2 4.46Å; R47-T68 HydrophobicContact CB-CG2 4.17Å; R47-V267 PolarHBondContact NH1-O 3.06Å; R47-D272 IonicContact CZ-OD1 3.69Å; R47-D272 IonicContact CZ-OD2 3.32Å; R47-D272 IonicContact NH1-OD1 3.97Å; R47-D272 IonicContact NH1-OD2 2.66Å; R47-D272 PolarHBondContact NH1-OD2 3.42Å; R47-D272 IonicContact NH2-OD1 2.77Å; R47-D272 PolarHBondContact NH2-OD1 2.9Å; R47-D272 IonicContact NH2-OD2 2.9Å; R47-D272 PolarHBondContact NH2-OD2 2.77Å
48	L	98.6	Very high	98.4	Very high	18 Å²	18	63.4 Å²	63.4	9%	0.094	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	156.7	-170.6	-62.3	176	0	0	0	111.2	P46 D52 R54 A55 L58 V65 V66 L67 T68	P46-L48 HydrophobicContact CB-CD1 4.21Å; P46-L48 HydrophobicContact CB-CG 4.18Å; L48-D52 HydrophobicContact CB-CB 4.34Å; L48-R54 HydrophobicContact CD1-CB 3.85Å; L48-A55 HydrophobicContact CB-CB 4.04Å; L48-A55 HydrophobicContact CD1-CB 4.05Å; L48-L58 HydrophobicContact CD1-CD1 4.04Å; L48-V65 HydrophobicContact CB-CG2 4.26Å; L48-V65 HydrophobicContact CD1-CG2 3.98Å; L48-V65 HydrophobicContact CG-CG2 4.28Å; L48-V66 PolarHBondContact N-O 2.64Å; L48-L67 VanDerWaalsContact O-CA 3.32Å; L48-L67 WeakPolarHBondContact O-CA 3.45Å; L48-T68 PolarHBondContact O-N 2.87Å; L48-T68 PolarHBondContact O-OG1 3.3Å
49	S	98.6	Very high	98.4	Very high	28 Å²	28	61.8 Å²	61.8	20%	0.196	33%	0.327	C	S	.	.			trans	-66.6	145.8	163.9	172.6	0	0	0	0	110	T51 D52 D69	S49-T51 PolarHBondContact O-N 2.97Å; S49-T51 VanDerWaalsContact O-N 3.15Å; S49-T51 PolarHBondContact OG-N 2.94Å; S49-T51 VanDerWaalsContact OG-N 3.16Å; S49-T51 PolarHBondContact OG-OG1 2.8Å; S49-D52 VanDerWaalsContact O-CB 3.23Å; S49-D52 WeakPolarHBondContact O-CB 3.41Å; S49-D52 PolarHBondContact O-N 3.1Å; S49-D69 WeakPolarHBondContact CA-OD1 3.37Å; S49-D69 VanDerWaalsContact CB-OD2 3.23Å; S49-D69 WeakPolarHBondContact CB-OD2 3.23Å; S49-D69 VanDerWaalsContact OG-CG 3.29Å; S49-D69 PolarHBondContact OG-OD1 2.65Å; S49-D69 PolarHBondContact OG-OD2 3.04Å
50	Y	97.1	Very high	98.4	Very high	71 Å²	71	62.5 Å²	62.5	28%	0.278	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-15.5	173	84.2	-91.9	0	0	0	113.2	D69 W172	Y50-D69 WeakPolarHBondContact CD1-O 2.81Å; Y50-D69 VanDerWaalsContact CD1-OD1 3.26Å; Y50-D69 WeakPolarHBondContact CD1-OD1 3.19Å; Y50-D69 VanDerWaalsContact CE1-O 3.3Å; Y50-D69 WeakPolarHBondContact CE1-O 3.26Å; Y50-D69 PolarHBondContact N-OD1 3.02Å; Y50-W172 AromaticContact CD2-CD1 3.43Å; Y50-W172 VanDerWaalsContact CD2-CD1 3.43Å; Y50-W172 AromaticContact CD2-NE1 3.41Å; Y50-W172 AromaticContact CE2-CD1 3.8Å; Y50-W172 AromaticContact CG-NE1 3.83Å
51	T	97.3	Very high	98.4	Very high	98 Å²	98	65.5 Å²	65.5	60%	0.601	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-9.3	175.3	63.8	0	0	0	0	113.1	S49 P53	S49-T51 PolarHBondContact O-N 2.97Å; S49-T51 VanDerWaalsContact O-N 3.15Å; S49-T51 PolarHBondContact OG-N 2.94Å; S49-T51 VanDerWaalsContact OG-N 3.16Å; S49-T51 PolarHBondContact OG-OG1 2.8Å; T51-P53 WeakPolarHBondContact O-CD 3.3Å
52	D	98.4	Very high	98.4	Very high	31 Å²	31	63.7 Å²	63.7	17%	0.166	33%	0.328	C	S	.	.	S	Bend	trans	-70.5	124.2	176.2	-167.5	-45.4	0	0	0	110.1	L48 S49 R54 A55	L48-D52 HydrophobicContact CB-CB 4.34Å; S49-D52 VanDerWaalsContact O-CB 3.23Å; S49-D52 WeakPolarHBondContact O-CB 3.41Å; S49-D52 PolarHBondContact O-N 3.1Å; D52-R54 PolarHBondContact O-N 2.86Å; D52-R54 VanDerWaalsContact O-N 3.08Å; D52-R54 WeakPolarHBondContact OD1-CB 3.49Å; D52-R54 VanDerWaalsContact OD1-CG 3.26Å; D52-R54 WeakPolarHBondContact OD1-CG 3.24Å; D52-R54 IonicContact OD1-CZ 3.97Å; D52-R54 PolarHBondContact OD1-N 2.95Å; D52-R54 IonicContact OD1-NE 2.65Å; D52-R54 PolarHBondContact OD1-NE 3.22Å; D52-R54 IonicContact OD2-CZ 3.22Å; D52-R54 VanDerWaalsContact OD2-CZ 3.25Å; D52-R54 IonicContact OD2-NE 3.89Å; D52-R54 PolarHBondContact OD2-NE 3.22Å; D52-R54 IonicContact OD2-NH2 2.95Å; D52-R54 PolarHBondContact OD2-NH2 2.88Å; D52-A55 HydrophobicContact CB-CB 4.43Å; D52-A55 VanDerWaalsContact O-CB 3.32Å; D52-A55 WeakPolarHBondContact O-CB 3.47Å; D52-A55 PolarHBondContact O-N 3.27Å
53	P	98.3	Very high	98.4	Very high	101 Å²	101	65.1 Å²	65.1	66%	0.656	33%	0.331	S	S	*	.	H	α-helix	trans	-56.5	-27.6	178.3	-25.5	34.5	0	0	0	114	T51 A55 E56 M57	T51-P53 WeakPolarHBondContact O-CD 3.3Å; P53-A55 VanDerWaalsContact C-N 3.31Å; P53-E56 PolarHBondContact O-N 2.65Å; P53-M57 WeakPolarHBondContact O-CB 3.21Å; P53-M57 PolarHBondContact O-N 3.05Å
54	R	98.6	Very high	98.4	Very high	146 Å²	146	59.9 Å²	59.9	55%	0.551	31%	0.309	S	S	*	.	H	α-helix	trans	-66.8	-33.8	176.7	-58.9	174.4	-66.9	172.8	-0.1	111.6	L48 D52 M57 L58	L48-R54 HydrophobicContact CD1-CB 3.85Å; D52-R54 PolarHBondContact O-N 2.86Å; D52-R54 VanDerWaalsContact O-N 3.08Å; D52-R54 WeakPolarHBondContact OD1-CB 3.49Å; D52-R54 VanDerWaalsContact OD1-CG 3.26Å; D52-R54 WeakPolarHBondContact OD1-CG 3.24Å; D52-R54 IonicContact OD1-CZ 3.97Å; D52-R54 PolarHBondContact OD1-N 2.95Å; D52-R54 IonicContact OD1-NE 2.65Å; D52-R54 PolarHBondContact OD1-NE 3.22Å; D52-R54 IonicContact OD2-CZ 3.22Å; D52-R54 VanDerWaalsContact OD2-CZ 3.25Å; D52-R54 IonicContact OD2-NE 3.89Å; D52-R54 PolarHBondContact OD2-NE 3.22Å; D52-R54 IonicContact OD2-NH2 2.95Å; D52-R54 PolarHBondContact OD2-NH2 2.88Å; R54-M57 PolarHBondContact O-N 2.78Å; R54-L58 WeakPolarHBondContact O-CG 3.36Å; R54-L58 PolarHBondContact O-N 3.14Å
55	A	98.5	Very high	98.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-47.3	176.2	0	0	0	0	0	110.7	L48 D52 P53 M57 L58 I59 V65 L67	L48-A55 HydrophobicContact CB-CB 4.04Å; L48-A55 HydrophobicContact CD1-CB 4.05Å; D52-A55 HydrophobicContact CB-CB 4.43Å; D52-A55 VanDerWaalsContact O-CB 3.32Å; D52-A55 WeakPolarHBondContact O-CB 3.47Å; D52-A55 PolarHBondContact O-N 3.27Å; P53-A55 VanDerWaalsContact C-N 3.31Å; A55-M57 VanDerWaalsContact C-N 3.3Å; A55-M57 PolarHBondContact O-N 3.06Å; A55-L58 PolarHBondContact O-N 2.87Å; A55-I59 VanDerWaalsContact O-CG1 3.29Å; A55-I59 WeakPolarHBondContact O-CG1 3.49Å; A55-I59 PolarHBondContact O-N 3.47Å; A55-I59 VanDerWaalsContact O-N 3.08Å; A55-V65 HydrophobicContact CB-CG2 4.35Å; A55-L67 HydrophobicContact CB-CD2 3.69Å
56	E	97.9	Very high	98.4	Very high	52 Å²	52	54.3 Å²	54.3	24%	0.243	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-41	174.8	-74	-67.3	131.5	0	0	111.9	P53 I59 N60 Q176 R180	P53-E56 PolarHBondContact O-N 2.65Å; E56-I59 PolarHBondContact O-N 3.32Å; E56-N60 WeakPolarHBondContact O-CB 3.35Å; E56-N60 PolarHBondContact O-N 3.21Å; E56-N60 PolarHBondContact O-ND2 3.36Å; E56-N60 VanDerWaalsContact O-ND2 3.09Å; E56-Q176 PolarHBondContact OE1-NE2 2.94Å; E56-R180 VanDerWaalsContact CD-NH2 3.31Å; E56-R180 IonicContact OE1-NH2 3.19Å; E56-R180 IonicContact OE2-CZ 3.83Å; E56-R180 IonicContact OE2-NH1 3.54Å; E56-R180 PolarHBondContact OE2-NH1 3.29Å; E56-R180 IonicContact OE2-NH2 3.81Å; E56-R180 PolarHBondContact OE2-NH2 3.08Å
57	M	98.5	Very high	98.4	Very high	103 Å²	103	51.5 Å²	51.5	51%	0.507	26%	0.255	S	S	.	.	H	α-helix	trans	-59.1	-47.7	176	-174.7	-176.7	72.1	0	0	112	P53 R54 A55 N60 N61	P53-M57 WeakPolarHBondContact O-CB 3.21Å; P53-M57 PolarHBondContact O-N 3.05Å; R54-M57 PolarHBondContact O-N 2.78Å; A55-M57 VanDerWaalsContact C-N 3.3Å; A55-M57 PolarHBondContact O-N 3.06Å; M57-N60 PolarHBondContact O-N 3.06Å; M57-N61 WeakPolarHBondContact O-CB 3.41Å; M57-N61 VanDerWaalsContact O-CG 3.31Å; M57-N61 PolarHBondContact O-N 2.82Å
58	L	98.8	Very high	98.4	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.094	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-46.8	177.8	-71	167.8	0	0	0	111.4	P46 L48 R54 A55 N60 N61 E62 E63 V65	P46-L58 HydrophobicContact CB-CD1 4.15Å; P46-L58 HydrophobicContact CG-CD1 4.04Å; L48-L58 HydrophobicContact CD1-CD1 4.04Å; R54-L58 WeakPolarHBondContact O-CG 3.36Å; R54-L58 PolarHBondContact O-N 3.14Å; A55-L58 PolarHBondContact O-N 2.87Å; L58-N60 VanDerWaalsContact C-N 3.32Å; L58-N60 PolarHBondContact O-N 3.2Å; L58-N61 CarbonylContact O-C 3.49Å; L58-N61 PolarHBondContact O-N 3.31Å; L58-N61 VanDerWaalsContact O-N 3.15Å; L58-E62 PolarHBondContact O-N 3.44Å; L58-E62 VanDerWaalsContact O-N 3.15Å; L58-E63 HydrophobicContact CB-CB 4.33Å; L58-E63 HydrophobicContact CD2-CB 3.87Å; L58-E63 VanDerWaalsContact CD2-OE2 3.31Å; L58-E63 WeakPolarHBondContact CD2-OE2 3.42Å; L58-E63 PolarHBondContact O-N 2.83Å; L58-V65 HydrophobicContact CB-CB 4.21Å; L58-V65 HydrophobicContact CB-CG1 4.43Å; L58-V65 HydrophobicContact CD1-CB 3.86Å; L58-V65 HydrophobicContact CD1-CG2 3.87Å
59	I	98.6	Very high	98.4	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-65	-38.6	179.8	-54	164.4	0	0	0	110.8	A55 E56 N61 E62 V65 L67 W182 F209 Y275	A55-I59 VanDerWaalsContact O-CG1 3.29Å; A55-I59 WeakPolarHBondContact O-CG1 3.49Å; A55-I59 PolarHBondContact O-N 3.47Å; A55-I59 VanDerWaalsContact O-N 3.08Å; E56-I59 PolarHBondContact O-N 3.32Å; I59-N61 VanDerWaalsContact C-N 3.28Å; I59-N61 PolarHBondContact O-N 3.36Å; I59-E62 PolarHBondContact O-N 3.15Å; I59-E62 VanDerWaalsContact O-N 3.14Å; I59-V65 HydrophobicContact CD1-CG1 4.14Å; I59-V65 HydrophobicContact CG1-CG1 3.62Å; I59-L67 HydrophobicContact CD1-CD1 4.22Å; I59-W182 HydrophobicContact CG2-CH2 4.24Å; I59-W182 HydrophobicContact CG2-CZ2 4.32Å; I59-F209 HydrophobicContact CD1-CE1 4.35Å; I59-F209 HydrophobicContact CD1-CZ 4.46Å; I59-F209 HydrophobicContact CG2-CZ 4.44Å; I59-Y275 HydrophobicContact CB-CD1 4.04Å; I59-Y275 HydrophobicContact CB-CE1 4.05Å; I59-Y275 HydrophobicContact CG1-CD1 3.79Å; I59-Y275 HydrophobicContact CG1-CE1 4.33Å; I59-Y275 HydrophobicContact CG1-CG 4.23Å; I59-Y275 HydrophobicContact CG2-CD1 3.82Å; I59-Y275 HydrophobicContact CG2-CD2 4.43Å; I59-Y275 HydrophobicContact CG2-CE1 3.62Å; I59-Y275 HydrophobicContact CG2-CE2 4.29Å; I59-Y275 HydrophobicContact CG2-CG 4.23Å
60	N	98.2	Very high	98.4	Very high	81 Å²	81	49.3 Å²	49.3	43%	0.433	25%	0.252	S	S	.	.	H	α-helix	trans	-66.8	-29.9	176.4	-72	-27.8	0	0	0	113	E56 M57 L58 E62 R180	E56-N60 WeakPolarHBondContact O-CB 3.35Å; E56-N60 PolarHBondContact O-N 3.21Å; E56-N60 PolarHBondContact O-ND2 3.36Å; E56-N60 VanDerWaalsContact O-ND2 3.09Å; M57-N60 PolarHBondContact O-N 3.06Å; L58-N60 VanDerWaalsContact C-N 3.32Å; L58-N60 PolarHBondContact O-N 3.2Å; N60-E62 VanDerWaalsContact C-N 3.26Å; N60-R180 PolarHBondContact OD1-NH2 3.08Å
61	N	98.2	Very high	98.5	Very high	85 Å²	85	50.1 Å²	50.1	46%	0.455	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.7	174.6	-70.2	-8.4	0	0	0	113.2	M57 L58 I59 E63	M57-N61 WeakPolarHBondContact O-CB 3.41Å; M57-N61 VanDerWaalsContact O-CG 3.31Å; M57-N61 PolarHBondContact O-N 2.82Å; L58-N61 CarbonylContact O-C 3.49Å; L58-N61 PolarHBondContact O-N 3.31Å; L58-N61 VanDerWaalsContact O-N 3.15Å; I59-N61 VanDerWaalsContact C-N 3.28Å; I59-N61 PolarHBondContact O-N 3.36Å; N61-E63 VanDerWaalsContact C-N 3.31Å; N61-E63 HydrophobicContact CB-CG 4.13Å; N61-E63 WeakPolarHBondContact CB-OE1 3.29Å
62	E	98.7	Very high	98.6	Very high	43 Å²	43	45.5 Å²	45.5	20%	0.201	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	42.6	-174.8	-54.7	179.6	111.2	0	0	112	L58 I59 N60 Q207 P277 W280 R314 H316	L58-E62 PolarHBondContact O-N 3.44Å; L58-E62 VanDerWaalsContact O-N 3.15Å; I59-E62 PolarHBondContact O-N 3.15Å; I59-E62 VanDerWaalsContact O-N 3.14Å; N60-E62 VanDerWaalsContact C-N 3.26Å; E62-Q207 PolarHBondContact OE1-NE2 3.38Å; E62-P277 VanDerWaalsContact C-CG 3.47Å; E62-P277 HydrophobicContact CB-CB 4.06Å; E62-P277 VanDerWaalsContact O-CB 3.26Å; E62-P277 WeakPolarHBondContact O-CB 3.25Å; E62-P277 WeakPolarHBondContact O-CG 3.42Å; E62-W280 PolarHBondContact O-NE1 2.6Å; E62-R314 IonicContact OE2-NH1 3.67Å; E62-H316 IonicContact OE2-NE2 3.15Å
63	E	98.8	Very high	98.6	Very high	81 Å²	81	44.2 Å²	44.2	38%	0.379	23%	0.226	S	C	.	.			trans	-111.6	145.5	175.5	-68	176.5	-138	0	0	110.9	L58 N61 Y275	L58-E63 HydrophobicContact CB-CB 4.33Å; L58-E63 HydrophobicContact CD2-CB 3.87Å; L58-E63 VanDerWaalsContact CD2-OE2 3.31Å; L58-E63 WeakPolarHBondContact CD2-OE2 3.42Å; L58-E63 PolarHBondContact O-N 2.83Å; N61-E63 VanDerWaalsContact C-N 3.31Å; N61-E63 HydrophobicContact CB-CG 4.13Å; N61-E63 WeakPolarHBondContact CB-OE1 3.29Å; E63-Y275 VanDerWaalsContact O-CD1 3.27Å; E63-Y275 WeakPolarHBondContact O-CD1 3.49Å
64	P	98.9	Very high	98.6	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.039	22%	0.223	C	C	.	.			trans	-69.8	143.8	-176.5	29.4	-36	0	0	0	112.3	I45 L221 L274 Y275 W280	I45-P64 HydrophobicContact CD1-CB 4.23Å; I45-P64 HydrophobicContact CD1-CG 4.48Å; I45-P64 HydrophobicContact CG1-CB 4.43Å; I45-P64 HydrophobicContact CG1-CG 4.32Å; I45-P64 HydrophobicContact CG2-CB 4.19Å; P64-L221 HydrophobicContact CB-CD2 3.54Å; P64-L221 HydrophobicContact CG-CD2 4.11Å; P64-L274 HydrophobicContact CB-CD1 4.47Å; P64-Y275 WeakPolarHBondContact CA-O 3.32Å; P64-W280 HydrophobicContact CG-CE3 4.1Å; P64-W280 HydrophobicContact CG-CH2 3.82Å; P64-W280 HydrophobicContact CG-CZ2 4.33Å; P64-W280 HydrophobicContact CG-CZ3 3.69Å
65	V	98.9	Very high	98.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	141.4	174.3	61.8	0	0	0	0	109.4	L48 A55 L58 I59 L67 Y275	L48-V65 HydrophobicContact CB-CG2 4.26Å; L48-V65 HydrophobicContact CD1-CG2 3.98Å; L48-V65 HydrophobicContact CG-CG2 4.28Å; A55-V65 HydrophobicContact CB-CG2 4.35Å; L58-V65 HydrophobicContact CB-CB 4.21Å; L58-V65 HydrophobicContact CB-CG1 4.43Å; L58-V65 HydrophobicContact CD1-CB 3.86Å; L58-V65 HydrophobicContact CD1-CG2 3.87Å; I59-V65 HydrophobicContact CD1-CG1 4.14Å; I59-V65 HydrophobicContact CG1-CG1 3.62Å; V65-L67 HydrophobicContact CG1-CD2 3.97Å; V65-L67 HydrophobicContact CG1-CG 4.34Å; V65-L67 HydrophobicContact CG2-CD2 4.03Å; V65-Y275 PolarHBondContact O-N 2.98Å
66	V	98.9	Very high	98.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.6	168.3	178.7	0	0	0	0	108.8	I45 P46 R47 L48 A266 V268 D272 V273 L274	I45-V66 HydrophobicContact CG2-CG2 4.12Å; P46-V66 PolarHBondContact O-N 3.48Å; R47-V66 CarbonylContact C-O 3.59Å; R47-V66 WeakPolarHBondContact CA-O 3.01Å; R47-V66 HydrophobicContact CB-CB 4.48Å; R47-V66 HydrophobicContact CG-CB 3.95Å; R47-V66 HydrophobicContact CG-CG1 4.23Å; R47-V66 HydrophobicContact CG-CG2 4.46Å; L48-V66 PolarHBondContact N-O 2.64Å; V66-A266 HydrophobicContact CG2-CB 3.71Å; V66-V268 HydrophobicContact CG1-CG1 4.24Å; V66-V268 HydrophobicContact CG2-CG1 4.1Å; V66-D272 HydrophobicContact CG1-CB 4.04Å; V66-V273 WeakPolarHBondContact CA-O 3.43Å; V66-L274 HydrophobicContact CG2-CB 4.41Å; V66-L274 HydrophobicContact CG2-CD1 3.79Å
67	L	98.9	Very high	98.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.3	177.5	-53.9	177.2	0	0	0	109.5	L48 A55 I59 V65 T70 W172 F209 V273	L48-L67 VanDerWaalsContact O-CA 3.32Å; L48-L67 WeakPolarHBondContact O-CA 3.45Å; A55-L67 HydrophobicContact CB-CD2 3.69Å; I59-L67 HydrophobicContact CD1-CD1 4.22Å; V65-L67 HydrophobicContact CG1-CD2 3.97Å; V65-L67 HydrophobicContact CG1-CG 4.34Å; V65-L67 HydrophobicContact CG2-CD2 4.03Å; L67-T70 HydrophobicContact CB-CG2 3.38Å; L67-T70 HydrophobicContact CD1-CG2 3.75Å; L67-T70 HydrophobicContact CG-CG2 4.23Å; L67-W172 HydrophobicContact CD1-CH2 3.66Å; L67-W172 HydrophobicContact CD1-CZ2 3.34Å; L67-F209 HydrophobicContact CD1-CE1 4.39Å; L67-V273 HydrophobicContact CB-CB 4.38Å; L67-V273 PolarHBondContact N-O 3.01Å; L67-V273 PolarHBondContact O-N 3.4Å
68	T	98.6	Very high	98.7	Very high	60 Å²	60	41.4 Å²	41.4	37%	0.368	21%	0.206	S	C	.	.	S	Bend	trans	-92.7	-13.4	-167.1	57.1	0	0	0	0	114.5	R47 L48	R47-T68 HydrophobicContact CB-CG2 4.17Å; L48-T68 PolarHBondContact O-N 2.87Å; L48-T68 PolarHBondContact O-OG1 3.3Å
69	D	98.5	Very high	98.7	Very high	56 Å²	56	40.8 Å²	40.8	30%	0.299	20%	0.202	S	C	.	.	S	Bend	trans	-141	23.6	-166.1	62.4	-11.4	0	0	0	113.8	S49 Y50 N71	S49-D69 WeakPolarHBondContact CA-OD1 3.37Å; S49-D69 VanDerWaalsContact CB-OD2 3.23Å; S49-D69 WeakPolarHBondContact CB-OD2 3.23Å; S49-D69 VanDerWaalsContact OG-CG 3.29Å; S49-D69 PolarHBondContact OG-OD1 2.65Å; S49-D69 PolarHBondContact OG-OD2 3.04Å; Y50-D69 WeakPolarHBondContact CD1-O 2.81Å; Y50-D69 VanDerWaalsContact CD1-OD1 3.26Å; Y50-D69 WeakPolarHBondContact CD1-OD1 3.19Å; Y50-D69 VanDerWaalsContact CE1-O 3.3Å; Y50-D69 WeakPolarHBondContact CE1-O 3.26Å; Y50-D69 PolarHBondContact N-OD1 3.02Å; D69-N71 PolarHBondContact O-N 3.37Å; D69-N71 PolarHBondContact O-ND2 3.1Å
70	T	98.6	Very high	98.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.216	C	C	.	.			trans	-64.3	-27.5	-179.3	65.6	0	0	0	0	113.5	L67 L72 N169 W172 V273	L67-T70 HydrophobicContact CB-CG2 3.38Å; L67-T70 HydrophobicContact CD1-CG2 3.75Å; L67-T70 HydrophobicContact CG-CG2 4.23Å; T70-L72 PolarHBondContact O-N 3.07Å; T70-L72 WeakPolarHBondContact OG1-CB 3.18Å; T70-L72 PolarHBondContact OG1-N 2.85Å; T70-N169 PolarHBondContact O-ND2 3.07Å; T70-W172 HydrophobicContact CG2-CH2 3.98Å; T70-W172 HydrophobicContact CG2-CZ2 3.96Å; T70-W172 HydrophobicContact CG2-CZ3 4.3Å; T70-V273 HydrophobicContact CG2-CB 4.17Å; T70-V273 HydrophobicContact CG2-CG2 4.12Å; T70-V273 WeakPolarHBondContact OG1-CG2 3.32Å
71	N	98.5	Very high	98.7	Very high	89 Å²	89	40.3 Å²	40.3	48%	0.476	20%	0.2	S	C	.	.			trans	53	25.2	-165.2	-63.1	-72.5	0	0	0	113.4	D69 V73 Y74	D69-N71 PolarHBondContact O-N 3.37Å; D69-N71 PolarHBondContact O-ND2 3.1Å; N71-V73 VanDerWaalsContact C-N 3.3Å; N71-V73 PolarHBondContact O-N 2.85Å; N71-Y74 PolarHBondContact O-N 3.43Å
72	L	98.8	Very high	98.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-48	-174	177.1	59.2	0	0	0	112.1	T70 F168 N169 W172 I173 F209 A211 V273 F298	T70-L72 PolarHBondContact O-N 3.07Å; T70-L72 WeakPolarHBondContact OG1-CB 3.18Å; T70-L72 PolarHBondContact OG1-N 2.85Å; L72-F168 CarbonylContact O-C 3.5Å; L72-F168 WeakPolarHBondContact O-CA 3.23Å; L72-F168 WeakPolarHBondContact O-CB 3.26Å; L72-N169 PolarHBondContact O-N 3.18Å; L72-W172 HydrophobicContact CB-CZ3 4.48Å; L72-W172 HydrophobicContact CD1-CE3 4.12Å; L72-W172 HydrophobicContact CD1-CZ3 4.17Å; L72-W172 HydrophobicContact CD2-CZ3 4.09Å; L72-W172 HydrophobicContact CG-CZ3 4.48Å; L72-I173 HydrophobicContact CD1-CB 3.93Å; L72-I173 HydrophobicContact CD1-CD1 3.83Å; L72-I173 HydrophobicContact CD1-CG1 4.41Å; L72-I173 HydrophobicContact CD1-CG2 4.16Å; L72-I173 HydrophobicContact CD2-CD1 4.04Å; L72-F209 HydrophobicContact CD2-CB 4.4Å; L72-A211 HydrophobicContact CD2-CB 4.01Å; L72-V273 HydrophobicContact CB-CG2 3.8Å; L72-V273 HydrophobicContact CD2-CG1 4.04Å; L72-V273 HydrophobicContact CD2-CG2 3.88Å; L72-V273 HydrophobicContact CG-CG2 4.48Å; L72-F298 HydrophobicContact CD1-CE1 4.32Å; L72-F298 HydrophobicContact CD1-CZ 4.16Å; L72-F298 HydrophobicContact CD2-CD2 3.88Å; L72-F298 HydrophobicContact CD2-CE2 3.68Å; L72-F298 HydrophobicContact CD2-CZ 4.14Å; L72-F298 HydrophobicContact CG-CE2 4Å; L72-F298 HydrophobicContact CG-CZ 4.01Å
73	V	98.7	Very high	98.7	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.018	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	28.6	-178.7	-64	0	0	0	0	112.3	N71 P75 A76 L77 F168 A211 I213 F298	N71-V73 VanDerWaalsContact C-N 3.3Å; N71-V73 PolarHBondContact O-N 2.85Å; V73-P75 VanDerWaalsContact C-CD 3.48Å; V73-P75 VanDerWaalsContact C-N 3.35Å; V73-A76 HydrophobicContact CB-CB 4.31Å; V73-A76 WeakPolarHBondContact O-CA 3.3Å; V73-A76 WeakPolarHBondContact O-CB 3.33Å; V73-A76 PolarHBondContact O-N 2.87Å; V73-L77 HydrophobicContact CG2-CD2 4.38Å; V73-L77 PolarHBondContact O-N 2.57Å; V73-F168 HydrophobicContact CB-CD1 4.41Å; V73-F168 HydrophobicContact CB-CE1 4.13Å; V73-F168 HydrophobicContact CB-CZ 4.35Å; V73-F168 HydrophobicContact CG1-CD1 4.43Å; V73-F168 HydrophobicContact CG1-CD2 4.34Å; V73-F168 HydrophobicContact CG1-CE1 4.21Å; V73-F168 HydrophobicContact CG1-CE2 4.11Å; V73-F168 HydrophobicContact CG1-CG 4.49Å; V73-F168 HydrophobicContact CG1-CZ 4.04Å; V73-A211 HydrophobicContact CB-CB 4.38Å; V73-A211 HydrophobicContact CG1-CB 3.62Å; V73-A211 HydrophobicContact CG2-CB 3.81Å; V73-I213 HydrophobicContact CB-CG1 4.41Å; V73-I213 HydrophobicContact CG2-CG1 3.88Å; V73-F298 HydrophobicContact CG1-CE2 3.78Å; V73-F298 HydrophobicContact CG1-CZ 3.84Å
74	Y	98.7	Very high	98.7	Very high	152 Å²	152	35.8 Å²	35.8	60%	0.596	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-48.3	-46.6	-175.9	172.9	-95.6	0	0	0	114.1	N71 A76 L77	N71-Y74 PolarHBondContact O-N 3.43Å; Y74-A76 PolarHBondContact O-N 2.82Å; Y74-L77 HydrophobicContact CD2-CD1 4.15Å; Y74-L77 WeakPolarHBondContact O-CB 3.23Å; Y74-L77 WeakPolarHBondContact O-CG 3.5Å; Y74-L77 PolarHBondContact O-N 3.25Å; Y74-L77 VanDerWaalsContact O-N 3.14Å
75	P	98.7	Very high	98.6	Very high	23 Å²	23	38.7 Å²	38.7	15%	0.149	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-61.3	-26.4	176.9	-22.8	32.9	0	0	0	114.5	V73 K78 D164 G167 F168	V73-P75 VanDerWaalsContact C-CD 3.48Å; V73-P75 VanDerWaalsContact C-N 3.35Å; P75-K78 WeakPolarHBondContact O-CG 3.38Å; P75-K78 PolarHBondContact O-NZ 3.24Å; P75-D164 HydrophobicContact CB-CB 4.03Å; P75-G167 VanDerWaalsContact CG-C 3.46Å; P75-G167 VanDerWaalsContact CG-O 3.28Å; P75-G167 WeakPolarHBondContact CG-O 3.16Å; P75-F168 HydrophobicContact CG-CD1 4.37Å
76	A	98.7	Very high	98.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-85.7	-7.8	-180	0	0	0	0	0	113.3	V73 Y74 K78 W79 F168 I213	V73-A76 HydrophobicContact CB-CB 4.31Å; V73-A76 WeakPolarHBondContact O-CA 3.3Å; V73-A76 WeakPolarHBondContact O-CB 3.33Å; V73-A76 PolarHBondContact O-N 2.87Å; Y74-A76 PolarHBondContact O-N 2.82Å; A76-K78 PolarHBondContact O-N 3.28Å; A76-W79 HydrophobicContact CB-CD2 3.6Å; A76-W79 HydrophobicContact CB-CE3 3.95Å; A76-W79 HydrophobicContact CB-CG 4.04Å; A76-W79 HydrophobicContact CB-CH2 4.25Å; A76-W79 HydrophobicContact CB-CZ2 3.93Å; A76-W79 HydrophobicContact CB-CZ3 4.26Å; A76-W79 WeakPolarHBondContact O-CB 3.35Å; A76-W79 PolarHBondContact O-N 2.75Å; A76-F168 HydrophobicContact CB-CE1 3.78Å; A76-F168 HydrophobicContact CB-CZ 4.08Å; A76-I213 HydrophobicContact CB-CD1 3.9Å; A76-I213 HydrophobicContact CB-CG1 4.28Å; A76-I213 WeakPolarHBondContact O-CG2 3.48Å
77	L	98.6	Very high	98.5	Very high	65 Å²	65	45.8 Å²	45.8	34%	0.34	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-63.1	-16.6	178.1	-61.8	-178	0	0	0	113.6	V73 Y74 W79	V73-L77 HydrophobicContact CG2-CD2 4.38Å; V73-L77 PolarHBondContact O-N 2.57Å; Y74-L77 HydrophobicContact CD2-CD1 4.15Å; Y74-L77 WeakPolarHBondContact O-CB 3.23Å; Y74-L77 WeakPolarHBondContact O-CG 3.5Å; Y74-L77 PolarHBondContact O-N 3.25Å; Y74-L77 VanDerWaalsContact O-N 3.14Å; L77-W79 VanDerWaalsContact C-N 3.31Å
78	K	98.5	Very high	98.4	Very high	103 Å²	103	45.8 Å²	45.8	45%	0.448	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-81.2	-6.2	170.5	71	-177.8	178.7	-89.4	0	114	P75 A76 D80 Y83 D164	P75-K78 WeakPolarHBondContact O-CG 3.38Å; P75-K78 PolarHBondContact O-NZ 3.24Å; A76-K78 PolarHBondContact O-N 3.28Å; K78-D80 PolarHBondContact O-N 2.92Å; K78-Y83 HydrophobicContact CD-CE2 4.35Å; K78-Y83 WeakPolarHBondContact CE-OH 3.2Å; K78-D164 WeakPolarHBondContact CE-OD2 3.45Å; K78-D164 IonicContact NZ-OD1 3.14Å; K78-D164 PolarHBondContact NZ-OD1 3.4Å; K78-D164 IonicContact NZ-OD2 3.7Å; K78-D164 PolarHBondContact NZ-OD2 2.81Å
79	W	98.7	Very high	98.2	Very high	5 Å²	5	44.1 Å²	44.1	2%	0.019	23%	0.225	C	C	.	.			trans	-70.6	119.3	-176.9	-67.5	2.8	0	0	0	110.2	A76 L77 Y83 L84 I161 D164 L190 I213 V296	A76-W79 HydrophobicContact CB-CD2 3.6Å; A76-W79 HydrophobicContact CB-CE3 3.95Å; A76-W79 HydrophobicContact CB-CG 4.04Å; A76-W79 HydrophobicContact CB-CH2 4.25Å; A76-W79 HydrophobicContact CB-CZ2 3.93Å; A76-W79 HydrophobicContact CB-CZ3 4.26Å; A76-W79 WeakPolarHBondContact O-CB 3.35Å; A76-W79 PolarHBondContact O-N 2.75Å; L77-W79 VanDerWaalsContact C-N 3.31Å; W79-Y83 AromaticContact CD1-CD1 3.44Å; W79-Y83 VanDerWaalsContact CD1-CD1 3.44Å; W79-Y83 AromaticContact CD1-CE1 3.36Å; W79-Y83 HydrophobicContact CG-CD1 4.11Å; W79-Y83 HydrophobicContact CG-CE1 4.34Å; W79-Y83 AromaticContact NE1-CD1 3.97Å; W79-Y83 AromaticContact NE1-CE1 3.43Å; W79-L84 HydrophobicContact CB-CD2 4.23Å; W79-L84 HydrophobicContact CB-CG 4.35Å; W79-L84 HydrophobicContact CD2-CD2 3.81Å; W79-L84 HydrophobicContact CE3-CD2 3.86Å; W79-L84 HydrophobicContact CG-CD2 4Å; W79-L84 HydrophobicContact CZ3-CD2 4.49Å; W79-I161 HydrophobicContact CH2-CD1 4.44Å; W79-I161 HydrophobicContact CH2-CG2 3.94Å; W79-I161 HydrophobicContact CZ2-CD1 3.77Å; W79-I161 HydrophobicContact CZ2-CG2 3.91Å; W79-D164 HydrophobicContact CZ2-CB 3.95Å; W79-D164 PolarHBondContact NE1-OD2 3.28Å; W79-L190 HydrophobicContact CZ3-CD1 4.31Å; W79-I213 HydrophobicContact CB-CG2 4.05Å; W79-I213 HydrophobicContact CE3-CD1 4.1Å; W79-I213 HydrophobicContact CZ3-CD1 4.36Å; W79-V296 HydrophobicContact CZ3-CG2 4.14Å
80	D	98.6	Very high	97.9	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	25%	0.247	S	C	.	.			trans	-130.1	179.4	166.1	63.9	10.7	0	0	0	109.7	K78 P82 Y83 L84 K214	K78-D80 PolarHBondContact O-N 2.92Å; D80-P82 WeakPolarHBondContact OD1-CD 3.36Å; D80-Y83 PolarHBondContact O-N 2.98Å; D80-Y83 WeakPolarHBondContact OD1-CB 3.32Å; D80-Y83 PolarHBondContact OD1-N 2.84Å; D80-L84 WeakPolarHBondContact O-CB 3.36Å; D80-L84 WeakPolarHBondContact O-CG 3.45Å; D80-L84 PolarHBondContact O-N 2.95Å; D80-K214 HydrophobicContact CB-CD 4.34Å
81	I	98.4	Very high	97.7	Very high	16 Å²	16	49 Å²	49	8%	0.082	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-48	-178.4	-63.2	-59.3	0	0	0	112	Y83 L84 L85 F128 V132 M135 V192 V292	I81-Y83 PolarHBondContact O-N 3.02Å; I81-L84 PolarHBondContact O-N 3.07Å; I81-L85 HydrophobicContact CG2-CD1 3.85Å; I81-L85 HydrophobicContact CG2-CG 4.34Å; I81-L85 WeakPolarHBondContact O-CB 3.32Å; I81-L85 WeakPolarHBondContact O-CG 3.46Å; I81-L85 PolarHBondContact O-N 2.85Å; I81-F128 HydrophobicContact CD1-CZ 4.3Å; I81-V132 HydrophobicContact CD1-CG2 4.49Å; I81-V132 HydrophobicContact CG2-CB 4.31Å; I81-V132 HydrophobicContact CG2-CG1 3.65Å; I81-V132 HydrophobicContact CG2-CG2 3.6Å; I81-M135 HydrophobicContact CD1-CE 4.36Å; I81-M135 HydrophobicContact CG1-CE 4.28Å; I81-V192 HydrophobicContact CD1-CG1 4Å; I81-V292 HydrophobicContact CD1-CG1 4.17Å; I81-V292 HydrophobicContact CG1-CG1 4.42Å
82	P	98.5	Very high	97.6	Very high	80 Å²	80	48.8 Å²	48.8	52%	0.519	25%	0.252	S	S	.	.	H	α-helix	trans	-55.6	-46.9	173.7	-27.5	34.6	0	0	0	114.4	D80 L84 L85 E86	D80-P82 WeakPolarHBondContact OD1-CD 3.36Å; P82-L84 PolarHBondContact O-N 3.21Å; P82-L85 PolarHBondContact O-N 3.19Å; P82-E86 PolarHBondContact O-N 2.78Å
83	Y	98.7	Very high	97.5	Very high	34 Å²	34	49 Å²	49	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-44.2	-179.8	-176.8	-91.9	0	0	0	111.6	K78 W79 D80 I81 E86 N87 K160 I161 D164	K78-Y83 HydrophobicContact CD-CE2 4.35Å; K78-Y83 WeakPolarHBondContact CE-OH 3.2Å; W79-Y83 AromaticContact CD1-CD1 3.44Å; W79-Y83 VanDerWaalsContact CD1-CD1 3.44Å; W79-Y83 AromaticContact CD1-CE1 3.36Å; W79-Y83 HydrophobicContact CG-CD1 4.11Å; W79-Y83 HydrophobicContact CG-CE1 4.34Å; W79-Y83 AromaticContact NE1-CD1 3.97Å; W79-Y83 AromaticContact NE1-CE1 3.43Å; D80-Y83 PolarHBondContact O-N 2.98Å; D80-Y83 WeakPolarHBondContact OD1-CB 3.32Å; D80-Y83 PolarHBondContact OD1-N 2.84Å; I81-Y83 PolarHBondContact O-N 3.02Å; Y83-E86 PolarHBondContact O-N 2.72Å; Y83-N87 HydrophobicContact CE1-CB 4.28Å; Y83-N87 VanDerWaalsContact O-CB 3.31Å; Y83-N87 WeakPolarHBondContact O-CB 3.28Å; Y83-N87 PolarHBondContact O-N 2.81Å; Y83-N87 VanDerWaalsContact O-N 3.09Å; Y83-N87 PolarHBondContact O-ND2 2.96Å; Y83-K160 WeakPolarHBondContact OH-CB 3.48Å; Y83-I161 HydrophobicContact CD1-CD1 4.46Å; Y83-I161 HydrophobicContact CE1-CD1 3.82Å; Y83-D164 PolarHBondContact OH-OD2 3.37Å
84	L	98.4	Very high	97.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-41.5	178.4	-67.6	179	0	0	0	111.5	W79 D80 I81 P82 E86 N87 I88 F128 I161 I294	W79-L84 HydrophobicContact CB-CD2 4.23Å; W79-L84 HydrophobicContact CB-CG 4.35Å; W79-L84 HydrophobicContact CD2-CD2 3.81Å; W79-L84 HydrophobicContact CE3-CD2 3.86Å; W79-L84 HydrophobicContact CG-CD2 4Å; W79-L84 HydrophobicContact CZ3-CD2 4.49Å; D80-L84 WeakPolarHBondContact O-CB 3.36Å; D80-L84 WeakPolarHBondContact O-CG 3.45Å; D80-L84 PolarHBondContact O-N 2.95Å; I81-L84 PolarHBondContact O-N 3.07Å; P82-L84 PolarHBondContact O-N 3.21Å; L84-E86 VanDerWaalsContact C-N 3.28Å; L84-E86 PolarHBondContact O-N 2.9Å; L84-N87 PolarHBondContact O-N 3.39Å; L84-I88 HydrophobicContact CB-CB 4.49Å; L84-I88 HydrophobicContact CD2-CD1 4.24Å; L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 WeakPolarHBondContact O-CG2 3.45Å; L84-I88 PolarHBondContact O-N 2.84Å; L84-F128 HydrophobicContact CB-CD1 4.39Å; L84-F128 HydrophobicContact CB-CE1 3.53Å; L84-F128 HydrophobicContact CB-CE2 4.37Å; L84-F128 HydrophobicContact CB-CZ 3.52Å; L84-F128 HydrophobicContact CD1-CE2 4.35Å; L84-F128 HydrophobicContact CD1-CZ 3.8Å; L84-F128 HydrophobicContact CG-CZ 4.33Å; L84-I161 HydrophobicContact CD2-CD1 3.99Å; L84-I294 HydrophobicContact CD1-CD1 4.02Å
85	L	97.6	Very high	97.5	Very high	67 Å²	67	42.2 Å²	42.2	35%	0.351	23%	0.228	S	C	.	.	H	α-helix	trans	-55.1	-42.5	175.1	-82.6	165.9	0	0	0	112.9	I81 P82 F128 V132	I81-L85 HydrophobicContact CG2-CD1 3.85Å; I81-L85 HydrophobicContact CG2-CG 4.34Å; I81-L85 WeakPolarHBondContact O-CB 3.32Å; I81-L85 WeakPolarHBondContact O-CG 3.46Å; I81-L85 PolarHBondContact O-N 2.85Å; P82-L85 PolarHBondContact O-N 3.19Å; L85-F128 HydrophobicContact CD2-CD1 3.87Å; L85-F128 HydrophobicContact CD2-CE1 4.36Å; L85-F128 HydrophobicContact CG-CD1 4.03Å; L85-F128 HydrophobicContact CG-CE1 4.07Å; L85-V132 HydrophobicContact CD1-CG1 4.22Å; L85-V132 HydrophobicContact CD1-CG2 4.37Å; L85-V132 HydrophobicContact CD2-CB 4.32Å; L85-V132 HydrophobicContact CD2-CG2 4.03Å; L85-V132 HydrophobicContact CG-CG2 4.17Å
86	E	98.2	Very high	97.4	Very high	134 Å²	134	42.1 Å²	42.1	63%	0.626	23%	0.225	S	C	*	.	H	α-helix	trans	-74.6	-34.2	-179.3	-173.5	-154.7	165.3	0	0	112	P82 Y83 L84 K160	P82-E86 PolarHBondContact O-N 2.78Å; Y83-E86 PolarHBondContact O-N 2.72Å; L84-E86 VanDerWaalsContact C-N 3.28Å; L84-E86 PolarHBondContact O-N 2.9Å; E86-K160 IonicContact OE1-NZ 3.98Å; E86-K160 PolarHBondContact OE1-NZ 2.92Å; E86-K160 IonicContact OE2-NZ 2.76Å
87	N	98.1	Very high	97.4	Very high	14 Å²	14	42.9 Å²	42.9	8%	0.075	23%	0.23	C	C	.	.	H	α-helix	trans	-118.9	-16.5	-160.6	-60.6	-72.1	0	0	0	115.4	Y83 L84 G89 G158 K160 I161	Y83-N87 HydrophobicContact CE1-CB 4.28Å; Y83-N87 VanDerWaalsContact O-CB 3.31Å; Y83-N87 WeakPolarHBondContact O-CB 3.28Å; Y83-N87 PolarHBondContact O-N 2.81Å; Y83-N87 VanDerWaalsContact O-N 3.09Å; Y83-N87 PolarHBondContact O-ND2 2.96Å; L84-N87 PolarHBondContact O-N 3.39Å; N87-G89 PolarHBondContact O-N 2.83Å; N87-G158 WeakPolarHBondContact O-CA 3.44Å; N87-G158 PolarHBondContact O-N 3.14Å; N87-K160 HydrophobicContact CB-CB 4.19Å; N87-K160 WeakPolarHBondContact OD1-CD 3.38Å; N87-K160 WeakPolarHBondContact OD1-CE 3.22Å; N87-K160 PolarHBondContact OD1-NZ 3.47Å; N87-I161 HydrophobicContact CB-CD1 4.27Å; N87-I161 HydrophobicContact CB-CG1 4.39Å; N87-I161 WeakPolarHBondContact O-CG1 3.42Å
88	I	96.8	Very high	97.2	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	22%	0.215	C	C	.	.	S	Bend	trans	-72.3	-16.4	-173.6	-150.3	174.2	0	0	0	113.6	L84 F93 F128 V157 G158 I161 L190	L84-I88 HydrophobicContact CB-CB 4.49Å; L84-I88 HydrophobicContact CD2-CD1 4.24Å; L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 WeakPolarHBondContact O-CG2 3.45Å; L84-I88 PolarHBondContact O-N 2.84Å; I88-F93 HydrophobicContact CB-CZ 4.38Å; I88-F93 HydrophobicContact CD1-CE1 3.49Å; I88-F93 VanDerWaalsContact CD1-CE1 3.49Å; I88-F93 HydrophobicContact CD1-CZ 3.62Å; I88-F93 HydrophobicContact CG1-CE1 4.05Å; I88-F93 HydrophobicContact CG1-CZ 3.75Å; I88-F93 HydrophobicContact CG2-CE2 4.22Å; I88-F93 HydrophobicContact CG2-CZ 3.83Å; I88-F128 HydrophobicContact CD1-CD2 3.94Å; I88-F128 HydrophobicContact CD1-CE2 4.03Å; I88-F128 HydrophobicContact CG2-CB 3.73Å; I88-F128 HydrophobicContact CG2-CD1 4.09Å; I88-F128 HydrophobicContact CG2-CD2 4.17Å; I88-F128 HydrophobicContact CG2-CG 3.73Å; I88-V157 VanDerWaalsContact O-CA 3.27Å; I88-V157 WeakPolarHBondContact O-CA 3.48Å; I88-G158 PolarHBondContact O-N 2.91Å; I88-I161 HydrophobicContact CG1-CG1 4.49Å; I88-L190 HydrophobicContact CD1-CD2 3.67Å
89	G	94.1	Very high	97	Very high	25 Å²	25	43.1 Å²	43.1	26%	0.258	23%	0.232	S	C	.	.			trans	92.1	-178.3	179.4	0	0	0	0	0	113.2	N87	N87-G89 PolarHBondContact O-N 2.83Å
90	N	91.8	Very high	96.8	Very high	146 Å²	146	45.8 Å²	45.8	78%	0.781	25%	0.246	S	C	*	.	S	Bend	trans	-103.7	16.4	-171.2	-66.7	-21	0	0	0	113.4	K127	N90-K127 WeakPolarHBondContact O-CE 3.28Å; N90-K127 PolarHBondContact O-NZ 2.9Å
91	G	93.8	Very high	96.7	Very high	13 Å²	13	44 Å²	44	13%	0.134	24%	0.236	C	C	.	.			trans	-62.6	162.2	173.3	0	0	0	0	0	112.2	F93	G91-F93 VanDerWaalsContact O-CD2 3.32Å; G91-F93 WeakPolarHBondContact O-CD2 3.4Å; G91-F93 VanDerWaalsContact O-CE2 3.26Å; G91-F93 WeakPolarHBondContact O-CE2 3.45Å
92	D	96.7	Very high	96.7	Very high	83 Å²	83	45 Å²	45	44%	0.444	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	148.2	167.7	-64.2	-25.8	0	0	0	109.6	E125 K127	D92-E125 HydrophobicContact CB-CB 4.41Å; D92-K127 WeakPolarHBondContact OD1-CD 3.46Å; D92-K127 VanDerWaalsContact OD1-CE 3.25Å; D92-K127 WeakPolarHBondContact OD1-CE 3.23Å; D92-K127 IonicContact OD1-NZ 2.82Å; D92-K127 PolarHBondContact OD1-NZ 2.7Å
93	F	98	Very high	96.7	Very high	5 Å²	5	41.5 Å²	41.5	2%	0.022	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.7	179.3	-65.8	-99.5	0	0	0	109.5	I88 G91 V95 E125 M126 F128 L149 Q151	I88-F93 HydrophobicContact CB-CZ 4.38Å; I88-F93 HydrophobicContact CD1-CE1 3.49Å; I88-F93 VanDerWaalsContact CD1-CE1 3.49Å; I88-F93 HydrophobicContact CD1-CZ 3.62Å; I88-F93 HydrophobicContact CG1-CE1 4.05Å; I88-F93 HydrophobicContact CG1-CZ 3.75Å; I88-F93 HydrophobicContact CG2-CE2 4.22Å; I88-F93 HydrophobicContact CG2-CZ 3.83Å; G91-F93 VanDerWaalsContact O-CD2 3.32Å; G91-F93 WeakPolarHBondContact O-CD2 3.4Å; G91-F93 VanDerWaalsContact O-CE2 3.26Å; G91-F93 WeakPolarHBondContact O-CE2 3.45Å; F93-V95 PolarHBondContact O-N 2.79Å; F93-E125 VanDerWaalsContact C-OE2 3.29Å; F93-M126 PolarHBondContact N-O 2.94Å; F93-M126 PolarHBondContact O-N 3.08Å; F93-M126 VanDerWaalsContact O-N 3.16Å; F93-F128 HydrophobicContact CD1-CD2 4.5Å; F93-F128 HydrophobicContact CD2-CB 4.02Å; F93-F128 HydrophobicContact CE1-CD2 4.47Å; F93-F128 HydrophobicContact CE2-CB 3.83Å; F93-F128 HydrophobicContact CZ-CB 4.42Å; F93-L149 HydrophobicContact CB-CD1 3.8Å; F93-L149 HydrophobicContact CB-CG 4.24Å; F93-L149 HydrophobicContact CD1-CD1 3.95Å; F93-L149 HydrophobicContact CD1-CD2 4.27Å; F93-L149 HydrophobicContact CD1-CG 4.46Å; F93-L149 HydrophobicContact CG-CD1 4.02Å; F93-Q151 HydrophobicContact CB-CB 4.36Å; F93-Q151 HydrophobicContact CB-CG 4.42Å; F93-Q151 HydrophobicContact CD1-CB 3.68Å; F93-Q151 HydrophobicContact CD1-CG 3.54Å; F93-Q151 HydrophobicContact CE1-CB 4.48Å; F93-Q151 HydrophobicContact CE1-CG 4.09Å; F93-Q151 HydrophobicContact CG-CB 4.47Å; F93-Q151 HydrophobicContact CG-CG 4.27Å
94	S	97.9	Very high	96.5	Very high	13 Å²	13	41 Å²	41	9%	0.091	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	115.9	168.8	-64.2	0	0	0	0	110.2	E125 Q150	S94-E125 WeakPolarHBondContact CB-OE1 3.07Å; S94-E125 PolarHBondContact N-OE2 2.86Å; S94-E125 PolarHBondContact OG-OE1 2.81Å; S94-E125 PolarHBondContact OG-OE2 3.06Å; S94-Q150 WeakPolarHBondContact CB-O 3.34Å; S94-Q150 PolarHBondContact O-N 2.73Å
95	V	98.1	Very high	96.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.8	177	178.4	0	0	0	0	109.2	F93 R123 M124 M126 F131 V147 L149	F93-V95 PolarHBondContact O-N 2.79Å; V95-R123 CarbonylContact O-C 3.58Å; V95-M124 PolarHBondContact N-O 2.67Å; V95-M124 PolarHBondContact O-N 3.18Å; V95-M126 HydrophobicContact CB-CE 3.98Å; V95-M126 HydrophobicContact CB-CG 4.18Å; V95-M126 HydrophobicContact CB-SD 4Å; V95-M126 HydrophobicContact CG1-CE 4.17Å; V95-M126 HydrophobicContact CG1-SD 4.15Å; V95-M126 HydrophobicContact CG2-CE 4.45Å; V95-M126 HydrophobicContact CG2-CG 3.67Å; V95-M126 HydrophobicContact CG2-SD 3.86Å; V95-F131 HydrophobicContact CB-CD2 4.49Å; V95-F131 HydrophobicContact CG1-CD2 3.75Å; V95-F131 HydrophobicContact CG1-CE2 4.26Å; V95-F131 HydrophobicContact CG2-CB 4.05Å; V95-F131 HydrophobicContact CG2-CD2 3.84Å; V95-F131 HydrophobicContact CG2-CG 4.13Å; V95-V147 HydrophobicContact CG1-CB 4.08Å; V95-V147 HydrophobicContact CG1-CG1 4.23Å; V95-L149 HydrophobicContact CG2-CB 4.14Å; V95-L149 HydrophobicContact CG2-CD1 4.22Å; V95-L149 HydrophobicContact CG2-CG 4.19Å
96	Y	98	Very high	96	Very high	22 Å²	22	43.2 Å²	43.2	9%	0.086	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.9	175.4	-65	-98.2	0	0	0	109.4	F103 R122 R123 V147 Y148 Q150	Y96-F103 WeakPolarHBondContact O-CE1 3.4Å; Y96-R122 CarbonylContact C-O 3.57Å; Y96-R122 VanDerWaalsContact CA-O 3.28Å; Y96-R122 WeakPolarHBondContact CA-O 3.16Å; Y96-R123 HydrophobicContact CD1-CB 4.09Å; Y96-R123 HydrophobicContact CE1-CB 3.79Å; Y96-R123 HydrophobicContact CE1-CG 4.17Å; Y96-R123 HydrophobicContact CE2-CG 4.49Å; Y96-V147 CarbonylContact O-C 3.54Å; Y96-V147 VanDerWaalsContact O-CA 3.23Å; Y96-V147 WeakPolarHBondContact O-CA 3.29Å; Y96-Y148 PolarHBondContact N-O 3.36Å; Y96-Y148 PolarHBondContact O-N 3.26Å; Y96-Q150 HydrophobicContact CD2-CB 4.17Å; Y96-Q150 HydrophobicContact CD2-CG 4.15Å; Y96-Q150 HydrophobicContact CE2-CB 3.95Å; Y96-Q150 HydrophobicContact CE2-CG 4.33Å
97	S	97.1	Very high	95.8	Very high	15 Å²	15	38.9 Å²	38.9	11%	0.105	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146	164.1	64.1	0	0	0	0	111	S121 R122 M124 R146	S97-S121 CarbonylContact O-C 3.55Å; S97-S121 WeakPolarHBondContact O-CA 3.43Å; S97-S121 WeakPolarHBondContact O-CB 3.45Å; S97-R122 PolarHBondContact N-O 3.19Å; S97-R122 PolarHBondContact O-N 2.88Å; S97-M124 WeakPolarHBondContact OG-CE 3.45Å; S97-R146 CarbonylContact C-O 3.46Å; S97-R146 VanDerWaalsContact CA-O 3.31Å; S97-R146 WeakPolarHBondContact CA-O 3.31Å
98	S	96.3	Very high	95.5	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.8	176	-174.8	0	0	0	0	109.8	N100 K102 K120 E145 R146	S98-N100 VanDerWaalsContact CB-O 3.32Å; S98-N100 WeakPolarHBondContact CB-O 3.25Å; S98-N100 PolarHBondContact O-N 3.25Å; S98-N100 PolarHBondContact OG-N 2.87Å; S98-N100 PolarHBondContact OG-O 2.92Å; S98-K102 WeakPolarHBondContact CB-O 3.41Å; S98-K102 PolarHBondContact OG-O 2.82Å; S98-K120 PolarHBondContact OG-O 3.49Å; S98-E145 CarbonylContact O-C 3.54Å; S98-E145 VanDerWaalsContact O-CA 3.29Å; S98-E145 WeakPolarHBondContact O-CA 3.49Å; S98-E145 VanDerWaalsContact O-CG 3.26Å; S98-E145 WeakPolarHBondContact O-CG 3.46Å; S98-R146 PolarHBondContact N-O 3.26Å; S98-R146 PolarHBondContact O-N 3.18Å
99	E	93.9	Very high	95.4	Very high	170 Å²	170	50.8 Å²	50.8	79%	0.794	25%	0.254	S	S	*	.	S	Bend	trans	-71.7	-11.1	176.5	-64.7	179.6	172.5	0	0	112.8
100	N	94.3	Very high	95.4	Very high	62 Å²	62	51.4 Å²	51.4	33%	0.332	25%	0.25	S	C	.	.	S	Bend	trans	-143	-170.6	176.6	65.2	54.1	0	0	0	110.3	S98 K102	S98-N100 VanDerWaalsContact CB-O 3.32Å; S98-N100 WeakPolarHBondContact CB-O 3.25Å; S98-N100 PolarHBondContact O-N 3.25Å; S98-N100 PolarHBondContact OG-N 2.87Å; S98-N100 PolarHBondContact OG-O 2.92Å; N100-K102 VanDerWaalsContact C-N 3.28Å; N100-K102 PolarHBondContact O-N 3.47Å; N100-K102 WeakPolarHBondContact OD1-CB 3.28Å; N100-K102 PolarHBondContact OD1-N 2.87Å
101	H	96.6	Very high	95.5	Very high	20 Å²	20	47.2 Å²	47.2	9%	0.093	23%	0.226	C	C	.	.	S	Bend	trans	-73.6	-11	-175.4	68.9	-92.7	0	0	0	115.5	R36 V198 D248	R36-H101 VanDerWaalsContact CZ-CD2 3.41Å; R36-H101 VanDerWaalsContact NH2-CB 3.32Å; H101-V198 VanDerWaalsContact CD2-CG2 3.46Å; H101-V198 WeakPolarHBondContact CD2-CG2 3.26Å; H101-V198 PolarHBondContact O-N 3.25Å; H101-D248 IonicContact CE1-OD2 2.78Å; H101-D248 PolarHBondContact CE1-OD2 3.44Å; H101-D248 IonicContact NE2-OD2 3.58Å; H101-D248 PolarHBondContact NE2-OD2 3.4Å
102	K	97.7	Very high	95.4	Very high	38 Å²	38	50.4 Å²	50.4	17%	0.165	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-95.4	127.7	-176	-59.9	173.9	-173.1	156.7	0	111.1	S98 N100 V198 P200 D246 D248	S98-K102 WeakPolarHBondContact CB-O 3.41Å; S98-K102 PolarHBondContact OG-O 2.82Å; N100-K102 VanDerWaalsContact C-N 3.28Å; N100-K102 PolarHBondContact O-N 3.47Å; N100-K102 WeakPolarHBondContact OD1-CB 3.28Å; N100-K102 PolarHBondContact OD1-N 2.87Å; K102-V198 HydrophobicContact CG-CB 4.47Å; K102-V198 HydrophobicContact CG-CG1 4.44Å; K102-P200 HydrophobicContact CB-CG 4.21Å; K102-D246 IonicContact NZ-OD1 3.54Å; K102-D246 PolarHBondContact NZ-OD1 3.48Å; K102-D246 IonicContact NZ-OD2 3.25Å; K102-D246 PolarHBondContact NZ-OD2 2.87Å; K102-D246 VanDerWaalsContact NZ-OD2 3.08Å; K102-D248 VanDerWaalsContact CE-CG 3.49Å; K102-D248 WeakPolarHBondContact CE-OD2 3.47Å; K102-D248 VanDerWaalsContact NZ-CG 3.26Å; K102-D248 IonicContact NZ-OD2 3.61Å; K102-D248 PolarHBondContact NZ-OD2 3.2Å
103	F	97.9	Very high	95	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	23%	0.234	C	C	.	.			trans	-107.2	77.2	175.5	-69.5	-94.9	0	0	0	109.8	Y96 Y105 R146 Y148 N197 V198 P200	Y96-F103 WeakPolarHBondContact O-CE1 3.4Å; F103-Y105 PolarHBondContact O-N 3.22Å; F103-R146 HydrophobicContact CE2-CB 3.94Å; F103-R146 HydrophobicContact CZ-CB 3.63Å; F103-Y148 HydrophobicContact CB-CD1 4.31Å; F103-Y148 HydrophobicContact CD1-CD1 4.37Å; F103-Y148 AromaticContact CD2-CD1 3.93Å; F103-Y148 HydrophobicContact CD2-CD1 3.93Å; F103-Y148 HydrophobicContact CE2-CD1 4.37Å; F103-Y148 AromaticContact CG-CD1 3.93Å; F103-Y148 HydrophobicContact CG-CD1 3.93Å; F103-N197 HydrophobicContact CD2-CB 4.38Å; F103-N197 HydrophobicContact CE2-CB 4.07Å; F103-N197 VanDerWaalsContact CE2-CG 3.43Å; F103-N197 WeakPolarHBondContact CE2-OD1 3.45Å; F103-V198 PolarHBondContact N-O 2.76Å; F103-P200 VanDerWaalsContact O-CD 3.32Å; F103-P200 WeakPolarHBondContact O-CD 3.47Å
104	L	94.7	Very high	94.7	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.131	24%	0.244	C	C	.	.			trans	-70	118.5	172.3	-166.8	76.6	0	0	0	108.7	S121 P200 C239 Q242	L104-S121 PolarHBondContact O-OG 2.97Å; L104-P200 HydrophobicContact CD1-CB 4.28Å; L104-P200 HydrophobicContact CD1-CG 4.2Å; L104-C239 VanDerWaalsContact CD2-SG 3.59Å; L104-Q242 HydrophobicContact CD1-CB 4.2Å; L104-Q242 HydrophobicContact CD1-CG 4.34Å
105	Y	92.1	Very high	94.2	Very high	94 Å²	94	57.1 Å²	57.1	37%	0.369	28%	0.275	S	S	.	.			trans	-71.4	157.5	176.3	171.6	-98.5	0	0	0	110.4	F103 D107 C239 Q242	F103-Y105 PolarHBondContact O-N 3.22Å; Y105-D107 HydrophobicContact CE1-CB 4.45Å; Y105-C239 PolarHBondContact O-SG 3.21Å; Y105-Q242 PolarHBondContact O-NE2 3.36Å
106	Y	94.3	Very high	93.9	Very high	19 Å²	19	64.7 Å²	64.7	8%	0.075	32%	0.316	C	S	.	.			trans	-147.8	140.9	170.4	58.5	-81.5	0	0	0	110.3	E108 M111 F117 P119 S121 R123 P238	Y106-E108 HydrophobicContact CD2-CG 4.14Å; Y106-E108 HydrophobicContact CE2-CG 3.72Å; Y106-E108 PolarHBondContact O-N 2.91Å; Y106-M111 HydrophobicContact CD2-CG 4.31Å; Y106-M111 HydrophobicContact CD2-SD 3.66Å; Y106-M111 HydrophobicContact CE2-SD 3.72Å; Y106-F117 HydrophobicContact CD2-CE1 4.45Å; Y106-F117 HydrophobicContact CG-CE1 4.13Å; Y106-F117 HydrophobicContact CG-CZ 4.48Å; Y106-P119 HydrophobicContact CD1-CB 3.98Å; Y106-P119 HydrophobicContact CD2-CG 4.34Å; Y106-P119 HydrophobicContact CE1-CB 3.75Å; Y106-P119 HydrophobicContact CE1-CG 4.45Å; Y106-P119 HydrophobicContact CE2-CB 4.28Å; Y106-P119 HydrophobicContact CE2-CG 4.11Å; Y106-P119 HydrophobicContact CG-CB 4.39Å; Y106-S121 WeakPolarHBondContact CE1-O 3.42Å; Y106-R123 PolarHBondContact OH-N 3.4Å; Y106-P238 CarbonylContact C-O 3.12Å; Y106-P238 WeakPolarHBondContact CA-O 3.45Å
107	D	93.9	Very high	93.6	Very high	43 Å²	43	65.3 Å²	65.3	23%	0.23	32%	0.319	C	S	.	.			trans	-82.2	105.1	171.6	-175.2	-11.1	0	0	0	109.2	Y105 K109 K110 M111 P238	Y105-D107 HydrophobicContact CE1-CB 4.45Å; D107-K109 PolarHBondContact O-N 2.95Å; D107-K109 VanDerWaalsContact O-N 3.13Å; D107-K109 WeakPolarHBondContact OD1-CB 3.27Å; D107-K109 PolarHBondContact OD1-N 3.18Å; D107-K110 HydrophobicContact CB-CB 4.3Å; D107-K110 HydrophobicContact CB-CD 4.11Å; D107-K110 HydrophobicContact CB-CG 4.21Å; D107-K110 PolarHBondContact O-N 3.14Å; D107-K110 WeakPolarHBondContact OD2-CE 3.42Å; D107-M111 PolarHBondContact O-N 3.32Å; D107-P238 PolarHBondContact N-O 3.32Å
108	E	92.8	Very high	93.4	Very high	89 Å²	89	69.6 Å²	69.6	42%	0.416	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-52.6	-32.4	178.2	-72	174.3	-166.8	0	0	112.5	Y106 K110 M111 R123	Y106-E108 HydrophobicContact CD2-CG 4.14Å; Y106-E108 HydrophobicContact CE2-CG 3.72Å; Y106-E108 PolarHBondContact O-N 2.91Å; E108-K110 PolarHBondContact O-N 3.31Å; E108-M111 WeakPolarHBondContact O-CB 3.22Å; E108-M111 PolarHBondContact O-N 3.05Å; E108-R123 IonicContact OE1-CZ 2.69Å; E108-R123 VanDerWaalsContact OE1-CZ 3.31Å; E108-R123 IonicContact OE1-NE 3.65Å; E108-R123 PolarHBondContact OE1-NE 3.43Å; E108-R123 IonicContact OE1-NH2 2.9Å; E108-R123 PolarHBondContact OE1-NH2 3.09Å; E108-R123 IonicContact OE2-CZ 3.21Å; E108-R123 IonicContact OE2-NH2 3.08Å; E108-R123 PolarHBondContact OE2-NH2 2.83Å
109	K	93.6	Very high	93.2	Very high	177 Å²	177	71.4 Å²	71.4	77%	0.77	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-69.9	-23.6	179.9	-61.7	179.5	-179	176.6	0	112.8	D107 C112	D107-K109 PolarHBondContact O-N 2.95Å; D107-K109 VanDerWaalsContact O-N 3.13Å; D107-K109 WeakPolarHBondContact OD1-CB 3.27Å; D107-K109 PolarHBondContact OD1-N 3.18Å; K109-C112 PolarHBondContact O-SG 2.95Å
110	K	94.8	Very high	93.1	Very high	38 Å²	38	69.9 Å²	69.9	17%	0.165	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-93.4	-8.7	179.6	-67.5	-179.3	-171.4	179	0	112.8	D107 E108 C112 N113 V235 H237 P238 D240	D107-K110 HydrophobicContact CB-CB 4.3Å; D107-K110 HydrophobicContact CB-CD 4.11Å; D107-K110 HydrophobicContact CB-CG 4.21Å; D107-K110 PolarHBondContact O-N 3.14Å; D107-K110 WeakPolarHBondContact OD2-CE 3.42Å; E108-K110 PolarHBondContact O-N 3.31Å; K110-C112 PolarHBondContact O-N 2.65Å; K110-N113 WeakPolarHBondContact O-CB 3.29Å; K110-N113 PolarHBondContact O-N 3.21Å; K110-V235 PolarHBondContact NZ-O 2.69Å; K110-H237 WeakPolarHBondContact CD-O 3.36Å; K110-P238 HydrophobicContact CB-CG 4.39Å; K110-D240 VanDerWaalsContact NZ-CB 3.28Å; K110-D240 IonicContact NZ-OD2 3.49Å; K110-D240 PolarHBondContact NZ-OD2 2.82Å
111	M	93	Very high	93.1	Very high	57 Å²	57	67.2 Å²	67.2	28%	0.281	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-60	-31.5	176.7	-69.4	-175.7	66.3	0	0	112.1	Y106 D107 E108 N113 F114 F117 P119 P238	Y106-M111 HydrophobicContact CD2-CG 4.31Å; Y106-M111 HydrophobicContact CD2-SD 3.66Å; Y106-M111 HydrophobicContact CE2-SD 3.72Å; D107-M111 PolarHBondContact O-N 3.32Å; E108-M111 WeakPolarHBondContact O-CB 3.22Å; E108-M111 PolarHBondContact O-N 3.05Å; M111-N113 PolarHBondContact O-N 2.77Å; M111-N113 VanDerWaalsContact O-N 3.15Å; M111-F114 CarbonylContact O-C 3.44Å; M111-F114 PolarHBondContact O-N 3.23Å; M111-F117 HydrophobicContact CE-CD1 4.38Å; M111-F117 HydrophobicContact CG-CD1 4.35Å; M111-P119 HydrophobicContact CE-CG 3.61Å; M111-P119 HydrophobicContact SD-CG 4.29Å; M111-P238 HydrophobicContact CG-CB 4.29Å; M111-P238 HydrophobicContact CG-CG 4.18Å
112	C	91.3	Very high	92.9	Very high	81 Å²	81	74.4 Å²	74.4	55%	0.547	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-64.5	-16.1	175.5	65.3	0	0	0	0	113.8	K109 K110 M115	K109-C112 PolarHBondContact O-SG 2.95Å; K110-C112 PolarHBondContact O-N 2.65Å; C112-M115 VanDerWaalsContact C-CE 3.43Å; C112-M115 VanDerWaalsContact CA-CE 3.46Å; C112-M115 HydrophobicContact CB-CE 4.28Å; C112-M115 WeakPolarHBondContact O-CE 3.1Å
113	N	89.9	Confident	92.9	Very high	38 Å²	38	77 Å²	77	20%	0.203	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-86	-16	175.5	-58.1	-27.1	0	0	0	111.9	K110 M111 H236 H337	K110-N113 WeakPolarHBondContact O-CB 3.29Å; K110-N113 PolarHBondContact O-N 3.21Å; M111-N113 PolarHBondContact O-N 2.77Å; M111-N113 VanDerWaalsContact O-N 3.15Å; N113-H236 PolarHBondContact ND2-O 3.35Å; N113-H337 PolarHBondContact O-CE1 3.28Å; N113-H337 PolarHBondContact O-NE2 3.3Å
114	F	91.4	Very high	92.8	Very high	54 Å²	54	79.5 Å²	79.5	24%	0.237	38%	0.38	C	S	.	.			trans	-139.8	83.1	-174.2	-69.8	-93.8	0	0	0	109.9	M111 D116 F117 H236 H237 P238	M111-F114 CarbonylContact O-C 3.44Å; M111-F114 PolarHBondContact O-N 3.23Å; F114-D116 PolarHBondContact O-N 2.99Å; F114-F117 HydrophobicContact CB-CB 4.05Å; F114-F117 VanDerWaalsContact O-CB 3.26Å; F114-F117 WeakPolarHBondContact O-CB 3.2Å; F114-F117 PolarHBondContact O-N 3.01Å; F114-H236 HydrophobicContact CE2-CB 4.4Å; F114-H236 WeakPolarHBondContact CE2-O 3.47Å; F114-H237 AromaticContact CD1-CD2 3.95Å; F114-H237 HydrophobicContact CE2-CB 4.15Å; F114-H237 HydrophobicContact CZ-CB 4.31Å; F114-P238 HydrophobicContact CB-CG 4.48Å
115	M	87.2	Confident	92.9	Very high	149 Å²	149	82.7 Å²	82.7	73%	0.734	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.4	-174.6	-65.6	-66.6	131.5	0	0	113.9	C112 F117	C112-M115 VanDerWaalsContact C-CE 3.43Å; C112-M115 VanDerWaalsContact CA-CE 3.46Å; C112-M115 HydrophobicContact CB-CE 4.28Å; C112-M115 WeakPolarHBondContact O-CE 3.1Å; M115-F117 VanDerWaalsContact C-N 3.28Å; M115-F117 PolarHBondContact O-N 2.96Å
116	D	90.8	Very high	93.2	Very high	160 Å²	160	79.3 Å²	79.3	86%	0.856	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.1	179.9	-59.3	-36.6	0	0	0	113	F114 V118	F114-D116 PolarHBondContact O-N 2.99Å; D116-V118 PolarHBondContact O-N 3.39Å
117	F	92.4	Very high	93.4	Very high	34 Å²	34	81.7 Å²	81.7	15%	0.149	39%	0.393	C	S	.	.			trans	-72.4	117.2	177.9	176.2	-101.6	0	0	0	110.7	Y106 M111 F114 M115 P119 H237 P238 C239	Y106-F117 HydrophobicContact CD2-CE1 4.45Å; Y106-F117 HydrophobicContact CG-CE1 4.13Å; Y106-F117 HydrophobicContact CG-CZ 4.48Å; M111-F117 HydrophobicContact CE-CD1 4.38Å; M111-F117 HydrophobicContact CG-CD1 4.35Å; F114-F117 HydrophobicContact CB-CB 4.05Å; F114-F117 VanDerWaalsContact O-CB 3.26Å; F114-F117 WeakPolarHBondContact O-CB 3.2Å; F114-F117 PolarHBondContact O-N 3.01Å; M115-F117 VanDerWaalsContact C-N 3.28Å; M115-F117 PolarHBondContact O-N 2.96Å; F117-P119 HydrophobicContact CD1-CG 4.27Å; F117-P119 HydrophobicContact CE1-CB 4.22Å; F117-P119 HydrophobicContact CE1-CG 3.85Å; F117-H237 AromaticContact CD2-CE1 3.78Å; F117-H237 AromaticContact CD2-NE2 3.84Å; F117-H237 AromaticContact CE2-CE1 3.87Å; F117-P238 HydrophobicContact CB-CG 4.35Å; F117-P238 HydrophobicContact CD1-CB 3.89Å; F117-P238 HydrophobicContact CD1-CG 3.79Å; F117-P238 HydrophobicContact CE1-CB 3.77Å; F117-P238 HydrophobicContact CE1-CG 4.21Å; F117-P238 HydrophobicContact CG-CB 4.34Å; F117-P238 HydrophobicContact CG-CG 3.97Å; F117-P238 HydrophobicContact CZ-CB 4.14Å; F117-C239 WeakPolarHBondContact CE2-SG 3.39Å; F117-C239 VanDerWaalsContact CZ-SG 3.51Å
118	V	92	Very high	93.6	Very high	105 Å²	105	79.9 Å²	79.9	64%	0.636	38%	0.383	S	S	*	.			trans	-103	113.5	172.9	-176.9	0	0	0	0	109	D116 K120	D116-V118 PolarHBondContact O-N 3.39Å; V118-K120 PolarHBondContact O-N 2.91Å
119	P	92.6	Very high	93.8	Very high	41 Å²	41	78.4 Å²	78.4	27%	0.266	38%	0.382	S	S	.	.			trans	-55.3	136.2	176.5	-25	33.1	0	0	0	112.1	Y106 M111 F117 S121	Y106-P119 HydrophobicContact CD1-CB 3.98Å; Y106-P119 HydrophobicContact CD2-CG 4.34Å; Y106-P119 HydrophobicContact CE1-CB 3.75Å; Y106-P119 HydrophobicContact CE1-CG 4.45Å; Y106-P119 HydrophobicContact CE2-CB 4.28Å; Y106-P119 HydrophobicContact CE2-CG 4.11Å; Y106-P119 HydrophobicContact CG-CB 4.39Å; M111-P119 HydrophobicContact CE-CG 3.61Å; M111-P119 HydrophobicContact SD-CG 4.29Å; F117-P119 HydrophobicContact CD1-CG 4.27Å; F117-P119 HydrophobicContact CE1-CB 4.22Å; F117-P119 HydrophobicContact CE1-CG 3.85Å; P119-S121 VanDerWaalsContact CB-O 3.26Å; P119-S121 WeakPolarHBondContact CB-O 3.44Å
120	K	92.1	Very high	94	Very high	139 Å²	139	74.8 Å²	74.8	60%	0.604	37%	0.368	S	S	*	.	S	Bend	trans	-88.2	-15.5	175.9	-62.3	-60.6	-176.4	-178.3	0	113.3	S98 V118	S98-K120 PolarHBondContact OG-O 3.49Å; V118-K120 PolarHBondContact O-N 2.91Å
121	S	93.5	Very high	94.2	Very high	5 Å²	5	73 Å²	73	4%	0.035	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	159.5	168.6	68.3	0	0	0	0	109.2	S97 L104 Y106 P119	S97-S121 CarbonylContact O-C 3.55Å; S97-S121 WeakPolarHBondContact O-CA 3.43Å; S97-S121 WeakPolarHBondContact O-CB 3.45Å; L104-S121 PolarHBondContact O-OG 2.97Å; Y106-S121 WeakPolarHBondContact CE1-O 3.42Å; P119-S121 VanDerWaalsContact CB-O 3.26Å; P119-S121 WeakPolarHBondContact CB-O 3.44Å
122	R	94.1	Very high	94.4	Very high	171 Å²	171	70.3 Å²	70.3	65%	0.645	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	127.7	175.8	-178	-178.2	-65.5	-156.7	0.9	110	Y96 S97 M124	Y96-R122 CarbonylContact C-O 3.57Å; Y96-R122 VanDerWaalsContact CA-O 3.28Å; Y96-R122 WeakPolarHBondContact CA-O 3.16Å; S97-R122 PolarHBondContact N-O 3.19Å; S97-R122 PolarHBondContact O-N 2.88Å; R122-M124 HydrophobicContact CG-CG 4.39Å
123	R	95.9	Very high	94.7	Very high	92 Å²	92	71 Å²	71	35%	0.347	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	136.7	169.3	-173.5	169.5	68.7	136	-0.1	111.3	V95 Y96 Y106 E108 E125	V95-R123 CarbonylContact O-C 3.58Å; Y96-R123 HydrophobicContact CD1-CB 4.09Å; Y96-R123 HydrophobicContact CE1-CB 3.79Å; Y96-R123 HydrophobicContact CE1-CG 4.17Å; Y96-R123 HydrophobicContact CE2-CG 4.49Å; Y106-R123 PolarHBondContact OH-N 3.4Å; E108-R123 IonicContact OE1-CZ 2.69Å; E108-R123 VanDerWaalsContact OE1-CZ 3.31Å; E108-R123 IonicContact OE1-NE 3.65Å; E108-R123 PolarHBondContact OE1-NE 3.43Å; E108-R123 IonicContact OE1-NH2 2.9Å; E108-R123 PolarHBondContact OE1-NH2 3.09Å; E108-R123 IonicContact OE2-CZ 3.21Å; E108-R123 IonicContact OE2-NH2 3.08Å; E108-R123 PolarHBondContact OE2-NH2 2.83Å; R123-E125 IonicContact NH1-OE1 3.05Å
124	M	96	Very high	95	Very high	58 Å²	58	70.5 Å²	70.5	29%	0.286	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.4	175.3	-61.2	173.9	-69.7	0	0	108.6	V95 S97 R122 M126	V95-M124 PolarHBondContact N-O 2.67Å; V95-M124 PolarHBondContact O-N 3.18Å; S97-M124 WeakPolarHBondContact OG-CE 3.45Å; R122-M124 HydrophobicContact CG-CG 4.39Å; M124-M126 HydrophobicContact CB-CE 3.77Å; M124-M126 HydrophobicContact CE-CE 3.81Å; M124-M126 HydrophobicContact SD-CE 4.2Å
125	E	97.6	Very high	95.3	Very high	93 Å²	93	68.2 Å²	68.2	44%	0.435	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.3	170.6	-62.5	-59.1	143.9	0	0	108.3	D92 F93 S94 R123	D92-E125 HydrophobicContact CB-CB 4.41Å; F93-E125 VanDerWaalsContact C-OE2 3.29Å; S94-E125 WeakPolarHBondContact CB-OE1 3.07Å; S94-E125 PolarHBondContact N-OE2 2.86Å; S94-E125 PolarHBondContact OG-OE1 2.81Å; S94-E125 PolarHBondContact OG-OE2 3.06Å; R123-E125 IonicContact NH1-OE1 3.05Å
126	M	97.8	Very high	95.7	Very high	22 Å²	22	66.4 Å²	66.4	11%	0.108	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	164.5	-179.8	65.1	-175.7	66.4	0	0	111.6	F93 V95 M124 E130 F131	F93-M126 PolarHBondContact N-O 2.94Å; F93-M126 PolarHBondContact O-N 3.08Å; F93-M126 VanDerWaalsContact O-N 3.16Å; V95-M126 HydrophobicContact CB-CE 3.98Å; V95-M126 HydrophobicContact CB-CG 4.18Å; V95-M126 HydrophobicContact CB-SD 4Å; V95-M126 HydrophobicContact CG1-CE 4.17Å; V95-M126 HydrophobicContact CG1-SD 4.15Å; V95-M126 HydrophobicContact CG2-CE 4.45Å; V95-M126 HydrophobicContact CG2-CG 3.67Å; V95-M126 HydrophobicContact CG2-SD 3.86Å; M124-M126 HydrophobicContact CB-CE 3.77Å; M124-M126 HydrophobicContact CE-CE 3.81Å; M124-M126 HydrophobicContact SD-CE 4.2Å; M126-E130 WeakPolarHBondContact CA-OE2 2.85Å; M126-E130 HydrophobicContact CB-CB 4.14Å; M126-E130 WeakPolarHBondContact CB-OE2 3.46Å; M126-E130 HydrophobicContact CG-CB 4.48Å; M126-E130 HydrophobicContact SD-CB 4.47Å; M126-F131 HydrophobicContact CG-CB 4.29Å; M126-F131 HydrophobicContact SD-CB 3.97Å
127	K	97.9	Very high	95.9	Very high	69 Å²	69	64.3 Å²	64.3	30%	0.3	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	154.5	172	-58.6	-55.7	-178.5	-164.9	0	110.8	N90 D92 S129 E130 F131	N90-K127 WeakPolarHBondContact O-CE 3.28Å; N90-K127 PolarHBondContact O-NZ 2.9Å; D92-K127 WeakPolarHBondContact OD1-CD 3.46Å; D92-K127 VanDerWaalsContact OD1-CE 3.25Å; D92-K127 WeakPolarHBondContact OD1-CE 3.23Å; D92-K127 IonicContact OD1-NZ 2.82Å; D92-K127 PolarHBondContact OD1-NZ 2.7Å; K127-S129 PolarHBondContact O-N 3.29Å; K127-E130 HydrophobicContact CB-CB 4.49Å; K127-E130 HydrophobicContact CB-CG 4.08Å; K127-E130 PolarHBondContact N-OE2 2.83Å; K127-E130 WeakPolarHBondContact O-CB 3.35Å; K127-E130 PolarHBondContact O-N 2.99Å; K127-E130 VanDerWaalsContact O-N 3.08Å; K127-F131 PolarHBondContact O-N 3.47Å
128	F	98.1	Very high	95.9	Very high	6 Å²	6	64.1 Å²	64.1	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-35.1	176.6	-167.1	-95.8	0	0	0	112.5	I81 L84 L85 I88 F93 F131 V132 L149	I81-F128 HydrophobicContact CD1-CZ 4.3Å; L84-F128 HydrophobicContact CB-CD1 4.39Å; L84-F128 HydrophobicContact CB-CE1 3.53Å; L84-F128 HydrophobicContact CB-CE2 4.37Å; L84-F128 HydrophobicContact CB-CZ 3.52Å; L84-F128 HydrophobicContact CD1-CE2 4.35Å; L84-F128 HydrophobicContact CD1-CZ 3.8Å; L84-F128 HydrophobicContact CG-CZ 4.33Å; L85-F128 HydrophobicContact CD2-CD1 3.87Å; L85-F128 HydrophobicContact CD2-CE1 4.36Å; L85-F128 HydrophobicContact CG-CD1 4.03Å; L85-F128 HydrophobicContact CG-CE1 4.07Å; I88-F128 HydrophobicContact CD1-CD2 3.94Å; I88-F128 HydrophobicContact CD1-CE2 4.03Å; I88-F128 HydrophobicContact CG2-CB 3.73Å; I88-F128 HydrophobicContact CG2-CD1 4.09Å; I88-F128 HydrophobicContact CG2-CD2 4.17Å; I88-F128 HydrophobicContact CG2-CG 3.73Å; F93-F128 HydrophobicContact CD1-CD2 4.5Å; F93-F128 HydrophobicContact CD2-CB 4.02Å; F93-F128 HydrophobicContact CE1-CD2 4.47Å; F93-F128 HydrophobicContact CE2-CB 3.83Å; F93-F128 HydrophobicContact CZ-CB 4.42Å; F128-F131 HydrophobicContact CD2-CD1 4.36Å; F128-F131 HydrophobicContact CE2-CD1 4.18Å; F128-F131 HydrophobicContact CE2-CE1 4.44Å; F128-F131 WeakPolarHBondContact O-CB 3.35Å; F128-F131 PolarHBondContact O-N 3.08Å; F128-V132 HydrophobicContact CD1-CG2 4.03Å; F128-V132 HydrophobicContact CE1-CG2 3.73Å; F128-V132 HydrophobicContact CZ-CG2 4.34Å; F128-V132 WeakPolarHBondContact O-CG2 3.49Å; F128-V132 PolarHBondContact O-N 2.82Å; F128-L149 HydrophobicContact CD2-CD1 3.68Å; F128-L149 HydrophobicContact CE2-CD1 3.83Å
129	S	97.8	Very high	95.8	Very high	57 Å²	57	63.5 Å²	63.5	40%	0.399	29%	0.292	S	S	.	.	H	α-helix	trans	-63.1	-44.2	174.1	54.3	0	0	0	0	112.8	K127 F131 V132 D133	K127-S129 PolarHBondContact O-N 3.29Å; S129-F131 VanDerWaalsContact C-N 3.3Å; S129-F131 PolarHBondContact O-N 3.16Å; S129-V132 PolarHBondContact O-N 2.94Å; S129-D133 PolarHBondContact O-N 2.75Å
130	E	98.3	Very high	95.8	Very high	102 Å²	102	69.4 Å²	69.4	48%	0.477	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-38	178.6	-64	169.5	160.5	0	0	111	M126 K127 D133 S134	M126-E130 WeakPolarHBondContact CA-OE2 2.85Å; M126-E130 HydrophobicContact CB-CB 4.14Å; M126-E130 WeakPolarHBondContact CB-OE2 3.46Å; M126-E130 HydrophobicContact CG-CB 4.48Å; M126-E130 HydrophobicContact SD-CB 4.47Å; K127-E130 HydrophobicContact CB-CB 4.49Å; K127-E130 HydrophobicContact CB-CG 4.08Å; K127-E130 PolarHBondContact N-OE2 2.83Å; K127-E130 WeakPolarHBondContact O-CB 3.35Å; K127-E130 PolarHBondContact O-N 2.99Å; K127-E130 VanDerWaalsContact O-N 3.08Å; E130-D133 PolarHBondContact O-N 3.31Å; E130-S134 WeakPolarHBondContact O-CB 3.34Å; E130-S134 PolarHBondContact O-N 3.13Å
131	F	98.3	Very high	95.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.4	-48.5	171.5	164.3	-111	0	0	0	112.1	V95 M126 K127 F128 S129 D133 S134 M135 V147 L149 V192	V95-F131 HydrophobicContact CB-CD2 4.49Å; V95-F131 HydrophobicContact CG1-CD2 3.75Å; V95-F131 HydrophobicContact CG1-CE2 4.26Å; V95-F131 HydrophobicContact CG2-CB 4.05Å; V95-F131 HydrophobicContact CG2-CD2 3.84Å; V95-F131 HydrophobicContact CG2-CG 4.13Å; M126-F131 HydrophobicContact CG-CB 4.29Å; M126-F131 HydrophobicContact SD-CB 3.97Å; K127-F131 PolarHBondContact O-N 3.47Å; F128-F131 HydrophobicContact CD2-CD1 4.36Å; F128-F131 HydrophobicContact CE2-CD1 4.18Å; F128-F131 HydrophobicContact CE2-CE1 4.44Å; F128-F131 WeakPolarHBondContact O-CB 3.35Å; F128-F131 PolarHBondContact O-N 3.08Å; S129-F131 VanDerWaalsContact C-N 3.3Å; S129-F131 PolarHBondContact O-N 3.16Å; F131-D133 VanDerWaalsContact C-N 3.33Å; F131-D133 PolarHBondContact O-N 3.32Å; F131-S134 VanDerWaalsContact O-CB 3.24Å; F131-S134 WeakPolarHBondContact O-CB 3.41Å; F131-S134 PolarHBondContact O-N 3.4Å; F131-M135 HydrophobicContact CZ-SD 4.29Å; F131-M135 WeakPolarHBondContact O-CB 3.37Å; F131-M135 PolarHBondContact O-N 2.9Å; F131-V147 HydrophobicContact CD2-CG2 4.27Å; F131-V147 HydrophobicContact CE2-CB 4.17Å; F131-V147 HydrophobicContact CE2-CG2 3.83Å; F131-L149 HydrophobicContact CB-CD1 4.46Å; F131-L149 HydrophobicContact CD1-CB 4.26Å; F131-L149 HydrophobicContact CD1-CD1 3.68Å; F131-L149 HydrophobicContact CD2-CB 4.14Å; F131-L149 HydrophobicContact CE1-CB 3.96Å; F131-L149 HydrophobicContact CE1-CD1 4.04Å; F131-L149 HydrophobicContact CE2-CB 3.83Å; F131-L149 HydrophobicContact CG-CB 4.34Å; F131-L149 HydrophobicContact CG-CD1 3.96Å; F131-L149 HydrophobicContact CZ-CB 3.74Å; F131-V192 HydrophobicContact CE1-CB 4.06Å; F131-V192 HydrophobicContact CE1-CG1 3.8Å; F131-V192 HydrophobicContact CZ-CB 4.18Å; F131-V192 HydrophobicContact CZ-CG1 4.01Å
132	V	97.9	Very high	95.3	Very high	1 Å²	1	71.5 Å²	71.5	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-62.6	-41.6	179.9	172.1	0	0	0	0	111.3	I81 L85 F128 S129 S134 M135 R136	I81-V132 HydrophobicContact CD1-CG2 4.49Å; I81-V132 HydrophobicContact CG2-CB 4.31Å; I81-V132 HydrophobicContact CG2-CG1 3.65Å; I81-V132 HydrophobicContact CG2-CG2 3.6Å; L85-V132 HydrophobicContact CD1-CG1 4.22Å; L85-V132 HydrophobicContact CD1-CG2 4.37Å; L85-V132 HydrophobicContact CD2-CB 4.32Å; L85-V132 HydrophobicContact CD2-CG2 4.03Å; L85-V132 HydrophobicContact CG-CG2 4.17Å; F128-V132 HydrophobicContact CD1-CG2 4.03Å; F128-V132 HydrophobicContact CE1-CG2 3.73Å; F128-V132 HydrophobicContact CZ-CG2 4.34Å; F128-V132 WeakPolarHBondContact O-CG2 3.49Å; F128-V132 PolarHBondContact O-N 2.82Å; S129-V132 PolarHBondContact O-N 2.94Å; V132-S134 VanDerWaalsContact C-N 3.34Å; V132-M135 PolarHBondContact O-N 2.91Å; V132-R136 WeakPolarHBondContact O-CG 3.32Å; V132-R136 PolarHBondContact O-N 3.18Å
133	D	97.5	Very high	94.9	Very high	95 Å²	95	65.5 Å²	65.5	51%	0.508	34%	0.336	S	S	.	.	H	α-helix	trans	-63.9	-41.5	175.3	-66.5	-21.9	0	0	0	111	S129 E130 F131 M135 R136 K137	S129-D133 PolarHBondContact O-N 2.75Å; E130-D133 PolarHBondContact O-N 3.31Å; F131-D133 VanDerWaalsContact C-N 3.33Å; F131-D133 PolarHBondContact O-N 3.32Å; D133-M135 VanDerWaalsContact C-N 3.3Å; D133-M135 PolarHBondContact O-N 2.92Å; D133-R136 PolarHBondContact O-N 2.91Å; D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.31Å; D133-K137 PolarHBondContact O-N 3.46Å
134	S	96.7	Very high	94.6	Very high	28 Å²	28	67 Å²	67	20%	0.196	35%	0.347	C	S	.	.	H	α-helix	trans	-58.6	-40.3	174.1	-127.2	0	0	0	0	113	E130 F131 V132 R138	E130-S134 WeakPolarHBondContact O-CB 3.34Å; E130-S134 PolarHBondContact O-N 3.13Å; F131-S134 VanDerWaalsContact O-CB 3.24Å; F131-S134 WeakPolarHBondContact O-CB 3.41Å; F131-S134 PolarHBondContact O-N 3.4Å; V132-S134 VanDerWaalsContact C-N 3.34Å; S134-R138 VanDerWaalsContact CB-NH1 3.29Å; S134-R138 WeakPolarHBondContact O-CG 3.1Å; S134-R138 PolarHBondContact O-N 2.97Å; S134-R138 PolarHBondContact O-NH1 2.94Å; S134-R138 PolarHBondContact OG-NH1 3.4Å
135	M	96.3	Very high	94.5	Very high	6 Å²	6	67.9 Å²	67.9	3%	0.03	35%	0.351	C	S	.	.	H	α-helix	trans	-69.3	-52	-179.8	-176.1	-177.8	73.2	0	0	110.7	I81 F131 V132 D133 K137 R138 E139 V147 M194 V292	I81-M135 HydrophobicContact CD1-CE 4.36Å; I81-M135 HydrophobicContact CG1-CE 4.28Å; F131-M135 HydrophobicContact CZ-SD 4.29Å; F131-M135 WeakPolarHBondContact O-CB 3.37Å; F131-M135 PolarHBondContact O-N 2.9Å; V132-M135 PolarHBondContact O-N 2.91Å; D133-M135 VanDerWaalsContact C-N 3.3Å; D133-M135 PolarHBondContact O-N 2.92Å; M135-K137 VanDerWaalsContact C-N 3.32Å; M135-K137 PolarHBondContact O-N 3.47Å; M135-R138 PolarHBondContact O-N 3.18Å; M135-R138 VanDerWaalsContact O-N 3.15Å; M135-E139 PolarHBondContact O-N 3.01Å; M135-V147 HydrophobicContact CB-CG2 4.03Å; M135-V147 HydrophobicContact CG-CG2 4.48Å; M135-M194 HydrophobicContact CG-CE 4.44Å; M135-M194 HydrophobicContact CG-CG 3.66Å; M135-M194 HydrophobicContact CG-SD 4.18Å; M135-M194 HydrophobicContact SD-CG 4.24Å; M135-V292 HydrophobicContact CE-CG2 3.68Å; M135-V292 HydrophobicContact SD-CG2 3.61Å
136	R	95.7	Very high	94.5	Very high	110 Å²	110	65.3 Å²	65.3	42%	0.415	34%	0.337	S	S	.	.	H	α-helix	trans	-58.4	-43.8	178.7	-72.6	173.9	177.3	164.5	-0.9	112	V132 D133 R138 E139 E140	V132-R136 WeakPolarHBondContact O-CG 3.32Å; V132-R136 PolarHBondContact O-N 3.18Å; D133-R136 PolarHBondContact O-N 2.91Å; R136-R138 VanDerWaalsContact C-N 3.31Å; R136-R138 PolarHBondContact O-N 3.44Å; R136-E139 PolarHBondContact O-N 3.08Å; R136-E140 WeakPolarHBondContact O-CG 3.5Å; R136-E140 PolarHBondContact O-N 3.44Å
137	K	95.2	Very high	94.5	Very high	117 Å²	117	64.3 Å²	64.3	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-56.9	-44.3	177.2	-178.5	-179.7	171.9	-174.8	0	112	D133 M135 E140 E141	D133-K137 VanDerWaalsContact O-CB 3.29Å; D133-K137 WeakPolarHBondContact O-CB 3.31Å; D133-K137 PolarHBondContact O-N 3.46Å; M135-K137 VanDerWaalsContact C-N 3.32Å; M135-K137 PolarHBondContact O-N 3.47Å; K137-E140 PolarHBondContact O-N 3.03Å; K137-E141 WeakPolarHBondContact CE-OE1 3.23Å; K137-E141 HydrophobicContact CG-CG 4.45Å; K137-E141 IonicContact NZ-OE1 2.97Å; K137-E141 WeakPolarHBondContact O-CB 3.4Å; K137-E141 VanDerWaalsContact O-CG 3.32Å; K137-E141 WeakPolarHBondContact O-CG 3.47Å; K137-E141 PolarHBondContact O-N 3.16Å
138	R	93.7	Very high	94.5	Very high	29 Å²	29	61.2 Å²	61.2	11%	0.109	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-35.6	179.1	-73.2	176.4	178.7	89.3	-6.3	112.7	S134 M135 R136 G142 E145 M194	S134-R138 VanDerWaalsContact CB-NH1 3.29Å; S134-R138 WeakPolarHBondContact O-CG 3.1Å; S134-R138 PolarHBondContact O-N 2.97Å; S134-R138 PolarHBondContact O-NH1 2.94Å; S134-R138 PolarHBondContact OG-NH1 3.4Å; M135-R138 PolarHBondContact O-N 3.18Å; M135-R138 VanDerWaalsContact O-N 3.15Å; R136-R138 VanDerWaalsContact C-N 3.31Å; R136-R138 PolarHBondContact O-N 3.44Å; R138-G142 PolarHBondContact O-N 3.48Å; R138-E145 WeakPolarHBondContact CD-O 3.35Å; R138-E145 IonicContact CZ-OE1 3.02Å; R138-E145 IonicContact CZ-OE2 2.65Å; R138-E145 IonicContact NE-OE1 2.67Å; R138-E145 PolarHBondContact NE-OE1 2.77Å; R138-E145 IonicContact NE-OE2 3.04Å; R138-E145 PolarHBondContact NE-OE2 3.13Å; R138-E145 VanDerWaalsContact NE-OE2 3.13Å; R138-E145 IonicContact NH2-OE1 3.75Å; R138-E145 PolarHBondContact NH2-OE1 3Å; R138-E145 IonicContact NH2-OE2 3.5Å; R138-E145 PolarHBondContact NH2-OE2 2.83Å; R138-M194 HydrophobicContact CB-CE 3.93Å
139	E	89.9	Confident	94.5	Very high	93 Å²	93	60.9 Å²	60.9	44%	0.435	32%	0.317	S	S	.	.	H	α-helix	trans	-63.6	-43	172.3	-69.5	174.3	173.3	0	0	111.4	M135 R136 G142 M194	M135-E139 PolarHBondContact O-N 3.01Å; R136-E139 PolarHBondContact O-N 3.08Å; E139-G142 PolarHBondContact O-N 3Å; E139-M194 HydrophobicContact CG-CE 3.85Å
140	E	90.9	Very high	94.6	Very high	164 Å²	164	59.9 Å²	59.9	77%	0.766	31%	0.306	S	S	*	.	H	α-helix	trans	-68.1	-39.6	178.2	-72.6	173.4	-173.3	0	0	113.1	R136 K137 G142	R136-E140 WeakPolarHBondContact O-CG 3.5Å; R136-E140 PolarHBondContact O-N 3.44Å; K137-E140 PolarHBondContact O-N 3.03Å; E140-G142 VanDerWaalsContact C-N 3.26Å; E140-G142 PolarHBondContact O-N 3.15Å
141	E	91.3	Very high	94.5	Very high	123 Å²	123	56.2 Å²	56.2	58%	0.575	29%	0.289	S	S	*	.	H	α-helix	trans	-72.3	-19.6	178.9	-73.3	175	165.8	0	0	112.7	K137 G143	K137-E141 WeakPolarHBondContact CE-OE1 3.23Å; K137-E141 HydrophobicContact CG-CG 4.45Å; K137-E141 IonicContact NZ-OE1 2.97Å; K137-E141 WeakPolarHBondContact O-CB 3.4Å; K137-E141 VanDerWaalsContact O-CG 3.32Å; K137-E141 WeakPolarHBondContact O-CG 3.47Å; K137-E141 PolarHBondContact O-N 3.16Å; E141-G143 PolarHBondContact O-N 2.89Å
142	G	84.3	Confident	94.5	Very high	66 Å²	66	58.9 Å²	58.9	68%	0.68	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	23.5	178.6	0	0	0	0	0	114.1	R138 E139 E140	R138-G142 PolarHBondContact O-N 3.48Å; E139-G142 PolarHBondContact O-N 3Å; E140-G142 VanDerWaalsContact C-N 3.26Å; E140-G142 PolarHBondContact O-N 3.15Å
143	G	86.1	Confident	94.4	Very high	44 Å²	44	60.1 Å²	60.1	45%	0.454	31%	0.312	S	S	.	.			trans	-81.7	174.2	-179.1	0	0	0	0	0	114.1	E141	E141-G143 PolarHBondContact O-N 2.89Å
144	E	89.9	Confident	94.1	Very high	124 Å²	124	58.5 Å²	58.5	58%	0.579	30%	0.303	S	S	*	.	S	Bend	trans	-83.9	-15.4	175.1	-68.4	-63.4	158.7	0	0	113.4	R146	E144-R146 WeakPolarHBondContact O-CG 3.42Å
145	E	93.8	Very high	93.7	Very high	77 Å²	77	65.2 Å²	65.2	36%	0.36	34%	0.337	S	S	.	.			trans	-66.1	136.7	178.2	-161.8	-163.6	172.2	0	0	110	S98 R138	S98-E145 CarbonylContact O-C 3.54Å; S98-E145 VanDerWaalsContact O-CA 3.29Å; S98-E145 WeakPolarHBondContact O-CA 3.49Å; S98-E145 VanDerWaalsContact O-CG 3.26Å; S98-E145 WeakPolarHBondContact O-CG 3.46Å; R138-E145 WeakPolarHBondContact CD-O 3.35Å; R138-E145 IonicContact CZ-OE1 3.02Å; R138-E145 IonicContact CZ-OE2 2.65Å; R138-E145 IonicContact NE-OE1 2.67Å; R138-E145 PolarHBondContact NE-OE1 2.77Å; R138-E145 IonicContact NE-OE2 3.04Å; R138-E145 PolarHBondContact NE-OE2 3.13Å; R138-E145 VanDerWaalsContact NE-OE2 3.13Å; R138-E145 IonicContact NH2-OE1 3.75Å; R138-E145 PolarHBondContact NH2-OE1 3Å; R138-E145 IonicContact NH2-OE2 3.5Å; R138-E145 PolarHBondContact NH2-OE2 2.83Å
146	R	96.9	Very high	93.4	Very high	39 Å²	39	68.7 Å²	68.7	15%	0.147	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.2	-179.4	-57.8	-167.3	-168.5	-96.9	-17.6	111.6	S97 S98 F103 E144 M194 E195 N197	S97-R146 CarbonylContact C-O 3.46Å; S97-R146 VanDerWaalsContact CA-O 3.31Å; S97-R146 WeakPolarHBondContact CA-O 3.31Å; S98-R146 PolarHBondContact N-O 3.26Å; S98-R146 PolarHBondContact O-N 3.18Å; F103-R146 HydrophobicContact CE2-CB 3.94Å; F103-R146 HydrophobicContact CZ-CB 3.63Å; E144-R146 WeakPolarHBondContact O-CG 3.42Å; R146-M194 HydrophobicContact CB-SD 4.07Å; R146-E195 PolarHBondContact NH1-O 3.46Å; R146-N197 WeakPolarHBondContact CB-OD1 3.47Å; R146-N197 WeakPolarHBondContact CD-OD1 3.42Å
147	V	98	Very high	93.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152	169.4	-73.6	0	0	0	0	111.9	V95 Y96 F131 M135 M194 N197	V95-V147 HydrophobicContact CG1-CB 4.08Å; V95-V147 HydrophobicContact CG1-CG1 4.23Å; Y96-V147 CarbonylContact O-C 3.54Å; Y96-V147 VanDerWaalsContact O-CA 3.23Å; Y96-V147 WeakPolarHBondContact O-CA 3.29Å; F131-V147 HydrophobicContact CD2-CG2 4.27Å; F131-V147 HydrophobicContact CE2-CB 4.17Å; F131-V147 HydrophobicContact CE2-CG2 3.83Å; M135-V147 HydrophobicContact CB-CG2 4.03Å; M135-V147 HydrophobicContact CG-CG2 4.48Å; V147-M194 HydrophobicContact CG2-CG 4.36Å; V147-M194 HydrophobicContact CG2-SD 3.66Å; V147-M194 PolarHBondContact N-SD 3.15Å; V147-N197 PolarHBondContact O-ND2 3.47Å
148	Y	98.6	Very high	93.3	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	112.9	177.4	-159.7	170.2	0	0	0	109.6	Y96 F103 Q150 L191 V192 N197 K217	Y96-Y148 PolarHBondContact N-O 3.36Å; Y96-Y148 PolarHBondContact O-N 3.26Å; F103-Y148 HydrophobicContact CB-CD1 4.31Å; F103-Y148 HydrophobicContact CD1-CD1 4.37Å; F103-Y148 AromaticContact CD2-CD1 3.93Å; F103-Y148 HydrophobicContact CD2-CD1 3.93Å; F103-Y148 HydrophobicContact CE2-CD1 4.37Å; F103-Y148 AromaticContact CG-CD1 3.93Å; F103-Y148 HydrophobicContact CG-CD1 3.93Å; Y148-Q150 HydrophobicContact CD2-CG 4.17Å; Y148-Q150 HydrophobicContact CE2-CG 4.45Å; Y148-Q150 HydrophobicContact CG-CG 4.34Å; Y148-L191 HydrophobicContact CE2-CB 3.9Å; Y148-L191 HydrophobicContact CE2-CD2 4.42Å; Y148-V192 VanDerWaalsContact CD2-O 3.28Å; Y148-V192 WeakPolarHBondContact CD2-O 3.38Å; Y148-N197 HydrophobicContact CD1-CB 4.39Å; Y148-K217 PolarHBondContact OH-NZ 3.28Å
149	L	98.7	Very high	93.4	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.2	173.3	-177.7	153.7	0	0	0	109.9	F93 V95 F128 F131 Q151 L190 L191 V192	F93-L149 HydrophobicContact CB-CD1 3.8Å; F93-L149 HydrophobicContact CB-CG 4.24Å; F93-L149 HydrophobicContact CD1-CD1 3.95Å; F93-L149 HydrophobicContact CD1-CD2 4.27Å; F93-L149 HydrophobicContact CD1-CG 4.46Å; F93-L149 HydrophobicContact CG-CD1 4.02Å; V95-L149 HydrophobicContact CG2-CB 4.14Å; V95-L149 HydrophobicContact CG2-CD1 4.22Å; V95-L149 HydrophobicContact CG2-CG 4.19Å; F128-L149 HydrophobicContact CD2-CD1 3.68Å; F128-L149 HydrophobicContact CE2-CD1 3.83Å; F131-L149 HydrophobicContact CB-CD1 4.46Å; F131-L149 HydrophobicContact CD1-CB 4.26Å; F131-L149 HydrophobicContact CD1-CD1 3.68Å; F131-L149 HydrophobicContact CD2-CB 4.14Å; F131-L149 HydrophobicContact CE1-CB 3.96Å; F131-L149 HydrophobicContact CE1-CD1 4.04Å; F131-L149 HydrophobicContact CE2-CB 3.83Å; F131-L149 HydrophobicContact CG-CB 4.34Å; F131-L149 HydrophobicContact CG-CD1 3.96Å; F131-L149 HydrophobicContact CZ-CB 3.74Å; L149-Q151 HydrophobicContact CD2-CB 4.02Å; L149-L190 HydrophobicContact CD2-CD2 4.23Å; L149-L190 HydrophobicContact CD2-CG 4.23Å; L149-L191 WeakPolarHBondContact O-CA 3.26Å; L149-V192 HydrophobicContact CB-CB 4.18Å; L149-V192 HydrophobicContact CD2-CB 4.5Å; L149-V192 HydrophobicContact CD2-CG2 4.27Å; L149-V192 PolarHBondContact N-O 3.1Å; L149-V192 PolarHBondContact O-N 2.83Å
150	Q	98.2	Very high	93.8	Very high	35 Å²	35	67.4 Å²	67.4	16%	0.164	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	94.2	177.2	-57.7	179.5	21.2	0	0	108.8	S94 Y96 Y148 L189 L190 L191	S94-Q150 WeakPolarHBondContact CB-O 3.34Å; S94-Q150 PolarHBondContact O-N 2.73Å; Y96-Q150 HydrophobicContact CD2-CB 4.17Å; Y96-Q150 HydrophobicContact CD2-CG 4.15Å; Y96-Q150 HydrophobicContact CE2-CB 3.95Å; Y96-Q150 HydrophobicContact CE2-CG 4.33Å; Y148-Q150 HydrophobicContact CD2-CG 4.17Å; Y148-Q150 HydrophobicContact CE2-CG 4.45Å; Y148-Q150 HydrophobicContact CG-CG 4.34Å; Q150-L189 HydrophobicContact CB-CD1 4.39Å; Q150-L190 WeakPolarHBondContact CA-O 3.24Å; Q150-L191 HydrophobicContact CG-CD2 4.35Å
151	Q	97.8	Very high	94.1	Very high	25 Å²	25	59.7 Å²	59.7	12%	0.117	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.8	-172.4	178.1	57.6	50.3	0	0	111.2	F93 L149 L153 L190	F93-Q151 HydrophobicContact CB-CB 4.36Å; F93-Q151 HydrophobicContact CB-CG 4.42Å; F93-Q151 HydrophobicContact CD1-CB 3.68Å; F93-Q151 HydrophobicContact CD1-CG 3.54Å; F93-Q151 HydrophobicContact CE1-CB 4.48Å; F93-Q151 HydrophobicContact CE1-CG 4.09Å; F93-Q151 HydrophobicContact CG-CB 4.47Å; F93-Q151 HydrophobicContact CG-CG 4.27Å; L149-Q151 HydrophobicContact CD2-CB 4.02Å; Q151-L153 PolarHBondContact O-N 2.86Å; Q151-L190 PolarHBondContact N-O 3.03Å; Q151-L190 WeakPolarHBondContact O-CB 3.46Å; Q151-L190 PolarHBondContact O-N 2.74Å
152	T	97.6	Very high	94.4	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.344	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	125.3	169.6	-62.3	0	0	0	0	109.1	N154 N188	T152-N154 PolarHBondContact O-N 2.82Å; T152-N188 WeakPolarHBondContact CA-O 3.48Å
153	L	94.8	Very high	95.1	Very high	27 Å²	27	58.3 Å²	58.3	14%	0.141	31%	0.312	C	S	.	.			trans	-60.6	131.6	171.7	-64.2	178.5	0	0	0	109.3	Q151 V157 F165 N188 L190 V296	Q151-L153 PolarHBondContact O-N 2.86Å; L153-V157 HydrophobicContact CD2-CG1 4.17Å; L153-F165 HydrophobicContact CD1-CD2 4.5Å; L153-N188 HydrophobicContact CD1-CB 4.33Å; L153-N188 PolarHBondContact N-O 3.48Å; L153-L190 HydrophobicContact CD2-CB 3.94Å; L153-L190 HydrophobicContact CD2-CD2 4.16Å; L153-L190 HydrophobicContact CG-CB 4.23Å; L153-V296 HydrophobicContact CD1-CG2 4.45Å
154	N	92.1	Very high	95.7	Very high	62 Å²	62	56.7 Å²	56.7	33%	0.332	29%	0.293	S	S	.	.			trans	-142.5	178.9	-175.2	65.1	44.6	0	0	0	110.6	T152 T156 V157	T152-N154 PolarHBondContact O-N 2.82Å; N154-T156 PolarHBondContact O-N 3.48Å; N154-T156 VanDerWaalsContact OD1-CB 3.26Å; N154-T156 WeakPolarHBondContact OD1-CB 3.48Å; N154-T156 WeakPolarHBondContact OD1-CG2 3.33Å; N154-T156 PolarHBondContact OD1-N 2.93Å; N154-T156 PolarHBondContact OD1-OG1 2.95Å; N154-V157 WeakPolarHBondContact O-CG1 3.32Å; N154-V157 VanDerWaalsContact O-CG2 3.24Å; N154-V157 WeakPolarHBondContact O-CG2 3.31Å; N154-V157 PolarHBondContact O-N 3.24Å
155	D	88.4	Confident	96.1	Very high	169 Å²	169	53.6 Å²	53.6	90%	0.904	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-5.9	-174.5	-60.6	-23.7	0	0	0	114.7	V157	D155-V157 VanDerWaalsContact C-N 3.29Å
156	T	90.4	Very high	96.2	Very high	78 Å²	78	55.8 Å²	55.8	48%	0.479	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-7.5	176.6	72.9	0	0	0	0	113.3	N154	N154-T156 PolarHBondContact O-N 3.48Å; N154-T156 VanDerWaalsContact OD1-CB 3.26Å; N154-T156 WeakPolarHBondContact OD1-CB 3.48Å; N154-T156 WeakPolarHBondContact OD1-CG2 3.33Å; N154-T156 PolarHBondContact OD1-N 2.93Å; N154-T156 PolarHBondContact OD1-OG1 2.95Å
157	V	93.9	Very high	96.3	Very high	24 Å²	24	56 Å²	56	15%	0.145	31%	0.306	C	S	.	.	S	Bend	trans	-66.3	147.8	178.4	-64.2	0	0	0	0	112.4	I88 L153 N154 D155 I161 V162	I88-V157 VanDerWaalsContact O-CA 3.27Å; I88-V157 WeakPolarHBondContact O-CA 3.48Å; L153-V157 HydrophobicContact CD2-CG1 4.17Å; N154-V157 WeakPolarHBondContact O-CG1 3.32Å; N154-V157 VanDerWaalsContact O-CG2 3.24Å; N154-V157 WeakPolarHBondContact O-CG2 3.31Å; N154-V157 PolarHBondContact O-N 3.24Å; D155-V157 VanDerWaalsContact C-N 3.29Å; V157-I161 HydrophobicContact CB-CB 4.12Å; V157-I161 HydrophobicContact CB-CG2 3.94Å; V157-I161 HydrophobicContact CG1-CG2 4.27Å; V157-I161 HydrophobicContact CG2-CB 4.31Å; V157-I161 HydrophobicContact CG2-CG2 4.03Å; V157-V162 HydrophobicContact CG2-CG2 3.8Å
158	G	94.6	Very high	96.4	Very high	17 Å²	17	56.4 Å²	56.4	18%	0.175	31%	0.308	C	S	.	.			trans	-68	160.7	-179.7	0	0	0	0	0	114	N87 I88 K160 I161 V162	N87-G158 WeakPolarHBondContact O-CA 3.44Å; N87-G158 PolarHBondContact O-N 3.14Å; I88-G158 PolarHBondContact O-N 2.91Å; G158-K160 VanDerWaalsContact C-N 3.32Å; G158-K160 PolarHBondContact O-N 3.16Å; G158-I161 WeakPolarHBondContact O-CB 3.32Å; G158-I161 PolarHBondContact O-N 3.11Å; G158-V162 PolarHBondContact O-N 3.36Å
159	K	96.2	Very high	96.4	Very high	187 Å²	187	58.1 Å²	58.1	81%	0.813	32%	0.317	S	S	*	.	H	α-helix	trans	-55.5	-38.3	-172.5	-65.9	-179.6	-179	177.2	0	114.2	V162 V163	K159-V162 PolarHBondContact O-N 3.36Å; K159-V163 WeakPolarHBondContact O-CG2 3.39Å; K159-V163 PolarHBondContact O-N 2.8Å; K159-V163 VanDerWaalsContact O-N 3.08Å
160	K	97.4	Very high	96.4	Very high	94 Å²	94	60.3 Å²	60.3	41%	0.409	33%	0.326	S	S	.	.	H	α-helix	trans	-69.1	-34.8	179.5	-58.5	-162.3	-158.8	137.1	0	111.9	Y83 E86 N87 G158 V162 V163 D164	Y83-K160 WeakPolarHBondContact OH-CB 3.48Å; E86-K160 IonicContact OE1-NZ 3.98Å; E86-K160 PolarHBondContact OE1-NZ 2.92Å; E86-K160 IonicContact OE2-NZ 2.76Å; N87-K160 HydrophobicContact CB-CB 4.19Å; N87-K160 WeakPolarHBondContact OD1-CD 3.38Å; N87-K160 WeakPolarHBondContact OD1-CE 3.22Å; N87-K160 PolarHBondContact OD1-NZ 3.47Å; G158-K160 VanDerWaalsContact C-N 3.32Å; G158-K160 PolarHBondContact O-N 3.16Å; K160-V162 VanDerWaalsContact C-N 3.34Å; K160-V163 PolarHBondContact O-N 2.94Å; K160-D164 PolarHBondContact O-N 3.04Å
161	I	98	Very high	96.4	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-65.4	-39.7	173.9	-58.1	-55.2	0	0	0	111	W79 Y83 L84 N87 I88 V157 G158 V163 D164 F165	W79-I161 HydrophobicContact CH2-CD1 4.44Å; W79-I161 HydrophobicContact CH2-CG2 3.94Å; W79-I161 HydrophobicContact CZ2-CD1 3.77Å; W79-I161 HydrophobicContact CZ2-CG2 3.91Å; Y83-I161 HydrophobicContact CD1-CD1 4.46Å; Y83-I161 HydrophobicContact CE1-CD1 3.82Å; L84-I161 HydrophobicContact CD2-CD1 3.99Å; N87-I161 HydrophobicContact CB-CD1 4.27Å; N87-I161 HydrophobicContact CB-CG1 4.39Å; N87-I161 WeakPolarHBondContact O-CG1 3.42Å; I88-I161 HydrophobicContact CG1-CG1 4.49Å; V157-I161 HydrophobicContact CB-CB 4.12Å; V157-I161 HydrophobicContact CB-CG2 3.94Å; V157-I161 HydrophobicContact CG1-CG2 4.27Å; V157-I161 HydrophobicContact CG2-CB 4.31Å; V157-I161 HydrophobicContact CG2-CG2 4.03Å; G158-I161 WeakPolarHBondContact O-CB 3.32Å; G158-I161 PolarHBondContact O-N 3.11Å; I161-V163 VanDerWaalsContact C-N 3.34Å; I161-V163 PolarHBondContact O-N 2.98Å; I161-D164 PolarHBondContact O-N 3.48Å; I161-F165 WeakPolarHBondContact O-CB 3.13Å; I161-F165 PolarHBondContact O-N 3.24Å
162	V	97.5	Very high	96.4	Very high	63 Å²	63	63.5 Å²	63.5	38%	0.382	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-44.1	173.5	177.3	0	0	0	0	111	V157 G158 K159 K160 D164 F165 L166	V157-V162 HydrophobicContact CG2-CG2 3.8Å; G158-V162 PolarHBondContact O-N 3.36Å; K159-V162 PolarHBondContact O-N 3.36Å; K160-V162 VanDerWaalsContact C-N 3.34Å; V162-D164 VanDerWaalsContact C-N 3.34Å; V162-D164 PolarHBondContact O-N 3.47Å; V162-F165 PolarHBondContact O-N 3.15Å; V162-L166 HydrophobicContact CG1-CD1 4.13Å; V162-L166 HydrophobicContact CG1-CG 4.41Å; V162-L166 VanDerWaalsContact O-CG 3.27Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.28Å
163	V	97.9	Very high	96.5	Very high	97 Å²	97	60.9 Å²	60.9	59%	0.588	33%	0.328	S	S	*	.	H	α-helix	trans	-61	-43.9	176.4	172	0	0	0	0	111.3	K159 K160 I161 L166 G167	K159-V163 WeakPolarHBondContact O-CG2 3.39Å; K159-V163 PolarHBondContact O-N 2.8Å; K159-V163 VanDerWaalsContact O-N 3.08Å; K160-V163 PolarHBondContact O-N 2.94Å; I161-V163 VanDerWaalsContact C-N 3.34Å; I161-V163 PolarHBondContact O-N 2.98Å; V163-L166 PolarHBondContact O-N 2.76Å; V163-G167 PolarHBondContact O-N 3.1Å; V163-G167 VanDerWaalsContact O-N 3.11Å
164	D	98.4	Very high	96.6	Very high	10 Å²	10	63 Å²	63	5%	0.053	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-44.3	177.6	-71.2	-14.1	0	0	0	111.8	P75 K78 W79 Y83 K160 I161 V162 L166 G167 F168	P75-D164 HydrophobicContact CB-CB 4.03Å; K78-D164 WeakPolarHBondContact CE-OD2 3.45Å; K78-D164 IonicContact NZ-OD1 3.14Å; K78-D164 PolarHBondContact NZ-OD1 3.4Å; K78-D164 IonicContact NZ-OD2 3.7Å; K78-D164 PolarHBondContact NZ-OD2 2.81Å; W79-D164 HydrophobicContact CZ2-CB 3.95Å; W79-D164 PolarHBondContact NE1-OD2 3.28Å; Y83-D164 PolarHBondContact OH-OD2 3.37Å; K160-D164 PolarHBondContact O-N 3.04Å; I161-D164 PolarHBondContact O-N 3.48Å; V162-D164 VanDerWaalsContact C-N 3.34Å; V162-D164 PolarHBondContact O-N 3.47Å; D164-L166 PolarHBondContact O-N 2.96Å; D164-G167 WeakPolarHBondContact O-CA 3.31Å; D164-G167 PolarHBondContact O-N 3.38Å; D164-F168 WeakPolarHBondContact O-CD1 3.28Å; D164-F168 WeakPolarHBondContact O-CE1 3.48Å; D164-F168 PolarHBondContact O-N 2.87Å
165	F	98.1	Very high	96.9	Very high	60 Å²	60	67.3 Å²	67.3	26%	0.263	35%	0.351	S	S	.	.	H	α-helix	trans	-59.7	-44.5	176.1	-175.5	-94.7	0	0	0	111.8	L153 I161 V162 G167 F168 W170 N188	L153-F165 HydrophobicContact CD1-CD2 4.5Å; I161-F165 WeakPolarHBondContact O-CB 3.13Å; I161-F165 PolarHBondContact O-N 3.24Å; V162-F165 PolarHBondContact O-N 3.15Å; F165-G167 PolarHBondContact O-N 3.2Å; F165-F168 AromaticContact CD2-CD2 3.97Å; F165-F168 HydrophobicContact CD2-CD2 3.97Å; F165-F168 AromaticContact CD2-CE2 3.67Å; F165-F168 HydrophobicContact CD2-CE2 3.67Å; F165-F168 HydrophobicContact CD2-CZ 4.45Å; F165-F168 HydrophobicContact CE2-CD2 4.39Å; F165-F168 HydrophobicContact CE2-CE2 4.25Å; F165-F168 HydrophobicContact CG-CE2 4.44Å; F165-F168 WeakPolarHBondContact O-CB 3.2Å; F165-F168 WeakPolarHBondContact O-CG 3.16Å; F165-F168 PolarHBondContact O-N 3.03Å; F165-F168 VanDerWaalsContact O-N 3.17Å; F165-W170 AromaticContact CD1-CZ2 3.84Å; F165-W170 HydrophobicContact CD1-CZ2 3.84Å; F165-W170 HydrophobicContact CD2-CZ2 4.1Å; F165-W170 AromaticContact CE1-CH2 3.91Å; F165-W170 HydrophobicContact CE1-CH2 3.91Å; F165-W170 AromaticContact CE1-CZ2 3.38Å; F165-W170 HydrophobicContact CE1-CZ2 3.38Å; F165-W170 AromaticContact CE2-CH2 3.81Å; F165-W170 HydrophobicContact CE2-CH2 3.81Å; F165-W170 AromaticContact CE2-CZ2 3.67Å; F165-W170 HydrophobicContact CE2-CZ2 3.67Å; F165-W170 HydrophobicContact CG-CZ2 4.18Å; F165-W170 AromaticContact CZ-CH2 3.4Å; F165-W170 HydrophobicContact CZ-CH2 3.4Å; F165-W170 AromaticContact CZ-CZ2 3.3Å; F165-W170 HydrophobicContact CZ-CZ2 3.3Å; F165-W170 PolarHBondContact O-NE1 3.01Å; F165-N188 WeakPolarHBondContact CE2-OD1 3.46Å
166	L	97.8	Very high	97.4	Very high	122 Å²	122	59.7 Å²	59.7	64%	0.639	31%	0.31	S	S	*	.	H	α-helix	trans	-63.5	-26.5	175.6	-69.9	173.8	0	0	0	112.7	V162 V163 D164 F168	V162-L166 HydrophobicContact CG1-CD1 4.13Å; V162-L166 HydrophobicContact CG1-CG 4.41Å; V162-L166 VanDerWaalsContact O-CG 3.27Å; V162-L166 WeakPolarHBondContact O-CG 3.41Å; V162-L166 PolarHBondContact O-N 3.28Å; V163-L166 PolarHBondContact O-N 2.76Å; D164-L166 PolarHBondContact O-N 2.96Å; L166-F168 VanDerWaalsContact C-N 3.34Å
167	G	98.4	Very high	97.8	Very high	44 Å²	44	58 Å²	58	45%	0.454	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.7	177.2	0	0	0	0	0	115	P75 V163 D164 F165	P75-G167 VanDerWaalsContact CG-C 3.46Å; P75-G167 VanDerWaalsContact CG-O 3.28Å; P75-G167 WeakPolarHBondContact CG-O 3.16Å; V163-G167 PolarHBondContact O-N 3.1Å; V163-G167 VanDerWaalsContact O-N 3.11Å; D164-G167 WeakPolarHBondContact O-CA 3.31Å; D164-G167 PolarHBondContact O-N 3.38Å; F165-G167 PolarHBondContact O-N 3.2Å
168	F	98.8	Very high	98	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.035	32%	0.319	C	S	.	.	S	Bend	trans	-60	156.6	173.6	-69	-4.2	0	0	0	110.9	L72 V73 P75 A76 D164 F165 L166 W170 F298	L72-F168 CarbonylContact O-C 3.5Å; L72-F168 WeakPolarHBondContact O-CA 3.23Å; L72-F168 WeakPolarHBondContact O-CB 3.26Å; V73-F168 HydrophobicContact CB-CD1 4.41Å; V73-F168 HydrophobicContact CB-CE1 4.13Å; V73-F168 HydrophobicContact CB-CZ 4.35Å; V73-F168 HydrophobicContact CG1-CD1 4.43Å; V73-F168 HydrophobicContact CG1-CD2 4.34Å; V73-F168 HydrophobicContact CG1-CE1 4.21Å; V73-F168 HydrophobicContact CG1-CE2 4.11Å; V73-F168 HydrophobicContact CG1-CG 4.49Å; V73-F168 HydrophobicContact CG1-CZ 4.04Å; P75-F168 HydrophobicContact CG-CD1 4.37Å; A76-F168 HydrophobicContact CB-CE1 3.78Å; A76-F168 HydrophobicContact CB-CZ 4.08Å; D164-F168 WeakPolarHBondContact O-CD1 3.28Å; D164-F168 WeakPolarHBondContact O-CE1 3.48Å; D164-F168 PolarHBondContact O-N 2.87Å; F165-F168 AromaticContact CD2-CD2 3.97Å; F165-F168 HydrophobicContact CD2-CD2 3.97Å; F165-F168 AromaticContact CD2-CE2 3.67Å; F165-F168 HydrophobicContact CD2-CE2 3.67Å; F165-F168 HydrophobicContact CD2-CZ 4.45Å; F165-F168 HydrophobicContact CE2-CD2 4.39Å; F165-F168 HydrophobicContact CE2-CE2 4.25Å; F165-F168 HydrophobicContact CG-CE2 4.44Å; F165-F168 WeakPolarHBondContact O-CB 3.2Å; F165-F168 WeakPolarHBondContact O-CG 3.16Å; F165-F168 PolarHBondContact O-N 3.03Å; F165-F168 VanDerWaalsContact O-N 3.17Å; L166-F168 VanDerWaalsContact C-N 3.34Å; F168-W170 HydrophobicContact CB-CD2 4.45Å; F168-W170 HydrophobicContact CB-CZ2 4.08Å; F168-W170 HydrophobicContact CD2-CH2 4.43Å; F168-W170 AromaticContact CD2-CZ2 3.87Å; F168-W170 HydrophobicContact CD2-CZ2 3.87Å; F168-W170 HydrophobicContact CG-CZ2 4.41Å; F168-W170 PolarHBondContact O-N 3.36Å; F168-F298 HydrophobicContact CD2-CE1 4.04Å; F168-F298 AromaticContact CD2-CZ 3.66Å; F168-F298 HydrophobicContact CD2-CZ 3.66Å; F168-F298 AromaticContact CE2-CZ 3.91Å; F168-F298 HydrophobicContact CE2-CZ 3.91Å
169	N	98.7	Very high	98.2	Very high	40 Å²	40	64.1 Å²	64.1	21%	0.214	34%	0.338	C	S	.	.			trans	-76.3	63.7	179.8	-165.5	-7.3	0	0	0	111.9	T70 L72 N171 W172 I173	T70-N169 PolarHBondContact O-ND2 3.07Å; L72-N169 PolarHBondContact O-N 3.18Å; N169-N171 PolarHBondContact O-N 2.85Å; N169-W172 HydrophobicContact CB-CB 4.4Å; N169-W172 WeakPolarHBondContact ND2-CB 3.48Å; N169-W172 PolarHBondContact O-N 3.36Å; N169-W172 VanDerWaalsContact O-N 3.15Å; N169-W172 WeakPolarHBondContact OD1-CB 3.37Å; N169-W172 PolarHBondContact OD1-N 2.84Å; N169-W172 VanDerWaalsContact OD1-N 3.09Å; N169-I173 PolarHBondContact O-N 3.2Å
170	W	98.7	Very high	98.3	Very high	47 Å²	47	56.3 Å²	56.3	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-57	-34.9	177.6	-65.6	112	0	0	0	111.8	F165 F168 W172 I173 N174 L185 F298	F165-W170 AromaticContact CD1-CZ2 3.84Å; F165-W170 HydrophobicContact CD1-CZ2 3.84Å; F165-W170 HydrophobicContact CD2-CZ2 4.1Å; F165-W170 AromaticContact CE1-CH2 3.91Å; F165-W170 HydrophobicContact CE1-CH2 3.91Å; F165-W170 AromaticContact CE1-CZ2 3.38Å; F165-W170 HydrophobicContact CE1-CZ2 3.38Å; F165-W170 AromaticContact CE2-CH2 3.81Å; F165-W170 HydrophobicContact CE2-CH2 3.81Å; F165-W170 AromaticContact CE2-CZ2 3.67Å; F165-W170 HydrophobicContact CE2-CZ2 3.67Å; F165-W170 HydrophobicContact CG-CZ2 4.18Å; F165-W170 AromaticContact CZ-CH2 3.4Å; F165-W170 HydrophobicContact CZ-CH2 3.4Å; F165-W170 AromaticContact CZ-CZ2 3.3Å; F165-W170 HydrophobicContact CZ-CZ2 3.3Å; F165-W170 PolarHBondContact O-NE1 3.01Å; F168-W170 HydrophobicContact CB-CD2 4.45Å; F168-W170 HydrophobicContact CB-CZ2 4.08Å; F168-W170 HydrophobicContact CD2-CH2 4.43Å; F168-W170 AromaticContact CD2-CZ2 3.87Å; F168-W170 HydrophobicContact CD2-CZ2 3.87Å; F168-W170 HydrophobicContact CG-CZ2 4.41Å; F168-W170 PolarHBondContact O-N 3.36Å; W170-W172 VanDerWaalsContact C-N 3.34Å; W170-W172 PolarHBondContact O-N 3Å; W170-I173 HydrophobicContact CE3-CG2 3.86Å; W170-I173 HydrophobicContact CZ3-CG2 4.33Å; W170-I173 PolarHBondContact O-N 3.4Å; W170-N174 WeakPolarHBondContact O-CB 3.47Å; W170-N174 PolarHBondContact O-N 2.78Å; W170-N174 PolarHBondContact O-ND2 2.84Å; W170-N174 PolarHBondContact O-OD1 3.42Å; W170-L185 HydrophobicContact CH2-CD2 4.33Å; W170-L185 HydrophobicContact CZ3-CD2 4.07Å; W170-F298 HydrophobicContact CH2-CD1 4.34Å; W170-F298 AromaticContact CH2-CE1 3.75Å; W170-F298 HydrophobicContact CH2-CE1 3.75Å; W170-F298 HydrophobicContact CZ3-CD1 4.25Å; W170-F298 AromaticContact CZ3-CE1 3.95Å; W170-F298 HydrophobicContact CZ3-CE1 3.95Å
171	N	98.5	Very high	98.3	Very high	122 Å²	122	56.9 Å²	56.9	65%	0.652	31%	0.312	S	S	*	.	H	α-helix	trans	-60.9	-41.9	177.8	-73.2	-19.6	0	0	0	112.6	N169 R175	N169-N171 PolarHBondContact O-N 2.85Å; N171-R175 WeakPolarHBondContact O-CG 3.19Å; N171-R175 PolarHBondContact O-N 3.3Å; N171-R175 PolarHBondContact O-NE 2.89Å
172	W	98.6	Very high	98.3	Very high	5 Å²	5	57.8 Å²	57.8	2%	0.019	32%	0.315	C	S	.	.	H	α-helix	trans	-69.9	-54.3	176.2	173.3	82.2	0	0	0	111	Y50 L67 T70 L72 N169 W170 N174 R175 Q176 F209	Y50-W172 AromaticContact CD2-CD1 3.43Å; Y50-W172 VanDerWaalsContact CD2-CD1 3.43Å; Y50-W172 AromaticContact CD2-NE1 3.41Å; Y50-W172 AromaticContact CE2-CD1 3.8Å; Y50-W172 AromaticContact CG-NE1 3.83Å; L67-W172 HydrophobicContact CD1-CH2 3.66Å; L67-W172 HydrophobicContact CD1-CZ2 3.34Å; T70-W172 HydrophobicContact CG2-CH2 3.98Å; T70-W172 HydrophobicContact CG2-CZ2 3.96Å; T70-W172 HydrophobicContact CG2-CZ3 4.3Å; L72-W172 HydrophobicContact CB-CZ3 4.48Å; L72-W172 HydrophobicContact CD1-CE3 4.12Å; L72-W172 HydrophobicContact CD1-CZ3 4.17Å; L72-W172 HydrophobicContact CD2-CZ3 4.09Å; L72-W172 HydrophobicContact CG-CZ3 4.48Å; N169-W172 HydrophobicContact CB-CB 4.4Å; N169-W172 WeakPolarHBondContact ND2-CB 3.48Å; N169-W172 PolarHBondContact O-N 3.36Å; N169-W172 VanDerWaalsContact O-N 3.15Å; N169-W172 WeakPolarHBondContact OD1-CB 3.37Å; N169-W172 PolarHBondContact OD1-N 2.84Å; N169-W172 VanDerWaalsContact OD1-N 3.09Å; W170-W172 VanDerWaalsContact C-N 3.34Å; W170-W172 PolarHBondContact O-N 3Å; W172-N174 PolarHBondContact O-N 3.29Å; W172-R175 WeakPolarHBondContact O-CB 3.14Å; W172-R175 PolarHBondContact O-N 2.82Å; W172-R175 VanDerWaalsContact O-N 3.1Å; W172-Q176 HydrophobicContact CD2-CG 4.1Å; W172-Q176 HydrophobicContact CE3-CG 4.46Å; W172-Q176 HydrophobicContact CH2-CG 4.08Å; W172-Q176 HydrophobicContact CZ2-CG 3.67Å; W172-Q176 HydrophobicContact CZ3-CG 4.45Å; W172-Q176 WeakPolarHBondContact O-CG 3.22Å; W172-Q176 PolarHBondContact O-N 3.3Å; W172-F209 HydrophobicContact CH2-CD1 4.01Å; W172-F209 HydrophobicContact CH2-CD2 4.48Å; W172-F209 AromaticContact CH2-CE1 3.73Å; W172-F209 HydrophobicContact CH2-CE1 3.73Å; W172-F209 HydrophobicContact CH2-CE2 4.2Å; W172-F209 HydrophobicContact CH2-CG 4.38Å; W172-F209 AromaticContact CH2-CZ 3.83Å; W172-F209 HydrophobicContact CH2-CZ 3.83Å; W172-F209 HydrophobicContact CZ2-CE1 4.38Å; W172-F209 HydrophobicContact CZ2-CZ 4.36Å
173	I	98.6	Very high	98.4	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-69.1	-31.4	-173.2	-156.7	172.6	0	0	0	113.2	L72 N169 W170 R175 Q176 Q177 F209 F298 Y300	L72-I173 HydrophobicContact CD1-CB 3.93Å; L72-I173 HydrophobicContact CD1-CD1 3.83Å; L72-I173 HydrophobicContact CD1-CG1 4.41Å; L72-I173 HydrophobicContact CD1-CG2 4.16Å; L72-I173 HydrophobicContact CD2-CD1 4.04Å; N169-I173 PolarHBondContact O-N 3.2Å; W170-I173 HydrophobicContact CE3-CG2 3.86Å; W170-I173 HydrophobicContact CZ3-CG2 4.33Å; W170-I173 PolarHBondContact O-N 3.4Å; I173-R175 VanDerWaalsContact C-N 3.33Å; I173-R175 PolarHBondContact O-N 3.06Å; I173-Q176 WeakPolarHBondContact O-CB 3.46Å; I173-Q176 PolarHBondContact O-N 3.02Å; I173-Q177 PolarHBondContact O-N 3.4Å; I173-F209 HydrophobicContact CD1-CB 4.29Å; I173-F209 HydrophobicContact CD1-CD2 3.79Å; I173-F209 HydrophobicContact CD1-CG 4.39Å; I173-F209 HydrophobicContact CG1-CD2 3.79Å; I173-F209 HydrophobicContact CG1-CE2 4.08Å; I173-F298 HydrophobicContact CD1-CB 3.8Å; I173-F298 HydrophobicContact CD1-CD1 3.59Å; I173-F298 HydrophobicContact CD1-CD2 4.41Å; I173-F298 HydrophobicContact CD1-CE1 4.28Å; I173-F298 HydrophobicContact CD1-CG 3.69Å; I173-Y300 HydrophobicContact CD1-CE2 3.8Å; I173-Y300 WeakPolarHBondContact CD1-OH 3.35Å; I173-Y300 HydrophobicContact CG1-CE2 4.02Å; I173-Y300 WeakPolarHBondContact CG1-OH 3.47Å
174	N	98.6	Very high	98.4	Very high	73 Å²	73	54.8 Å²	54.8	39%	0.39	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-34.5	173.3	-67.2	-13.2	0	0	0	111.6	W170 W172 A178	W170-N174 WeakPolarHBondContact O-CB 3.47Å; W170-N174 PolarHBondContact O-N 2.78Å; W170-N174 PolarHBondContact O-ND2 2.84Å; W170-N174 PolarHBondContact O-OD1 3.42Å; W172-N174 PolarHBondContact O-N 3.29Å; N174-A178 WeakPolarHBondContact O-CB 3.41Å; N174-A178 PolarHBondContact O-N 2.86Å
175	R	98.4	Very high	98.4	Very high	152 Å²	152	56.9 Å²	56.9	57%	0.574	31%	0.313	S	S	*	.	H	α-helix	trans	-66.5	-40.4	171.4	-77.5	-177.1	-69.5	-163.8	4.5	111.1	N171 W172 I173 A178 T179	N171-R175 WeakPolarHBondContact O-CG 3.19Å; N171-R175 PolarHBondContact O-N 3.3Å; N171-R175 PolarHBondContact O-NE 2.89Å; W172-R175 WeakPolarHBondContact O-CB 3.14Å; W172-R175 PolarHBondContact O-N 2.82Å; W172-R175 VanDerWaalsContact O-N 3.1Å; I173-R175 VanDerWaalsContact C-N 3.33Å; I173-R175 PolarHBondContact O-N 3.06Å; R175-A178 PolarHBondContact O-N 3.43Å; R175-T179 WeakPolarHBondContact O-CB 3.33Å; R175-T179 PolarHBondContact O-N 2.85Å; R175-T179 PolarHBondContact O-OG1 2.67Å; R175-T179 VanDerWaalsContact O-OG1 3.07Å
176	Q	98.6	Very high	98.4	Very high	8 Å²	8	57 Å²	57	4%	0.037	32%	0.319	C	S	.	.	H	α-helix	trans	-56.3	-53.3	174.6	-63	-64.6	-43.6	0	0	110.8	E56 W172 I173 A178 T179 R180 F209	E56-Q176 PolarHBondContact OE1-NE2 2.94Å; W172-Q176 HydrophobicContact CD2-CG 4.1Å; W172-Q176 HydrophobicContact CE3-CG 4.46Å; W172-Q176 HydrophobicContact CH2-CG 4.08Å; W172-Q176 HydrophobicContact CZ2-CG 3.67Å; W172-Q176 HydrophobicContact CZ3-CG 4.45Å; W172-Q176 WeakPolarHBondContact O-CG 3.22Å; W172-Q176 PolarHBondContact O-N 3.3Å; I173-Q176 WeakPolarHBondContact O-CB 3.46Å; I173-Q176 PolarHBondContact O-N 3.02Å; Q176-A178 PolarHBondContact O-N 3.08Å; Q176-T179 PolarHBondContact O-N 3.25Å; Q176-R180 VanDerWaalsContact O-CD 3.29Å; Q176-R180 WeakPolarHBondContact O-CD 3.5Å; Q176-R180 PolarHBondContact O-N 3.36Å; Q176-R180 PolarHBondContact O-NH1 3.4Å; Q176-F209 HydrophobicContact CB-CE2 3.87Å; Q176-F209 HydrophobicContact CB-CZ 4.09Å; Q176-F209 HydrophobicContact CG-CE2 4.17Å; Q176-F209 HydrophobicContact CG-CZ 4.05Å
177	Q	98.6	Very high	98.4	Very high	43 Å²	43	52.3 Å²	52.3	20%	0.201	30%	0.296	C	S	.	.	H	α-helix	trans	-54.6	-49.8	177.1	-174.5	-167.4	10.3	0	0	112.1	I173 R180 N181 W182 G183 Y300	I173-Q177 PolarHBondContact O-N 3.4Å; Q177-R180 PolarHBondContact O-N 3.4Å; Q177-N181 PolarHBondContact O-N 3.15Å; Q177-W182 HydrophobicContact CG-CB 3.98Å; Q177-W182 PolarHBondContact O-N 2.9Å; Q177-G183 PolarHBondContact NE2-O 3.45Å; Q177-Y300 HydrophobicContact CB-CD1 4.2Å; Q177-Y300 HydrophobicContact CB-CE1 3.93Å; Q177-Y300 VanDerWaalsContact CD-CE1 3.48Å; Q177-Y300 HydrophobicContact CG-CD1 3.69Å; Q177-Y300 HydrophobicContact CG-CE1 3.77Å
178	A	98.3	Very high	98.4	Very high	75 Å²	75	50.7 Å²	50.7	62%	0.62	28%	0.277	S	S	*	.	H	α-helix	trans	-65.1	-47.3	-177.8	0	0	0	0	0	112.4	N174 R175 Q176 R180 N181	N174-A178 WeakPolarHBondContact O-CB 3.41Å; N174-A178 PolarHBondContact O-N 2.86Å; R175-A178 PolarHBondContact O-N 3.43Å; Q176-A178 PolarHBondContact O-N 3.08Å; A178-R180 PolarHBondContact O-N 3.32Å; A178-N181 PolarHBondContact O-N 3.15Å; A178-N181 VanDerWaalsContact O-N 3.12Å
179	T	98.1	Very high	98.3	Very high	94 Å²	94	51.2 Å²	51.2	58%	0.577	28%	0.28	S	S	*	.	H	α-helix	trans	-58.1	-35.4	179.6	-68.9	0	0	0	0	112	R175 Q176	R175-T179 WeakPolarHBondContact O-CB 3.33Å; R175-T179 PolarHBondContact O-N 2.85Å; R175-T179 PolarHBondContact O-OG1 2.67Å; R175-T179 VanDerWaalsContact O-OG1 3.07Å; Q176-T179 PolarHBondContact O-N 3.25Å
180	R	97.9	Very high	98.4	Very high	24 Å²	24	49.3 Å²	49.3	9%	0.091	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	3.1	-177	-64.8	146.7	-177.8	80.7	2.3	113.3	E56 N60 Q176 Q177 A178 W182	E56-R180 VanDerWaalsContact CD-NH2 3.31Å; E56-R180 IonicContact OE1-NH2 3.19Å; E56-R180 IonicContact OE2-CZ 3.83Å; E56-R180 IonicContact OE2-NH1 3.54Å; E56-R180 PolarHBondContact OE2-NH1 3.29Å; E56-R180 IonicContact OE2-NH2 3.81Å; E56-R180 PolarHBondContact OE2-NH2 3.08Å; N60-R180 PolarHBondContact OD1-NH2 3.08Å; Q176-R180 VanDerWaalsContact O-CD 3.29Å; Q176-R180 WeakPolarHBondContact O-CD 3.5Å; Q176-R180 PolarHBondContact O-N 3.36Å; Q176-R180 PolarHBondContact O-NH1 3.4Å; Q177-R180 PolarHBondContact O-N 3.4Å; A178-R180 PolarHBondContact O-N 3.32Å; R180-W182 HydrophobicContact CB-CD2 4.04Å; R180-W182 HydrophobicContact CB-CG 4.05Å; R180-W182 HydrophobicContact CB-CZ2 4.24Å; R180-W182 HydrophobicContact CG-CZ2 4.35Å; R180-W182 PolarHBondContact O-N 2.92Å
181	N	97.7	Very high	98.4	Very high	106 Å²	106	47.7 Å²	47.7	57%	0.567	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	39.8	-178	-171.2	47.8	0	0	0	112.4	Q177 A178 A303	Q177-N181 PolarHBondContact O-N 3.15Å; A178-N181 PolarHBondContact O-N 3.15Å; A178-N181 VanDerWaalsContact O-N 3.12Å; N181-A303 WeakPolarHBondContact O-CA 3.45Å
182	W	98.6	Very high	98.4	Very high	21 Å²	21	41.9 Å²	41.9	8%	0.08	23%	0.233	C	C	.	.			trans	-71.3	152	175.4	-67.8	-13.3	0	0	0	110.5	I59 Q177 R180 Q207 F209 Y275 Y300	I59-W182 HydrophobicContact CG2-CH2 4.24Å; I59-W182 HydrophobicContact CG2-CZ2 4.32Å; Q177-W182 HydrophobicContact CG-CB 3.98Å; Q177-W182 PolarHBondContact O-N 2.9Å; R180-W182 HydrophobicContact CB-CD2 4.04Å; R180-W182 HydrophobicContact CB-CG 4.05Å; R180-W182 HydrophobicContact CB-CZ2 4.24Å; R180-W182 HydrophobicContact CG-CZ2 4.35Å; R180-W182 PolarHBondContact O-N 2.92Å; W182-Q207 HydrophobicContact CD2-CB 4.13Å; W182-Q207 HydrophobicContact CD2-CG 3.93Å; W182-Q207 HydrophobicContact CE3-CB 4.18Å; W182-Q207 HydrophobicContact CE3-CG 4.49Å; W182-Q207 HydrophobicContact CG-CG 4.27Å; W182-Q207 HydrophobicContact CH2-CB 4.13Å; W182-Q207 HydrophobicContact CH2-CG 4.48Å; W182-Q207 HydrophobicContact CZ2-CB 4.06Å; W182-Q207 HydrophobicContact CZ2-CG 3.91Å; W182-Q207 HydrophobicContact CZ3-CB 4.17Å; W182-F209 AromaticContact CH2-CE2 3.8Å; W182-F209 HydrophobicContact CH2-CE2 3.8Å; W182-F209 AromaticContact CH2-CZ 3.99Å; W182-F209 HydrophobicContact CH2-CZ 3.99Å; W182-F209 HydrophobicContact CZ3-CD2 4.14Å; W182-F209 AromaticContact CZ3-CE2 3.5Å; W182-F209 HydrophobicContact CZ3-CE2 3.5Å; W182-F209 HydrophobicContact CZ3-CZ 4.16Å; W182-Y275 HydrophobicContact CH2-CD2 4.33Å; W182-Y275 AromaticContact CH2-CE2 3.65Å; W182-Y275 HydrophobicContact CH2-CE2 3.65Å; W182-Y275 AromaticContact CZ2-CE2 3.9Å; W182-Y275 HydrophobicContact CZ2-CE2 3.9Å; W182-Y300 HydrophobicContact CE3-CD2 4.25Å; W182-Y300 HydrophobicContact CE3-CG 4.06Å; W182-Y300 HydrophobicContact CZ3-CD2 4.4Å
183	G	98.4	Very high	98.4	Very high	19 Å²	19	41.6 Å²	41.6	20%	0.196	23%	0.233	C	C	.	.			trans	-68.6	-174.9	172.2	0	0	0	0	0	112.4	Q177 K301	Q177-G183 PolarHBondContact NE2-O 3.45Å; G183-K301 PolarHBondContact N-O 3.28Å
184	P	98.1	Very high	98.3	Very high	77 Å²	77	42 Å²	42	50%	0.5	23%	0.234	S	C	.	.			trans	-62.2	150.5	-175.8	26.8	-35.7	0	0	0	112.4	T186 K301	P184-T186 PolarHBondContact O-N 2.98Å; P184-K301 HydrophobicContact CG-CD 4.28Å; P184-K301 PolarHBondContact O-N 3.15Å
185	L	98.4	Very high	98.3	Very high	55 Å²	55	41.1 Å²	41.1	29%	0.288	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	126	160.8	179.9	71.1	0	0	0	107.9	W170 F298 W299 Y300	W170-L185 HydrophobicContact CH2-CD2 4.33Å; W170-L185 HydrophobicContact CZ3-CD2 4.07Å; L185-F298 HydrophobicContact CD1-CB 4.07Å; L185-F298 HydrophobicContact CD1-CD1 4.46Å; L185-W299 CarbonylContact C-O 3.6Å; L185-W299 WeakPolarHBondContact CA-O 3.4Å; L185-W299 WeakPolarHBondContact CD1-O 3.32Å; L185-Y300 HydrophobicContact CB-CD1 3.99Å; L185-Y300 HydrophobicContact CB-CE1 3.64Å; L185-Y300 HydrophobicContact CD1-CD1 4.46Å; L185-Y300 HydrophobicContact CD1-CD2 4.15Å; L185-Y300 HydrophobicContact CD1-CE1 4.11Å; L185-Y300 HydrophobicContact CD1-CE2 3.75Å; L185-Y300 HydrophobicContact CD1-CG 4.49Å; L185-Y300 HydrophobicContact CG-CE1 4.43Å
186	T	98.1	Very high	98.2	Very high	63 Å²	63	34 Å²	34	39%	0.387	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-38.1	-177.8	59.1	0	0	0	0	112.5	P184 Q206 W299 K301	P184-T186 PolarHBondContact O-N 2.98Å; T186-Q206 VanDerWaalsContact OG1-CD 3.27Å; T186-Q206 PolarHBondContact OG1-NE2 2.85Å; T186-Q206 PolarHBondContact OG1-OE1 2.94Å; T186-W299 PolarHBondContact N-O 3.02Å; T186-W299 PolarHBondContact OG1-O 3.5Å; T186-K301 HydrophobicContact CG2-CD 4.36Å; T186-K301 HydrophobicContact CG2-CG 3.78Å
187	S	97.3	Very high	98.2	Very high	23 Å²	23	33.6 Å²	33.6	16%	0.161	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	160.8	179.4	54	0	0	0	0	112.7	W299	S187-W299 PolarHBondContact O-N 2.76Å
188	N	98.6	Very high	98.3	Very high	9 Å²	9	31.7 Å²	31.7	5%	0.048	19%	0.191	C	C	.	.			trans	-115.7	109.2	163.8	-65.2	112.1	0	0	0	108.8	T152 L153 F165 V296 N297 F298	T152-N188 WeakPolarHBondContact CA-O 3.48Å; L153-N188 HydrophobicContact CD1-CB 4.33Å; L153-N188 PolarHBondContact N-O 3.48Å; F165-N188 WeakPolarHBondContact CE2-OD1 3.46Å; N188-V296 HydrophobicContact CB-CG1 4.05Å; N188-N297 VanDerWaalsContact CA-O 3.28Å; N188-N297 WeakPolarHBondContact CA-O 3.29Å; N188-N297 PolarHBondContact ND2-O 2.66Å; N188-F298 WeakPolarHBondContact ND2-CD1 3.41Å; N188-F298 VanDerWaalsContact ND2-CE1 3.35Å; N188-F298 WeakPolarHBondContact ND2-CE1 3.41Å; N188-F298 VanDerWaalsContact ND2-CG 3.3Å; N188-F298 WeakPolarHBondContact ND2-CG 3.41Å
189	L	98.5	Very high	98.3	Very high	19 Å²	19	29.1 Å²	29.1	10%	0.099	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.5	176.7	-170.2	69.6	0	0	0	109.2	Q150 L191 V296 N297 W299	Q150-L189 HydrophobicContact CB-CD1 4.39Å; L189-L191 HydrophobicContact CB-CD1 4.27Å; L189-L191 HydrophobicContact CD2-CD1 4.07Å; L189-L191 HydrophobicContact CD2-CD2 4.01Å; L189-L191 HydrophobicContact CD2-CG 3.97Å; L189-L191 HydrophobicContact CG-CD1 4.09Å; L189-L191 HydrophobicContact CG-CG 4.09Å; L189-L191 WeakPolarHBondContact O-CD1 3.41Å; L189-V296 WeakPolarHBondContact O-CA 3.47Å; L189-N297 WeakPolarHBondContact CA-OD1 3.47Å; L189-N297 WeakPolarHBondContact CB-ND2 3.45Å; L189-N297 WeakPolarHBondContact CB-OD1 3.32Å; L189-N297 PolarHBondContact N-OD1 3.07Å; L189-N297 PolarHBondContact O-N 2.78Å; L189-W299 HydrophobicContact CB-CE3 4.35Å; L189-W299 HydrophobicContact CB-CH2 4.31Å; L189-W299 HydrophobicContact CB-CZ3 3.72Å; L189-W299 HydrophobicContact CD2-CH2 3.62Å; L189-W299 HydrophobicContact CD2-CZ3 3.82Å; L189-W299 HydrophobicContact CG-CZ3 4.27Å
190	L	98.8	Very high	98.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	124.7	165.8	174.9	65	0	0	0	108.8	W79 I88 L149 Q150 Q151 L153 V192 I294 V296	W79-L190 HydrophobicContact CZ3-CD1 4.31Å; I88-L190 HydrophobicContact CD1-CD2 3.67Å; L149-L190 HydrophobicContact CD2-CD2 4.23Å; L149-L190 HydrophobicContact CD2-CG 4.23Å; Q150-L190 WeakPolarHBondContact CA-O 3.24Å; Q151-L190 PolarHBondContact N-O 3.03Å; Q151-L190 WeakPolarHBondContact O-CB 3.46Å; Q151-L190 PolarHBondContact O-N 2.74Å; L153-L190 HydrophobicContact CD2-CB 3.94Å; L153-L190 HydrophobicContact CD2-CD2 4.16Å; L153-L190 HydrophobicContact CG-CB 4.23Å; L190-V192 HydrophobicContact CD1-CG2 4.11Å; L190-V192 HydrophobicContact CD2-CG2 4.35Å; L190-V192 HydrophobicContact CG-CG2 4.08Å; L190-I294 HydrophobicContact CD1-CG2 3.9Å; L190-V296 HydrophobicContact CD1-CG2 3.91Å
191	L	98.9	Very high	98.4	Very high	13 Å²	13	24.5 Å²	24.5	7%	0.068	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.9	175.7	-57.2	102.3	0	0	0	109.3	Y148 L149 Q150 L189 I294 T295	Y148-L191 HydrophobicContact CE2-CB 3.9Å; Y148-L191 HydrophobicContact CE2-CD2 4.42Å; L149-L191 WeakPolarHBondContact O-CA 3.26Å; Q150-L191 HydrophobicContact CG-CD2 4.35Å; L189-L191 HydrophobicContact CB-CD1 4.27Å; L189-L191 HydrophobicContact CD2-CD1 4.07Å; L189-L191 HydrophobicContact CD2-CD2 4.01Å; L189-L191 HydrophobicContact CD2-CG 3.97Å; L189-L191 HydrophobicContact CG-CD1 4.09Å; L189-L191 HydrophobicContact CG-CG 4.09Å; L189-L191 WeakPolarHBondContact O-CD1 3.41Å; L191-I294 WeakPolarHBondContact O-CA 3.15Å; L191-T295 PolarHBondContact N-O 3.22Å; L191-T295 PolarHBondContact O-N 2.99Å
192	V	98.8	Very high	98.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	107.2	172.9	-173.6	0	0	0	0	108.9	I81 F131 Y148 L149 L190 V292 T293 I294	I81-V192 HydrophobicContact CD1-CG1 4Å; F131-V192 HydrophobicContact CE1-CB 4.06Å; F131-V192 HydrophobicContact CE1-CG1 3.8Å; F131-V192 HydrophobicContact CZ-CB 4.18Å; F131-V192 HydrophobicContact CZ-CG1 4.01Å; Y148-V192 VanDerWaalsContact CD2-O 3.28Å; Y148-V192 WeakPolarHBondContact CD2-O 3.38Å; L149-V192 HydrophobicContact CB-CB 4.18Å; L149-V192 HydrophobicContact CD2-CB 4.5Å; L149-V192 HydrophobicContact CD2-CG2 4.27Å; L149-V192 PolarHBondContact N-O 3.1Å; L149-V192 PolarHBondContact O-N 2.83Å; L190-V192 HydrophobicContact CD1-CG2 4.11Å; L190-V192 HydrophobicContact CD2-CG2 4.35Å; L190-V192 HydrophobicContact CG-CG2 4.08Å; V192-V292 HydrophobicContact CG1-CG1 3.75Å; V192-T293 WeakPolarHBondContact CA-O 3.38Å; V192-I294 HydrophobicContact CG1-CG1 4.24Å; V192-I294 HydrophobicContact CG2-CG1 4.28Å; V192-I294 HydrophobicContact CG2-CG2 4.39Å
193	G	98.4	Very high	98.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144	-172.4	0	0	0	0	0	112.8	V292 T293	G193-V292 WeakPolarHBondContact O-CA 3.39Å; G193-T293 PolarHBondContact N-O 3.37Å; G193-T293 PolarHBondContact O-N 3.41Å; G193-T293 PolarHBondContact O-OG1 3.17Å
194	M	98.3	Very high	98.4	Very high	7 Å²	7	20 Å²	20	3%	0.034	11%	0.114	C	C	.	.			trans	-62.4	159.3	165.7	-64.9	173.5	77.3	0	0	110.5	M135 R138 E139 R146 V147 N197 S286	M135-M194 HydrophobicContact CG-CE 4.44Å; M135-M194 HydrophobicContact CG-CG 3.66Å; M135-M194 HydrophobicContact CG-SD 4.18Å; M135-M194 HydrophobicContact SD-CG 4.24Å; R138-M194 HydrophobicContact CB-CE 3.93Å; E139-M194 HydrophobicContact CG-CE 3.85Å; R146-M194 HydrophobicContact CB-SD 4.07Å; V147-M194 HydrophobicContact CG2-CG 4.36Å; V147-M194 HydrophobicContact CG2-SD 3.66Å; V147-M194 PolarHBondContact N-SD 3.15Å; M194-N197 PolarHBondContact N-ND2 3Å; M194-N197 WeakPolarHBondContact O-CB 3.38Å; M194-N197 PolarHBondContact O-N 3.41Å; M194-S286 VanDerWaalsContact O-CB 3.3Å; M194-S286 WeakPolarHBondContact O-CB 3.45Å; M194-S286 PolarHBondContact O-OG 3.09Å
195	E	97.3	Very high	98.5	Very high	56 Å²	56	19.2 Å²	19.2	26%	0.262	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	149.5	169.4	57.4	174.7	-136.9	0	0	111.6	R146 N197 N289 G290 G291	R146-E195 PolarHBondContact NH1-O 3.46Å; E195-N197 PolarHBondContact O-N 2.85Å; E195-N289 WeakPolarHBondContact OE2-CA 3.46Å; E195-G290 PolarHBondContact OE2-N 2.95Å; E195-G291 PolarHBondContact OE2-N 3.26Å
196	G	97.6	Very high	98.5	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.01	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	-4.8	-178.9	0	0	0	0	0	116.2	R36 S286 L287	R36-G196 PolarHBondContact NH2-O 3.2Å; G196-S286 WeakPolarHBondContact CA-O 3.37Å; G196-S286 PolarHBondContact N-O 2.8Å; G196-S286 VanDerWaalsContact N-O 3.08Å; G196-L287 PolarHBondContact N-O 3.36Å
197	N	98.6	Very high	98.5	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	8%	0.082	C	C	.	.			trans	-57.6	139.3	173.9	-81.4	7	0	0	0	110.8	F103 R146 V147 Y148 M194 E195 E285 S286	F103-N197 HydrophobicContact CD2-CB 4.38Å; F103-N197 HydrophobicContact CE2-CB 4.07Å; F103-N197 VanDerWaalsContact CE2-CG 3.43Å; F103-N197 WeakPolarHBondContact CE2-OD1 3.45Å; R146-N197 WeakPolarHBondContact CB-OD1 3.47Å; R146-N197 WeakPolarHBondContact CD-OD1 3.42Å; V147-N197 PolarHBondContact O-ND2 3.47Å; Y148-N197 HydrophobicContact CD1-CB 4.39Å; M194-N197 PolarHBondContact N-ND2 3Å; M194-N197 WeakPolarHBondContact O-CB 3.38Å; M194-N197 PolarHBondContact O-N 3.41Å; E195-N197 PolarHBondContact O-N 2.85Å; N197-E285 CarbonylContact O-C 3.57Å; N197-E285 VanDerWaalsContact O-CA 3.27Å; N197-E285 WeakPolarHBondContact O-CA 3.49Å; N197-S286 PolarHBondContact O-N 3.05Å
198	V	98.8	Very high	98.6	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.012	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.6	177.5	170	0	0	0	0	109.6	H101 K102 F103 P200 H283 I284 E285	H101-V198 VanDerWaalsContact CD2-CG2 3.46Å; H101-V198 WeakPolarHBondContact CD2-CG2 3.26Å; H101-V198 PolarHBondContact O-N 3.25Å; K102-V198 HydrophobicContact CG-CB 4.47Å; K102-V198 HydrophobicContact CG-CG1 4.44Å; F103-V198 PolarHBondContact N-O 2.76Å; V198-P200 WeakPolarHBondContact O-CD 3.32Å; V198-H283 WeakPolarHBondContact CG1-CE1 3.08Å; V198-I284 CarbonylContact C-O 3.53Å; V198-I284 WeakPolarHBondContact CA-O 3.36Å; V198-E285 HydrophobicContact CG2-CB 3.79Å
199	T	98.8	Very high	98.6	Very high	21 Å²	21	14.4 Å²	14.4	13%	0.129	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	109.8	159.3	-59.2	0	0	0	0	107.5	H202 I284	T199-H202 WeakPolarHBondContact CG2-CE1 3.13Å; T199-I284 PolarHBondContact N-O 3.09Å; T199-I284 PolarHBondContact O-N 3.2Å; T199-I284 VanDerWaalsContact O-N 3.1Å
200	P	98.8	Very high	98.6	Very high	20 Å²	20	13.8 Å²	13.8	13%	0.13	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	160.1	-177.7	-25.9	36.1	0	0	0	113.5	K102 F103 L104 V198 H202	K102-P200 HydrophobicContact CB-CG 4.21Å; F103-P200 VanDerWaalsContact O-CD 3.32Å; F103-P200 WeakPolarHBondContact O-CD 3.47Å; L104-P200 HydrophobicContact CD1-CB 4.28Å; L104-P200 HydrophobicContact CD1-CG 4.2Å; V198-P200 WeakPolarHBondContact O-CD 3.32Å; P200-H202 PolarHBondContact O-N 3.49Å; P200-H202 PolarHBondContact O-ND1 3.07Å
201	A	98.9	Very high	98.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.008	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	123	-178.3	0	0	0	0	0	112.6	S243 F247 H282 H283	A201-S243 PolarHBondContact O-N 2.79Å; A201-F247 HydrophobicContact CB-CE1 3.99Å; A201-F247 HydrophobicContact CB-CE2 3.92Å; A201-F247 HydrophobicContact CB-CZ 3.45Å; A201-F247 VanDerWaalsContact CB-CZ 3.45Å; A201-H282 WeakPolarHBondContact CA-O 3.36Å; A201-H283 HydrophobicContact CB-CB 4.17Å
202	H	98.9	Very high	98.6	Very high	31 Å²	31	13.2 Å²	13.2	14%	0.144	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	166	177.2	66.8	-70.3	0	0	0	110.8	T199 P200 R241 Q242 W281 H282	T199-H202 WeakPolarHBondContact CG2-CE1 3.13Å; P200-H202 PolarHBondContact O-N 3.49Å; P200-H202 PolarHBondContact O-ND1 3.07Å; H202-R241 VanDerWaalsContact CA-O 3.23Å; H202-R241 WeakPolarHBondContact CA-O 3.37Å; H202-R241 WeakPolarHBondContact CB-O 3.14Å; H202-Q242 HydrophobicContact CB-CB 4.32Å; H202-Q242 HydrophobicContact CB-CG 3.67Å; H202-W281 CarbonylContact O-C 3.56Å; H202-W281 WeakPolarHBondContact O-CA 3.29Å; H202-H282 AromaticContact CD2-NE2 3.79Å; H202-H282 AromaticContact CE1-CD2 3.46Å; H202-H282 PolarHBondContact CE1-CD2 2.97Å; H202-H282 VanDerWaalsContact CE1-CD2 3.46Å; H202-H282 AromaticContact CE1-NE2 3.27Å; H202-H282 PolarHBondContact CE1-NE2 3.12Å; H202-H282 VanDerWaalsContact CE1-NE2 3.27Å; H202-H282 PolarHBondContact N-O 3.03Å; H202-H282 PolarHBondContact ND1-O 3.48Å; H202-H282 AromaticContact NE2-CD2 3.82Å; H202-H282 AromaticContact NE2-CE1 3.82Å; H202-H282 AromaticContact NE2-NE2 3.12Å; H202-H282 PolarHBondContact NE2-NE2 3.18Å; H202-H282 VanDerWaalsContact NE2-NE2 3.12Å; H202-H282 PolarHBondContact O-N 3.29Å; H202-H282 PolarHBondContact O-ND1 2.81Å
203	Y	98.9	Very high	98.6	Very high	3 Å²	3	13.3 Å²	13.3	1%	0.012	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151.7	171.7	66.2	-91.7	0	0	0	112	F227 R241 Y279 W281 V319 R323	Y203-F227 HydrophobicContact CE1-CE2 4.37Å; Y203-R241 HydrophobicContact CD1-CB 4.21Å; Y203-R241 WeakPolarHBondContact CD1-O 3.2Å; Y203-R241 HydrophobicContact CD2-CB 4.3Å; Y203-R241 HydrophobicContact CD2-CG 4.37Å; Y203-R241 HydrophobicContact CE1-CB 3.91Å; Y203-R241 HydrophobicContact CE1-CG 4.34Å; Y203-R241 HydrophobicContact CE2-CB 4Å; Y203-R241 HydrophobicContact CE2-CG 3.72Å; Y203-R241 HydrophobicContact CG-CB 4.41Å; Y203-R241 PolarHBondContact N-O 3.16Å; Y203-R241 WeakPolarHBondContact O-CB 3.29Å; Y203-Y279 AromaticContact CD2-CD1 3.79Å; Y203-Y279 HydrophobicContact CD2-CD1 3.79Å; Y203-Y279 HydrophobicContact CD2-CE1 4.44Å; Y203-Y279 AromaticContact CE2-CD1 3.93Å; Y203-Y279 HydrophobicContact CE2-CD1 3.93Å; Y203-Y279 HydrophobicContact CE2-CE1 4.24Å; Y203-W281 AromaticContact CD1-CD2 3.86Å; Y203-W281 HydrophobicContact CD1-CD2 3.86Å; Y203-W281 AromaticContact CD1-CE2 3.67Å; Y203-W281 AromaticContact CD1-CE3 3.92Å; Y203-W281 HydrophobicContact CD1-CE3 3.92Å; Y203-W281 AromaticContact CD1-CH2 3.62Å; Y203-W281 HydrophobicContact CD1-CH2 3.62Å; Y203-W281 AromaticContact CD1-CZ2 3.56Å; Y203-W281 HydrophobicContact CD1-CZ2 3.56Å; Y203-W281 AromaticContact CD1-CZ3 3.79Å; Y203-W281 HydrophobicContact CD1-CZ3 3.79Å; Y203-W281 AromaticContact CE1-CH2 3.7Å; Y203-W281 HydrophobicContact CE1-CH2 3.7Å; Y203-W281 AromaticContact CE1-CZ2 3.72Å; Y203-W281 HydrophobicContact CE1-CZ2 3.72Å; Y203-W281 HydrophobicContact CE1-CZ3 4.24Å; Y203-V319 HydrophobicContact CE2-CG1 4.36Å; Y203-R323 WeakPolarHBondContact OH-CD 3.49Å; Y203-R323 PolarHBondContact OH-NH1 2.88Å
204	D	98.7	Very high	98.6	Very high	17 Å²	17	17 Å²	17	9%	0.091	8%	0.083	C	C	.	.			trans	-104.1	151.1	175.6	-77.7	-37.7	0	0	0	112	Q206 Y279 H282 W299	D204-Q206 VanDerWaalsContact C-N 3.25Å; D204-Q206 PolarHBondContact O-N 3.09Å; D204-Y279 PolarHBondContact O-N 3.14Å; D204-H282 IonicContact OD2-CE1 2.65Å; D204-H282 IonicContact OD2-NE2 3.47Å; D204-W299 PolarHBondContact OD2-NE1 2.91Å
205	E	98.4	Very high	98.6	Very high	62 Å²	62	17.3 Å²	17.3	29%	0.29	9%	0.087	S	C	.	.	S	Bend	trans	-95	28	173.5	-59.4	-169.9	103.7	0	0	111.5	Y279 R323	E205-Y279 HydrophobicContact CG-CE1 3.98Å; E205-R323 VanDerWaalsContact CD-NE 3.31Å; E205-R323 IonicContact OE1-CZ 3.54Å; E205-R323 IonicContact OE1-NE 3.93Å; E205-R323 PolarHBondContact OE1-NE 3.13Å; E205-R323 IonicContact OE1-NH2 2.87Å; E205-R323 IonicContact OE2-CZ 3.4Å; E205-R323 IonicContact OE2-NE 3.45Å; E205-R323 IonicContact OE2-NH2 2.77Å; E205-R323 PolarHBondContact OE2-NH2 3.01Å
206	Q	98.7	Very high	98.7	Very high	46 Å²	46	15.9 Å²	15.9	22%	0.215	8%	0.081	C	C	.	.	S	Bend	trans	-140.1	153	175.8	-68.2	-163.2	80.6	0	0	109.9	T186 D204 W299 Y300	T186-Q206 VanDerWaalsContact OG1-CD 3.27Å; T186-Q206 PolarHBondContact OG1-NE2 2.85Å; T186-Q206 PolarHBondContact OG1-OE1 2.94Å; D204-Q206 VanDerWaalsContact C-N 3.25Å; D204-Q206 PolarHBondContact O-N 3.09Å; Q206-W299 HydrophobicContact CB-CB 4.24Å; Q206-W299 HydrophobicContact CB-CG 4.23Å; Q206-Y300 CarbonylContact C-O 3.56Å; Q206-Y300 WeakPolarHBondContact CA-O 3.27Å; Q206-Y300 VanDerWaalsContact CB-O 3.32Å; Q206-Y300 WeakPolarHBondContact CB-O 3.47Å
207	Q	98.8	Very high	98.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	142.8	168.2	-59	-72.2	3.2	0	0	108.5	E62 W182 Y275 M278 W299 Y300	E62-Q207 PolarHBondContact OE1-NE2 3.38Å; W182-Q207 HydrophobicContact CD2-CB 4.13Å; W182-Q207 HydrophobicContact CD2-CG 3.93Å; W182-Q207 HydrophobicContact CE3-CB 4.18Å; W182-Q207 HydrophobicContact CE3-CG 4.49Å; W182-Q207 HydrophobicContact CG-CG 4.27Å; W182-Q207 HydrophobicContact CH2-CB 4.13Å; W182-Q207 HydrophobicContact CH2-CG 4.48Å; W182-Q207 HydrophobicContact CZ2-CB 4.06Å; W182-Q207 HydrophobicContact CZ2-CG 3.91Å; W182-Q207 HydrophobicContact CZ3-CB 4.17Å; Q207-Y275 PolarHBondContact OE1-OH 2.97Å; Q207-M278 HydrophobicContact CG-CB 4.16Å; Q207-W299 WeakPolarHBondContact O-CA 3.5Å; Q207-Y300 PolarHBondContact N-O 3.19Å; Q207-Y300 PolarHBondContact O-N 2.82Å
208	N	98.9	Very high	98.8	Very high	3 Å²	3	16.8 Å²	16.8	2%	0.016	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	122.8	-174.1	-177.5	3.3	0	0	0	111.8	I276 N297 F298	N208-I276 HydrophobicContact CB-CB 4.17Å; N208-I276 PolarHBondContact N-O 3.03Å; N208-I276 VanDerWaalsContact N-O 3.13Å; N208-I276 PolarHBondContact O-N 3.49Å; N208-N297 WeakPolarHBondContact OD1-CB 3.26Å; N208-F298 WeakPolarHBondContact CA-O 3.42Å
209	F	98.9	Very high	98.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	113.1	159.5	-74.3	-64.8	0	0	0	109.2	I59 L67 L72 W172 I173 Q176 W182 V273 Y275 N297 F298	I59-F209 HydrophobicContact CD1-CE1 4.35Å; I59-F209 HydrophobicContact CD1-CZ 4.46Å; I59-F209 HydrophobicContact CG2-CZ 4.44Å; L67-F209 HydrophobicContact CD1-CE1 4.39Å; L72-F209 HydrophobicContact CD2-CB 4.4Å; W172-F209 HydrophobicContact CH2-CD1 4.01Å; W172-F209 HydrophobicContact CH2-CD2 4.48Å; W172-F209 AromaticContact CH2-CE1 3.73Å; W172-F209 HydrophobicContact CH2-CE1 3.73Å; W172-F209 HydrophobicContact CH2-CE2 4.2Å; W172-F209 HydrophobicContact CH2-CG 4.38Å; W172-F209 AromaticContact CH2-CZ 3.83Å; W172-F209 HydrophobicContact CH2-CZ 3.83Å; W172-F209 HydrophobicContact CZ2-CE1 4.38Å; W172-F209 HydrophobicContact CZ2-CZ 4.36Å; I173-F209 HydrophobicContact CD1-CB 4.29Å; I173-F209 HydrophobicContact CD1-CD2 3.79Å; I173-F209 HydrophobicContact CD1-CG 4.39Å; I173-F209 HydrophobicContact CG1-CD2 3.79Å; I173-F209 HydrophobicContact CG1-CE2 4.08Å; Q176-F209 HydrophobicContact CB-CE2 3.87Å; Q176-F209 HydrophobicContact CB-CZ 4.09Å; Q176-F209 HydrophobicContact CG-CE2 4.17Å; Q176-F209 HydrophobicContact CG-CZ 4.05Å; W182-F209 AromaticContact CH2-CE2 3.8Å; W182-F209 HydrophobicContact CH2-CE2 3.8Å; W182-F209 AromaticContact CH2-CZ 3.99Å; W182-F209 HydrophobicContact CH2-CZ 3.99Å; W182-F209 HydrophobicContact CZ3-CD2 4.14Å; W182-F209 AromaticContact CZ3-CE2 3.5Å; W182-F209 HydrophobicContact CZ3-CE2 3.5Å; W182-F209 HydrophobicContact CZ3-CZ 4.16Å; F209-V273 HydrophobicContact CB-CG1 3.92Å; F209-V273 HydrophobicContact CD1-CG1 3.84Å; F209-V273 HydrophobicContact CG-CG1 4.27Å; F209-Y275 HydrophobicContact CD1-CD2 4.09Å; F209-Y275 HydrophobicContact CD1-CG 4.45Å; F209-Y275 AromaticContact CE1-CD2 3.86Å; F209-Y275 HydrophobicContact CE1-CD2 3.86Å; F209-Y275 HydrophobicContact CE1-CG 4.05Å; F209-Y275 HydrophobicContact CZ-CD2 4.32Å; F209-N297 CarbonylContact O-C 3.55Å; F209-N297 WeakPolarHBondContact O-CA 3.28Å; F209-F298 HydrophobicContact CB-CB 4.28Å; F209-F298 PolarHBondContact N-O 2.79Å; F209-F298 PolarHBondContact O-N 3.17Å
210	F	98.9	Very high	98.8	Very high	6 Å²	6	15.7 Å²	15.7	3%	0.026	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	101.5	-176.3	-173	-88.6	0	0	0	109.7	K217 V268 V273 L274 I276 I284 T295 N297	F210-K217 HydrophobicContact CE1-CD 4.12Å; F210-K217 HydrophobicContact CZ-CD 3.8Å; F210-V268 HydrophobicContact CD1-CG2 4.39Å; F210-V268 HydrophobicContact CE1-CG2 4.16Å; F210-V273 WeakPolarHBondContact O-CA 3.26Å; F210-L274 HydrophobicContact CB-CB 4.3Å; F210-L274 WeakPolarHBondContact CB-O 3.36Å; F210-L274 PolarHBondContact N-O 2.58Å; F210-L274 PolarHBondContact O-N 3.42Å; F210-I276 HydrophobicContact CB-CD1 3.92Å; F210-I276 HydrophobicContact CB-CG1 4.32Å; F210-I276 HydrophobicContact CD2-CD1 4.18Å; F210-I276 HydrophobicContact CG-CD1 4.19Å; F210-I284 HydrophobicContact CD2-CD1 4.34Å; F210-I284 HydrophobicContact CE2-CD1 3.74Å; F210-I284 HydrophobicContact CZ-CD1 3.97Å; F210-I284 HydrophobicContact CZ-CG2 4.26Å; F210-T295 HydrophobicContact CD1-CG2 3.63Å; F210-T295 HydrophobicContact CD2-CG2 3.94Å; F210-T295 HydrophobicContact CE1-CG2 3.32Å; F210-T295 HydrophobicContact CE2-CG2 3.66Å; F210-T295 HydrophobicContact CG-CG2 3.94Å; F210-T295 HydrophobicContact CZ-CG2 3.34Å; F210-N297 HydrophobicContact CD2-CB 4.49Å
211	A	98.9	Very high	98.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	112.1	-172.5	0	0	0	0	0	111.6	L72 V73 V273 T295 V296 F298	L72-A211 HydrophobicContact CD2-CB 4.01Å; V73-A211 HydrophobicContact CB-CB 4.38Å; V73-A211 HydrophobicContact CG1-CB 3.62Å; V73-A211 HydrophobicContact CG2-CB 3.81Å; A211-V273 HydrophobicContact CB-CG2 4.09Å; A211-T295 WeakPolarHBondContact O-CA 3.48Å; A211-T295 WeakPolarHBondContact O-CG2 3.48Å; A211-V296 WeakPolarHBondContact CA-O 3.37Å; A211-V296 VanDerWaalsContact CB-O 3.31Å; A211-V296 WeakPolarHBondContact CB-O 3.46Å; A211-V296 PolarHBondContact N-O 3.36Å; A211-V296 PolarHBondContact O-N 3.27Å; A211-F298 HydrophobicContact CB-CD2 4.48Å; A211-F298 HydrophobicContact CB-CE2 4.01Å
212	Q	98.9	Very high	98.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	131.6	-176.7	-175.5	67.7	5.9	0	0	110.8	K214 G215 V268 G269 G271 D272 T295	Q212-K214 PolarHBondContact NE2-O 3.28Å; Q212-G215 PolarHBondContact NE2-O 2.9Å; Q212-V268 HydrophobicContact CB-CB 4.14Å; Q212-V268 HydrophobicContact CB-CG2 3.98Å; Q212-V268 HydrophobicContact CG-CB 4.44Å; Q212-V268 HydrophobicContact CG-CG2 4.13Å; Q212-G269 VanDerWaalsContact CB-O 3.28Å; Q212-G269 WeakPolarHBondContact CB-O 3.27Å; Q212-G269 VanDerWaalsContact CG-O 3.32Å; Q212-G269 WeakPolarHBondContact CG-O 3.47Å; Q212-G271 PolarHBondContact O-N 3.44Å; Q212-D272 PolarHBondContact N-O 2.98Å; Q212-T295 PolarHBondContact OE1-OG1 3.06Å
213	I	98.9	Very high	98.8	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-49.2	-172.5	-70	165.8	0	0	0	111.8	V73 A76 W79 P270 I294 V296	V73-I213 HydrophobicContact CB-CG1 4.41Å; V73-I213 HydrophobicContact CG2-CG1 3.88Å; A76-I213 HydrophobicContact CB-CD1 3.9Å; A76-I213 HydrophobicContact CB-CG1 4.28Å; A76-I213 WeakPolarHBondContact O-CG2 3.48Å; W79-I213 HydrophobicContact CB-CG2 4.05Å; W79-I213 HydrophobicContact CE3-CD1 4.1Å; W79-I213 HydrophobicContact CZ3-CD1 4.36Å; I213-P270 WeakPolarHBondContact O-CB 3.26Å; I213-I294 WeakPolarHBondContact CA-O 3.33Å; I213-I294 HydrophobicContact CB-CB 4.16Å; I213-I294 HydrophobicContact CB-CG2 4Å; I213-I294 WeakPolarHBondContact CB-O 3.12Å; I213-I294 HydrophobicContact CD1-CG2 4.17Å; I213-I294 HydrophobicContact CG2-CB 4.22Å; I213-I294 HydrophobicContact CG2-CG2 4.03Å; I213-I294 PolarHBondContact N-O 3.11Å; I213-V296 HydrophobicContact CD1-CB 4.02Å; I213-V296 HydrophobicContact CD1-CG2 3.57Å
214	K	98.8	Very high	98.8	Very high	79 Å²	79	14.5 Å²	14.5	34%	0.343	7%	0.072	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	142.9	-178.4	-174.1	180	177.8	69.2	0	110.5	D80 Q212 T293 I294	D80-K214 HydrophobicContact CB-CD 4.34Å; Q212-K214 PolarHBondContact NE2-O 3.28Å; K214-T293 CarbonylContact O-C 3.6Å; K214-T293 VanDerWaalsContact O-CA 3.24Å; K214-T293 WeakPolarHBondContact O-CA 3.5Å; K214-I294 HydrophobicContact CB-CB 3.82Å; K214-I294 HydrophobicContact CB-CD1 3.94Å; K214-I294 HydrophobicContact CB-CG1 3.88Å; K214-I294 HydrophobicContact CD-CD1 3.85Å; K214-I294 HydrophobicContact CD-CG1 4.33Å; K214-I294 PolarHBondContact N-O 3.33Å; K214-I294 VanDerWaalsContact N-O 3.08Å; K214-I294 PolarHBondContact O-N 3.26Å
215	G	98.4	Very high	98.8	Very high	13 Å²	13	18.7 Å²	18.7	13%	0.134	10%	0.095	C	C	.	.	S	Bend	trans	68.2	-172.6	-179.7	0	0	0	0	0	112.3	Q212	Q212-G215 PolarHBondContact NE2-O 2.9Å
216	H	98.8	Very high	98.8	Very high	26 Å²	26	17.1 Å²	17.1	12%	0.12	9%	0.087	C	C	.	.			trans	-119.7	137	-175.7	-67.5	89.9	0	0	0	111.4	E29 W30 V267 V268 G269 L287 T293	E29-H216 IonicContact OE2-CE1 3.21Å; E29-H216 PolarHBondContact OE2-CE1 3.31Å; E29-H216 IonicContact OE2-NE2 3.77Å; W30-H216 AromaticContact CD1-CD2 3.63Å; W30-H216 AromaticContact CD1-CG 3.95Å; W30-H216 AromaticContact CD1-NE2 3.9Å; H216-V267 HydrophobicContact CB-CG1 3.91Å; H216-V268 WeakPolarHBondContact CA-O 3.49Å; H216-G269 VanDerWaalsContact CD2-CA 3.45Å; H216-G269 WeakPolarHBondContact CD2-CA 3.47Å; H216-L287 HydrophobicContact CB-CD1 3.54Å; H216-L287 HydrophobicContact CB-CG 3.8Å; H216-L287 PolarHBondContact O-N 2.96Å; H216-T293 WeakPolarHBondContact O-CG2 3.26Å
217	K	98.9	Very high	98.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.6	171	-78.3	180	173.3	171.5	0	109.8	Y148 F210 V267 V268 I284 E285 T293 T295	Y148-K217 PolarHBondContact OH-NZ 3.28Å; F210-K217 HydrophobicContact CE1-CD 4.12Å; F210-K217 HydrophobicContact CZ-CD 3.8Å; K217-V267 CarbonylContact O-C 3.49Å; K217-V267 WeakPolarHBondContact O-CA 3.39Å; K217-V268 HydrophobicContact CB-CG2 4.07Å; K217-V268 PolarHBondContact N-O 3.18Å; K217-V268 WeakPolarHBondContact O-CG2 3.35Å; K217-V268 PolarHBondContact O-N 3.37Å; K217-I284 HydrophobicContact CB-CG2 4.17Å; K217-I284 HydrophobicContact CD-CG2 3.8Å; K217-I284 HydrophobicContact CG-CG2 4.28Å; K217-E285 CarbonylContact C-O 3.54Å; K217-E285 VanDerWaalsContact CA-O 3.23Å; K217-E285 WeakPolarHBondContact CA-O 3.45Å; K217-T293 VanDerWaalsContact CE-OG1 3.29Å; K217-T293 WeakPolarHBondContact CE-OG1 3.32Å; K217-T293 HydrophobicContact CG-CG2 4.13Å; K217-T295 PolarHBondContact NZ-OG1 2.95Å
218	R	98.9	Very high	98.8	Very high	21 Å²	21	23.5 Å²	23.5	8%	0.079	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.2	167.3	-178.7	-162.7	-167.4	-167	1.6	108.2	R36 I220 E265 V267 I284 E285 L287	R36-R218 PolarHBondContact O-NH1 3.22Å; R218-I220 HydrophobicContact CG-CG1 4.39Å; R218-E265 HydrophobicContact CG-CG 4.26Å; R218-E265 IonicContact CZ-OE1 3.81Å; R218-E265 VanDerWaalsContact CZ-OE1 3.22Å; R218-E265 IonicContact CZ-OE2 3.86Å; R218-E265 VanDerWaalsContact NE-CD 3.32Å; R218-E265 IonicContact NE-OE1 2.87Å; R218-E265 PolarHBondContact NE-OE1 2.83Å; R218-E265 IonicContact NE-OE2 3.79Å; R218-E265 VanDerWaalsContact NH2-CD 3.3Å; R218-E265 IonicContact NH2-OE1 3.93Å; R218-E265 PolarHBondContact NH2-OE1 3.12Å; R218-E265 IonicContact NH2-OE2 3.31Å; R218-E265 PolarHBondContact NH2-OE2 3.24Å; R218-E265 VanDerWaalsContact NH2-OE2 3.1Å; R218-V267 HydrophobicContact CB-CG2 4.15Å; R218-V267 HydrophobicContact CG-CG2 4.31Å; R218-I284 WeakPolarHBondContact O-CA 3.29Å; R218-E285 HydrophobicContact CB-CG 3.68Å; R218-E285 WeakPolarHBondContact CD-OE1 3.45Å; R218-E285 HydrophobicContact CG-CG 4.34Å; R218-E285 IonicContact CZ-OE1 2.8Å; R218-E285 PolarHBondContact N-O 3.16Å; R218-E285 IonicContact NE-OE1 3.1Å; R218-E285 IonicContact NH1-OE1 3.88Å; R218-E285 PolarHBondContact NH1-OE1 2.78Å; R218-E285 VanDerWaalsContact NH1-OE1 3.14Å; R218-E285 PolarHBondContact O-N 3.12Å; R218-L287 HydrophobicContact CB-CD2 3.74Å
219	C	98.9	Very high	98.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.1	-179.1	-59.8	0	0	0	0	108.2	L221 E265 A266 L274	C219-L221 HydrophobicContact CB-CD1 3.93Å; C219-E265 VanDerWaalsContact O-CA 3.32Å; C219-E265 WeakPolarHBondContact O-CA 3.36Å; C219-A266 PolarHBondContact N-O 2.98Å; C219-A266 PolarHBondContact O-N 3.37Å; C219-L274 HydrophobicContact CB-CD2 3.56Å
220	I	98.9	Very high	98.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	114	176.6	-51.8	175	0	0	0	107.6	Y38 F40 T42 R218 F222 Y264 E265 H282 H283	Y38-I220 HydrophobicContact CD2-CD1 3.71Å; Y38-I220 HydrophobicContact CE2-CD1 3.84Å; F40-I220 HydrophobicContact CE2-CD1 4.3Å; F40-I220 HydrophobicContact CE2-CG2 3.86Å; F40-I220 HydrophobicContact CZ-CD1 4.36Å; F40-I220 HydrophobicContact CZ-CG2 4.37Å; T42-I220 HydrophobicContact CG2-CG2 4.1Å; R218-I220 HydrophobicContact CG-CG1 4.39Å; I220-F222 HydrophobicContact CG2-CE1 4.23Å; I220-F222 HydrophobicContact CG2-CE2 3.9Å; I220-F222 HydrophobicContact CG2-CZ 3.57Å; I220-Y264 CarbonylContact C-O 3.43Å; I220-Y264 WeakPolarHBondContact CA-O 3.48Å; I220-E265 HydrophobicContact CG1-CG 4.26Å; I220-H282 CarbonylContact O-C 3.42Å; I220-H282 WeakPolarHBondContact O-CA 3.35Å; I220-H283 HydrophobicContact CB-CB 4.32Å; I220-H283 PolarHBondContact N-O 3.27Å; I220-H283 PolarHBondContact O-N 3.45Å
221	L	98.9	Very high	98.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	147.2	-174.3	-87.4	65.5	0	0	0	111.2	I45 P64 C219 G263 Y264 L274 I276 W280 W281 H282	I45-L221 HydrophobicContact CD1-CB 4.4Å; I45-L221 HydrophobicContact CD1-CD1 4.3Å; I45-L221 HydrophobicContact CD1-CD2 4.24Å; P64-L221 HydrophobicContact CB-CD2 3.54Å; P64-L221 HydrophobicContact CG-CD2 4.11Å; C219-L221 HydrophobicContact CB-CD1 3.93Å; L221-G263 CarbonylContact O-C 3.45Å; L221-G263 WeakPolarHBondContact O-CA 3.41Å; L221-Y264 PolarHBondContact N-O 3.18Å; L221-Y264 PolarHBondContact O-N 3.05Å; L221-L274 HydrophobicContact CD1-CD2 4.1Å; L221-I276 HydrophobicContact CD2-CG1 4.39Å; L221-I276 HydrophobicContact CD2-CG2 4.27Å; L221-W280 HydrophobicContact CB-CE3 3.99Å; L221-W280 HydrophobicContact CB-CZ3 4.4Å; L221-W280 HydrophobicContact CD2-CE3 4.46Å; L221-W281 CarbonylContact C-O 3.56Å; L221-W281 WeakPolarHBondContact CA-O 3.41Å; L221-H282 HydrophobicContact CD1-CB 3.84Å; L221-H282 HydrophobicContact CG-CB 3.99Å
222	F	98.9	Very high	98.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.5	173.4	-45.3	-95.7	0	0	0	110.3	F40 I220 L230 F247 V261 G263 W280 W281	F40-F222 HydrophobicContact CD2-CE1 4.2Å; F40-F222 HydrophobicContact CD2-CZ 4.33Å; F40-F222 HydrophobicContact CE1-CZ 4.35Å; F40-F222 HydrophobicContact CE2-CE1 4.14Å; F40-F222 AromaticContact CE2-CZ 3.82Å; F40-F222 HydrophobicContact CE2-CZ 3.82Å; F40-F222 HydrophobicContact CZ-CE1 4.48Å; F40-F222 AromaticContact CZ-CZ 3.83Å; F40-F222 HydrophobicContact CZ-CZ 3.83Å; I220-F222 HydrophobicContact CG2-CE1 4.23Å; I220-F222 HydrophobicContact CG2-CE2 3.9Å; I220-F222 HydrophobicContact CG2-CZ 3.57Å; F222-L230 HydrophobicContact CB-CD1 3.7Å; F222-L230 HydrophobicContact CD2-CD1 4.12Å; F222-L230 HydrophobicContact CD2-CD2 4.45Å; F222-L230 HydrophobicContact CG-CD1 3.93Å; F222-F247 AromaticContact CE2-CE2 3.82Å; F222-F247 HydrophobicContact CE2-CE2 3.82Å; F222-F247 AromaticContact CE2-CZ 3.99Å; F222-F247 HydrophobicContact CE2-CZ 3.99Å; F222-F247 AromaticContact CZ-CE2 3.79Å; F222-F247 HydrophobicContact CZ-CE2 3.79Å; F222-F247 HydrophobicContact CZ-CZ 4.08Å; F222-V261 HydrophobicContact CD1-CG2 3.45Å; F222-V261 VanDerWaalsContact CD1-CG2 3.45Å; F222-V261 HydrophobicContact CE1-CG1 4.39Å; F222-V261 HydrophobicContact CE1-CG2 3.58Å; F222-V261 HydrophobicContact CG-CG2 4.29Å; F222-G263 VanDerWaalsContact CE1-CA 3.46Å; F222-W280 VanDerWaalsContact C-CE3 3.46Å; F222-W281 HydrophobicContact CB-CB 3.95Å; F222-W281 HydrophobicContact CB-CG 4.48Å; F222-W281 HydrophobicContact CD2-CB 3.95Å; F222-W281 HydrophobicContact CG-CB 4.44Å; F222-W281 PolarHBondContact N-O 3.46Å; F222-W281 PolarHBondContact O-N 2.78Å
223	P	98.8	Very high	98.7	Very high	14 Å²	14	29.7 Å²	29.7	9%	0.091	15%	0.146	C	C	.	.			trans	-63.1	155.4	-179.7	23.8	-32.8	0	0	0	112.1	D225 Q226 Y264 W280	P223-D225 VanDerWaalsContact CB-OD1 3.27Å; P223-D225 WeakPolarHBondContact CB-OD1 3.46Å; P223-D225 WeakPolarHBondContact CG-OD1 3.45Å; P223-D225 PolarHBondContact O-N 2.9Å; P223-D225 VanDerWaalsContact O-N 3.09Å; P223-Q226 HydrophobicContact CG-CG 4.14Å; P223-Q226 PolarHBondContact O-N 2.86Å; P223-Q226 VanDerWaalsContact O-N 3.07Å; P223-Y264 HydrophobicContact CG-CE2 4.29Å; P223-W280 HydrophobicContact CB-CD2 4.45Å; P223-W280 HydrophobicContact CB-CE3 4.3Å; P223-W280 HydrophobicContact CB-CH2 3.78Å; P223-W280 HydrophobicContact CB-CZ2 3.92Å; P223-W280 HydrophobicContact CB-CZ3 3.97Å; P223-W280 HydrophobicContact CG-CH2 4.39Å; P223-W280 HydrophobicContact CG-CZ3 4.39Å
224	P	98.8	Very high	98.6	Very high	15 Å²	15	32.5 Å²	32.5	10%	0.097	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-61	-19.6	-179	-22.4	31.3	0	0	0	114.6	Q226 F227 A315 H316	P224-Q226 VanDerWaalsContact C-N 3.27Å; P224-Q226 PolarHBondContact O-N 3.34Å; P224-F227 PolarHBondContact O-N 3.05Å; P224-A315 HydrophobicContact CB-CB 4.12Å; P224-H316 HydrophobicContact CB-CB 4.17Å; P224-H316 HydrophobicContact CG-CB 4.23Å
225	D	98.5	Very high	98.6	Very high	106 Å²	106	29 Å²	29	57%	0.567	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-74.1	-15.5	177.2	61.6	1.7	0	0	0	113.4	P223 F227 A315	P223-D225 VanDerWaalsContact CB-OD1 3.27Å; P223-D225 WeakPolarHBondContact CB-OD1 3.46Å; P223-D225 WeakPolarHBondContact CG-OD1 3.45Å; P223-D225 PolarHBondContact O-N 2.9Å; P223-D225 VanDerWaalsContact O-N 3.09Å; D225-F227 PolarHBondContact O-N 2.92Å; D225-A315 HydrophobicContact CB-CB 3.67Å
226	Q	98.7	Very high	98.5	Very high	28 Å²	28	30 Å²	30	13%	0.131	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-84.9	15.2	172.2	-67.1	-172.6	43	0	0	113.5	P223 P224 E228 C229 L230 V262	P223-Q226 HydrophobicContact CG-CG 4.14Å; P223-Q226 PolarHBondContact O-N 2.86Å; P223-Q226 VanDerWaalsContact O-N 3.07Å; P224-Q226 VanDerWaalsContact C-N 3.27Å; P224-Q226 PolarHBondContact O-N 3.34Å; Q226-E228 PolarHBondContact O-N 3.08Å; Q226-E228 VanDerWaalsContact O-N 3.16Å; Q226-C229 WeakPolarHBondContact O-CB 3.32Å; Q226-C229 PolarHBondContact O-N 3.48Å; Q226-L230 HydrophobicContact CB-CD1 4.48Å; Q226-L230 PolarHBondContact O-N 2.61Å; Q226-V262 PolarHBondContact NE2-O 2.83Å; Q226-V262 PolarHBondContact OE1-O 2.88Å
227	F	98.6	Very high	98.5	Very high	39 Å²	39	29.8 Å²	29.8	17%	0.171	15%	0.149	C	C	.	.	H	α-helix	trans	-50.7	-39.5	175.9	-173.2	-86.3	0	0	0	112.5	Y203 P224 D225 C229 L230 Y231 W281 V319 M322	Y203-F227 HydrophobicContact CE1-CE2 4.37Å; P224-F227 PolarHBondContact O-N 3.05Å; D225-F227 PolarHBondContact O-N 2.92Å; F227-C229 PolarHBondContact O-N 3.01Å; F227-L230 PolarHBondContact O-N 3.09Å; F227-Y231 PolarHBondContact O-N 3.26Å; F227-W281 AromaticContact CD2-CZ2 3.82Å; F227-W281 HydrophobicContact CD2-CZ2 3.82Å; F227-W281 HydrophobicContact CE2-CZ2 4.2Å; F227-V319 HydrophobicContact CB-CG2 4.32Å; F227-V319 HydrophobicContact CD2-CG1 4.23Å; F227-V319 HydrophobicContact CD2-CG2 3.76Å; F227-V319 HydrophobicContact CE2-CG1 4.15Å; F227-V319 HydrophobicContact CE2-CG2 4.4Å; F227-V319 HydrophobicContact CG-CG2 4.21Å; F227-M322 HydrophobicContact CD1-CE 3.58Å; F227-M322 HydrophobicContact CD1-SD 4.4Å; F227-M322 HydrophobicContact CD2-CE 4.27Å; F227-M322 HydrophobicContact CE1-CE 3.59Å; F227-M322 HydrophobicContact CE1-SD 4.09Å; F227-M322 HydrophobicContact CE2-CE 4.27Å; F227-M322 HydrophobicContact CG-CE 3.95Å; F227-M322 HydrophobicContact CZ-CE 3.95Å
228	E	97.8	Very high	98.4	Very high	142 Å²	142	29.8 Å²	29.8	66%	0.664	15%	0.149	S	C	*	.	H	α-helix	trans	-65.6	-19.8	178.6	-63.6	178.8	-176.4	0	0	113.9	Q226 N257	Q226-E228 PolarHBondContact O-N 3.08Å; Q226-E228 VanDerWaalsContact O-N 3.16Å; E228-N257 WeakPolarHBondContact O-CB 3.44Å; E228-N257 PolarHBondContact O-ND2 3.34Å
229	C	98.7	Very high	98.4	Very high	17 Å²	17	28.8 Å²	28.8	12%	0.115	15%	0.146	C	C	.	.	H	α-helix	trans	-93.6	-23.8	179.2	-59.3	0	0	0	0	112.4	Q226 F227 Y231 N257 F258 V261	Q226-C229 WeakPolarHBondContact O-CB 3.32Å; Q226-C229 PolarHBondContact O-N 3.48Å; F227-C229 PolarHBondContact O-N 3.01Å; C229-Y231 WeakPolarHBondContact O-CD2 3.13Å; C229-Y231 WeakPolarHBondContact O-CE2 3.27Å; C229-N257 HydrophobicContact CB-CB 4.49Å; C229-N257 PolarHBondContact SG-O 2.85Å; C229-N257 VanDerWaalsContact SG-O 3.36Å; C229-F258 WeakPolarHBondContact O-CA 3.39Å; C229-F258 WeakPolarHBondContact O-CD2 3.18Å; C229-V261 HydrophobicContact CB-CB 4.1Å; C229-V261 HydrophobicContact CB-CG2 4.17Å
230	L	98.6	Very high	98.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-103.4	-9.9	-168.8	-72.3	164.7	0	0	0	114.4	F222 Q226 F227 S232 S243 F247 F258 V261 W281	F222-L230 HydrophobicContact CB-CD1 3.7Å; F222-L230 HydrophobicContact CD2-CD1 4.12Å; F222-L230 HydrophobicContact CD2-CD2 4.45Å; F222-L230 HydrophobicContact CG-CD1 3.93Å; Q226-L230 HydrophobicContact CB-CD1 4.48Å; Q226-L230 PolarHBondContact O-N 2.61Å; F227-L230 PolarHBondContact O-N 3.09Å; L230-S232 PolarHBondContact O-N 3.46Å; L230-S243 WeakPolarHBondContact O-CA 3.19Å; L230-S243 VanDerWaalsContact O-CB 3.29Å; L230-S243 WeakPolarHBondContact O-CB 3.26Å; L230-S243 PolarHBondContact O-OG 2.81Å; L230-F247 HydrophobicContact CD2-CE1 4.11Å; L230-F247 HydrophobicContact CD2-CZ 3.77Å; L230-F258 HydrophobicContact CD2-CD2 4.36Å; L230-F258 HydrophobicContact CD2-CE2 4Å; L230-V261 HydrophobicContact CD2-CG2 4.13Å; L230-V261 HydrophobicContact CG-CG2 4.26Å; L230-W281 HydrophobicContact CB-CD2 4.15Å; L230-W281 HydrophobicContact CB-CE3 4.3Å; L230-W281 HydrophobicContact CB-CH2 4.1Å; L230-W281 HydrophobicContact CB-CZ2 3.93Å; L230-W281 HydrophobicContact CB-CZ3 4.29Å; L230-W281 HydrophobicContact CD1-CB 3.83Å; L230-W281 VanDerWaalsContact CD1-CD1 3.45Å; L230-W281 HydrophobicContact CD1-CD2 3.52Å; L230-W281 HydrophobicContact CD1-CE3 4.19Å; L230-W281 HydrophobicContact CD1-CG 3.33Å; L230-W281 HydrophobicContact CG-CD2 4.41Å
231	Y	98.6	Very high	98.3	Very high	52 Å²	52	32.1 Å²	32.1	20%	0.204	16%	0.159	C	C	.	.			trans	47.8	67.3	168.4	-59.7	-87.6	0	0	0	113.4	F227 C229 Q244 V245 F255 P256 N257	F227-Y231 PolarHBondContact O-N 3.26Å; C229-Y231 WeakPolarHBondContact O-CD2 3.13Å; C229-Y231 WeakPolarHBondContact O-CE2 3.27Å; Y231-Q244 WeakPolarHBondContact O-CB 3.27Å; Y231-Q244 VanDerWaalsContact O-CG 3.25Å; Y231-Q244 WeakPolarHBondContact O-CG 3.39Å; Y231-Q244 PolarHBondContact O-N 2.84Å; Y231-Q244 PolarHBondContact O-NE2 2.89Å; Y231-V245 HydrophobicContact CD2-CG2 4.06Å; Y231-F255 AromaticContact CD1-CD1 3.8Å; Y231-F255 HydrophobicContact CD1-CD1 3.8Å; Y231-F255 HydrophobicContact CD1-CE1 4.45Å; Y231-F255 HydrophobicContact CD2-CB 3.63Å; Y231-F255 AromaticContact CD2-CD1 3.63Å; Y231-F255 HydrophobicContact CD2-CD1 3.63Å; Y231-F255 AromaticContact CD2-CG 3.96Å; Y231-F255 HydrophobicContact CD2-CG 3.96Å; Y231-F255 HydrophobicContact CE1-CD1 4.31Å; Y231-F255 HydrophobicContact CE2-CB 3.56Å; Y231-F255 HydrophobicContact CE2-CD1 4.17Å; Y231-F255 HydrophobicContact CE2-CG 4.32Å; Y231-F255 HydrophobicContact CG-CB 4.32Å; Y231-F255 AromaticContact CG-CD1 3.41Å; Y231-F255 HydrophobicContact CG-CD1 3.41Å; Y231-F255 VanDerWaalsContact CG-CD1 3.41Å; Y231-F255 HydrophobicContact CG-CE1 4.1Å; Y231-F255 HydrophobicContact CG-CG 4.22Å; Y231-P256 WeakPolarHBondContact OH-CD 3.29Å; Y231-N257 HydrophobicContact CE2-CB 4.15Å; Y231-N257 VanDerWaalsContact OH-CB 3.29Å; Y231-N257 WeakPolarHBondContact OH-CB 3.39Å; Y231-N257 PolarHBondContact OH-N 3.21Å
232	S	98.3	Very high	98.3	Very high	18 Å²	18	32.4 Å²	32.4	13%	0.126	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-49.7	144.2	174.5	-172.1	0	0	0	0	111.2	L230 Q242 Q244	L230-S232 PolarHBondContact O-N 3.46Å; S232-Q242 WeakPolarHBondContact CA-O 3.34Å; S232-Q244 PolarHBondContact O-NE2 2.77Å
233	Y	98.3	Very high	98.3	Very high	52 Å²	52	32.8 Å²	32.8	20%	0.204	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-58.2	151	160.9	-79.4	-87.2	0	0	0	110.5	H237 C239 Q242 Q244	Y233-H237 HydrophobicContact CD1-CB 4.45Å; Y233-H237 AromaticContact CD1-CE1 3.32Å; Y233-H237 WeakPolarHBondContact CD1-CE1 3.47Å; Y233-H237 AromaticContact CD1-CG 3.67Å; Y233-H237 AromaticContact CD1-ND1 3.15Å; Y233-H237 WeakPolarHBondContact CD1-ND1 3.48Å; Y233-H237 AromaticContact CD1-NE2 3.86Å; Y233-H237 AromaticContact CE1-CE1 3.41Å; Y233-H237 VanDerWaalsContact CE1-CE1 3.41Å; Y233-H237 WeakPolarHBondContact CE1-CE1 3.01Å; Y233-H237 AromaticContact CE1-ND1 3.76Å; Y233-H237 AromaticContact CE1-NE2 3.91Å; Y233-H237 AromaticContact CG-ND1 3.62Å; Y233-C239 HydrophobicContact CD1-CB 4.25Å; Y233-C239 HydrophobicContact CD2-CB 3.54Å; Y233-C239 HydrophobicContact CE1-CB 4.46Å; Y233-C239 HydrophobicContact CE2-CB 3.81Å; Y233-C239 HydrophobicContact CG-CB 3.78Å; Y233-Q242 HydrophobicContact CD2-CB 4.3Å; Y233-Q242 WeakPolarHBondContact CD2-O 3.21Å; Y233-Q242 PolarHBondContact N-O 3.24Å; Y233-Q244 HydrophobicContact CD1-CG 3.71Å; Y233-Q244 HydrophobicContact CD2-CB 4.47Å; Y233-Q244 HydrophobicContact CD2-CG 3.58Å; Y233-Q244 HydrophobicContact CE1-CG 3.77Å; Y233-Q244 HydrophobicContact CE2-CB 4.15Å; Y233-Q244 HydrophobicContact CE2-CG 3.63Å; Y233-Q244 HydrophobicContact CG-CG 3.62Å
234	P	98.1	Very high	98.3	Very high	61 Å²	61	34.6 Å²	34.6	40%	0.396	17%	0.17	S	C	.	.	P	Polyproline II helix	trans	-54.8	150	174.4	-25	34	0	0	0	112.2	H236 H237	P234-H236 PolarHBondContact O-N 2.83Å; P234-H236 VanDerWaalsContact O-N 3.07Å; P234-H237 HydrophobicContact CB-CB 4.38Å; P234-H237 VanDerWaalsContact O-CB 3.27Å; P234-H237 WeakPolarHBondContact O-CB 3.3Å; P234-H237 PolarHBondContact O-N 2.88Å
235	V	98.1	Very high	98.3	Very high	6 Å²	6	34.4 Å²	34.4	4%	0.036	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.3	-173.3	173.3	0	0	0	0	113.2	K110 D240 R323 E326 K327	K110-V235 PolarHBondContact NZ-O 2.69Å; V235-D240 WeakPolarHBondContact O-CB 3.38Å; V235-R323 HydrophobicContact CG2-CB 4.26Å; V235-R323 HydrophobicContact CG2-CG 4.16Å; V235-E326 HydrophobicContact CB-CB 3.99Å; V235-E326 HydrophobicContact CG2-CB 3.89Å; V235-E326 HydrophobicContact CG2-CG 4.32Å; V235-E326 WeakPolarHBondContact CG2-OE2 3.29Å; V235-E326 PolarHBondContact N-OE2 3.22Å; V235-K327 HydrophobicContact CG1-CD 4.46Å; V235-K327 HydrophobicContact CG1-CG 3.78Å
236	H	97.3	Very high	98.3	Very high	32 Å²	32	32.7 Å²	32.7	15%	0.148	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.1	179.8	-61.9	96.3	0	0	0	114.3	N113 F114 P234 E326 P336	N113-H236 PolarHBondContact ND2-O 3.35Å; F114-H236 HydrophobicContact CE2-CB 4.4Å; F114-H236 WeakPolarHBondContact CE2-O 3.47Å; P234-H236 PolarHBondContact O-N 2.83Å; P234-H236 VanDerWaalsContact O-N 3.07Å; H236-E326 PolarHBondContact CE1-O 3.18Å; H236-E326 VanDerWaalsContact CE1-O 3.28Å; H236-P336 HydrophobicContact CB-CB 3.69Å; H236-P336 HydrophobicContact CB-CG 4.37Å
237	H	98	Very high	98.3	Very high	22 Å²	22	31.9 Å²	31.9	10%	0.102	16%	0.156	C	C	.	.	S	Bend	trans	-72.5	148	179	-173.4	-91.3	0	0	0	110.9	K110 F114 F117 Y233 P234 C239 D240	K110-H237 WeakPolarHBondContact CD-O 3.36Å; F114-H237 AromaticContact CD1-CD2 3.95Å; F114-H237 HydrophobicContact CE2-CB 4.15Å; F114-H237 HydrophobicContact CZ-CB 4.31Å; F117-H237 AromaticContact CD2-CE1 3.78Å; F117-H237 AromaticContact CD2-NE2 3.84Å; F117-H237 AromaticContact CE2-CE1 3.87Å; Y233-H237 HydrophobicContact CD1-CB 4.45Å; Y233-H237 AromaticContact CD1-CE1 3.32Å; Y233-H237 WeakPolarHBondContact CD1-CE1 3.47Å; Y233-H237 AromaticContact CD1-CG 3.67Å; Y233-H237 AromaticContact CD1-ND1 3.15Å; Y233-H237 WeakPolarHBondContact CD1-ND1 3.48Å; Y233-H237 AromaticContact CD1-NE2 3.86Å; Y233-H237 AromaticContact CE1-CE1 3.41Å; Y233-H237 VanDerWaalsContact CE1-CE1 3.41Å; Y233-H237 WeakPolarHBondContact CE1-CE1 3.01Å; Y233-H237 AromaticContact CE1-ND1 3.76Å; Y233-H237 AromaticContact CE1-NE2 3.91Å; Y233-H237 AromaticContact CG-ND1 3.62Å; P234-H237 HydrophobicContact CB-CB 4.38Å; P234-H237 VanDerWaalsContact O-CB 3.27Å; P234-H237 WeakPolarHBondContact O-CB 3.3Å; P234-H237 PolarHBondContact O-N 2.88Å; H237-C239 WeakPolarHBondContact ND1-CB 3.35Å; H237-C239 PolarHBondContact ND1-N 2.99Å; H237-C239 PolarHBondContact O-N 2.98Å; H237-C239 VanDerWaalsContact O-N 3.14Å; H237-D240 WeakPolarHBondContact O-CB 3.34Å; H237-D240 PolarHBondContact O-N 2.91Å
238	P	97.6	Very high	98.2	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.1	177.4	-29	36.5	0	0	0	113.9	Y106 D107 K110 M111 F114 F117 D240	Y106-P238 CarbonylContact C-O 3.12Å; Y106-P238 WeakPolarHBondContact CA-O 3.45Å; D107-P238 PolarHBondContact N-O 3.32Å; K110-P238 HydrophobicContact CB-CG 4.39Å; M111-P238 HydrophobicContact CG-CB 4.29Å; M111-P238 HydrophobicContact CG-CG 4.18Å; F114-P238 HydrophobicContact CB-CG 4.48Å; F117-P238 HydrophobicContact CB-CG 4.35Å; F117-P238 HydrophobicContact CD1-CB 3.89Å; F117-P238 HydrophobicContact CD1-CG 3.79Å; F117-P238 HydrophobicContact CE1-CB 3.77Å; F117-P238 HydrophobicContact CE1-CG 4.21Å; F117-P238 HydrophobicContact CG-CB 4.34Å; F117-P238 HydrophobicContact CG-CG 3.97Å; F117-P238 HydrophobicContact CZ-CB 4.14Å; P238-D240 VanDerWaalsContact C-N 3.34Å; P238-D240 PolarHBondContact O-N 3.26Å
239	C	97.8	Very high	98.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	20.4	177.7	-56.6	0	0	0	0	114.9	L104 Y105 F117 Y233 H237 R241 Q242	L104-C239 VanDerWaalsContact CD2-SG 3.59Å; Y105-C239 PolarHBondContact O-SG 3.21Å; F117-C239 WeakPolarHBondContact CE2-SG 3.39Å; F117-C239 VanDerWaalsContact CZ-SG 3.51Å; Y233-C239 HydrophobicContact CD1-CB 4.25Å; Y233-C239 HydrophobicContact CD2-CB 3.54Å; Y233-C239 HydrophobicContact CE1-CB 4.46Å; Y233-C239 HydrophobicContact CE2-CB 3.81Å; Y233-C239 HydrophobicContact CG-CB 3.78Å; H237-C239 WeakPolarHBondContact ND1-CB 3.35Å; H237-C239 PolarHBondContact ND1-N 2.99Å; H237-C239 PolarHBondContact O-N 2.98Å; H237-C239 VanDerWaalsContact O-N 3.14Å; C239-R241 PolarHBondContact O-N 3.23Å; C239-Q242 VanDerWaalsContact CA-NE2 3.35Å; C239-Q242 WeakPolarHBondContact O-CB 3.43Å; C239-Q242 PolarHBondContact O-N 2.84Å; C239-Q242 PolarHBondContact O-NE2 3.17Å
240	D	98.4	Very high	98.2	Very high	11 Å²	11	32.7 Å²	32.7	6%	0.059	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-40.3	137	174.8	176	28.9	0	0	0	112.3	K110 V235 H237 P238 Q242 R323	K110-D240 VanDerWaalsContact NZ-CB 3.28Å; K110-D240 IonicContact NZ-OD2 3.49Å; K110-D240 PolarHBondContact NZ-OD2 2.82Å; V235-D240 WeakPolarHBondContact O-CB 3.38Å; H237-D240 WeakPolarHBondContact O-CB 3.34Å; H237-D240 PolarHBondContact O-N 2.91Å; P238-D240 VanDerWaalsContact C-N 3.34Å; P238-D240 PolarHBondContact O-N 3.26Å; D240-Q242 VanDerWaalsContact C-N 3.25Å; D240-Q242 PolarHBondContact O-N 3.45Å; D240-R323 IonicContact OD1-CZ 3.98Å; D240-R323 IonicContact OD1-NH1 3.51Å; D240-R323 PolarHBondContact OD1-NH1 3.09Å; D240-R323 IonicContact OD1-NH2 2.78Å; D240-R323 IonicContact OD2-CZ 3.48Å; D240-R323 IonicContact OD2-NH1 3.13Å; D240-R323 PolarHBondContact OD2-NH1 3.36Å; D240-R323 IonicContact OD2-NH2 3.5Å; D240-R323 PolarHBondContact OD2-NH2 3.38Å; D240-R323 VanDerWaalsContact OD2-NH2 3.15Å
241	R	98.4	Very high	98.2	Very high	59 Å²	59	36.4 Å²	36.4	22%	0.223	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	-4.3	-176.7	-47.6	171.9	-69.1	163.9	7.9	116.7	H202 Y203 C239 W281	H202-R241 VanDerWaalsContact CA-O 3.23Å; H202-R241 WeakPolarHBondContact CA-O 3.37Å; H202-R241 WeakPolarHBondContact CB-O 3.14Å; Y203-R241 HydrophobicContact CD1-CB 4.21Å; Y203-R241 WeakPolarHBondContact CD1-O 3.2Å; Y203-R241 HydrophobicContact CD2-CB 4.3Å; Y203-R241 HydrophobicContact CD2-CG 4.37Å; Y203-R241 HydrophobicContact CE1-CB 3.91Å; Y203-R241 HydrophobicContact CE1-CG 4.34Å; Y203-R241 HydrophobicContact CE2-CB 4Å; Y203-R241 HydrophobicContact CE2-CG 3.72Å; Y203-R241 HydrophobicContact CG-CB 4.41Å; Y203-R241 PolarHBondContact N-O 3.16Å; Y203-R241 WeakPolarHBondContact O-CB 3.29Å; C239-R241 PolarHBondContact O-N 3.23Å; R241-W281 WeakPolarHBondContact O-CZ3 3.33Å
242	Q	98.6	Very high	98.2	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.028	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-90.2	151	171.3	-67.9	167.6	107.4	0	0	111.1	L104 Y105 H202 S232 Y233 C239 D240	L104-Q242 HydrophobicContact CD1-CB 4.2Å; L104-Q242 HydrophobicContact CD1-CG 4.34Å; Y105-Q242 PolarHBondContact O-NE2 3.36Å; H202-Q242 HydrophobicContact CB-CB 4.32Å; H202-Q242 HydrophobicContact CB-CG 3.67Å; S232-Q242 WeakPolarHBondContact CA-O 3.34Å; Y233-Q242 HydrophobicContact CD2-CB 4.3Å; Y233-Q242 WeakPolarHBondContact CD2-O 3.21Å; Y233-Q242 PolarHBondContact N-O 3.24Å; C239-Q242 VanDerWaalsContact CA-NE2 3.35Å; C239-Q242 WeakPolarHBondContact O-CB 3.43Å; C239-Q242 PolarHBondContact O-N 2.84Å; C239-Q242 PolarHBondContact O-NE2 3.17Å; D240-Q242 VanDerWaalsContact C-N 3.25Å; D240-Q242 PolarHBondContact O-N 3.45Å
243	S	98.7	Very high	98.2	Very high	8 Å²	8	45.6 Å²	45.6	6%	0.056	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-67.9	139.1	170.9	-178.2	0	0	0	0	109.9	A201 L230 V245	A201-S243 PolarHBondContact O-N 2.79Å; L230-S243 WeakPolarHBondContact O-CA 3.19Å; L230-S243 VanDerWaalsContact O-CB 3.29Å; L230-S243 WeakPolarHBondContact O-CB 3.26Å; L230-S243 PolarHBondContact O-OG 2.81Å; S243-V245 WeakPolarHBondContact OG-CB 3.47Å; S243-V245 PolarHBondContact OG-N 2.66Å; S243-V245 VanDerWaalsContact OG-N 3.09Å
244	Q	98.5	Very high	98.1	Very high	51 Å²	51	49.1 Å²	49.1	24%	0.238	24%	0.242	C	C	.	.	S	Bend	trans	-78.2	-11.4	169.1	-66.6	178.1	66.7	0	0	112.8	Y231 S232 Y233 F255	Y231-Q244 WeakPolarHBondContact O-CB 3.27Å; Y231-Q244 VanDerWaalsContact O-CG 3.25Å; Y231-Q244 WeakPolarHBondContact O-CG 3.39Å; Y231-Q244 PolarHBondContact O-N 2.84Å; Y231-Q244 PolarHBondContact O-NE2 2.89Å; S232-Q244 PolarHBondContact O-NE2 2.77Å; Y233-Q244 HydrophobicContact CD1-CG 3.71Å; Y233-Q244 HydrophobicContact CD2-CB 4.47Å; Y233-Q244 HydrophobicContact CD2-CG 3.58Å; Y233-Q244 HydrophobicContact CE1-CG 3.77Å; Y233-Q244 HydrophobicContact CE2-CB 4.15Å; Y233-Q244 HydrophobicContact CE2-CG 3.63Å; Y233-Q244 HydrophobicContact CG-CG 3.62Å; Q244-F255 HydrophobicContact CB-CE1 3.79Å; Q244-F255 HydrophobicContact CB-CE2 4.31Å; Q244-F255 HydrophobicContact CB-CZ 3.45Å; Q244-F255 VanDerWaalsContact CB-CZ 3.45Å; Q244-F255 WeakPolarHBondContact O-CE2 3.2Å
245	V	98.6	Very high	98.2	Very high	11 Å²	11	46.8 Å²	46.8	7%	0.067	23%	0.226	C	C	.	.			trans	-79.7	124.8	-175.8	-172.1	0	0	0	0	109.4	Y231 S243 F247 P250 F255 F258	Y231-V245 HydrophobicContact CD2-CG2 4.06Å; S243-V245 WeakPolarHBondContact OG-CB 3.47Å; S243-V245 PolarHBondContact OG-N 2.66Å; S243-V245 VanDerWaalsContact OG-N 3.09Å; V245-F247 HydrophobicContact CB-CD1 4.26Å; V245-F247 HydrophobicContact CB-CE1 4.21Å; V245-F247 HydrophobicContact CG1-CD1 4.2Å; V245-F247 HydrophobicContact CG1-CE1 4.47Å; V245-F247 WeakPolarHBondContact O-CD1 3.15Å; V245-F247 PolarHBondContact O-N 3.09Å; V245-P250 HydrophobicContact CG1-CB 3.88Å; V245-P250 HydrophobicContact CG1-CG 4.46Å; V245-F255 HydrophobicContact CB-CD2 4.36Å; V245-F255 HydrophobicContact CG1-CD2 4.44Å; V245-F255 HydrophobicContact CG2-CB 3.92Å; V245-F255 HydrophobicContact CG2-CD1 4.33Å; V245-F255 HydrophobicContact CG2-CD2 3.82Å; V245-F255 HydrophobicContact CG2-CE2 4.38Å; V245-F255 HydrophobicContact CG2-CG 3.77Å; V245-F258 HydrophobicContact CB-CD2 4.24Å; V245-F258 HydrophobicContact CB-CE2 4.32Å; V245-F258 HydrophobicContact CG1-CD1 3.77Å; V245-F258 HydrophobicContact CG1-CD2 3.9Å; V245-F258 HydrophobicContact CG1-CE1 3.86Å; V245-F258 HydrophobicContact CG1-CE2 3.98Å; V245-F258 HydrophobicContact CG1-CG 3.79Å; V245-F258 HydrophobicContact CG1-CZ 3.95Å; V245-F258 HydrophobicContact CG2-CB 4.47Å; V245-F258 HydrophobicContact CG2-CD2 4.01Å; V245-F258 HydrophobicContact CG2-CG 4.27Å
246	D	98.1	Very high	98.2	Very high	71 Å²	71	49.5 Å²	49.5	38%	0.38	24%	0.244	S	C	.	.			trans	-77.2	110.3	165.9	-173.4	-16.1	0	0	0	109.2	K102 D248 N249 P250	K102-D246 IonicContact NZ-OD1 3.54Å; K102-D246 PolarHBondContact NZ-OD1 3.48Å; K102-D246 IonicContact NZ-OD2 3.25Å; K102-D246 PolarHBondContact NZ-OD2 2.87Å; K102-D246 VanDerWaalsContact NZ-OD2 3.08Å; D246-D248 PolarHBondContact O-N 3.07Å; D246-D248 PolarHBondContact OD1-N 3.14Å; D246-N249 CarbonylContact O-C 3.44Å; D246-N249 PolarHBondContact O-N 3.43Å; D246-P250 VanDerWaalsContact O-CA 3.26Å; D246-P250 WeakPolarHBondContact O-CA 3.28Å; D246-P250 WeakPolarHBondContact O-CD 3.34Å; D246-P250 WeakPolarHBondContact O-CG 3.36Å
247	F	98.4	Very high	98.2	Very high	11 Å²	11	51 Å²	51	5%	0.048	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-23	-177.3	-79.3	24.6	0	0	0	113.3	Y38 F40 A201 F222 L230 V245 F258 H283	Y38-F247 HydrophobicContact CD1-CB 3.83Å; Y38-F247 HydrophobicContact CE1-CB 3.8Å; F40-F247 AromaticContact CE1-CD2 3.51Å; F40-F247 HydrophobicContact CE1-CD2 3.51Å; F40-F247 AromaticContact CE1-CE2 3.64Å; F40-F247 HydrophobicContact CE1-CE2 3.64Å; F40-F247 HydrophobicContact CE1-CG 4.11Å; F40-F247 HydrophobicContact CE1-CZ 4.34Å; F40-F247 AromaticContact CZ-CD2 3.69Å; F40-F247 HydrophobicContact CZ-CD2 3.69Å; F40-F247 AromaticContact CZ-CE2 3.71Å; F40-F247 HydrophobicContact CZ-CE2 3.71Å; A201-F247 HydrophobicContact CB-CE1 3.99Å; A201-F247 HydrophobicContact CB-CE2 3.92Å; A201-F247 HydrophobicContact CB-CZ 3.45Å; A201-F247 VanDerWaalsContact CB-CZ 3.45Å; F222-F247 AromaticContact CE2-CE2 3.82Å; F222-F247 HydrophobicContact CE2-CE2 3.82Å; F222-F247 AromaticContact CE2-CZ 3.99Å; F222-F247 HydrophobicContact CE2-CZ 3.99Å; F222-F247 AromaticContact CZ-CE2 3.79Å; F222-F247 HydrophobicContact CZ-CE2 3.79Å; F222-F247 HydrophobicContact CZ-CZ 4.08Å; L230-F247 HydrophobicContact CD2-CE1 4.11Å; L230-F247 HydrophobicContact CD2-CZ 3.77Å; V245-F247 HydrophobicContact CB-CD1 4.26Å; V245-F247 HydrophobicContact CB-CE1 4.21Å; V245-F247 HydrophobicContact CG1-CD1 4.2Å; V245-F247 HydrophobicContact CG1-CE1 4.47Å; V245-F247 WeakPolarHBondContact O-CD1 3.15Å; V245-F247 PolarHBondContact O-N 3.09Å; F247-F258 HydrophobicContact CD1-CE1 4.49Å; F247-F258 AromaticContact CD1-CE2 3.9Å; F247-F258 HydrophobicContact CD1-CE2 3.9Å; F247-F258 AromaticContact CD1-CZ 3.53Å; F247-F258 HydrophobicContact CD1-CZ 3.53Å; F247-F258 HydrophobicContact CE1-CD2 4.46Å; F247-F258 AromaticContact CE1-CE2 3.32Å; F247-F258 HydrophobicContact CE1-CE2 3.32Å; F247-F258 AromaticContact CE1-CZ 3.45Å; F247-F258 HydrophobicContact CE1-CZ 3.45Å; F247-F258 VanDerWaalsContact CE1-CZ 3.45Å; F247-F258 HydrophobicContact CE2-CZ 4.43Å; F247-F258 HydrophobicContact CG-CZ 4.09Å; F247-F258 AromaticContact CZ-CE2 3.72Å; F247-F258 HydrophobicContact CZ-CE2 3.72Å; F247-F258 AromaticContact CZ-CZ 3.91Å; F247-F258 HydrophobicContact CZ-CZ 3.91Å; F247-H283 AromaticContact CD2-ND1 3.94Å; F247-H283 HydrophobicContact CE2-CB 4.25Å
248	D	97.8	Very high	98.2	Very high	69 Å²	69	50 Å²	50	37%	0.369	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-27	176.2	-64.7	-12.8	0	0	0	112	H101 K102 D246	H101-D248 IonicContact CE1-OD2 2.78Å; H101-D248 PolarHBondContact CE1-OD2 3.44Å; H101-D248 IonicContact NE2-OD2 3.58Å; H101-D248 PolarHBondContact NE2-OD2 3.4Å; K102-D248 VanDerWaalsContact CE-CG 3.49Å; K102-D248 WeakPolarHBondContact CE-OD2 3.47Å; K102-D248 VanDerWaalsContact NZ-CG 3.26Å; K102-D248 IonicContact NZ-OD2 3.61Å; K102-D248 PolarHBondContact NZ-OD2 3.2Å; D246-D248 PolarHBondContact O-N 3.07Å; D246-D248 PolarHBondContact OD1-N 3.14Å
249	N	98.1	Very high	98.3	Very high	127 Å²	127	56.5 Å²	56.5	68%	0.679	28%	0.276	S	S	*	.	S	Bend	trans	-148.9	75	179.7	-172.4	28.1	0	0	0	111.6	D246 N251	D246-N249 CarbonylContact O-C 3.44Å; D246-N249 PolarHBondContact O-N 3.43Å; N249-N251 PolarHBondContact O-N 3.42Å
250	P	98.1	Very high	98.3	Very high	18 Å²	18	61.7 Å²	61.7	12%	0.117	30%	0.304	C	S	.	.			trans	-66.5	125.1	-174.1	-21.1	32.9	0	0	0	112.3	V245 D246 Y252 F258	V245-P250 HydrophobicContact CG1-CB 3.88Å; V245-P250 HydrophobicContact CG1-CG 4.46Å; D246-P250 VanDerWaalsContact O-CA 3.26Å; D246-P250 WeakPolarHBondContact O-CA 3.28Å; D246-P250 WeakPolarHBondContact O-CD 3.34Å; D246-P250 WeakPolarHBondContact O-CG 3.36Å; P250-Y252 HydrophobicContact CB-CD1 4.42Å; P250-Y252 HydrophobicContact CB-CE1 3.9Å; P250-Y252 HydrophobicContact CB-CE2 4.17Å; P250-Y252 WeakPolarHBondContact O-CD2 3.43Å; P250-Y252 PolarHBondContact O-N 3.22Å; P250-Y252 VanDerWaalsContact O-N 3.14Å; P250-F258 HydrophobicContact CB-CD1 3.65Å; P250-F258 HydrophobicContact CB-CE1 3.82Å; P250-F258 HydrophobicContact CG-CD1 3.92Å; P250-F258 HydrophobicContact CG-CE1 3.55Å
251	N	98.4	Very high	98.3	Very high	78 Å²	78	61.2 Å²	61.2	42%	0.417	30%	0.302	S	S	.	.			trans	-80.2	93.1	171.6	-176.1	-26.5	0	0	0	110.3	N249 E253 K254 F255	N249-N251 PolarHBondContact O-N 3.42Å; N251-E253 VanDerWaalsContact C-N 3.28Å; N251-E253 PolarHBondContact O-N 3.02Å; N251-E253 WeakPolarHBondContact OD1-CB 3.41Å; N251-E253 PolarHBondContact OD1-N 2.7Å; N251-E253 VanDerWaalsContact OD1-N 3.07Å; N251-K254 HydrophobicContact CB-CB 4.37Å; N251-K254 PolarHBondContact O-N 2.89Å; N251-K254 PolarHBondContact OD1-N 2.98Å; N251-F255 HydrophobicContact CB-CD2 4.31Å; N251-F255 WeakPolarHBondContact O-CB 3.37Å; N251-F255 WeakPolarHBondContact O-CD2 3.27Å; N251-F255 PolarHBondContact O-N 3.35Å
252	Y	98.2	Very high	98.3	Very high	77 Å²	77	60.6 Å²	60.6	30%	0.302	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.7	-178.9	-63.4	-64.1	0	0	0	115.2	S39 P250 P256 F258 K259	S39-Y252 VanDerWaalsContact CB-OH 3.25Å; S39-Y252 WeakPolarHBondContact CB-OH 3.33Å; S39-Y252 PolarHBondContact OG-OH 3.5Å; P250-Y252 HydrophobicContact CB-CD1 4.42Å; P250-Y252 HydrophobicContact CB-CE1 3.9Å; P250-Y252 HydrophobicContact CB-CE2 4.17Å; P250-Y252 WeakPolarHBondContact O-CD2 3.43Å; P250-Y252 PolarHBondContact O-N 3.22Å; P250-Y252 VanDerWaalsContact O-N 3.14Å; Y252-P256 VanDerWaalsContact O-CA 3.22Å; Y252-P256 WeakPolarHBondContact O-CA 3.42Å; Y252-F258 AromaticContact CE1-CD1 3.96Å; Y252-F258 HydrophobicContact CE1-CD1 3.96Å; Y252-K259 HydrophobicContact CD1-CD 4.22Å; Y252-K259 HydrophobicContact CD1-CG 3.42Å; Y252-K259 VanDerWaalsContact CD1-CG 3.42Å; Y252-K259 HydrophobicContact CE1-CG 3.57Å; Y252-K259 HydrophobicContact CG-CG 4.21Å
253	E	97.9	Very high	98.3	Very high	186 Å²	186	60.3 Å²	60.3	87%	0.869	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-41.2	172.1	-63.4	-177.9	171.6	0	0	110.2	N251	N251-E253 VanDerWaalsContact C-N 3.28Å; N251-E253 PolarHBondContact O-N 3.02Å; N251-E253 WeakPolarHBondContact OD1-CB 3.41Å; N251-E253 PolarHBondContact OD1-N 2.7Å; N251-E253 VanDerWaalsContact OD1-N 3.07Å
254	K	97.6	Very high	98.3	Very high	126 Å²	126	63.4 Å²	63.4	55%	0.548	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-34.1	176.6	-168.2	177.7	172.1	-171.4	0	112.6	N251 P256	N251-K254 HydrophobicContact CB-CB 4.37Å; N251-K254 PolarHBondContact O-N 2.89Å; N251-K254 PolarHBondContact OD1-N 2.98Å; K254-P256 VanDerWaalsContact C-CD 3.41Å; K254-P256 WeakPolarHBondContact O-CD 3.42Å
255	F	98.5	Very high	98.4	Very high	13 Å²	13	62.3 Å²	62.3	6%	0.057	31%	0.309	C	S	.	.			trans	-126.8	60.6	-172.4	-50.5	-56.4	0	0	0	112.1	Y231 Q244 V245 N251 N257 F258	Y231-F255 AromaticContact CD1-CD1 3.8Å; Y231-F255 HydrophobicContact CD1-CD1 3.8Å; Y231-F255 HydrophobicContact CD1-CE1 4.45Å; Y231-F255 HydrophobicContact CD2-CB 3.63Å; Y231-F255 AromaticContact CD2-CD1 3.63Å; Y231-F255 HydrophobicContact CD2-CD1 3.63Å; Y231-F255 AromaticContact CD2-CG 3.96Å; Y231-F255 HydrophobicContact CD2-CG 3.96Å; Y231-F255 HydrophobicContact CE1-CD1 4.31Å; Y231-F255 HydrophobicContact CE2-CB 3.56Å; Y231-F255 HydrophobicContact CE2-CD1 4.17Å; Y231-F255 HydrophobicContact CE2-CG 4.32Å; Y231-F255 HydrophobicContact CG-CB 4.32Å; Y231-F255 AromaticContact CG-CD1 3.41Å; Y231-F255 HydrophobicContact CG-CD1 3.41Å; Y231-F255 VanDerWaalsContact CG-CD1 3.41Å; Y231-F255 HydrophobicContact CG-CE1 4.1Å; Y231-F255 HydrophobicContact CG-CG 4.22Å; Q244-F255 HydrophobicContact CB-CE1 3.79Å; Q244-F255 HydrophobicContact CB-CE2 4.31Å; Q244-F255 HydrophobicContact CB-CZ 3.45Å; Q244-F255 VanDerWaalsContact CB-CZ 3.45Å; Q244-F255 WeakPolarHBondContact O-CE2 3.2Å; V245-F255 HydrophobicContact CB-CD2 4.36Å; V245-F255 HydrophobicContact CG1-CD2 4.44Å; V245-F255 HydrophobicContact CG2-CB 3.92Å; V245-F255 HydrophobicContact CG2-CD1 4.33Å; V245-F255 HydrophobicContact CG2-CD2 3.82Å; V245-F255 HydrophobicContact CG2-CE2 4.38Å; V245-F255 HydrophobicContact CG2-CG 3.77Å; N251-F255 HydrophobicContact CB-CD2 4.31Å; N251-F255 WeakPolarHBondContact O-CB 3.37Å; N251-F255 WeakPolarHBondContact O-CD2 3.27Å; N251-F255 PolarHBondContact O-N 3.35Å; F255-N257 VanDerWaalsContact C-N 3.33Å; F255-N257 PolarHBondContact O-N 2.98Å; F255-F258 HydrophobicContact CB-CB 4.4Å; F255-F258 WeakPolarHBondContact O-CB 3.23Å; F255-F258 PolarHBondContact O-N 3.42Å; F255-F258 VanDerWaalsContact O-N 3.15Å
256	P	98.2	Very high	98.4	Very high	63 Å²	63	62.2 Å²	62.2	41%	0.409	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-61.1	-36	-171.1	22.9	-34.6	0	0	0	114.1	Y231 Y252 K254 F258 K259	Y231-P256 WeakPolarHBondContact OH-CD 3.29Å; Y252-P256 VanDerWaalsContact O-CA 3.22Å; Y252-P256 WeakPolarHBondContact O-CA 3.42Å; K254-P256 VanDerWaalsContact C-CD 3.41Å; K254-P256 WeakPolarHBondContact O-CD 3.42Å; P256-F258 PolarHBondContact O-N 3.5Å; P256-K259 WeakPolarHBondContact O-CG 3.47Å; P256-K259 PolarHBondContact O-N 3.39Å
257	N	98.4	Very high	98.4	Very high	62 Å²	62	59.5 Å²	59.5	33%	0.332	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-70.9	-14	-178.5	-67.9	-18.5	0	0	0	113.1	E228 C229 Y231 F255 K259 N260	E228-N257 WeakPolarHBondContact O-CB 3.44Å; E228-N257 PolarHBondContact O-ND2 3.34Å; C229-N257 HydrophobicContact CB-CB 4.49Å; C229-N257 PolarHBondContact SG-O 2.85Å; C229-N257 VanDerWaalsContact SG-O 3.36Å; Y231-N257 HydrophobicContact CE2-CB 4.15Å; Y231-N257 VanDerWaalsContact OH-CB 3.29Å; Y231-N257 WeakPolarHBondContact OH-CB 3.39Å; Y231-N257 PolarHBondContact OH-N 3.21Å; F255-N257 VanDerWaalsContact C-N 3.33Å; F255-N257 PolarHBondContact O-N 2.98Å; N257-K259 PolarHBondContact O-N 3.23Å; N257-K259 VanDerWaalsContact O-N 3.11Å; N257-N260 WeakPolarHBondContact O-CB 3.47Å; N257-N260 PolarHBondContact O-N 3.03Å
258	F	98.7	Very high	98.4	Very high	1 Å²	1	59 Å²	59	0%	0.004	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-60.6	-22.5	176.1	-170.6	-107.7	0	0	0	112.3	F40 C229 L230 V245 F247 P250 Y252 F255 P256 N260 V261	F40-F258 HydrophobicContact CD1-CE1 4.04Å; F40-F258 HydrophobicContact CD1-CE2 4.46Å; F40-F258 AromaticContact CD1-CZ 3.62Å; F40-F258 HydrophobicContact CD1-CZ 3.62Å; F40-F258 HydrophobicContact CE1-CE1 4.47Å; F40-F258 AromaticContact CE1-CZ 3.78Å; F40-F258 HydrophobicContact CE1-CZ 3.78Å; C229-F258 WeakPolarHBondContact O-CA 3.39Å; C229-F258 WeakPolarHBondContact O-CD2 3.18Å; L230-F258 HydrophobicContact CD2-CD2 4.36Å; L230-F258 HydrophobicContact CD2-CE2 4Å; V245-F258 HydrophobicContact CB-CD2 4.24Å; V245-F258 HydrophobicContact CB-CE2 4.32Å; V245-F258 HydrophobicContact CG1-CD1 3.77Å; V245-F258 HydrophobicContact CG1-CD2 3.9Å; V245-F258 HydrophobicContact CG1-CE1 3.86Å; V245-F258 HydrophobicContact CG1-CE2 3.98Å; V245-F258 HydrophobicContact CG1-CG 3.79Å; V245-F258 HydrophobicContact CG1-CZ 3.95Å; V245-F258 HydrophobicContact CG2-CB 4.47Å; V245-F258 HydrophobicContact CG2-CD2 4.01Å; V245-F258 HydrophobicContact CG2-CG 4.27Å; F247-F258 HydrophobicContact CD1-CE1 4.49Å; F247-F258 AromaticContact CD1-CE2 3.9Å; F247-F258 HydrophobicContact CD1-CE2 3.9Å; F247-F258 AromaticContact CD1-CZ 3.53Å; F247-F258 HydrophobicContact CD1-CZ 3.53Å; F247-F258 HydrophobicContact CE1-CD2 4.46Å; F247-F258 AromaticContact CE1-CE2 3.32Å; F247-F258 HydrophobicContact CE1-CE2 3.32Å; F247-F258 AromaticContact CE1-CZ 3.45Å; F247-F258 HydrophobicContact CE1-CZ 3.45Å; F247-F258 VanDerWaalsContact CE1-CZ 3.45Å; F247-F258 HydrophobicContact CE2-CZ 4.43Å; F247-F258 HydrophobicContact CG-CZ 4.09Å; F247-F258 AromaticContact CZ-CE2 3.72Å; F247-F258 HydrophobicContact CZ-CE2 3.72Å; F247-F258 AromaticContact CZ-CZ 3.91Å; F247-F258 HydrophobicContact CZ-CZ 3.91Å; P250-F258 HydrophobicContact CB-CD1 3.65Å; P250-F258 HydrophobicContact CB-CE1 3.82Å; P250-F258 HydrophobicContact CG-CD1 3.92Å; P250-F258 HydrophobicContact CG-CE1 3.55Å; Y252-F258 AromaticContact CE1-CD1 3.96Å; Y252-F258 HydrophobicContact CE1-CD1 3.96Å; F255-F258 HydrophobicContact CB-CB 4.4Å; F255-F258 WeakPolarHBondContact O-CB 3.23Å; F255-F258 PolarHBondContact O-N 3.42Å; F255-F258 VanDerWaalsContact O-N 3.15Å; P256-F258 PolarHBondContact O-N 3.5Å; F258-N260 PolarHBondContact O-N 3.44Å; F258-N260 VanDerWaalsContact O-N 3.16Å; F258-V261 HydrophobicContact CD2-CB 4.24Å; F258-V261 HydrophobicContact CD2-CG1 3.98Å; F258-V261 HydrophobicContact CE2-CB 4.37Å; F258-V261 HydrophobicContact CE2-CG1 3.78Å; F258-V261 HydrophobicContact CE2-CG2 4.47Å; F258-V261 HydrophobicContact CG-CG1 4.44Å; F258-V261 HydrophobicContact CZ-CG1 4.08Å; F258-V261 WeakPolarHBondContact O-CB 3.23Å; F258-V261 WeakPolarHBondContact O-CG1 3.17Å; F258-V261 PolarHBondContact O-N 2.94Å
259	K	98.3	Very high	98.4	Very high	138 Å²	138	56 Å²	56	60%	0.6	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-59.6	-22.7	171.6	-63.9	179.1	-174.7	173.2	0	113.8	Y252 P256 N257	Y252-K259 HydrophobicContact CD1-CD 4.22Å; Y252-K259 HydrophobicContact CD1-CG 3.42Å; Y252-K259 VanDerWaalsContact CD1-CG 3.42Å; Y252-K259 HydrophobicContact CE1-CG 3.57Å; Y252-K259 HydrophobicContact CG-CG 4.21Å; P256-K259 WeakPolarHBondContact O-CG 3.47Å; P256-K259 PolarHBondContact O-N 3.39Å; N257-K259 PolarHBondContact O-N 3.23Å; N257-K259 VanDerWaalsContact O-N 3.11Å
260	N	98.4	Very high	98.5	Very high	110 Å²	110	53 Å²	53	59%	0.588	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-100.2	0.6	-174.8	-54.4	-37.2	0	0	0	112.6	N257 F258	N257-N260 WeakPolarHBondContact O-CB 3.47Å; N257-N260 PolarHBondContact O-N 3.03Å; F258-N260 PolarHBondContact O-N 3.44Å; F258-N260 VanDerWaalsContact O-N 3.16Å
261	V	98.6	Very high	98.5	Very high	1 Å²	1	53 Å²	53	1%	0.006	27%	0.269	C	S	.	.			trans	-68.6	139.2	-177.6	81	0	0	0	0	110.3	F40 F222 C229 L230 F258	F40-V261 HydrophobicContact CB-CG1 3.41Å; F40-V261 VanDerWaalsContact CB-CG1 3.41Å; F40-V261 HydrophobicContact CD1-CG1 3.79Å; F40-V261 HydrophobicContact CG-CG1 3.69Å; F222-V261 HydrophobicContact CD1-CG2 3.45Å; F222-V261 VanDerWaalsContact CD1-CG2 3.45Å; F222-V261 HydrophobicContact CE1-CG1 4.39Å; F222-V261 HydrophobicContact CE1-CG2 3.58Å; F222-V261 HydrophobicContact CG-CG2 4.29Å; C229-V261 HydrophobicContact CB-CB 4.1Å; C229-V261 HydrophobicContact CB-CG2 4.17Å; L230-V261 HydrophobicContact CD2-CG2 4.13Å; L230-V261 HydrophobicContact CG-CG2 4.26Å; F258-V261 HydrophobicContact CD2-CB 4.24Å; F258-V261 HydrophobicContact CD2-CG1 3.98Å; F258-V261 HydrophobicContact CE2-CB 4.37Å; F258-V261 HydrophobicContact CE2-CG1 3.78Å; F258-V261 HydrophobicContact CE2-CG2 4.47Å; F258-V261 HydrophobicContact CG-CG1 4.44Å; F258-V261 HydrophobicContact CZ-CG1 4.08Å; F258-V261 WeakPolarHBondContact O-CB 3.23Å; F258-V261 WeakPolarHBondContact O-CG1 3.17Å; F258-V261 PolarHBondContact O-N 2.94Å
262	V	98.8	Very high	98.5	Very high	45 Å²	45	50 Å²	50	27%	0.273	25%	0.253	S	S	.	.			trans	-132.8	119.5	176.3	-177.7	0	0	0	0	108.8	P41 Q226	P41-V262 HydrophobicContact CG-CG1 4.39Å; P41-V262 HydrophobicContact CG-CG2 4.14Å; Q226-V262 PolarHBondContact NE2-O 2.83Å; Q226-V262 PolarHBondContact OE1-O 2.88Å
263	G	98.8	Very high	98.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	163.4	-178.1	0	0	0	0	0	114.1	P41 T42 K43 L221 F222	P41-G263 PolarHBondContact O-N 3.37Å; T42-G263 CarbonylContact C-O 3.59Å; T42-G263 WeakPolarHBondContact CA-O 3.24Å; K43-G263 PolarHBondContact N-O 3.47Å; L221-G263 CarbonylContact O-C 3.45Å; L221-G263 WeakPolarHBondContact O-CA 3.41Å; F222-G263 VanDerWaalsContact CE1-CA 3.46Å
264	Y	98.9	Very high	98.6	Very high	74 Å²	74	37.4 Å²	37.4	29%	0.29	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.6	165.9	-71.9	-101.7	0	0	0	107.8	K43 I220 L221 P223 W280	K43-Y264 HydrophobicContact CB-CD1 4.39Å; K43-Y264 CarbonylContact O-C 3.53Å; K43-Y264 VanDerWaalsContact O-CA 3.23Å; K43-Y264 WeakPolarHBondContact O-CA 3.37Å; I220-Y264 CarbonylContact C-O 3.43Å; I220-Y264 WeakPolarHBondContact CA-O 3.48Å; L221-Y264 PolarHBondContact N-O 3.18Å; L221-Y264 PolarHBondContact O-N 3.05Å; P223-Y264 HydrophobicContact CG-CE2 4.29Å; Y264-W280 HydrophobicContact CD2-CH2 4.26Å; Y264-W280 AromaticContact CD2-CZ3 3.87Å; Y264-W280 HydrophobicContact CD2-CZ3 3.87Å; Y264-W280 HydrophobicContact CE2-CH2 4.33Å; Y264-W280 HydrophobicContact CE2-CZ3 4.34Å; Y264-W280 HydrophobicContact CG-CZ3 4.23Å
265	E	98.7	Very high	98.7	Very high	27 Å²	27	31.4 Å²	31.4	13%	0.126	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139	-166	-178.3	-176.8	165.1	0	0	112.8	T42 K43 P44 I45 R218 C219 I220	T42-E265 WeakPolarHBondContact CB-OE2 3.08Å; T42-E265 HydrophobicContact CG2-CB 4.16Å; T42-E265 WeakPolarHBondContact CG2-OE2 3.37Å; T42-E265 PolarHBondContact OG1-OE2 2.91Å; K43-E265 PolarHBondContact O-N 3.44Å; P44-E265 CarbonylContact C-O 3.58Å; P44-E265 WeakPolarHBondContact CA-O 3.47Å; I45-E265 PolarHBondContact N-O 3.44Å; R218-E265 HydrophobicContact CG-CG 4.26Å; R218-E265 IonicContact CZ-OE1 3.81Å; R218-E265 VanDerWaalsContact CZ-OE1 3.22Å; R218-E265 IonicContact CZ-OE2 3.86Å; R218-E265 VanDerWaalsContact NE-CD 3.32Å; R218-E265 IonicContact NE-OE1 2.87Å; R218-E265 PolarHBondContact NE-OE1 2.83Å; R218-E265 IonicContact NE-OE2 3.79Å; R218-E265 VanDerWaalsContact NH2-CD 3.3Å; R218-E265 IonicContact NH2-OE1 3.93Å; R218-E265 PolarHBondContact NH2-OE1 3.12Å; R218-E265 IonicContact NH2-OE2 3.31Å; R218-E265 PolarHBondContact NH2-OE2 3.24Å; R218-E265 VanDerWaalsContact NH2-OE2 3.1Å; C219-E265 VanDerWaalsContact O-CA 3.32Å; C219-E265 WeakPolarHBondContact O-CA 3.36Å; I220-E265 HydrophobicContact CG1-CG 4.26Å
266	A	98.5	Very high	98.7	Very high	9 Å²	9	31 Å²	31	7%	0.074	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	152.2	161.7	0	0	0	0	0	111.3	I45 V66 C219	I45-A266 HydrophobicContact CB-CB 3.96Å; I45-A266 HydrophobicContact CD1-CB 4.25Å; V66-A266 HydrophobicContact CG2-CB 3.71Å; C219-A266 PolarHBondContact N-O 2.98Å; C219-A266 PolarHBondContact O-N 3.37Å
267	V	98.8	Very high	98.7	Very high	14 Å²	14	28 Å²	28	9%	0.085	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.6	160.7	-178.5	0	0	0	0	108.4	W30 F35 R47 H216 K217 R218 L287	W30-V267 HydrophobicContact CD2-CG1 4.35Å; W30-V267 HydrophobicContact CD2-CG2 4.38Å; W30-V267 HydrophobicContact CG-CG1 4.4Å; W30-V267 HydrophobicContact CH2-CG2 4.07Å; W30-V267 HydrophobicContact CZ2-CB 3.81Å; W30-V267 HydrophobicContact CZ2-CG1 4.35Å; W30-V267 HydrophobicContact CZ2-CG2 3.82Å; W30-V267 HydrophobicContact CZ3-CG2 4.46Å; F35-V267 HydrophobicContact CE1-CG2 3.65Å; F35-V267 HydrophobicContact CE2-CG2 4.44Å; F35-V267 HydrophobicContact CZ-CG2 3.36Å; R47-V267 PolarHBondContact NH1-O 3.06Å; H216-V267 HydrophobicContact CB-CG1 3.91Å; K217-V267 CarbonylContact O-C 3.49Å; K217-V267 WeakPolarHBondContact O-CA 3.39Å; R218-V267 HydrophobicContact CB-CG2 4.15Å; R218-V267 HydrophobicContact CG-CG2 4.31Å; V267-L287 HydrophobicContact CG1-CD1 4.2Å
268	V	98.8	Very high	98.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.3	171.7	-66.5	0	0	0	0	110.3	V66 F210 Q212 H216 K217 D272 L274	V66-V268 HydrophobicContact CG1-CG1 4.24Å; V66-V268 HydrophobicContact CG2-CG1 4.1Å; F210-V268 HydrophobicContact CD1-CG2 4.39Å; F210-V268 HydrophobicContact CE1-CG2 4.16Å; Q212-V268 HydrophobicContact CB-CB 4.14Å; Q212-V268 HydrophobicContact CB-CG2 3.98Å; Q212-V268 HydrophobicContact CG-CB 4.44Å; Q212-V268 HydrophobicContact CG-CG2 4.13Å; H216-V268 WeakPolarHBondContact CA-O 3.49Å; K217-V268 HydrophobicContact CB-CG2 4.07Å; K217-V268 PolarHBondContact N-O 3.18Å; K217-V268 WeakPolarHBondContact O-CG2 3.35Å; K217-V268 PolarHBondContact O-N 3.37Å; V268-D272 WeakPolarHBondContact CA-OD2 3.1Å; V268-D272 HydrophobicContact CB-CB 3.93Å; V268-D272 HydrophobicContact CG1-CB 4.12Å; V268-L274 HydrophobicContact CG1-CB 3.95Å
269	G	98.7	Very high	98.7	Very high	6 Å²	6	27.6 Å²	27.6	6%	0.062	15%	0.145	C	C	.	.			trans	-116.8	-177.3	175.1	0	0	0	0	0	112.5	Q212 H216 G271 D272	Q212-G269 VanDerWaalsContact CB-O 3.28Å; Q212-G269 WeakPolarHBondContact CB-O 3.27Å; Q212-G269 VanDerWaalsContact CG-O 3.32Å; Q212-G269 WeakPolarHBondContact CG-O 3.47Å; H216-G269 VanDerWaalsContact CD2-CA 3.45Å; H216-G269 WeakPolarHBondContact CD2-CA 3.47Å; G269-G271 PolarHBondContact O-N 3.34Å; G269-D272 PolarHBondContact N-OD2 2.72Å; G269-D272 WeakPolarHBondContact O-CB 3.32Å; G269-D272 PolarHBondContact O-N 2.93Å; G269-D272 VanDerWaalsContact O-N 3.07Å
270	P	98.7	Very high	98.8	Very high	66 Å²	66	22 Å²	22	43%	0.429	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	122.6	-179.8	-28.5	37.2	0	0	0	113.3	I213	I213-P270 WeakPolarHBondContact O-CB 3.26Å
271	G	98.6	Very high	98.8	Very high	17 Å²	17	16.9 Å²	16.9	18%	0.175	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.7	-18.8	179.3	0	0	0	0	0	115.1	Q212 G269	Q212-G271 PolarHBondContact O-N 3.44Å; G269-G271 PolarHBondContact O-N 3.34Å
272	D	98.9	Very high	98.8	Very high	14 Å²	14	17 Å²	17	8%	0.075	9%	0.093	C	C	.	.			trans	-67.1	143.2	174.7	-73	-28.6	0	0	0	111.3	R47 V66 Q212 V268 G269	R47-D272 IonicContact CZ-OD1 3.69Å; R47-D272 IonicContact CZ-OD2 3.32Å; R47-D272 IonicContact NH1-OD1 3.97Å; R47-D272 IonicContact NH1-OD2 2.66Å; R47-D272 PolarHBondContact NH1-OD2 3.42Å; R47-D272 IonicContact NH2-OD1 2.77Å; R47-D272 PolarHBondContact NH2-OD1 2.9Å; R47-D272 IonicContact NH2-OD2 2.9Å; R47-D272 PolarHBondContact NH2-OD2 2.77Å; V66-D272 HydrophobicContact CG1-CB 4.04Å; Q212-D272 PolarHBondContact N-O 2.98Å; V268-D272 WeakPolarHBondContact CA-OD2 3.1Å; V268-D272 HydrophobicContact CB-CB 3.93Å; V268-D272 HydrophobicContact CG1-CB 4.12Å; G269-D272 PolarHBondContact N-OD2 2.72Å; G269-D272 WeakPolarHBondContact O-CB 3.32Å; G269-D272 PolarHBondContact O-N 2.93Å; G269-D272 VanDerWaalsContact O-N 3.07Å
273	V	98.9	Very high	98.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	113.7	170.2	-179.8	0	0	0	0	109.4	V66 L67 T70 L72 F209 F210 A211	V66-V273 WeakPolarHBondContact CA-O 3.43Å; L67-V273 HydrophobicContact CB-CB 4.38Å; L67-V273 PolarHBondContact N-O 3.01Å; L67-V273 PolarHBondContact O-N 3.4Å; T70-V273 HydrophobicContact CG2-CB 4.17Å; T70-V273 HydrophobicContact CG2-CG2 4.12Å; T70-V273 WeakPolarHBondContact OG1-CG2 3.32Å; L72-V273 HydrophobicContact CB-CG2 3.8Å; L72-V273 HydrophobicContact CD2-CG1 4.04Å; L72-V273 HydrophobicContact CD2-CG2 3.88Å; L72-V273 HydrophobicContact CG-CG2 4.48Å; F209-V273 HydrophobicContact CB-CG1 3.92Å; F209-V273 HydrophobicContact CD1-CG1 3.84Å; F209-V273 HydrophobicContact CG-CG1 4.27Å; F210-V273 WeakPolarHBondContact O-CA 3.26Å; A211-V273 HydrophobicContact CB-CG2 4.09Å
274	L	98.9	Very high	98.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.6	170.9	172.5	65.1	0	0	0	109.6	I45 P64 V66 F210 C219 L221 V268 I276	I45-L274 HydrophobicContact CD1-CD1 4.12Å; I45-L274 HydrophobicContact CG2-CD1 4.27Å; P64-L274 HydrophobicContact CB-CD1 4.47Å; V66-L274 HydrophobicContact CG2-CB 4.41Å; V66-L274 HydrophobicContact CG2-CD1 3.79Å; F210-L274 HydrophobicContact CB-CB 4.3Å; F210-L274 WeakPolarHBondContact CB-O 3.36Å; F210-L274 PolarHBondContact N-O 2.58Å; F210-L274 PolarHBondContact O-N 3.42Å; C219-L274 HydrophobicContact CB-CD2 3.56Å; L221-L274 HydrophobicContact CD1-CD2 4.1Å; V268-L274 HydrophobicContact CG1-CB 3.95Å; L274-I276 HydrophobicContact CD2-CD1 4.12Å; L274-I276 HydrophobicContact CD2-CG1 3.79Å; L274-I276 HydrophobicContact CG-CG1 3.79Å; L274-I276 PolarHBondContact O-N 2.94Å
275	Y	98.9	Very high	98.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117	163.8	176.2	-129.9	0	0	0	109.2	I59 E63 P64 V65 W182 Q207 F209 P277	I59-Y275 HydrophobicContact CB-CD1 4.04Å; I59-Y275 HydrophobicContact CB-CE1 4.05Å; I59-Y275 HydrophobicContact CG1-CD1 3.79Å; I59-Y275 HydrophobicContact CG1-CE1 4.33Å; I59-Y275 HydrophobicContact CG1-CG 4.23Å; I59-Y275 HydrophobicContact CG2-CD1 3.82Å; I59-Y275 HydrophobicContact CG2-CD2 4.43Å; I59-Y275 HydrophobicContact CG2-CE1 3.62Å; I59-Y275 HydrophobicContact CG2-CE2 4.29Å; I59-Y275 HydrophobicContact CG2-CG 4.23Å; E63-Y275 VanDerWaalsContact O-CD1 3.27Å; E63-Y275 WeakPolarHBondContact O-CD1 3.49Å; P64-Y275 WeakPolarHBondContact CA-O 3.32Å; V65-Y275 PolarHBondContact O-N 2.98Å; W182-Y275 HydrophobicContact CH2-CD2 4.33Å; W182-Y275 AromaticContact CH2-CE2 3.65Å; W182-Y275 HydrophobicContact CH2-CE2 3.65Å; W182-Y275 AromaticContact CZ2-CE2 3.9Å; W182-Y275 HydrophobicContact CZ2-CE2 3.9Å; Q207-Y275 PolarHBondContact OE1-OH 2.97Å; F209-Y275 HydrophobicContact CD1-CD2 4.09Å; F209-Y275 HydrophobicContact CD1-CG 4.45Å; F209-Y275 AromaticContact CE1-CD2 3.86Å; F209-Y275 HydrophobicContact CE1-CD2 3.86Å; F209-Y275 HydrophobicContact CE1-CG 4.05Å; F209-Y275 HydrophobicContact CZ-CD2 4.32Å; Y275-P277 HydrophobicContact CD1-CG 3.99Å; Y275-P277 HydrophobicContact CE1-CB 3.81Å; Y275-P277 HydrophobicContact CE1-CG 3.58Å; Y275-P277 HydrophobicContact CE2-CB 4.4Å
276	I	98.9	Very high	98.8	Very high	3 Å²	3	11 Å²	11	2%	0.015	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	103.5	172.1	-52.6	178.1	0	0	0	106.4	N208 F210 L221 L274 H282 I284	N208-I276 HydrophobicContact CB-CB 4.17Å; N208-I276 PolarHBondContact N-O 3.03Å; N208-I276 VanDerWaalsContact N-O 3.13Å; N208-I276 PolarHBondContact O-N 3.49Å; F210-I276 HydrophobicContact CB-CD1 3.92Å; F210-I276 HydrophobicContact CB-CG1 4.32Å; F210-I276 HydrophobicContact CD2-CD1 4.18Å; F210-I276 HydrophobicContact CG-CD1 4.19Å; L221-I276 HydrophobicContact CD2-CG1 4.39Å; L221-I276 HydrophobicContact CD2-CG2 4.27Å; L274-I276 HydrophobicContact CD2-CD1 4.12Å; L274-I276 HydrophobicContact CD2-CG1 3.79Å; L274-I276 HydrophobicContact CG-CG1 3.79Å; L274-I276 PolarHBondContact O-N 2.94Å; I276-H282 HydrophobicContact CG2-CB 4.33Å; I276-I284 HydrophobicContact CD1-CD1 4.37Å
277	P	98.9	Very high	98.8	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.013	6%	0.062	C	C	.	.			trans	-68.1	149.4	-177.1	-8.8	21.3	0	0	0	111.2	E62 Y275 Y279 W280	E62-P277 VanDerWaalsContact C-CG 3.47Å; E62-P277 HydrophobicContact CB-CB 4.06Å; E62-P277 VanDerWaalsContact O-CB 3.26Å; E62-P277 WeakPolarHBondContact O-CB 3.25Å; E62-P277 WeakPolarHBondContact O-CG 3.42Å; Y275-P277 HydrophobicContact CD1-CG 3.99Å; Y275-P277 HydrophobicContact CE1-CB 3.81Å; Y275-P277 HydrophobicContact CE1-CG 3.58Å; Y275-P277 HydrophobicContact CE2-CB 4.4Å; P277-Y279 PolarHBondContact O-N 2.82Å; P277-W280 VanDerWaalsContact CB-CD1 3.46Å; P277-W280 HydrophobicContact CB-CG 4.18Å; P277-W280 HydrophobicContact CG-CD2 4.34Å; P277-W280 HydrophobicContact CG-CG 3.98Å; P277-W280 WeakPolarHBondContact O-CB 3.48Å; P277-W280 PolarHBondContact O-N 2.87Å
278	M	98.8	Very high	98.7	Very high	27 Å²	27	12.2 Å²	12.2	13%	0.133	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	138.6	177.4	-172.1	175.3	60.8	0	0	111	Q207 W280	Q207-M278 HydrophobicContact CG-CB 4.16Å; M278-W280 PolarHBondContact O-N 3.48Å
279	Y	98.8	Very high	98.6	Very high	27 Å²	27	18.4 Å²	18.4	11%	0.106	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	-5.1	-173.6	-59	-74.6	0	0	0	117.3	Y203 D204 E205 P277 W281 H316 V319	Y203-Y279 AromaticContact CD2-CD1 3.79Å; Y203-Y279 HydrophobicContact CD2-CD1 3.79Å; Y203-Y279 HydrophobicContact CD2-CE1 4.44Å; Y203-Y279 AromaticContact CE2-CD1 3.93Å; Y203-Y279 HydrophobicContact CE2-CD1 3.93Å; Y203-Y279 HydrophobicContact CE2-CE1 4.24Å; D204-Y279 PolarHBondContact O-N 3.14Å; E205-Y279 HydrophobicContact CG-CE1 3.98Å; P277-Y279 PolarHBondContact O-N 2.82Å; Y279-W281 PolarHBondContact O-N 3.4Å; Y279-H316 HydrophobicContact CD2-CB 3.65Å; Y279-H316 HydrophobicContact CE2-CB 4.44Å; Y279-H316 HydrophobicContact CG-CB 3.96Å; Y279-V319 HydrophobicContact CD1-CG1 4.01Å; Y279-V319 HydrophobicContact CE1-CG1 4.27Å
280	W	98.9	Very high	98.4	Very high	21 Å²	21	19.6 Å²	19.6	8%	0.08	12%	0.115	C	C	.	.			trans	-68.7	130	168.9	-80.4	65.6	0	0	0	110	E62 P64 L221 F222 P223 Y264 P277 M278 H282	E62-W280 PolarHBondContact O-NE1 2.6Å; P64-W280 HydrophobicContact CG-CE3 4.1Å; P64-W280 HydrophobicContact CG-CH2 3.82Å; P64-W280 HydrophobicContact CG-CZ2 4.33Å; P64-W280 HydrophobicContact CG-CZ3 3.69Å; L221-W280 HydrophobicContact CB-CE3 3.99Å; L221-W280 HydrophobicContact CB-CZ3 4.4Å; L221-W280 HydrophobicContact CD2-CE3 4.46Å; F222-W280 VanDerWaalsContact C-CE3 3.46Å; P223-W280 HydrophobicContact CB-CD2 4.45Å; P223-W280 HydrophobicContact CB-CE3 4.3Å; P223-W280 HydrophobicContact CB-CH2 3.78Å; P223-W280 HydrophobicContact CB-CZ2 3.92Å; P223-W280 HydrophobicContact CB-CZ3 3.97Å; P223-W280 HydrophobicContact CG-CH2 4.39Å; P223-W280 HydrophobicContact CG-CZ3 4.39Å; Y264-W280 HydrophobicContact CD2-CH2 4.26Å; Y264-W280 AromaticContact CD2-CZ3 3.87Å; Y264-W280 HydrophobicContact CD2-CZ3 3.87Å; Y264-W280 HydrophobicContact CE2-CH2 4.33Å; Y264-W280 HydrophobicContact CE2-CZ3 4.34Å; Y264-W280 HydrophobicContact CG-CZ3 4.23Å; P277-W280 VanDerWaalsContact CB-CD1 3.46Å; P277-W280 HydrophobicContact CB-CG 4.18Å; P277-W280 HydrophobicContact CG-CD2 4.34Å; P277-W280 HydrophobicContact CG-CG 3.98Å; P277-W280 WeakPolarHBondContact O-CB 3.48Å; P277-W280 PolarHBondContact O-N 2.87Å; M278-W280 PolarHBondContact O-N 3.48Å; W280-H282 PolarHBondContact O-ND1 3.07Å; W280-H282 VanDerWaalsContact O-ND1 3.12Å
281	W	98.9	Very high	98.3	Very high	1 Å²	1	17.8 Å²	17.8	0%	0.004	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	143.6	170.9	-61.2	85.4	0	0	0	108.9	H202 Y203 L221 F222 F227 L230 R241 Y279	H202-W281 CarbonylContact O-C 3.56Å; H202-W281 WeakPolarHBondContact O-CA 3.29Å; Y203-W281 AromaticContact CD1-CD2 3.86Å; Y203-W281 HydrophobicContact CD1-CD2 3.86Å; Y203-W281 AromaticContact CD1-CE2 3.67Å; Y203-W281 AromaticContact CD1-CE3 3.92Å; Y203-W281 HydrophobicContact CD1-CE3 3.92Å; Y203-W281 AromaticContact CD1-CH2 3.62Å; Y203-W281 HydrophobicContact CD1-CH2 3.62Å; Y203-W281 AromaticContact CD1-CZ2 3.56Å; Y203-W281 HydrophobicContact CD1-CZ2 3.56Å; Y203-W281 AromaticContact CD1-CZ3 3.79Å; Y203-W281 HydrophobicContact CD1-CZ3 3.79Å; Y203-W281 AromaticContact CE1-CH2 3.7Å; Y203-W281 HydrophobicContact CE1-CH2 3.7Å; Y203-W281 AromaticContact CE1-CZ2 3.72Å; Y203-W281 HydrophobicContact CE1-CZ2 3.72Å; Y203-W281 HydrophobicContact CE1-CZ3 4.24Å; L221-W281 CarbonylContact C-O 3.56Å; L221-W281 WeakPolarHBondContact CA-O 3.41Å; F222-W281 HydrophobicContact CB-CB 3.95Å; F222-W281 HydrophobicContact CB-CG 4.48Å; F222-W281 HydrophobicContact CD2-CB 3.95Å; F222-W281 HydrophobicContact CG-CB 4.44Å; F222-W281 PolarHBondContact N-O 3.46Å; F222-W281 PolarHBondContact O-N 2.78Å; F227-W281 AromaticContact CD2-CZ2 3.82Å; F227-W281 HydrophobicContact CD2-CZ2 3.82Å; F227-W281 HydrophobicContact CE2-CZ2 4.2Å; L230-W281 HydrophobicContact CB-CD2 4.15Å; L230-W281 HydrophobicContact CB-CE3 4.3Å; L230-W281 HydrophobicContact CB-CH2 4.1Å; L230-W281 HydrophobicContact CB-CZ2 3.93Å; L230-W281 HydrophobicContact CB-CZ3 4.29Å; L230-W281 HydrophobicContact CD1-CB 3.83Å; L230-W281 VanDerWaalsContact CD1-CD1 3.45Å; L230-W281 HydrophobicContact CD1-CD2 3.52Å; L230-W281 HydrophobicContact CD1-CE3 4.19Å; L230-W281 HydrophobicContact CD1-CG 3.33Å; L230-W281 HydrophobicContact CG-CD2 4.41Å; R241-W281 WeakPolarHBondContact O-CZ3 3.33Å; Y279-W281 PolarHBondContact O-N 3.4Å
282	H	98.9	Very high	98.2	Very high	4 Å²	4	18 Å²	18	2%	0.019	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	129.8	176.3	50.1	-81.8	0	0	0	110.7	A201 H202 D204 I220 L221 I276 W280	A201-H282 WeakPolarHBondContact CA-O 3.36Å; H202-H282 AromaticContact CD2-NE2 3.79Å; H202-H282 AromaticContact CE1-CD2 3.46Å; H202-H282 PolarHBondContact CE1-CD2 2.97Å; H202-H282 VanDerWaalsContact CE1-CD2 3.46Å; H202-H282 AromaticContact CE1-NE2 3.27Å; H202-H282 PolarHBondContact CE1-NE2 3.12Å; H202-H282 VanDerWaalsContact CE1-NE2 3.27Å; H202-H282 PolarHBondContact N-O 3.03Å; H202-H282 PolarHBondContact ND1-O 3.48Å; H202-H282 AromaticContact NE2-CD2 3.82Å; H202-H282 AromaticContact NE2-CE1 3.82Å; H202-H282 AromaticContact NE2-NE2 3.12Å; H202-H282 PolarHBondContact NE2-NE2 3.18Å; H202-H282 VanDerWaalsContact NE2-NE2 3.12Å; H202-H282 PolarHBondContact O-N 3.29Å; H202-H282 PolarHBondContact O-ND1 2.81Å; D204-H282 IonicContact OD2-CE1 2.65Å; D204-H282 IonicContact OD2-NE2 3.47Å; I220-H282 CarbonylContact O-C 3.42Å; I220-H282 WeakPolarHBondContact O-CA 3.35Å; L221-H282 HydrophobicContact CD1-CB 3.84Å; L221-H282 HydrophobicContact CG-CB 3.99Å; I276-H282 HydrophobicContact CG2-CB 4.33Å; W280-H282 PolarHBondContact O-ND1 3.07Å; W280-H282 VanDerWaalsContact O-ND1 3.12Å
283	H	98.9	Very high	98.2	Very high	4 Å²	4	17.4 Å²	17.4	2%	0.019	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	169.6	170.9	95.9	0	0	0	107.3	Y38 V198 A201 I220 F247 E285	Y38-H283 AromaticContact CE2-NE2 3.56Å; Y38-H283 AromaticContact CZ-CE1 3.78Å; Y38-H283 AromaticContact CZ-NE2 3.38Å; Y38-H283 PolarHBondContact OH-CE1 3.24Å; Y38-H283 VanDerWaalsContact OH-CE1 3.25Å; Y38-H283 PolarHBondContact OH-NE2 3.38Å; V198-H283 WeakPolarHBondContact CG1-CE1 3.08Å; A201-H283 HydrophobicContact CB-CB 4.17Å; I220-H283 HydrophobicContact CB-CB 4.32Å; I220-H283 PolarHBondContact N-O 3.27Å; I220-H283 PolarHBondContact O-N 3.45Å; F247-H283 AromaticContact CD2-ND1 3.94Å; F247-H283 HydrophobicContact CE2-CB 4.25Å; H283-E285 IonicContact NE2-OE2 2.81Å; H283-E285 PolarHBondContact NE2-OE2 2.81Å
284	I	98.9	Very high	98.2	Very high	10 Å²	10	17.4 Å²	17.4	5%	0.051	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126	-172.2	-58.2	-178.4	0	0	0	109	V198 T199 F210 K217 R218 I276	V198-I284 CarbonylContact C-O 3.53Å; V198-I284 WeakPolarHBondContact CA-O 3.36Å; T199-I284 PolarHBondContact N-O 3.09Å; T199-I284 PolarHBondContact O-N 3.2Å; T199-I284 VanDerWaalsContact O-N 3.1Å; F210-I284 HydrophobicContact CD2-CD1 4.34Å; F210-I284 HydrophobicContact CE2-CD1 3.74Å; F210-I284 HydrophobicContact CZ-CD1 3.97Å; F210-I284 HydrophobicContact CZ-CG2 4.26Å; K217-I284 HydrophobicContact CB-CG2 4.17Å; K217-I284 HydrophobicContact CD-CG2 3.8Å; K217-I284 HydrophobicContact CG-CG2 4.28Å; R218-I284 WeakPolarHBondContact O-CA 3.29Å; I276-I284 HydrophobicContact CD1-CD1 4.37Å
285	E	98.6	Very high	98.2	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.009	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.5	176.1	67.6	-173.3	-155.3	0	0	112	R36 Y38 N197 V198 K217 R218 H283	R36-E285 PolarHBondContact N-OE1 3.37Å; Y38-E285 WeakPolarHBondContact CE2-OE2 3.31Å; Y38-E285 PolarHBondContact OH-OE2 3.28Å; N197-E285 CarbonylContact O-C 3.57Å; N197-E285 VanDerWaalsContact O-CA 3.27Å; N197-E285 WeakPolarHBondContact O-CA 3.49Å; V198-E285 HydrophobicContact CG2-CB 3.79Å; K217-E285 CarbonylContact C-O 3.54Å; K217-E285 VanDerWaalsContact CA-O 3.23Å; K217-E285 WeakPolarHBondContact CA-O 3.45Å; R218-E285 HydrophobicContact CB-CG 3.68Å; R218-E285 WeakPolarHBondContact CD-OE1 3.45Å; R218-E285 HydrophobicContact CG-CG 4.34Å; R218-E285 IonicContact CZ-OE1 2.8Å; R218-E285 PolarHBondContact N-O 3.16Å; R218-E285 IonicContact NE-OE1 3.1Å; R218-E285 IonicContact NH1-OE1 3.88Å; R218-E285 PolarHBondContact NH1-OE1 2.78Å; R218-E285 VanDerWaalsContact NH1-OE1 3.14Å; R218-E285 PolarHBondContact O-N 3.12Å; H283-E285 IonicContact NE2-OE2 2.81Å; H283-E285 PolarHBondContact NE2-OE2 2.81Å
286	S	98.8	Very high	98.2	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.021	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	130.7	161.8	-58.5	0	0	0	0	108	M194 G196 N197 T293	M194-S286 VanDerWaalsContact O-CB 3.3Å; M194-S286 WeakPolarHBondContact O-CB 3.45Å; M194-S286 PolarHBondContact O-OG 3.09Å; G196-S286 WeakPolarHBondContact CA-O 3.37Å; G196-S286 PolarHBondContact N-O 2.8Å; G196-S286 VanDerWaalsContact N-O 3.08Å; N197-S286 PolarHBondContact O-N 3.05Å; S286-T293 WeakPolarHBondContact OG-CG2 3.41Å; S286-T293 PolarHBondContact OG-OG1 3.41Å
287	L	98.5	Very high	98.2	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.01	10%	0.104	C	C	.	.	P	Polyproline II helix	trans	-58.3	146.6	-177.4	-61.5	-165.6	0	0	0	111.9	W30 Q34 F35 G196 H216 R218 V267 G290	W30-L287 HydrophobicContact CB-CD1 3.45Å; W30-L287 VanDerWaalsContact CB-CD1 3.45Å; W30-L287 HydrophobicContact CD2-CD1 4.37Å; W30-L287 HydrophobicContact CG-CD1 3.78Å; Q34-L287 HydrophobicContact CB-CB 4.21Å; F35-L287 HydrophobicContact CD1-CD2 3.7Å; F35-L287 HydrophobicContact CE1-CD1 4.11Å; F35-L287 HydrophobicContact CE1-CD2 3.62Å; G196-L287 PolarHBondContact N-O 3.36Å; H216-L287 HydrophobicContact CB-CD1 3.54Å; H216-L287 HydrophobicContact CB-CG 3.8Å; H216-L287 PolarHBondContact O-N 2.96Å; R218-L287 HydrophobicContact CB-CD2 3.74Å; V267-L287 HydrophobicContact CG1-CD1 4.2Å; L287-G290 PolarHBondContact O-N 3Å
288	L	97.6	Very high	98.1	Very high	48 Å²	48	17.3 Å²	17.3	25%	0.251	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	139.5	173.7	-61.9	170.7	0	0	0	109.7	Q34 R36 G290	Q34-L288 HydrophobicContact CB-CB 4.48Å; Q34-L288 WeakPolarHBondContact CB-O 3.25Å; Q34-L288 VanDerWaalsContact CG-O 3.31Å; Q34-L288 WeakPolarHBondContact CG-O 3.36Å; Q34-L288 PolarHBondContact NE2-O 3.47Å; Q34-L288 WeakPolarHBondContact O-CB 3.47Å; Q34-L288 WeakPolarHBondContact O-CG 3.39Å; Q34-L288 PolarHBondContact O-N 3.05Å; Q34-L288 VanDerWaalsContact O-N 3.11Å; R36-L288 HydrophobicContact CG-CD1 4.45Å; L288-G290 PolarHBondContact O-N 3.39Å
289	N	95.1	Very high	98.1	Very high	129 Å²	129	18 Å²	18	69%	0.69	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	22.3	-178.4	-46.9	-50.9	0	0	0	113.8	E195	E195-N289 WeakPolarHBondContact OE2-CA 3.46Å
290	G	95.2	Very high	98.1	Very high	31 Å²	31	16.7 Å²	16.7	32%	0.32	10%	0.099	S	C	.	.			trans	-94.7	-0	-178	0	0	0	0	0	113.9	E195 L287 L288	E195-G290 PolarHBondContact OE2-N 2.95Å; L287-G290 PolarHBondContact O-N 3Å; L288-G290 PolarHBondContact O-N 3.39Å
291	G	95.9	Very high	98.1	Very high	28 Å²	28	21.3 Å²	21.3	29%	0.289	12%	0.119	S	C	.	.			trans	66.3	-166.6	-172.5	0	0	0	0	0	114.1	E195	E195-G291 PolarHBondContact OE2-N 3.26Å
292	V	97.9	Very high	98	Very high	22 Å²	22	22.1 Å²	22.1	13%	0.133	13%	0.128	C	C	.	.			trans	-63.9	136.3	-179.1	176	0	0	0	0	111.7	I81 M135 V192 G193 I294	I81-V292 HydrophobicContact CD1-CG1 4.17Å; I81-V292 HydrophobicContact CG1-CG1 4.42Å; M135-V292 HydrophobicContact CE-CG2 3.68Å; M135-V292 HydrophobicContact SD-CG2 3.61Å; V192-V292 HydrophobicContact CG1-CG1 3.75Å; G193-V292 WeakPolarHBondContact O-CA 3.39Å; V292-I294 HydrophobicContact CG1-CG1 4.38Å
293	T	98.8	Very high	97.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143	172.7	60.6	0	0	0	0	111.5	V192 G193 K214 H216 K217 S286	V192-T293 WeakPolarHBondContact CA-O 3.38Å; G193-T293 PolarHBondContact N-O 3.37Å; G193-T293 PolarHBondContact O-N 3.41Å; G193-T293 PolarHBondContact O-OG1 3.17Å; K214-T293 CarbonylContact O-C 3.6Å; K214-T293 VanDerWaalsContact O-CA 3.24Å; K214-T293 WeakPolarHBondContact O-CA 3.5Å; H216-T293 WeakPolarHBondContact O-CG2 3.26Å; K217-T293 VanDerWaalsContact CE-OG1 3.29Å; K217-T293 WeakPolarHBondContact CE-OG1 3.32Å; K217-T293 HydrophobicContact CG-CG2 4.13Å; S286-T293 WeakPolarHBondContact OG-CG2 3.41Å; S286-T293 PolarHBondContact OG-OG1 3.41Å
294	I	98.9	Very high	97.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	130.2	174.2	-55.4	174.8	0	0	0	108.3	L84 L190 L191 V192 I213 K214 V292	L84-I294 HydrophobicContact CD1-CD1 4.02Å; L190-I294 HydrophobicContact CD1-CG2 3.9Å; L191-I294 WeakPolarHBondContact O-CA 3.15Å; V192-I294 HydrophobicContact CG1-CG1 4.24Å; V192-I294 HydrophobicContact CG2-CG1 4.28Å; V192-I294 HydrophobicContact CG2-CG2 4.39Å; I213-I294 WeakPolarHBondContact CA-O 3.33Å; I213-I294 HydrophobicContact CB-CB 4.16Å; I213-I294 HydrophobicContact CB-CG2 4Å; I213-I294 WeakPolarHBondContact CB-O 3.12Å; I213-I294 HydrophobicContact CD1-CG2 4.17Å; I213-I294 HydrophobicContact CG2-CB 4.22Å; I213-I294 HydrophobicContact CG2-CG2 4.03Å; I213-I294 PolarHBondContact N-O 3.11Å; K214-I294 HydrophobicContact CB-CB 3.82Å; K214-I294 HydrophobicContact CB-CD1 3.94Å; K214-I294 HydrophobicContact CB-CG1 3.88Å; K214-I294 HydrophobicContact CD-CD1 3.85Å; K214-I294 HydrophobicContact CD-CG1 4.33Å; K214-I294 PolarHBondContact N-O 3.33Å; K214-I294 VanDerWaalsContact N-O 3.08Å; K214-I294 PolarHBondContact O-N 3.26Å; V292-I294 HydrophobicContact CG1-CG1 4.38Å
295	T	98.9	Very high	97.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.7	176.8	-41.4	0	0	0	0	109.4	L191 F210 A211 Q212 K217	L191-T295 PolarHBondContact N-O 3.22Å; L191-T295 PolarHBondContact O-N 2.99Å; F210-T295 HydrophobicContact CD1-CG2 3.63Å; F210-T295 HydrophobicContact CD2-CG2 3.94Å; F210-T295 HydrophobicContact CE1-CG2 3.32Å; F210-T295 HydrophobicContact CE2-CG2 3.66Å; F210-T295 HydrophobicContact CG-CG2 3.94Å; F210-T295 HydrophobicContact CZ-CG2 3.34Å; A211-T295 WeakPolarHBondContact O-CA 3.48Å; A211-T295 WeakPolarHBondContact O-CG2 3.48Å; Q212-T295 PolarHBondContact OE1-OG1 3.06Å; K217-T295 PolarHBondContact NZ-OG1 2.95Å
296	V	98.9	Very high	97.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.6	162.4	171.8	0	0	0	0	109	W79 L153 N188 L189 L190 A211 I213 F298	W79-V296 HydrophobicContact CZ3-CG2 4.14Å; L153-V296 HydrophobicContact CD1-CG2 4.45Å; N188-V296 HydrophobicContact CB-CG1 4.05Å; L189-V296 WeakPolarHBondContact O-CA 3.47Å; L190-V296 HydrophobicContact CD1-CG2 3.91Å; A211-V296 WeakPolarHBondContact CA-O 3.37Å; A211-V296 VanDerWaalsContact CB-O 3.31Å; A211-V296 WeakPolarHBondContact CB-O 3.46Å; A211-V296 PolarHBondContact N-O 3.36Å; A211-V296 PolarHBondContact O-N 3.27Å; I213-V296 HydrophobicContact CD1-CB 4.02Å; I213-V296 HydrophobicContact CD1-CG2 3.57Å; V296-F298 HydrophobicContact CG1-CE2 3.97Å; V296-F298 HydrophobicContact CG1-CZ 4.34Å
297	N	97	Very high	96.9	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	164.8	173.6	81.1	6.3	0	0	0	111.9	N188 L189 N208 F209 F210 W299	N188-N297 VanDerWaalsContact CA-O 3.28Å; N188-N297 WeakPolarHBondContact CA-O 3.29Å; N188-N297 PolarHBondContact ND2-O 2.66Å; L189-N297 WeakPolarHBondContact CA-OD1 3.47Å; L189-N297 WeakPolarHBondContact CB-ND2 3.45Å; L189-N297 WeakPolarHBondContact CB-OD1 3.32Å; L189-N297 PolarHBondContact N-OD1 3.07Å; L189-N297 PolarHBondContact O-N 2.78Å; N208-N297 WeakPolarHBondContact OD1-CB 3.26Å; F209-N297 CarbonylContact O-C 3.55Å; F209-N297 WeakPolarHBondContact O-CA 3.28Å; F210-N297 HydrophobicContact CD2-CB 4.49Å; N297-W299 VanDerWaalsContact ND2-CD2 3.34Å; N297-W299 VanDerWaalsContact ND2-CE3 3.29Å; N297-W299 WeakPolarHBondContact ND2-CH2 3.4Å; N297-W299 WeakPolarHBondContact ND2-CZ2 3.42Å; N297-W299 WeakPolarHBondContact ND2-CZ3 3.37Å
298	F	98.8	Very high	96.7	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	98.9	176.3	-64.5	-109.3	0	0	0	108.6	L72 V73 F168 W170 I173 L185 N188 N208 F209 A211 V296 Y300	L72-F298 HydrophobicContact CD1-CE1 4.32Å; L72-F298 HydrophobicContact CD1-CZ 4.16Å; L72-F298 HydrophobicContact CD2-CD2 3.88Å; L72-F298 HydrophobicContact CD2-CE2 3.68Å; L72-F298 HydrophobicContact CD2-CZ 4.14Å; L72-F298 HydrophobicContact CG-CE2 4Å; L72-F298 HydrophobicContact CG-CZ 4.01Å; V73-F298 HydrophobicContact CG1-CE2 3.78Å; V73-F298 HydrophobicContact CG1-CZ 3.84Å; F168-F298 HydrophobicContact CD2-CE1 4.04Å; F168-F298 AromaticContact CD2-CZ 3.66Å; F168-F298 HydrophobicContact CD2-CZ 3.66Å; F168-F298 AromaticContact CE2-CZ 3.91Å; F168-F298 HydrophobicContact CE2-CZ 3.91Å; W170-F298 HydrophobicContact CH2-CD1 4.34Å; W170-F298 AromaticContact CH2-CE1 3.75Å; W170-F298 HydrophobicContact CH2-CE1 3.75Å; W170-F298 HydrophobicContact CZ3-CD1 4.25Å; W170-F298 AromaticContact CZ3-CE1 3.95Å; W170-F298 HydrophobicContact CZ3-CE1 3.95Å; I173-F298 HydrophobicContact CD1-CB 3.8Å; I173-F298 HydrophobicContact CD1-CD1 3.59Å; I173-F298 HydrophobicContact CD1-CD2 4.41Å; I173-F298 HydrophobicContact CD1-CE1 4.28Å; I173-F298 HydrophobicContact CD1-CG 3.69Å; L185-F298 HydrophobicContact CD1-CB 4.07Å; L185-F298 HydrophobicContact CD1-CD1 4.46Å; N188-F298 WeakPolarHBondContact ND2-CD1 3.41Å; N188-F298 VanDerWaalsContact ND2-CE1 3.35Å; N188-F298 WeakPolarHBondContact ND2-CE1 3.41Å; N188-F298 VanDerWaalsContact ND2-CG 3.3Å; N188-F298 WeakPolarHBondContact ND2-CG 3.41Å; N208-F298 WeakPolarHBondContact CA-O 3.42Å; F209-F298 HydrophobicContact CB-CB 4.28Å; F209-F298 PolarHBondContact N-O 2.79Å; F209-F298 PolarHBondContact O-N 3.17Å; A211-F298 HydrophobicContact CB-CD2 4.48Å; A211-F298 HydrophobicContact CB-CE2 4.01Å; V296-F298 HydrophobicContact CG1-CE2 3.97Å; V296-F298 HydrophobicContact CG1-CZ 4.34Å; F298-Y300 HydrophobicContact CB-CE2 3.92Å
299	W	98.7	Very high	96.6	Very high	41 Å²	41	55.8 Å²	55.8	16%	0.155	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119.5	-177.1	-84.8	-51.4	0	0	0	112.5	L185 T186 S187 L189 D204 Q206 Q207 N297	L185-W299 CarbonylContact C-O 3.6Å; L185-W299 WeakPolarHBondContact CA-O 3.4Å; L185-W299 WeakPolarHBondContact CD1-O 3.32Å; T186-W299 PolarHBondContact N-O 3.02Å; T186-W299 PolarHBondContact OG1-O 3.5Å; S187-W299 PolarHBondContact O-N 2.76Å; L189-W299 HydrophobicContact CB-CE3 4.35Å; L189-W299 HydrophobicContact CB-CH2 4.31Å; L189-W299 HydrophobicContact CB-CZ3 3.72Å; L189-W299 HydrophobicContact CD2-CH2 3.62Å; L189-W299 HydrophobicContact CD2-CZ3 3.82Å; L189-W299 HydrophobicContact CG-CZ3 4.27Å; D204-W299 PolarHBondContact OD2-NE1 2.91Å; Q206-W299 HydrophobicContact CB-CB 4.24Å; Q206-W299 HydrophobicContact CB-CG 4.23Å; Q207-W299 WeakPolarHBondContact O-CA 3.5Å; N297-W299 VanDerWaalsContact ND2-CD2 3.34Å; N297-W299 VanDerWaalsContact ND2-CE3 3.29Å; N297-W299 WeakPolarHBondContact ND2-CH2 3.4Å; N297-W299 WeakPolarHBondContact ND2-CZ2 3.42Å; N297-W299 WeakPolarHBondContact ND2-CZ3 3.37Å
300	Y	98.8	Very high	96.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.7	174.5	-66.6	-95	0	0	0	110.4	I173 Q177 W182 L185 Q206 Q207 F298 G302	I173-Y300 HydrophobicContact CD1-CE2 3.8Å; I173-Y300 WeakPolarHBondContact CD1-OH 3.35Å; I173-Y300 HydrophobicContact CG1-CE2 4.02Å; I173-Y300 WeakPolarHBondContact CG1-OH 3.47Å; Q177-Y300 HydrophobicContact CB-CD1 4.2Å; Q177-Y300 HydrophobicContact CB-CE1 3.93Å; Q177-Y300 VanDerWaalsContact CD-CE1 3.48Å; Q177-Y300 HydrophobicContact CG-CD1 3.69Å; Q177-Y300 HydrophobicContact CG-CE1 3.77Å; W182-Y300 HydrophobicContact CE3-CD2 4.25Å; W182-Y300 HydrophobicContact CE3-CG 4.06Å; W182-Y300 HydrophobicContact CZ3-CD2 4.4Å; L185-Y300 HydrophobicContact CB-CD1 3.99Å; L185-Y300 HydrophobicContact CB-CE1 3.64Å; L185-Y300 HydrophobicContact CD1-CD1 4.46Å; L185-Y300 HydrophobicContact CD1-CD2 4.15Å; L185-Y300 HydrophobicContact CD1-CE1 4.11Å; L185-Y300 HydrophobicContact CD1-CE2 3.75Å; L185-Y300 HydrophobicContact CD1-CG 4.49Å; L185-Y300 HydrophobicContact CG-CE1 4.43Å; Q206-Y300 CarbonylContact C-O 3.56Å; Q206-Y300 WeakPolarHBondContact CA-O 3.27Å; Q206-Y300 VanDerWaalsContact CB-O 3.32Å; Q206-Y300 WeakPolarHBondContact CB-O 3.47Å; Q207-Y300 PolarHBondContact N-O 3.19Å; Q207-Y300 PolarHBondContact O-N 2.82Å; F298-Y300 HydrophobicContact CB-CE2 3.92Å; Y300-G302 PolarHBondContact O-N 2.99Å
301	K	98.3	Very high	96.7	Very high	117 Å²	117	63.7 Å²	63.7	51%	0.509	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-57.7	138.6	166.1	-73.7	-174.3	180	-178.2	0	109.5	G183 P184 T186	G183-K301 PolarHBondContact N-O 3.28Å; P184-K301 HydrophobicContact CG-CD 4.28Å; P184-K301 PolarHBondContact O-N 3.15Å; T186-K301 HydrophobicContact CG2-CD 4.36Å; T186-K301 HydrophobicContact CG2-CG 3.78Å
302	G	96.3	Very high	96.8	Very high	18 Å²	18	68.1 Å²	68.1	19%	0.186	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-59.3	165.5	175.8	0	0	0	0	0	113	Y300	Y300-G302 PolarHBondContact O-N 2.99Å
303	A	95.6	Very high	96.7	Very high	50 Å²	50	68.8 Å²	68.8	41%	0.413	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-59.2	148.4	172.3	0	0	0	0	0	110.7	N181	N181-A303 WeakPolarHBondContact O-CA 3.45Å
304	P	95.4	Very high	96.7	Very high	87 Å²	87	75.8 Å²	75.8	57%	0.565	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-61.7	150.6	175.9	27.4	-35	0	0	0	110.8
305	T	93.9	Very high	96.6	Very high	115 Å²	115	77.1 Å²	77.1	71%	0.706	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-52.6	128.2	174.6	-55.7	0	0	0	0	110.3	I309	T305-I309 HydrophobicContact CG2-CD1 3.68Å
306	P	91.9	Very high	96.6	Very high	79 Å²	79	78.9 Å²	78.9	51%	0.513	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-56.2	142.5	179.2	-26.7	34.6	0	0	0	112	K308	P306-K308 WeakPolarHBondContact CB-O 3.42Å; P306-K308 PolarHBondContact O-N 3.44Å
307	K	93.6	Very high	96.5	Very high	225 Å²	225	80.9 Å²	80.9	98%	0.978	41%	0.409	S	S	*	.	S	Bend	trans	-59.6	-31.5	177.5	-68.9	-174.7	179.1	180	0	112.8
308	K	94.8	Very high	96.6	Very high	164 Å²	164	86.2 Å²	86.2	71%	0.713	43%	0.432	S	S	*	.	S	Bend	trans	-116.6	119.6	175.5	-173.5	-176.7	178.1	-170.8	0	107.9	P306	P306-K308 WeakPolarHBondContact CB-O 3.42Å; P306-K308 PolarHBondContact O-N 3.44Å
309	I	96.6	Very high	96.6	Very high	61 Å²	61	86.4 Å²	86.4	31%	0.313	43%	0.433	S	S	.	.			trans	-83	127.4	175.4	-57.1	-59	0	0	0	108.8	T305 Y311 L313	T305-I309 HydrophobicContact CG2-CD1 3.68Å; I309-Y311 HydrophobicContact CB-CE2 4.25Å; I309-Y311 HydrophobicContact CG2-CD2 4.31Å; I309-Y311 HydrophobicContact CG2-CE2 3.8Å; I309-L313 HydrophobicContact CG2-CD2 3.47Å; I309-L313 VanDerWaalsContact CG2-CD2 3.47Å
310	E	95.7	Very high	96.6	Very high	146 Å²	146	85.7 Å²	85.7	68%	0.682	44%	0.436	S	S	*	.			trans	-92.7	141.9	172.8	-63.2	-174.2	167.7	0	0	110.2
311	Y	96.3	Very high	96.6	Very high	180 Å²	180	89.8 Å²	89.8	71%	0.706	46%	0.457	S	S	*	.	S	Bend	trans	-117.1	147.4	179.1	-73	-90.8	0	0	0	110.3	I309 L313	I309-Y311 HydrophobicContact CB-CE2 4.25Å; I309-Y311 HydrophobicContact CG2-CD2 4.31Å; I309-Y311 HydrophobicContact CG2-CE2 3.8Å; Y311-L313 HydrophobicContact CD1-CD2 3.97Å; Y311-L313 HydrophobicContact CD1-CG 3.92Å; Y311-L313 HydrophobicContact CE1-CD1 4.23Å; Y311-L313 HydrophobicContact CE1-CD2 3.68Å; Y311-L313 HydrophobicContact CE1-CG 3.72Å
312	P	96.7	Very high	96.6	Very high	120 Å²	120	87.7 Å²	87.7	78%	0.779	45%	0.45	S	S	*	.	S	Bend	cis	-69.2	152.1	0.5	30.8	-36	0	0	0	112.9
313	L	97.7	Very high	96.7	Very high	37 Å²	37	87.1 Å²	87.1	19%	0.194	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-63.9	141.6	178.7	-61.8	-178.9	0	0	0	111.2	I309 Y311 Q317 K318 I321	I309-L313 HydrophobicContact CG2-CD2 3.47Å; I309-L313 VanDerWaalsContact CG2-CD2 3.47Å; Y311-L313 HydrophobicContact CD1-CD2 3.97Å; Y311-L313 HydrophobicContact CD1-CG 3.92Å; Y311-L313 HydrophobicContact CE1-CD1 4.23Å; Y311-L313 HydrophobicContact CE1-CD2 3.68Å; Y311-L313 HydrophobicContact CE1-CG 3.72Å; L313-Q317 HydrophobicContact CB-CB 4.29Å; L313-K318 HydrophobicContact CB-CG 4.26Å; L313-K318 WeakPolarHBondContact O-CE 3.44Å; L313-I321 HydrophobicContact CD1-CD1 3.46Å; L313-I321 VanDerWaalsContact CD1-CD1 3.46Å
314	R	97.5	Very high	96.8	Very high	147 Å²	147	88.7 Å²	88.7	56%	0.555	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-67.4	156.8	170.6	-62.4	-178	179.1	-169	-1.2	110.9	E62 H316 Q317 K318	E62-R314 IonicContact OE2-NH1 3.67Å; R314-H316 WeakPolarHBondContact CB-NE2 3.36Å; R314-H316 VanDerWaalsContact CD-NE2 3.29Å; R314-H316 WeakPolarHBondContact CD-NE2 3.34Å; R314-H316 PolarHBondContact O-N 3.07Å; R314-Q317 HydrophobicContact CB-CG 4.32Å; R314-Q317 WeakPolarHBondContact O-CB 3.38Å; R314-Q317 PolarHBondContact O-N 2.95Å; R314-Q317 VanDerWaalsContact O-N 3.09Å; R314-K318 PolarHBondContact O-N 2.87Å
315	A	98.1	Very high	97	Very high	28 Å²	28	88.4 Å²	88.4	23%	0.231	44%	0.437	C	S	.	.	H	α-helix	trans	-57.8	-45.7	-177	0	0	0	0	0	113.2	P224 D225 Q317 K318 V319	P224-A315 HydrophobicContact CB-CB 4.12Å; D225-A315 HydrophobicContact CB-CB 3.67Å; A315-Q317 VanDerWaalsContact C-N 3.25Å; A315-Q317 PolarHBondContact O-N 2.74Å; A315-K318 WeakPolarHBondContact O-CA 3.48Å; A315-K318 WeakPolarHBondContact O-CB 3.35Å; A315-K318 PolarHBondContact O-N 2.96Å; A315-V319 PolarHBondContact O-N 2.98Å
316	H	97.4	Very high	97.2	Very high	38 Å²	38	85 Å²	85	18%	0.176	41%	0.412	C	S	.	.	H	α-helix	trans	-61.4	-31.6	177.8	70.5	93.8	0	0	0	113.2	E62 P224 Y279 R314 V319 A320	E62-H316 IonicContact OE2-NE2 3.15Å; P224-H316 HydrophobicContact CB-CB 4.17Å; P224-H316 HydrophobicContact CG-CB 4.23Å; Y279-H316 HydrophobicContact CD2-CB 3.65Å; Y279-H316 HydrophobicContact CE2-CB 4.44Å; Y279-H316 HydrophobicContact CG-CB 3.96Å; R314-H316 WeakPolarHBondContact CB-NE2 3.36Å; R314-H316 VanDerWaalsContact CD-NE2 3.29Å; R314-H316 WeakPolarHBondContact CD-NE2 3.34Å; R314-H316 PolarHBondContact O-N 3.07Å; H316-V319 PolarHBondContact O-N 3.2Å; H316-A320 PolarHBondContact O-N 3.31Å
317	Q	98.2	Very high	97.5	Very high	41 Å²	41	85 Å²	85	19%	0.192	41%	0.405	C	S	.	.	H	α-helix	trans	-68.2	-37.8	173.7	-62.2	174.9	-53.4	0	0	111.2	L313 R314 A315 A320 I321	L313-Q317 HydrophobicContact CB-CB 4.29Å; R314-Q317 HydrophobicContact CB-CG 4.32Å; R314-Q317 WeakPolarHBondContact O-CB 3.38Å; R314-Q317 PolarHBondContact O-N 2.95Å; R314-Q317 VanDerWaalsContact O-N 3.09Å; A315-Q317 VanDerWaalsContact C-N 3.25Å; A315-Q317 PolarHBondContact O-N 2.74Å; Q317-A320 PolarHBondContact O-N 3.26Å; Q317-I321 WeakPolarHBondContact O-CG1 3.39Å; Q317-I321 PolarHBondContact O-N 3.18Å
318	K	98.5	Very high	97.7	Very high	116 Å²	116	80.3 Å²	80.3	50%	0.504	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-41.3	173.4	-60.9	176.3	-176.5	176	0	111.3	L313 R314 A315 A320 I321 M322	L313-K318 HydrophobicContact CB-CG 4.26Å; L313-K318 WeakPolarHBondContact O-CE 3.44Å; R314-K318 PolarHBondContact O-N 2.87Å; A315-K318 WeakPolarHBondContact O-CA 3.48Å; A315-K318 WeakPolarHBondContact O-CB 3.35Å; A315-K318 PolarHBondContact O-N 2.96Å; K318-A320 VanDerWaalsContact C-N 3.34Å; K318-A320 PolarHBondContact O-N 2.98Å; K318-I321 WeakPolarHBondContact O-CB 3.5Å; K318-I321 PolarHBondContact O-N 3.43Å; K318-M322 WeakPolarHBondContact O-CG 3.5Å; K318-M322 PolarHBondContact O-N 3.13Å
319	V	98.5	Very high	97.9	Very high	5 Å²	5	74.2 Å²	74.2	3%	0.03	36%	0.362	C	S	.	.	H	α-helix	trans	-58	-46.7	172.9	176	0	0	0	0	110.6	Y203 F227 Y279 A315 H316 I321 M322 R323	Y203-V319 HydrophobicContact CE2-CG1 4.36Å; F227-V319 HydrophobicContact CB-CG2 4.32Å; F227-V319 HydrophobicContact CD2-CG1 4.23Å; F227-V319 HydrophobicContact CD2-CG2 3.76Å; F227-V319 HydrophobicContact CE2-CG1 4.15Å; F227-V319 HydrophobicContact CE2-CG2 4.4Å; F227-V319 HydrophobicContact CG-CG2 4.21Å; Y279-V319 HydrophobicContact CD1-CG1 4.01Å; Y279-V319 HydrophobicContact CE1-CG1 4.27Å; A315-V319 PolarHBondContact O-N 2.98Å; H316-V319 PolarHBondContact O-N 3.2Å; V319-I321 VanDerWaalsContact C-N 3.33Å; V319-I321 PolarHBondContact O-N 2.98Å; V319-M322 HydrophobicContact CB-CE 4.45Å; V319-M322 HydrophobicContact CG2-CE 4.09Å; V319-M322 PolarHBondContact O-N 3.04Å; V319-R323 HydrophobicContact CG1-CG 4.42Å; V319-R323 VanDerWaalsContact O-CG 3.32Å; V319-R323 WeakPolarHBondContact O-CG 3.11Å; V319-R323 PolarHBondContact O-N 3.15Å
320	A	98.3	Very high	97.9	Very high	26 Å²	26	71.6 Å²	71.6	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-60.1	-40.1	175.7	0	0	0	0	0	112.8	H316 Q317 K318 N324	H316-A320 PolarHBondContact O-N 3.31Å; Q317-A320 PolarHBondContact O-N 3.26Å; K318-A320 VanDerWaalsContact C-N 3.34Å; K318-A320 PolarHBondContact O-N 2.98Å; A320-N324 WeakPolarHBondContact O-CB 3.36Å; A320-N324 VanDerWaalsContact O-CG 3.27Å; A320-N324 PolarHBondContact O-N 3.22Å; A320-N324 PolarHBondContact O-ND2 2.89Å
321	I	98.6	Very high	97.9	Very high	85 Å²	85	72.6 Å²	72.6	44%	0.436	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-51	174.1	-69.8	166	0	0	0	110.8	L313 Q317 K318 V319 R323 N324 I325	L313-I321 HydrophobicContact CD1-CD1 3.46Å; L313-I321 VanDerWaalsContact CD1-CD1 3.46Å; Q317-I321 WeakPolarHBondContact O-CG1 3.39Å; Q317-I321 PolarHBondContact O-N 3.18Å; K318-I321 WeakPolarHBondContact O-CB 3.5Å; K318-I321 PolarHBondContact O-N 3.43Å; V319-I321 VanDerWaalsContact C-N 3.33Å; V319-I321 PolarHBondContact O-N 2.98Å; I321-R323 VanDerWaalsContact C-N 3.3Å; I321-R323 PolarHBondContact O-N 3.39Å; I321-N324 PolarHBondContact O-N 2.96Å; I321-N324 VanDerWaalsContact O-N 3.09Å; I321-I325 HydrophobicContact CG2-CG1 4.24Å; I321-I325 WeakPolarHBondContact O-CG1 3.42Å; I321-I325 PolarHBondContact O-N 3.38Å
322	M	98.6	Very high	98	Very high	73 Å²	73	68.1 Å²	68.1	36%	0.36	36%	0.356	S	S	.	.	H	α-helix	trans	-56.3	-46.3	179.3	-70	-173.7	-66.1	0	0	111.2	F227 K318 V319 N324 I325 E326	F227-M322 HydrophobicContact CD1-CE 3.58Å; F227-M322 HydrophobicContact CD1-SD 4.4Å; F227-M322 HydrophobicContact CD2-CE 4.27Å; F227-M322 HydrophobicContact CE1-CE 3.59Å; F227-M322 HydrophobicContact CE1-SD 4.09Å; F227-M322 HydrophobicContact CE2-CE 4.27Å; F227-M322 HydrophobicContact CG-CE 3.95Å; F227-M322 HydrophobicContact CZ-CE 3.95Å; K318-M322 WeakPolarHBondContact O-CG 3.5Å; K318-M322 PolarHBondContact O-N 3.13Å; V319-M322 HydrophobicContact CB-CE 4.45Å; V319-M322 HydrophobicContact CG2-CE 4.09Å; V319-M322 PolarHBondContact O-N 3.04Å; M322-N324 VanDerWaalsContact C-N 3.33Å; M322-N324 PolarHBondContact O-N 2.82Å; M322-I325 PolarHBondContact O-N 2.9Å; M322-E326 PolarHBondContact O-N 3Å
323	R	98.5	Very high	98	Very high	6 Å²	6	66 Å²	66	2%	0.023	34%	0.337	C	S	.	.	H	α-helix	trans	-58.8	-43.4	176.4	-69.5	177.9	67.7	61.3	1.5	112.3	Y203 E205 V235 D240 V319 I321 K327	Y203-R323 WeakPolarHBondContact OH-CD 3.49Å; Y203-R323 PolarHBondContact OH-NH1 2.88Å; E205-R323 VanDerWaalsContact CD-NE 3.31Å; E205-R323 IonicContact OE1-CZ 3.54Å; E205-R323 IonicContact OE1-NE 3.93Å; E205-R323 PolarHBondContact OE1-NE 3.13Å; E205-R323 IonicContact OE1-NH2 2.87Å; E205-R323 IonicContact OE2-CZ 3.4Å; E205-R323 IonicContact OE2-NE 3.45Å; E205-R323 IonicContact OE2-NH2 2.77Å; E205-R323 PolarHBondContact OE2-NH2 3.01Å; V235-R323 HydrophobicContact CG2-CB 4.26Å; V235-R323 HydrophobicContact CG2-CG 4.16Å; D240-R323 IonicContact OD1-CZ 3.98Å; D240-R323 IonicContact OD1-NH1 3.51Å; D240-R323 PolarHBondContact OD1-NH1 3.09Å; D240-R323 IonicContact OD1-NH2 2.78Å; D240-R323 IonicContact OD2-CZ 3.48Å; D240-R323 IonicContact OD2-NH1 3.13Å; D240-R323 PolarHBondContact OD2-NH1 3.36Å; D240-R323 IonicContact OD2-NH2 3.5Å; D240-R323 PolarHBondContact OD2-NH2 3.38Å; D240-R323 VanDerWaalsContact OD2-NH2 3.15Å; V319-R323 HydrophobicContact CG1-CG 4.42Å; V319-R323 VanDerWaalsContact O-CG 3.32Å; V319-R323 WeakPolarHBondContact O-CG 3.11Å; V319-R323 PolarHBondContact O-N 3.15Å; I321-R323 VanDerWaalsContact C-N 3.3Å; I321-R323 PolarHBondContact O-N 3.39Å; R323-K327 VanDerWaalsContact O-CG 3.29Å; R323-K327 WeakPolarHBondContact O-CG 3.43Å; R323-K327 PolarHBondContact O-N 3.36Å; R323-K327 VanDerWaalsContact O-N 3.09Å
324	N	98.4	Very high	98	Very high	84 Å²	84	67.6 Å²	67.6	45%	0.449	36%	0.362	S	S	.	.	H	α-helix	trans	-70.5	-36.5	-179.9	-73.6	-25.6	0	0	0	112.5	A320 I321 M322 K327 M328	A320-N324 WeakPolarHBondContact O-CB 3.36Å; A320-N324 VanDerWaalsContact O-CG 3.27Å; A320-N324 PolarHBondContact O-N 3.22Å; A320-N324 PolarHBondContact O-ND2 2.89Å; I321-N324 PolarHBondContact O-N 2.96Å; I321-N324 VanDerWaalsContact O-N 3.09Å; M322-N324 VanDerWaalsContact C-N 3.33Å; M322-N324 PolarHBondContact O-N 2.82Å; N324-K327 PolarHBondContact O-N 3.17Å; N324-M328 WeakPolarHBondContact O-CB 3.26Å; N324-M328 WeakPolarHBondContact O-CG 3.43Å; N324-M328 PolarHBondContact O-N 2.86Å
325	I	98.6	Very high	97.8	Very high	81 Å²	81	63.5 Å²	63.5	42%	0.415	35%	0.352	S	S	.	.	H	α-helix	trans	-60.8	-48.3	173.8	-67.7	-64.4	0	0	0	110.3	I321 M322 K327 M328 L329	I321-I325 HydrophobicContact CG2-CG1 4.24Å; I321-I325 WeakPolarHBondContact O-CG1 3.42Å; I321-I325 PolarHBondContact O-N 3.38Å; M322-I325 PolarHBondContact O-N 2.9Å; I325-K327 PolarHBondContact O-N 3.3Å; I325-M328 PolarHBondContact O-N 2.99Å; I325-L329 HydrophobicContact CG2-CD1 3.97Å; I325-L329 HydrophobicContact CG2-CG 4.36Å; I325-L329 WeakPolarHBondContact O-CB 3.45Å; I325-L329 VanDerWaalsContact O-CG 3.31Å; I325-L329 WeakPolarHBondContact O-CG 3.03Å; I325-L329 PolarHBondContact O-N 2.91Å
326	E	98.4	Very high	97.7	Very high	42 Å²	42	63.6 Å²	63.6	20%	0.196	35%	0.35	C	S	.	.	H	α-helix	trans	-58.3	-48.7	176.8	-73.8	-179.1	-115.4	0	0	111.4	V235 H236 M322 M328 L329 G330 V339	V235-E326 HydrophobicContact CB-CB 3.99Å; V235-E326 HydrophobicContact CG2-CB 3.89Å; V235-E326 HydrophobicContact CG2-CG 4.32Å; V235-E326 WeakPolarHBondContact CG2-OE2 3.29Å; V235-E326 PolarHBondContact N-OE2 3.22Å; H236-E326 PolarHBondContact CE1-O 3.18Å; H236-E326 VanDerWaalsContact CE1-O 3.28Å; M322-E326 PolarHBondContact O-N 3Å; E326-M328 PolarHBondContact O-N 3.07Å; E326-L329 PolarHBondContact O-N 3.38Å; E326-G330 PolarHBondContact O-N 3.42Å; E326-V339 HydrophobicContact CG-CG1 4.45Å
327	K	97.9	Very high	97.6	Very high	81 Å²	81	66.4 Å²	66.4	35%	0.352	36%	0.363	S	S	.	.	H	α-helix	trans	-56.7	-49.4	177.2	-70.9	171.4	-174.8	175.6	0	112.3	V235 R323 N324 I325 L329 G330 E331	V235-K327 HydrophobicContact CG1-CD 4.46Å; V235-K327 HydrophobicContact CG1-CG 3.78Å; R323-K327 VanDerWaalsContact O-CG 3.29Å; R323-K327 WeakPolarHBondContact O-CG 3.43Å; R323-K327 PolarHBondContact O-N 3.36Å; R323-K327 VanDerWaalsContact O-N 3.09Å; N324-K327 PolarHBondContact O-N 3.17Å; I325-K327 PolarHBondContact O-N 3.3Å; K327-L329 VanDerWaalsContact C-N 3.33Å; K327-L329 PolarHBondContact O-N 3.49Å; K327-G330 PolarHBondContact O-N 3.49Å; K327-E331 PolarHBondContact O-N 3.42Å
328	M	98.4	Very high	97.5	Very high	125 Å²	125	69.1 Å²	69.1	62%	0.616	38%	0.376	S	S	*	.	H	α-helix	trans	-62.1	-40.8	-179.6	-73.7	174.6	67.5	0	0	111.8	N324 I325 E326 A332	N324-M328 WeakPolarHBondContact O-CB 3.26Å; N324-M328 WeakPolarHBondContact O-CG 3.43Å; N324-M328 PolarHBondContact O-N 2.86Å; I325-M328 PolarHBondContact O-N 2.99Å; E326-M328 PolarHBondContact O-N 3.07Å; M328-A332 WeakPolarHBondContact O-CB 3.27Å; M328-A332 PolarHBondContact O-N 3.09Å
329	L	98.3	Very high	97.5	Very high	36 Å²	36	64 Å²	64	19%	0.188	35%	0.354	C	S	.	.	H	α-helix	trans	-66.8	-43.1	176	-69.9	178.6	0	0	0	111.6	I325 E326 K327 E331 A332 L333 V339 L342 L343	I325-L329 HydrophobicContact CG2-CD1 3.97Å; I325-L329 HydrophobicContact CG2-CG 4.36Å; I325-L329 WeakPolarHBondContact O-CB 3.45Å; I325-L329 VanDerWaalsContact O-CG 3.31Å; I325-L329 WeakPolarHBondContact O-CG 3.03Å; I325-L329 PolarHBondContact O-N 2.91Å; E326-L329 PolarHBondContact O-N 3.38Å; K327-L329 VanDerWaalsContact C-N 3.33Å; K327-L329 PolarHBondContact O-N 3.49Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 2.98Å; L329-A332 PolarHBondContact O-N 3.37Å; L329-L333 HydrophobicContact CB-CD1 4.43Å; L329-L333 VanDerWaalsContact O-CB 3.28Å; L329-L333 WeakPolarHBondContact O-CB 3.48Å; L329-L333 WeakPolarHBondContact O-CD1 2.88Å; L329-L333 WeakPolarHBondContact O-CG 3.46Å; L329-L333 PolarHBondContact O-N 3.45Å; L329-V339 HydrophobicContact CB-CG1 4.16Å; L329-V339 HydrophobicContact CB-CG2 4.07Å; L329-V339 HydrophobicContact CD1-CG1 4.29Å; L329-L342 HydrophobicContact CD2-CD2 3.87Å; L329-L343 HydrophobicContact CD1-CD2 3.66Å; L329-L343 HydrophobicContact CD1-CG 3.99Å
330	G	97.1	Very high	97.4	Very high	6 Å²	6	65.4 Å²	65.4	6%	0.062	37%	0.369	C	S	.	.	H	α-helix	trans	-59.2	-43.3	177	0	0	0	0	0	112.2	E326 K327 G334	E326-G330 PolarHBondContact O-N 3.42Å; K327-G330 PolarHBondContact O-N 3.49Å; G330-G334 PolarHBondContact O-N 3.28Å
331	E	96.5	Very high	97.4	Very high	168 Å²	168	67.2 Å²	67.2	79%	0.785	38%	0.379	S	S	*	.	H	α-helix	trans	-68.4	-45.6	175.9	-173	171.9	-174.2	0	0	112.3	K327 L329 L333 G334	K327-E331 PolarHBondContact O-N 3.42Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 2.98Å; E331-L333 VanDerWaalsContact C-N 3.34Å; E331-L333 PolarHBondContact O-N 3.49Å; E331-G334 PolarHBondContact O-N 3.5Å
332	A	97.8	Very high	97.4	Very high	86 Å²	86	66 Å²	66	71%	0.711	37%	0.373	S	S	*	.	H	α-helix	trans	-67.3	-32.4	-177.7	0	0	0	0	0	113.5	M328 L329	M328-A332 WeakPolarHBondContact O-CB 3.27Å; M328-A332 PolarHBondContact O-N 3.09Å; L329-A332 PolarHBondContact O-N 3.37Å
333	L	97.5	Very high	97.3	Very high	75 Å²	75	65.3 Å²	65.3	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-83.7	-19.9	178.6	-64.8	169.2	0	0	0	112.5	L329 E331 D335 E338 V339 L342	L329-L333 HydrophobicContact CB-CD1 4.43Å; L329-L333 VanDerWaalsContact O-CB 3.28Å; L329-L333 WeakPolarHBondContact O-CB 3.48Å; L329-L333 WeakPolarHBondContact O-CD1 2.88Å; L329-L333 WeakPolarHBondContact O-CG 3.46Å; L329-L333 PolarHBondContact O-N 3.45Å; E331-L333 VanDerWaalsContact C-N 3.34Å; E331-L333 PolarHBondContact O-N 3.49Å; L333-D335 PolarHBondContact O-N 3.48Å; L333-E338 HydrophobicContact CB-CB 4.34Å; L333-E338 HydrophobicContact CD1-CB 3.84Å; L333-V339 HydrophobicContact CD1-CG2 4.3Å; L333-L342 HydrophobicContact CD1-CB 4.45Å; L333-L342 HydrophobicContact CD1-CD2 3.88Å; L333-L342 HydrophobicContact CD2-CD2 4.17Å; L333-L342 HydrophobicContact CG-CD2 4.45Å
334	G	96	Very high	97.2	Very high	70 Å²	70	69.7 Å²	69.7	72%	0.722	40%	0.395	S	S	*	.	S	Bend	trans	71	1.3	-175	0	0	0	0	0	114.5	G330 E331	G330-G334 PolarHBondContact O-N 3.28Å; E331-G334 PolarHBondContact O-N 3.5Å
335	D	94.6	Very high	97.1	Very high	62 Å²	62	70.2 Å²	70.2	33%	0.332	40%	0.401	S	S	.	.			trans	-144	116	176.4	-172.3	-10.4	0	0	0	110.7	L333 H337 E338	L333-D335 PolarHBondContact O-N 3.48Å; D335-H337 PolarHBondContact O-N 2.83Å; D335-H337 VanDerWaalsContact O-N 3.16Å; D335-H337 WeakPolarHBondContact OD1-CB 3.4Å; D335-H337 IonicContact OD1-CE1 2.67Å; D335-H337 IonicContact OD1-CG 3.52Å; D335-H337 PolarHBondContact OD1-N 2.89Å; D335-H337 IonicContact OD1-ND1 3.66Å; D335-H337 PolarHBondContact OD1-ND1 3.22Å; D335-H337 IonicContact OD2-ND1 3.55Å; D335-E338 HydrophobicContact CB-CG 4.21Å; D335-E338 PolarHBondContact O-N 2.98Å
336	P	94.4	Very high	97	Very high	30 Å²	30	70.8 Å²	70.8	20%	0.195	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-56.6	-24.5	175.6	-27.9	36.8	0	0	0	115.6	H236 E338 V339	H236-P336 HydrophobicContact CB-CB 3.69Å; H236-P336 HydrophobicContact CB-CG 4.37Å; P336-E338 VanDerWaalsContact C-N 3.29Å; P336-E338 PolarHBondContact O-N 3.34Å; P336-V339 WeakPolarHBondContact O-CG2 3.4Å; P336-V339 PolarHBondContact O-N 3.21Å
337	H	95.3	Very high	96.8	Very high	96 Å²	96	72.9 Å²	72.9	44%	0.444	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-71.2	-25.1	-178.9	-61.1	89.8	0	0	0	113	N113 D335 V339 P341	N113-H337 PolarHBondContact O-CE1 3.28Å; N113-H337 PolarHBondContact O-NE2 3.3Å; D335-H337 PolarHBondContact O-N 2.83Å; D335-H337 VanDerWaalsContact O-N 3.16Å; D335-H337 WeakPolarHBondContact OD1-CB 3.4Å; D335-H337 IonicContact OD1-CE1 2.67Å; D335-H337 IonicContact OD1-CG 3.52Å; D335-H337 PolarHBondContact OD1-N 2.89Å; D335-H337 IonicContact OD1-ND1 3.66Å; D335-H337 PolarHBondContact OD1-ND1 3.22Å; D335-H337 IonicContact OD2-ND1 3.55Å; H337-V339 VanDerWaalsContact C-N 3.31Å; H337-V339 PolarHBondContact O-N 2.78Å; H337-P341 WeakPolarHBondContact O-CD 3.31Å
338	E	97.5	Very high	96.6	Very high	99 Å²	99	76.8 Å²	76.8	46%	0.463	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-81	-11.9	-178.1	-68.1	-63.6	158.4	0	0	112.9	L333 D335 P336 G340 L342	L333-E338 HydrophobicContact CB-CB 4.34Å; L333-E338 HydrophobicContact CD1-CB 3.84Å; D335-E338 HydrophobicContact CB-CG 4.21Å; D335-E338 PolarHBondContact O-N 2.98Å; P336-E338 VanDerWaalsContact C-N 3.29Å; P336-E338 PolarHBondContact O-N 3.34Å; E338-G340 PolarHBondContact O-N 3.4Å; E338-L342 VanDerWaalsContact O-CB 3.29Å; E338-L342 WeakPolarHBondContact O-CB 3.48Å; E338-L342 PolarHBondContact O-N 3.45Å
339	V	97.8	Very high	96.3	Very high	8 Å²	8	73.2 Å²	73.2	5%	0.048	43%	0.427	C	S	.	.	H	α-helix	trans	-61	-48.1	178.6	178.8	0	0	0	0	111.1	E326 L329 L333 P336 H337 L342 L343	E326-V339 HydrophobicContact CG-CG1 4.45Å; L329-V339 HydrophobicContact CB-CG1 4.16Å; L329-V339 HydrophobicContact CB-CG2 4.07Å; L329-V339 HydrophobicContact CD1-CG1 4.29Å; L333-V339 HydrophobicContact CD1-CG2 4.3Å; P336-V339 WeakPolarHBondContact O-CG2 3.4Å; P336-V339 PolarHBondContact O-N 3.21Å; H337-V339 VanDerWaalsContact C-N 3.31Å; H337-V339 PolarHBondContact O-N 2.78Å; V339-L342 PolarHBondContact O-N 3.34Å; V339-L343 HydrophobicContact CG1-CD1 3.88Å; V339-L343 HydrophobicContact CG1-CG 4.4Å; V339-L343 WeakPolarHBondContact O-CB 3.21Å; V339-L343 VanDerWaalsContact O-CG 3.26Å; V339-L343 WeakPolarHBondContact O-CG 3.36Å; V339-L343 PolarHBondContact O-N 3.45Å
340	G	96.8	Very high	96.1	Very high	34 Å²	34	79.9 Å²	79.9	35%	0.351	45%	0.45	S	S	.	.	H	α-helix	trans	-63.5	-52.5	-179.7	0	0	0	0	0	113.7	E338 L342 L343 N344	E338-G340 PolarHBondContact O-N 3.4Å; G340-L342 VanDerWaalsContact C-N 3.32Å; G340-L342 PolarHBondContact O-N 2.94Å; G340-L343 PolarHBondContact O-N 3.3Å; G340-N344 WeakPolarHBondContact O-CB 3.41Å; G340-N344 PolarHBondContact O-N 2.9Å; G340-N344 PolarHBondContact O-ND2 2.99Å
341	P	98	Very high	95.8	Very high	65 Å²	65	88.1 Å²	88.1	42%	0.422	48%	0.48	S	S	.	.	H	α-helix	trans	-55.3	-42.5	174.2	-28.7	36.2	0	0	0	113.8	H337 N344 T345	H337-P341 WeakPolarHBondContact O-CD 3.31Å; P341-N344 PolarHBondContact O-N 3.08Å; P341-T345 PolarHBondContact O-N 3.49Å; P341-T345 PolarHBondContact O-OG1 2.91Å
342	L	97.8	Very high	94.9	Very high	59 Å²	59	83.1 Å²	83.1	31%	0.309	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-49.3	177.6	-179.7	63.5	0	0	0	111.6	L329 L333 E338 V339 G340 N344 T345 M346	L329-L342 HydrophobicContact CD2-CD2 3.87Å; L333-L342 HydrophobicContact CD1-CB 4.45Å; L333-L342 HydrophobicContact CD1-CD2 3.88Å; L333-L342 HydrophobicContact CD2-CD2 4.17Å; L333-L342 HydrophobicContact CG-CD2 4.45Å; E338-L342 VanDerWaalsContact O-CB 3.29Å; E338-L342 WeakPolarHBondContact O-CB 3.48Å; E338-L342 PolarHBondContact O-N 3.45Å; V339-L342 PolarHBondContact O-N 3.34Å; G340-L342 VanDerWaalsContact C-N 3.32Å; G340-L342 PolarHBondContact O-N 2.94Å; L342-N344 VanDerWaalsContact C-N 3.31Å; L342-N344 PolarHBondContact O-N 3.02Å; L342-T345 WeakPolarHBondContact O-CB 3.29Å; L342-T345 PolarHBondContact O-N 3.05Å; L342-T345 VanDerWaalsContact O-N 3.08Å; L342-M346 HydrophobicContact CG-SD 4.33Å; L342-M346 WeakPolarHBondContact O-CG 3.49Å; L342-M346 PolarHBondContact O-N 3.27Å
343	L	97.4	Very high	92.9	Very high	58 Å²	58	87.3 Å²	87.3	30%	0.304	46%	0.464	S	S	.	.	H	α-helix	trans	-58.2	-43.2	178.1	-73	174.8	0	0	0	111.5	L329 V339 G340 T345 M346 I347	L329-L343 HydrophobicContact CD1-CD2 3.66Å; L329-L343 HydrophobicContact CD1-CG 3.99Å; V339-L343 HydrophobicContact CG1-CD1 3.88Å; V339-L343 HydrophobicContact CG1-CG 4.4Å; V339-L343 WeakPolarHBondContact O-CB 3.21Å; V339-L343 VanDerWaalsContact O-CG 3.26Å; V339-L343 WeakPolarHBondContact O-CG 3.36Å; V339-L343 PolarHBondContact O-N 3.45Å; G340-L343 PolarHBondContact O-N 3.3Å; L343-T345 VanDerWaalsContact C-N 3.33Å; L343-T345 PolarHBondContact O-N 2.88Å; L343-M346 PolarHBondContact O-N 3.46Å; L343-M346 VanDerWaalsContact O-N 3.17Å; L343-I347 WeakPolarHBondContact O-CG1 3.46Å; L343-I347 PolarHBondContact O-N 3.39Å
344	N	96.6	Very high	90.8	Very high	99 Å²	99	87.1 Å²	87.1	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-58.7	-43.5	174.4	-81.9	-59.1	0	0	0	112.3	G340 P341 L342 M346 I347 K348	G340-N344 WeakPolarHBondContact O-CB 3.41Å; G340-N344 PolarHBondContact O-N 2.9Å; G340-N344 PolarHBondContact O-ND2 2.99Å; P341-N344 PolarHBondContact O-N 3.08Å; L342-N344 VanDerWaalsContact C-N 3.31Å; L342-N344 PolarHBondContact O-N 3.02Å; N344-M346 VanDerWaalsContact C-N 3.28Å; N344-M346 PolarHBondContact O-N 2.99Å; N344-I347 PolarHBondContact O-N 3.22Å; N344-K348 VanDerWaalsContact O-CB 3.27Å; N344-K348 WeakPolarHBondContact O-CB 3.17Å; N344-K348 PolarHBondContact O-N 3.16Å
345	T	96.7	Very high	88.8	Confident	95 Å²	95	90.9 Å²	90.9	58%	0.583	48%	0.482	S	S	*	.	H	α-helix	trans	-64.1	-33.8	177.8	-59.3	0	0	0	0	112.1	P341 L342 L343	P341-T345 PolarHBondContact O-N 3.49Å; P341-T345 PolarHBondContact O-OG1 2.91Å; L342-T345 WeakPolarHBondContact O-CB 3.29Å; L342-T345 PolarHBondContact O-N 3.05Å; L342-T345 VanDerWaalsContact O-N 3.08Å; L343-T345 VanDerWaalsContact C-N 3.33Å; L343-T345 PolarHBondContact O-N 2.88Å
346	M	95.6	Very high	86	Confident	93 Å²	93	96.6 Å²	96.6	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-71.5	-29.3	178.4	-70.2	178.9	66	0	0	113.4	L342 L343 N344 R350	L342-M346 HydrophobicContact CG-SD 4.33Å; L342-M346 WeakPolarHBondContact O-CG 3.49Å; L342-M346 PolarHBondContact O-N 3.27Å; L343-M346 PolarHBondContact O-N 3.46Å; L343-M346 VanDerWaalsContact O-N 3.17Å; N344-M346 VanDerWaalsContact C-N 3.28Å; N344-M346 PolarHBondContact O-N 2.99Å; M346-R350 WeakPolarHBondContact O-CD 3.17Å
347	I	95.7	Very high	85.6	Confident	85 Å²	85	99.9 Å²	99.9	44%	0.436	54%	0.544	S	S	.	.	H	α-helix	trans	-101	-35.3	-173.6	67.9	178.6	0	0	0	114.5	L343 N344 G349 R350 Y351	L343-I347 WeakPolarHBondContact O-CG1 3.46Å; L343-I347 PolarHBondContact O-N 3.39Å; N344-I347 PolarHBondContact O-N 3.22Å; I347-G349 PolarHBondContact O-N 2.95Å; I347-R350 PolarHBondContact O-N 2.89Å; I347-Y351 HydrophobicContact CG2-CD2 4.49Å; I347-Y351 PolarHBondContact O-N 3.33Å
348	K	93.3	Very high	85.1	Confident	163 Å²	163	100.1 Å²	100.1	71%	0.709	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	123.6	-172.3	-168.4	177.3	-176.7	176.1	0	111.4	N344 R350	N344-K348 VanDerWaalsContact O-CB 3.27Å; N344-K348 WeakPolarHBondContact O-CB 3.17Å; N344-K348 PolarHBondContact O-N 3.16Å; K348-R350 PolarHBondContact O-N 2.91Å
349	G	91.8	Very high	84.4	Confident	51 Å²	51	100.2 Å²	100.2	53%	0.526	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	71.6	6.2	-175.4	0	0	0	0	0	115.3	I347 D352	I347-G349 PolarHBondContact O-N 2.95Å; G349-D352 WeakPolarHBondContact CA-OD1 3.28Å; G349-D352 PolarHBondContact N-OD1 3.31Å; G349-D352 PolarHBondContact N-OD2 3.22Å
350	R	93	Very high	83.6	Confident	175 Å²	175	105.6 Å²	105.6	66%	0.66	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	-44.2	-175.2	-62.4	-176.8	-175.4	179.1	3	113.1	M346 I347 K348 D352	M346-R350 WeakPolarHBondContact O-CD 3.17Å; I347-R350 PolarHBondContact O-N 2.89Å; K348-R350 PolarHBondContact O-N 2.91Å; R350-D352 PolarHBondContact N-OD1 3.43Å
351	Y	91.3	Very high	82.8	Confident	179 Å²	179	110.1 Å²	110.1	70%	0.702	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	0.7	-176.9	-63.1	-78.9	0	0	0	112.8	I347	I347-Y351 HydrophobicContact CG2-CD2 4.49Å; I347-Y351 PolarHBondContact O-N 3.33Å
352	D	77.6	Confident	81.8	Confident	64 Å²	64	113.1 Å²	113.1	34%	0.342	61%	0.61	S	S	.	*			trans	-90.7	-4.9	178.9	59	-8.2	0	0	0	113.7	G349 R350 G354 L355	G349-D352 WeakPolarHBondContact CA-OD1 3.28Å; G349-D352 PolarHBondContact N-OD1 3.31Å; G349-D352 PolarHBondContact N-OD2 3.22Å; R350-D352 PolarHBondContact N-OD1 3.43Å; D352-G354 PolarHBondContact O-N 3.21Å; D352-L355 PolarHBondContact O-N 3.42Å
353	Q	55.9	Low	80.6	Confident	174 Å²	174	116.9 Å²	116.9	81%	0.813	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	102.1	173.7	-66.9	-167.5	-0.5	0	0	110.2
354	G	54.3	Low	79.3	Confident	71 Å²	71	121.5 Å²	121.5	73%	0.732	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.3	0.7	-179.8	0	0	0	0	0	115.2	D352	D352-G354 PolarHBondContact O-N 3.21Å
355	L	52.7	Low	77.9	Confident	148 Å²	148	123.3 Å²	123.3	78%	0.775	67%	0.667	S	S	*	*			trans	-99.3	20.5	176	-69.8	172	0	0	0	113.3	D352	D352-L355 PolarHBondContact O-N 3.42Å
356	S	37	Very low	76.2	Confident	182 Å²	182	125.9 Å²	125.9	100%	1.273	68%	0.675	S	S	*	*			trans	-77.7	0	-179.7	64.5	0	0	0	0	113.4

Retrieved 356 of 356 residues in 78.8 ms (Link to these results)

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