A0A096NGJ9_PAPAN Loading...

Triosephosphate isomerase

It is also responsible for the non-negligible production of methylglyoxal a reactive cytotoxic side-product that modifies and can alter proteins, DNA and lipids. Triosephosphate isomerase is an extremely efficient metabolic enzyme that catalyzes the interconversion between dihydroxyacetone phosphate (DHAP) and D-glyceraldehyde-3-phosphate (G3P) in glycolysis and gluconeogenesis.

AlphaFold DB (A0A0D9RCV3), UniProt , Accession A0A096NGJ9, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 286 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	37.6	Very low	246 Å²	246	165.7 Å²	165.7	100%	1.212	88%	0.883	S	S	*	*				0	117.7	0	-57.4	-171	-44.9	0	0	106.2
2	A	35.1	Very low	37.3	Very low	86 Å²	86	169.9 Å²	169.9	71%	0.711	89%	0.888	S	S	*	*			cis	-149.4	134.3	-7.7	0	0	0	0	0	104.1
3	E	40.9	Very low	37.5	Very low	181 Å²	181	164.7 Å²	164.7	85%	0.846	89%	0.885	S	S	*	*				61.8	122.5	114.2	-72.4	-177.7	170.7	0	0	115.3
4	D	41.3	Very low	37.4	Very low	172 Å²	172	159.3 Å²	159.3	92%	0.92	87%	0.874	S	S	*	*				-168.9	113.5	129.8	-87.8	-21.9	0	0	0	109.5
5	G	35	Very low	37.1	Very low	70 Å²	70	159.7 Å²	159.7	72%	0.722	87%	0.874	S	S	*	*			trans	-122.2	169.5	168.3	0	0	0	0	0	109.7
6	E	44.7	Very low	37.3	Very low	199 Å²	199	164.1 Å²	164.1	93%	0.93	88%	0.875	S	S	*	*			trans	67.3	83.4	170.4	-80.8	179.9	153.3	0	0	117.9
7	E	37.3	Very low	37.7	Very low	205 Å²	205	164.2 Å²	164.2	96%	0.958	87%	0.874	S	S	*	*			trans	-159.1	55.6	156.6	-127.1	-176.5	-153.8	0	0	114.5
8	A	39.2	Very low	37.6	Very low	104 Å²	104	160.4 Å²	160.4	86%	0.86	86%	0.862	S	S	*	*	S	Bend	trans	-140.9	18.5	178.1	0	0	0	0	0	116.5
9	E	37.2	Very low	37.8	Very low	183 Å²	183	156.6 Å²	156.6	86%	0.855	87%	0.865	S	S	*	*	S	Bend	trans	-112.8	6	-177.3	-105.7	-167.9	168.6	0	0	116.7
10	F	33.2	Very low	37.7	Very low	195 Å²	195	157.4 Å²	157.4	86%	0.855	86%	0.862	S	S	*	*	S	Bend	trans	-129.4	44.5	-172.2	-85.5	-81.5	0	0	0	116.1
11	H	36.3	Very low	37.5	Very low	182 Å²	182	162.1 Å²	162.1	84%	0.843	87%	0.868	S	S	*	*			trans	-137.9	42.3	177.1	-103.8	68	0	0	0	115.7
12	F	33.7	Very low	37.6	Very low	216 Å²	216	155.5 Å²	155.5	95%	0.947	84%	0.843	S	S	*	*	S	Bend	trans	-133	24.2	168.7	-103.1	-79.7	0	0	0	115.3
13	A	39.3	Very low	38.2	Very low	102 Å²	102	163.5 Å²	163.5	84%	0.843	86%	0.855	S	S	*	*	S	Bend	trans	-129.9	62.6	177	0	0	0	0	0	112.3
14	A	36.3	Very low	38	Very low	89 Å²	89	162.4 Å²	162.4	74%	0.736	85%	0.854	S	S	*	*			trans	-170.4	94.1	158.7	0	0	0	0	0	110.9
15	L	32.9	Very low	37.8	Very low	166 Å²	166	165.2 Å²	165.2	87%	0.869	85%	0.852	S	S	*	*			trans	-174.5	63.3	150.4	-99.8	143.2	0	0	0	109.7
16	Y	40.9	Very low	38.4	Very low	230 Å²	230	166 Å²	166	90%	0.902	85%	0.851	S	S	*	*			trans	-94.7	142.5	146.6	-106.1	-98.4	0	0	0	106.2
17	I	43.6	Very low	38.3	Very low	165 Å²	165	164 Å²	164	85%	0.846	85%	0.847	S	S	*	*			trans	96.1	76.4	-179.4	-45.7	158.2	0	0	0	114.1
18	S	36.1	Very low	38.4	Very low	96 Å²	96	160.1 Å²	160.1	67%	0.671	84%	0.838	S	S	*	*				-166	118.9	125.8	53.1	0	0	0	0	108.9	Q20	S18-Q20 VanDerWaalsContact C-N 3.33Å; S18-Q20 PolarHBondContact O-N 2.9Å
19	G	41.6	Very low	38.2	Very low	89 Å²	89	162.4 Å²	162.4	92%	0.918	84%	0.835	S	S	*	*			trans	-73.3	77.6	-174.5	0	0	0	0	0	113.2
20	Q	35.7	Very low	38.2	Very low	172 Å²	172	161.3 Å²	161.3	80%	0.804	83%	0.834	S	S	*	*			trans	-127.9	109	166.5	-73.8	-175.4	-9.2	0	0	109.6	S18 P22	S18-Q20 VanDerWaalsContact C-N 3.33Å; S18-Q20 PolarHBondContact O-N 2.9Å; Q20-P22 WeakPolarHBondContact O-CD 3.44Å
21	W	33.6	Very low	38.2	Very low	257 Å²	257	161 Å²	161	97%	0.973	84%	0.836	S	S	*	*			trans	-87.6	119	169.8	-91.6	21.3	0	0	0	110
22	P	36	Very low	38.3	Very low	107 Å²	107	163.7 Å²	163.7	70%	0.695	84%	0.838	S	S	*	*			trans	-78	127.4	157	-3.1	21.7	0	0	0	108.4	Q20 L24	Q20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-L24 PolarHBondContact O-N 2.9Å
23	R	46.8	Very low	38.6	Very low	254 Å²	254	161 Å²	161	96%	0.958	83%	0.833	S	S	*	*			trans	-61.1	97.1	167.6	-70.9	179.4	-175.9	176.5	0.8	108.8
24	L	37.4	Very low	38.4	Very low	158 Å²	158	159.4 Å²	159.4	83%	0.827	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.2	126.6	166.5	-94.4	143.5	0	0	0	108.7	P22 A26	P22-L24 PolarHBondContact O-N 2.9Å; L24-A26 PolarHBondContact O-N 3.38Å
25	R	37.3	Very low	38.4	Very low	231 Å²	231	160.9 Å²	160.9	87%	0.872	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-56	127.6	172	-69.7	176.3	-178.4	173.3	-0.2	108.1
26	A	46.7	Very low	38.7	Very low	87 Å²	87	160 Å²	160	72%	0.719	83%	0.826	S	S	*	*	S	Bend	trans	-57.4	148	157.4	0	0	0	0	0	108.4	L24	L24-A26 PolarHBondContact O-N 3.38Å
27	D	42.4	Very low	38.5	Very low	156 Å²	156	153 Å²	153	83%	0.834	82%	0.816	S	S	*	*	S	Bend	trans	92.2	68.3	179.3	-53	-24.3	0	0	0	116.1
28	T	39.6	Very low	38.3	Very low	124 Å²	124	153.5 Å²	153.5	76%	0.761	82%	0.817	S	S	*	*	S	Bend	trans	-165.2	-2.5	141.4	33.6	0	0	0	0	116.4
29	D	36	Very low	38.7	Very low	152 Å²	152	152 Å²	152	81%	0.813	81%	0.811	S	S	*	*	S	Bend	trans	-109.2	40.2	-174.3	-76.7	-35.9	0	0	0	115.6
30	L	36	Very low	39.4	Very low	160 Å²	160	153.5 Å²	153.5	84%	0.838	80%	0.804	S	S	*	*	S	Bend	trans	-113.4	7.6	170.5	-96.3	162.4	0	0	0	114.5
31	Q	35	Very low	41.6	Very low	189 Å²	189	150.7 Å²	150.7	88%	0.883	80%	0.803	S	S	*	*	S	Bend	trans	-105	11.2	179.3	-74.1	-172.9	-13.6	0	0	115
32	R	38.2	Very low	44.6	Very low	237 Å²	237	141 Å²	141	89%	0.894	77%	0.767	S	S	*	*	S	Bend	trans	-120.3	32.2	178.4	-88.8	-173.4	179.1	-177.8	1.1	114.5
33	L	39	Very low	47.4	Very low	160 Å²	160	140.5 Å²	140.5	84%	0.838	75%	0.753	S	S	*	*	S	Bend	trans	-117.1	107.3	164.8	-74.9	168.2	0	0	0	109.4
34	G	35.6	Very low	49.9	Very low	69 Å²	69	128.6 Å²	128.6	71%	0.711	71%	0.708	S	S	*	*			trans	76.7	64	153.8	0	0	0	0	0	117.2	I36	G34-I36 PolarHBondContact O-N 3.02Å
35	S	35.8	Very low	52.8	Low	119 Å²	119	121 Å²	121	83%	0.832	67%	0.669	S	S	*	*			trans	-71.3	89.7	141.1	178.7	0	0	0	0	106.1	A37	S35-A37 PolarHBondContact O-N 2.97Å
36	I	39.1	Very low	55.8	Low	147 Å²	147	110 Å²	110	75%	0.754	63%	0.628	S	S	*	*			trans	-58.1	105.7	153.3	-61.6	170.9	0	0	0	102.7	G34 M38	G34-I36 PolarHBondContact O-N 3.02Å; I36-M38 VanDerWaalsContact C-N 3.3Å; I36-M38 PolarHBondContact O-N 2.81Å
37	A	36.4	Very low	58.2	Low	84 Å²	84	106 Å²	106	69%	0.694	59%	0.594	S	S	*	*			trans	-52.3	107.3	167.5	0	0	0	0	0	105.1	S35 A39	S35-A37 PolarHBondContact O-N 2.97Å; A37-A39 PolarHBondContact O-N 3.01Å
38	M	39.4	Very low	60.9	Low	176 Å²	176	98.6 Å²	98.6	87%	0.867	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-55.6	120.8	175.3	-74.9	-153.6	-175.7	0	0	105.1	I36 P40	I36-M38 VanDerWaalsContact C-N 3.3Å; I36-M38 PolarHBondContact O-N 2.81Å; M38-P40 VanDerWaalsContact O-N 3.13Å
39	A	45.9	Very low	63.8	Low	65 Å²	65	93 Å²	93	54%	0.537	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-49.4	127.5	172.3	0	0	0	0	0	106.6	A37 S41	A37-A39 PolarHBondContact O-N 3.01Å; A39-S41 PolarHBondContact O-N 2.79Å
40	P	55.1	Low	66.7	Low	120 Å²	120	85.8 Å²	85.8	78%	0.779	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-54.1	129.8	-177.9	19.9	-30.2	0	0	0	108.3	M38 R42	M38-P40 VanDerWaalsContact O-N 3.13Å; P40-R42 PolarHBondContact O-N 2.99Å
41	S	82.1	Confident	69.7	Low	113 Å²	113	79.9 Å²	79.9	79%	0.79	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-57.7	135.4	-179.4	54.2	0	0	0	0	109.4	A39 K43	A39-S41 PolarHBondContact O-N 2.79Å; S41-K43 PolarHBondContact O-N 3.17Å; S41-K43 VanDerWaalsContact O-N 3.16Å
42	R	96.1	Very high	72.7	Confident	54 Å²	54	79.5 Å²	79.5	20%	0.204	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-60.4	121.1	178.2	-67.4	171.8	-64.8	-82.5	2.5	108.6	P40 F44 Q240 T242 R243 P262 D265	P40-R42 PolarHBondContact O-N 2.99Å; R42-F44 PolarHBondContact O-N 3.38Å; R42-Q240 WeakPolarHBondContact CD-O 3.3Å; R42-Q240 WeakPolarHBondContact CG-O 3.41Å; R42-Q240 PolarHBondContact NH1-O 3.34Å; R42-T242 VanDerWaalsContact CD-O 3.26Å; R42-T242 WeakPolarHBondContact CD-O 3.31Å; R42-R243 HydrophobicContact CB-CG 4.24Å; R42-P262 PolarHBondContact NH2-O 3.07Å; R42-D265 WeakPolarHBondContact CD-OD2 3.3Å; R42-D265 IonicContact CZ-OD1 3.86Å; R42-D265 VanDerWaalsContact NE-CG 3.28Å; R42-D265 IonicContact NE-OD1 2.67Å; R42-D265 PolarHBondContact NE-OD1 3.16Å; R42-D265 IonicContact NE-OD2 2.72Å; R42-D265 PolarHBondContact NE-OD2 3.21Å; R42-D265 IonicContact NH2-OD1 3.2Å
43	K	96.6	Very high	75.6	Confident	95 Å²	95	71.9 Å²	71.9	41%	0.413	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-57.8	131.7	177.3	-167.7	176.7	-179.4	177.3	0	109.2	S41 A73 D74 T75 E76 R243	S41-K43 PolarHBondContact O-N 3.17Å; S41-K43 VanDerWaalsContact O-N 3.16Å; K43-A73 WeakPolarHBondContact CE-O 3.5Å; K43-A73 PolarHBondContact NZ-O 3.33Å; K43-A73 VanDerWaalsContact NZ-O 3.07Å; K43-D74 WeakPolarHBondContact CG-O 3.22Å; K43-T75 VanDerWaalsContact CE-C 3.48Å; K43-E76 HydrophobicContact CD-CB 4.17Å; K43-R243 WeakPolarHBondContact O-CD 3.4Å
44	F	98.4	Very high	78.3	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.018	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	137.1	-179	-165	-117.2	0	0	0	109.6	R42 V46 D74 T75 E76 A259 D265 F267 A284 K285	R42-F44 PolarHBondContact O-N 3.38Å; F44-V46 HydrophobicContact CD1-CG2 3.85Å; F44-V46 HydrophobicContact CE1-CG2 3.57Å; F44-V46 HydrophobicContact CZ-CG2 4.48Å; F44-D74 PolarHBondContact N-O 3.49Å; F44-D74 VanDerWaalsContact N-O 3.09Å; F44-T75 HydrophobicContact CD1-CG2 4.06Å; F44-T75 CarbonylContact O-C 3.53Å; F44-T75 WeakPolarHBondContact O-CA 3.25Å; F44-E76 PolarHBondContact O-N 2.81Å; F44-A259 HydrophobicContact CE2-CB 4.02Å; F44-A259 HydrophobicContact CZ-CB 3.8Å; F44-D265 CarbonylContact C-O 3.51Å; F44-D265 WeakPolarHBondContact CA-O 3.18Å; F44-D265 VanDerWaalsContact CD2-O 3.24Å; F44-D265 WeakPolarHBondContact CD2-O 3.48Å; F44-F267 HydrophobicContact CE1-CD2 4.38Å; F44-F267 HydrophobicContact CE1-CE2 4.27Å; F44-F267 AromaticContact CZ-CD2 3.96Å; F44-F267 HydrophobicContact CZ-CD2 3.96Å; F44-F267 AromaticContact CZ-CE2 3.59Å; F44-F267 HydrophobicContact CZ-CE2 3.59Å; F44-F267 HydrophobicContact CZ-CZ 4.25Å; F44-A284 HydrophobicContact CE1-CB 4.18Å; F44-A284 HydrophobicContact CZ-CB 4.22Å; F44-K285 HydrophobicContact CB-CD 4.34Å; F44-K285 HydrophobicContact CD1-CG 4.44Å; F44-K285 HydrophobicContact CD2-CD 3.64Å; F44-K285 HydrophobicContact CD2-CG 4.13Å; F44-K285 HydrophobicContact CE1-CG 4.41Å; F44-K285 HydrophobicContact CE2-CD 3.97Å; F44-K285 VanDerWaalsContact CE2-CE 3.46Å; F44-K285 HydrophobicContact CE2-CG 4.06Å; F44-K285 HydrophobicContact CG-CD 3.97Å; F44-K285 HydrophobicContact CG-CG 4.3Å; F44-K285 HydrophobicContact CZ-CG 4.21Å
45	F	98.8	Very high	81.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.7	-173.1	-175.3	-79.4	0	0	0	111.8	E76 V78 W128 I162 V199 I245 D265 G266 F267	F45-E76 CarbonylContact C-O 3.46Å; F45-E76 WeakPolarHBondContact CA-O 3.13Å; F45-E76 HydrophobicContact CD2-CB 4.08Å; F45-E76 HydrophobicContact CD2-CG 3.99Å; F45-E76 HydrophobicContact CE2-CG 4.16Å; F45-V78 HydrophobicContact CD2-CG2 4.49Å; F45-V78 HydrophobicContact CE1-CG2 4.24Å; F45-V78 HydrophobicContact CE2-CG2 3.46Å; F45-V78 VanDerWaalsContact CE2-CG2 3.46Å; F45-V78 HydrophobicContact CZ-CB 3.96Å; F45-V78 HydrophobicContact CZ-CG2 3.32Å; F45-W128 HydrophobicContact CE2-CH2 4.2Å; F45-W128 HydrophobicContact CE2-CZ2 4.05Å; F45-I162 HydrophobicContact CE1-CD1 3.93Å; F45-I162 HydrophobicContact CE1-CG1 4.2Å; F45-I162 HydrophobicContact CZ-CD1 3.78Å; F45-I162 HydrophobicContact CZ-CG1 3.95Å; F45-V199 HydrophobicContact CD1-CG1 4.23Å; F45-V199 HydrophobicContact CD2-CG2 4.05Å; F45-V199 HydrophobicContact CE1-CG1 4.37Å; F45-V199 HydrophobicContact CE2-CG2 3.94Å; F45-V199 HydrophobicContact CG-CG2 4.36Å; F45-V199 HydrophobicContact CZ-CG2 4.17Å; F45-I245 HydrophobicContact CB-CG2 3.99Å; F45-I245 HydrophobicContact CD1-CD1 3.82Å; F45-I245 HydrophobicContact CD1-CG2 4.03Å; F45-I245 HydrophobicContact CE1-CD1 3.99Å; F45-I245 HydrophobicContact CG-CG2 4.39Å; F45-D265 PolarHBondContact N-O 3.32Å; F45-G266 CarbonylContact O-C 3.34Å; F45-G266 WeakPolarHBondContact O-CA 3.17Å; F45-F267 PolarHBondContact O-N 3.05Å
46	V	98.9	Very high	84.2	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	106.9	178.8	-176.6	0	0	0	0	110.3	F44 T75 E76 V77 V78 F267 V269 F278 I281 I282	F44-V46 HydrophobicContact CD1-CG2 3.85Å; F44-V46 HydrophobicContact CE1-CG2 3.57Å; F44-V46 HydrophobicContact CZ-CG2 4.48Å; V46-T75 HydrophobicContact CB-CG2 4.42Å; V46-T75 HydrophobicContact CG2-CG2 4Å; V46-E76 PolarHBondContact N-O 3.43Å; V46-V77 WeakPolarHBondContact O-CA 3.37Å; V46-V78 PolarHBondContact O-N 3.09Å; V46-F267 WeakPolarHBondContact CA-O 3.47Å; V46-F267 HydrophobicContact CG2-CD2 4.46Å; V46-V269 HydrophobicContact CG1-CG2 4.4Å; V46-F278 HydrophobicContact CG1-CD2 4.42Å; V46-F278 HydrophobicContact CG1-CE2 3.48Å; V46-F278 VanDerWaalsContact CG1-CE2 3.48Å; V46-F278 HydrophobicContact CG1-CZ 3.78Å; V46-I281 HydrophobicContact CG1-CG2 4.11Å; V46-I282 HydrophobicContact CB-CG1 4.28Å; V46-I282 HydrophobicContact CG1-CG1 3.98Å
47	G	98.9	Very high	87	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.01	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	131.9	174	0	0	0	0	0	111.8	V78 F267 V269	G47-V78 CarbonylContact C-O 3.6Å; G47-V78 VanDerWaalsContact CA-O 3.26Å; G47-V78 WeakPolarHBondContact CA-O 3.48Å; G47-F267 PolarHBondContact N-O 3.46Å; G47-V269 PolarHBondContact O-N 2.83Å
48	G	98.8	Very high	89.9	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	105.3	169.6	0	0	0	0	0	110.7	V78 A80 V269	G48-V78 PolarHBondContact N-O 2.94Å; G48-A80 PolarHBondContact O-N 2.85Å; G48-V269 CarbonylContact C-O 3.55Å
49	N	98.8	Very high	92.7	Very high	7 Å²	7	63.5 Å²	63.5	4%	0.037	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	102.5	174.7	-176.6	6.5	0	0	0	109.9	K51 H133 L268 V269	N49-K51 PolarHBondContact O-N 3.31Å; N49-K51 PolarHBondContact OD1-N 2.95Å; N49-H133 PolarHBondContact ND2-NE2 2.87Å; N49-L268 HydrophobicContact CB-CD1 4.23Å; N49-V269 PolarHBondContact N-O 2.87Å
50	W	98.6	Very high	95.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.316	C	S	.	.			trans	-73.1	-12.8	-178	-60.8	-7.2	0	0	0	112.5	N53 L59 L62 I63 L66 C79 A80 P81 A89 L274	W50-N53 VanDerWaalsContact O-CB 3.28Å; W50-N53 WeakPolarHBondContact O-CB 3.38Å; W50-N53 PolarHBondContact O-N 2.74Å; W50-N53 PolarHBondContact O-ND2 2.9Å; W50-L59 HydrophobicContact CD2-CD2 4.28Å; W50-L59 HydrophobicContact CE3-CD1 4.28Å; W50-L59 HydrophobicContact CE3-CD2 3.49Å; W50-L59 VanDerWaalsContact CE3-CD2 3.49Å; W50-L59 HydrophobicContact CE3-CG 4.46Å; W50-L59 HydrophobicContact CZ3-CD1 4.16Å; W50-L59 HydrophobicContact CZ3-CD2 3.63Å; W50-L59 HydrophobicContact CZ3-CG 4.31Å; W50-L62 HydrophobicContact CD2-CD2 4.35Å; W50-L62 HydrophobicContact CH2-CD2 4.38Å; W50-L62 HydrophobicContact CZ2-CD2 3.8Å; W50-I63 HydrophobicContact CH2-CD1 4.25Å; W50-I63 HydrophobicContact CH2-CG1 4.01Å; W50-L66 HydrophobicContact CZ2-CD1 4.44Å; W50-C79 HydrophobicContact CH2-CB 4.36Å; W50-C79 HydrophobicContact CZ2-CB 3.67Å; W50-A80 WeakPolarHBondContact CB-O 3.37Å; W50-A80 PolarHBondContact N-O 2.71Å; W50-A80 VanDerWaalsContact N-O 3.13Å; W50-P81 HydrophobicContact CD2-CB 4.41Å; W50-P81 VanDerWaalsContact CE3-CA 3.45Å; W50-P81 HydrophobicContact CE3-CB 3.48Å; W50-P81 VanDerWaalsContact CE3-CB 3.48Å; W50-P81 HydrophobicContact CZ3-CB 3.59Å; W50-A89 HydrophobicContact CH2-CB 4.44Å; W50-A89 HydrophobicContact CZ3-CB 4.34Å; W50-L274 HydrophobicContact CB-CD2 3.83Å; W50-L274 HydrophobicContact CD2-CD2 4.47Å; W50-L274 HydrophobicContact CG-CD2 3.79Å
51	K	98.6	Very high	97.2	Very high	37 Å²	37	61.2 Å²	61.2	16%	0.161	30%	0.304	C	S	.	.			trans	50.3	-146.8	-176.1	-55.9	-177.7	175.7	-165.7	0	110.6	N49 N53 P82 Q102 E135	N49-K51 PolarHBondContact O-N 3.31Å; N49-K51 PolarHBondContact OD1-N 2.95Å; K51-N53 PolarHBondContact O-N 3.13Å; K51-P82 WeakPolarHBondContact O-CG 3.23Å; K51-Q102 PolarHBondContact O-NE2 3.2Å; K51-Q102 PolarHBondContact O-OE1 3.03Å; K51-E135 WeakPolarHBondContact CD-OE1 3.49Å; K51-E135 VanDerWaalsContact CE-OE1 3.24Å; K51-E135 WeakPolarHBondContact CE-OE1 3.23Å; K51-E135 IonicContact NZ-OE1 2.67Å; K51-E135 PolarHBondContact NZ-OE1 2.94Å
52	M	98.4	Very high	98	Very high	181 Å²	181	56.7 Å²	56.7	89%	0.892	27%	0.271	S	S	*	.	S	Bend	trans	-82.2	51.2	177	-161.4	175.4	69.8	0	0	112.5
53	N	98.6	Very high	98.1	Very high	77 Å²	77	54.2 Å²	54.2	41%	0.412	26%	0.262	S	S	.	.			trans	-123.8	150.4	179.5	-61.6	-86.7	0	0	0	112.7	W50 K51 P82 L274	W50-N53 VanDerWaalsContact O-CB 3.28Å; W50-N53 WeakPolarHBondContact O-CB 3.38Å; W50-N53 PolarHBondContact O-N 2.74Å; W50-N53 PolarHBondContact O-ND2 2.9Å; K51-N53 PolarHBondContact O-N 3.13Å; N53-P82 VanDerWaalsContact O-CG 3.22Å; N53-P82 WeakPolarHBondContact O-CG 3.48Å; N53-L274 HydrophobicContact CB-CD1 3.59Å; N53-L274 HydrophobicContact CB-CD2 4.28Å
54	G	96.1	Very high	98.2	Very high	25 Å²	25	51.5 Å²	51.5	26%	0.258	26%	0.261	S	S	.	.			trans	107	156.9	169.3	0	0	0	0	0	115.1	N58 Y85	G54-N58 VanDerWaalsContact CA-OD1 3.3Å; G54-N58 WeakPolarHBondContact CA-OD1 3.43Å; G54-Y85 WeakPolarHBondContact O-CE2 3.48Å
55	R	97.1	Very high	98.1	Very high	191 Å²	191	54.3 Å²	54.3	72%	0.721	28%	0.278	S	S	*	.			trans	-137.2	160.6	170.8	-62.7	179.7	-177.5	168.6	0.6	106.8	Q57 N58 L59	R55-Q57 PolarHBondContact O-N 2.8Å; R55-N58 PolarHBondContact N-OD1 3.32Å; R55-N58 PolarHBondContact O-N 2.7Å; R55-N58 PolarHBondContact O-OD1 3.39Å; R55-L59 WeakPolarHBondContact O-CB 3.39Å; R55-L59 WeakPolarHBondContact O-CG 2.86Å; R55-L59 PolarHBondContact O-N 3.13Å
56	K	98.1	Very high	98.1	Very high	132 Å²	132	54.4 Å²	54.4	57%	0.574	28%	0.279	S	S	*	.	H	α-helix	trans	-49.1	-36.9	-176	-73.1	-171.7	174.8	-178.4	0	114.5	G60 Y85 F88	K56-G60 PolarHBondContact O-N 3.38Å; K56-Y85 HydrophobicContact CG-CD1 4.17Å; K56-Y85 HydrophobicContact CG-CE1 3.91Å; K56-F88 HydrophobicContact CB-CE2 4.16Å; K56-F88 HydrophobicContact CB-CZ 4.07Å; K56-F88 HydrophobicContact CD-CD2 4.21Å; K56-F88 HydrophobicContact CD-CE2 4.24Å; K56-F88 HydrophobicContact CG-CD2 4.18Å; K56-F88 HydrophobicContact CG-CE2 4.07Å; K56-F88 HydrophobicContact CG-CG 4.45Å; K56-F88 HydrophobicContact CG-CZ 4.29Å; K56-F88 VanDerWaalsContact O-CZ 3.3Å; K56-F88 WeakPolarHBondContact O-CZ 3.39Å
57	Q	97.7	Very high	98.1	Very high	152 Å²	152	56.8 Å²	56.8	71%	0.71	29%	0.292	S	S	*	.	H	α-helix	trans	-64	-63	178.3	-176.7	-179.9	-2.4	0	0	112.2	R55 L59 G60 E61	R55-Q57 PolarHBondContact O-N 2.8Å; Q57-L59 VanDerWaalsContact C-N 3.33Å; Q57-L59 PolarHBondContact O-N 3.16Å; Q57-G60 WeakPolarHBondContact O-CA 3.39Å; Q57-G60 PolarHBondContact O-N 3.4Å; Q57-E61 PolarHBondContact O-N 2.72Å
58	N	96.4	Very high	98	Very high	77 Å²	77	61 Å²	61	41%	0.412	33%	0.327	S	S	.	.	H	α-helix	trans	-69.4	-29.5	-175.8	65.4	13.3	0	0	0	113	G54 R55 G60 E61 L62	G54-N58 VanDerWaalsContact CA-OD1 3.3Å; G54-N58 WeakPolarHBondContact CA-OD1 3.43Å; R55-N58 PolarHBondContact N-OD1 3.32Å; R55-N58 PolarHBondContact O-N 2.7Å; R55-N58 PolarHBondContact O-OD1 3.39Å; N58-G60 VanDerWaalsContact C-N 3.33Å; N58-E61 PolarHBondContact O-N 2.89Å; N58-L62 WeakPolarHBondContact O-CB 3.08Å; N58-L62 PolarHBondContact O-N 3.46Å
59	L	98	Very high	97.9	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-67.5	-36.9	170.3	-66.5	-175.6	0	0	0	111	W50 R55 Q57 L62 I63 Y85 F88	W50-L59 HydrophobicContact CD2-CD2 4.28Å; W50-L59 HydrophobicContact CE3-CD1 4.28Å; W50-L59 HydrophobicContact CE3-CD2 3.49Å; W50-L59 VanDerWaalsContact CE3-CD2 3.49Å; W50-L59 HydrophobicContact CE3-CG 4.46Å; W50-L59 HydrophobicContact CZ3-CD1 4.16Å; W50-L59 HydrophobicContact CZ3-CD2 3.63Å; W50-L59 HydrophobicContact CZ3-CG 4.31Å; R55-L59 WeakPolarHBondContact O-CB 3.39Å; R55-L59 WeakPolarHBondContact O-CG 2.86Å; R55-L59 PolarHBondContact O-N 3.13Å; Q57-L59 VanDerWaalsContact C-N 3.33Å; Q57-L59 PolarHBondContact O-N 3.16Å; L59-L62 PolarHBondContact O-N 3.5Å; L59-I63 VanDerWaalsContact O-CB 3.3Å; L59-I63 WeakPolarHBondContact O-CB 3.38Å; L59-I63 WeakPolarHBondContact O-CD1 3.2Å; L59-I63 WeakPolarHBondContact O-CG1 3.21Å; L59-I63 PolarHBondContact O-N 3Å; L59-Y85 HydrophobicContact CD1-CD1 4.48Å; L59-Y85 HydrophobicContact CD1-CD2 3.61Å; L59-Y85 HydrophobicContact CD1-CE2 4.21Å; L59-Y85 HydrophobicContact CD1-CG 3.76Å; L59-F88 HydrophobicContact CB-CE1 3.96Å
60	G	98.3	Very high	97.6	Very high	21 Å²	21	70 Å²	70	22%	0.216	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-41.2	173.9	0	0	0	0	0	112.7	K56 Q57 N58 G64	K56-G60 PolarHBondContact O-N 3.38Å; Q57-G60 WeakPolarHBondContact O-CA 3.39Å; Q57-G60 PolarHBondContact O-N 3.4Å; N58-G60 VanDerWaalsContact C-N 3.33Å; G60-G64 PolarHBondContact O-N 2.94Å
61	E	98.1	Very high	97.4	Very high	116 Å²	116	71.5 Å²	71.5	54%	0.542	38%	0.376	S	S	.	.	H	α-helix	trans	-63.2	-49.6	174.4	-68.9	164.7	-165.9	0	0	111.2	Q57 N58 I63 G64 T65	Q57-E61 PolarHBondContact O-N 2.72Å; N58-E61 PolarHBondContact O-N 2.89Å; E61-I63 PolarHBondContact O-N 2.84Å; E61-G64 WeakPolarHBondContact O-CA 3.38Å; E61-G64 PolarHBondContact O-N 2.98Å; E61-G64 VanDerWaalsContact O-N 3.12Å; E61-T65 PolarHBondContact O-N 2.74Å; E61-T65 PolarHBondContact O-OG1 3.36Å
62	L	98.2	Very high	97.2	Very high	17 Å²	17	70.2 Å²	70.2	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-48.3	175.8	177.1	63	0	0	0	111.7	W50 N58 L59 G64 T65 L66 L274	W50-L62 HydrophobicContact CD2-CD2 4.35Å; W50-L62 HydrophobicContact CH2-CD2 4.38Å; W50-L62 HydrophobicContact CZ2-CD2 3.8Å; N58-L62 WeakPolarHBondContact O-CB 3.08Å; N58-L62 PolarHBondContact O-N 3.46Å; L59-L62 PolarHBondContact O-N 3.5Å; L62-G64 VanDerWaalsContact C-N 3.29Å; L62-G64 PolarHBondContact O-N 3.2Å; L62-T65 WeakPolarHBondContact O-CB 3.48Å; L62-T65 PolarHBondContact O-N 2.91Å; L62-T65 VanDerWaalsContact O-N 3.16Å; L62-L66 HydrophobicContact CD1-CD1 4.47Å; L62-L66 HydrophobicContact CD1-CG 4.47Å; L62-L66 HydrophobicContact CG-CD1 4.26Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.77Å; L62-L274 HydrophobicContact CD2-CD2 4.22Å
63	I	98.6	Very high	96.9	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.015	37%	0.367	C	S	.	.	H	α-helix	trans	-61.2	-39.5	177.4	-70.3	165.9	0	0	0	110.9	W50 L59 E61 T65 L66 N67 F88 A89 K92 L93	W50-I63 HydrophobicContact CH2-CD1 4.25Å; W50-I63 HydrophobicContact CH2-CG1 4.01Å; L59-I63 VanDerWaalsContact O-CB 3.3Å; L59-I63 WeakPolarHBondContact O-CB 3.38Å; L59-I63 WeakPolarHBondContact O-CD1 3.2Å; L59-I63 WeakPolarHBondContact O-CG1 3.21Å; L59-I63 PolarHBondContact O-N 3Å; E61-I63 PolarHBondContact O-N 2.84Å; I63-T65 VanDerWaalsContact C-N 3.34Å; I63-T65 PolarHBondContact O-N 3.49Å; I63-L66 PolarHBondContact O-N 2.79Å; I63-N67 WeakPolarHBondContact O-CB 3.36Å; I63-N67 VanDerWaalsContact O-CG 3.25Å; I63-N67 PolarHBondContact O-N 2.67Å; I63-N67 PolarHBondContact O-OD1 3.09Å; I63-F88 HydrophobicContact CD1-CD1 4.48Å; I63-F88 HydrophobicContact CD1-CE1 4.08Å; I63-A89 HydrophobicContact CD1-CB 4.24Å; I63-K92 HydrophobicContact CD1-CB 4.19Å; I63-K92 HydrophobicContact CG2-CB 3.82Å; I63-K92 WeakPolarHBondContact CG2-O 3.3Å; I63-L93 HydrophobicContact CB-CD2 4.32Å; I63-L93 HydrophobicContact CD1-CG 4.35Å; I63-L93 HydrophobicContact CG1-CD2 4Å; I63-L93 HydrophobicContact CG1-CG 3.95Å; I63-L93 HydrophobicContact CG2-CD2 3.89Å; I63-L93 HydrophobicContact CG2-CG 3.94Å
64	G	98.3	Very high	96.7	Very high	38 Å²	38	66.4 Å²	66.4	39%	0.392	37%	0.368	S	S	.	.	H	α-helix	trans	-57.5	-45.8	173.9	0	0	0	0	0	112.3	G60 E61 L62 A68	G60-G64 PolarHBondContact O-N 2.94Å; E61-G64 WeakPolarHBondContact O-CA 3.38Å; E61-G64 PolarHBondContact O-N 2.98Å; E61-G64 VanDerWaalsContact O-N 3.12Å; L62-G64 VanDerWaalsContact C-N 3.29Å; L62-G64 PolarHBondContact O-N 3.2Å; G64-A68 WeakPolarHBondContact O-CB 3.09Å; G64-A68 PolarHBondContact O-N 3.38Å
65	T	97.7	Very high	96.8	Very high	62 Å²	62	65.5 Å²	65.5	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-45.6	174.2	-57.6	0	0	0	0	111.9	E61 L62 I63 A68 A69 V279	E61-T65 PolarHBondContact O-N 2.74Å; E61-T65 PolarHBondContact O-OG1 3.36Å; L62-T65 WeakPolarHBondContact O-CB 3.48Å; L62-T65 PolarHBondContact O-N 2.91Å; L62-T65 VanDerWaalsContact O-N 3.16Å; I63-T65 VanDerWaalsContact C-N 3.34Å; I63-T65 PolarHBondContact O-N 3.49Å; T65-A68 PolarHBondContact O-N 3.25Å; T65-A69 PolarHBondContact O-N 3.49Å; T65-A69 VanDerWaalsContact O-N 3.11Å; T65-V279 HydrophobicContact CG2-CG2 4.42Å
66	L	98.1	Very high	96.8	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-37.9	-178.8	-64.5	176.5	0	0	0	112.9	W50 L62 I63 A68 A69 L93 I97 F278 V279 I282	W50-L66 HydrophobicContact CZ2-CD1 4.44Å; L62-L66 HydrophobicContact CD1-CD1 4.47Å; L62-L66 HydrophobicContact CD1-CG 4.47Å; L62-L66 HydrophobicContact CG-CD1 4.26Å; L62-L66 WeakPolarHBondContact O-CG 3.45Å; L62-L66 PolarHBondContact O-N 2.77Å; I63-L66 PolarHBondContact O-N 2.79Å; L66-A68 VanDerWaalsContact C-N 3.33Å; L66-A68 PolarHBondContact O-N 3.11Å; L66-A69 WeakPolarHBondContact O-CB 3.26Å; L66-A69 PolarHBondContact O-N 3.37Å; L66-L93 HydrophobicContact CB-CD2 4.29Å; L66-L93 HydrophobicContact CD1-CD2 4.22Å; L66-I97 HydrophobicContact CB-CD1 3.85Å; L66-F278 HydrophobicContact CD2-CD1 3.76Å; L66-F278 HydrophobicContact CD2-CE1 4.41Å; L66-V279 HydrophobicContact CD2-CG2 4.27Å; L66-I282 HydrophobicContact CD2-CD1 4.41Å
67	N	98.3	Very high	96.9	Very high	51 Å²	51	52.5 Å²	52.5	27%	0.273	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-37.9	177.1	-72.8	-5.8	0	0	0	111.9	I63 A69 K92 D94 K96	I63-N67 WeakPolarHBondContact O-CB 3.36Å; I63-N67 VanDerWaalsContact O-CG 3.25Å; I63-N67 PolarHBondContact O-N 2.67Å; I63-N67 PolarHBondContact O-OD1 3.09Å; N67-A69 VanDerWaalsContact C-N 3.29Å; N67-K92 PolarHBondContact ND2-O 2.84Å; N67-D94 WeakPolarHBondContact OD1-CB 3.48Å; N67-D94 PolarHBondContact OD1-N 3.38Å; N67-K96 PolarHBondContact O-NZ 3Å
68	A	97.5	Very high	96.9	Very high	90 Å²	90	45.3 Å²	45.3	74%	0.744	27%	0.274	S	S	*	.	H	α-helix	trans	-74.6	-17.7	177.1	0	0	0	0	0	113.3	G64 T65 L66	G64-A68 WeakPolarHBondContact O-CB 3.09Å; G64-A68 PolarHBondContact O-N 3.38Å; T65-A68 PolarHBondContact O-N 3.25Å; L66-A68 VanDerWaalsContact C-N 3.33Å; L66-A68 PolarHBondContact O-N 3.11Å
69	A	95.6	Very high	97	Very high	14 Å²	14	41.6 Å²	41.6	12%	0.116	25%	0.254	C	S	.	.	S	Bend	trans	-70.3	142.5	-179.6	0	0	0	0	0	112.1	T65 L66 N67 V71 V279	T65-A69 PolarHBondContact O-N 3.49Å; T65-A69 VanDerWaalsContact O-N 3.11Å; L66-A69 WeakPolarHBondContact O-CB 3.26Å; L66-A69 PolarHBondContact O-N 3.37Å; N67-A69 VanDerWaalsContact C-N 3.29Å; A69-V71 PolarHBondContact O-N 3.19Å; A69-V279 HydrophobicContact CB-CB 4.38Å; A69-V279 HydrophobicContact CB-CG1 3.76Å; A69-V279 HydrophobicContact CB-CG2 3.66Å
70	K	94.2	Very high	97.1	Very high	182 Å²	182	41.7 Å²	41.7	79%	0.791	26%	0.255	S	S	*	.			trans	-77.5	113.7	166.6	-172.6	-179.6	178.5	-172.9	0	108.3	N283	K70-N283 PolarHBondContact O-ND2 3.45Å; K70-N283 PolarHBondContact O-OD1 3.34Å
71	V	93.7	Very high	97.1	Very high	31 Å²	31	40.7 Å²	40.7	19%	0.188	25%	0.245	C	C	.	.			trans	-95.7	125.1	174	-179.8	0	0	0	0	108.1	A69 V77 I282	A69-V71 PolarHBondContact O-N 3.19Å; V71-V77 HydrophobicContact CG1-CG2 3.62Å; V71-V77 HydrophobicContact CG2-CG2 4.47Å; V71-I282 HydrophobicContact CG1-CG2 4.1Å; V71-I282 HydrophobicContact CG2-CG2 4.4Å
72	P	94.4	Very high	97.1	Very high	11 Å²	11	36 Å²	36	7%	0.071	23%	0.225	C	C	.	.			trans	-59.2	142.5	174.5	-23.6	35	0	0	0	111.5	D74 T75 N283 Q286	P72-D74 WeakPolarHBondContact CB-OD1 3.14Å; P72-D74 PolarHBondContact O-N 3.46Å; P72-T75 PolarHBondContact O-N 3.27Å; P72-N283 VanDerWaalsContact CD-OD1 3.22Å; P72-N283 WeakPolarHBondContact CD-OD1 3.42Å; P72-N283 WeakPolarHBondContact CG-OD1 3.39Å; P72-Q286 HydrophobicContact CB-CG 4.45Å; P72-Q286 HydrophobicContact CG-CG 3.69Å
73	A	91.9	Very high	97.2	Very high	95 Å²	95	38.6 Å²	38.6	79%	0.785	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-28.1	-177.4	0	0	0	0	0	112.6	K43	K43-A73 WeakPolarHBondContact CE-O 3.5Å; K43-A73 PolarHBondContact NZ-O 3.33Å; K43-A73 VanDerWaalsContact NZ-O 3.07Å
74	D	93.9	Very high	97.2	Very high	82 Å²	82	42.6 Å²	42.6	44%	0.439	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	4	178.2	63.4	-37	0	0	0	113.9	K43 F44 P72	K43-D74 WeakPolarHBondContact CG-O 3.22Å; F44-D74 PolarHBondContact N-O 3.49Å; F44-D74 VanDerWaalsContact N-O 3.09Å; P72-D74 WeakPolarHBondContact CB-OD1 3.14Å; P72-D74 PolarHBondContact O-N 3.46Å
75	T	98	Very high	97.2	Very high	6 Å²	6	43.3 Å²	43.3	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	126.7	170.3	-56.8	0	0	0	0	110.8	K43 F44 V46 P72 V77 I282	K43-T75 VanDerWaalsContact CE-C 3.48Å; F44-T75 HydrophobicContact CD1-CG2 4.06Å; F44-T75 CarbonylContact O-C 3.53Å; F44-T75 WeakPolarHBondContact O-CA 3.25Å; V46-T75 HydrophobicContact CB-CG2 4.42Å; V46-T75 HydrophobicContact CG2-CG2 4Å; P72-T75 PolarHBondContact O-N 3.27Å; T75-V77 HydrophobicContact CG2-CG2 3.92Å; T75-I282 HydrophobicContact CG2-CG2 4.13Å; T75-I282 PolarHBondContact OG1-O 2.73Å
76	E	98.6	Very high	97.2	Very high	48 Å²	48	40.6 Å²	40.6	22%	0.224	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	127.2	166.3	-175.5	175.4	-175.7	0	0	109.1	K43 F44 F45 V46 V78 W128 R243	K43-E76 HydrophobicContact CD-CB 4.17Å; F44-E76 PolarHBondContact O-N 2.81Å; F45-E76 CarbonylContact C-O 3.46Å; F45-E76 WeakPolarHBondContact CA-O 3.13Å; F45-E76 HydrophobicContact CD2-CB 4.08Å; F45-E76 HydrophobicContact CD2-CG 3.99Å; F45-E76 HydrophobicContact CE2-CG 4.16Å; V46-E76 PolarHBondContact N-O 3.43Å; E76-V78 HydrophobicContact CG-CG2 4.43Å; E76-W128 WeakPolarHBondContact OE1-CZ2 3.45Å; E76-R243 IonicContact OE2-NH1 2.79Å; E76-R243 PolarHBondContact OE2-NH1 3.04Å
77	V	98.8	Very high	97.3	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131	-177.4	-173.2	0	0	0	0	109.6	V46 V71 T75 I97 A98 F278 I282	V46-V77 WeakPolarHBondContact O-CA 3.37Å; V71-V77 HydrophobicContact CG1-CG2 3.62Å; V71-V77 HydrophobicContact CG2-CG2 4.47Å; T75-V77 HydrophobicContact CG2-CG2 3.92Å; V77-I97 HydrophobicContact CB-CG1 4.41Å; V77-I97 HydrophobicContact CB-CG2 4.38Å; V77-I97 HydrophobicContact CG1-CG1 4.45Å; V77-I97 HydrophobicContact CG1-CG2 4Å; V77-A98 PolarHBondContact O-N 2.83Å; V77-F278 HydrophobicContact CG1-CE1 4.41Å; V77-I282 HydrophobicContact CG1-CD1 3.8Å; V77-I282 HydrophobicContact CG1-CG1 4.2Å; V77-I282 HydrophobicContact CG2-CD1 4.11Å; V77-I282 HydrophobicContact CG2-CG1 4Å; V77-I282 HydrophobicContact CG2-CG2 3.8Å
78	V	98.9	Very high	97.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.4	179.7	-171	0	0	0	0	109.8	F45 V46 G47 G48 E76 A98 A100 W128 I162	F45-V78 HydrophobicContact CD2-CG2 4.49Å; F45-V78 HydrophobicContact CE1-CG2 4.24Å; F45-V78 HydrophobicContact CE2-CG2 3.46Å; F45-V78 VanDerWaalsContact CE2-CG2 3.46Å; F45-V78 HydrophobicContact CZ-CB 3.96Å; F45-V78 HydrophobicContact CZ-CG2 3.32Å; V46-V78 PolarHBondContact O-N 3.09Å; G47-V78 CarbonylContact C-O 3.6Å; G47-V78 VanDerWaalsContact CA-O 3.26Å; G47-V78 WeakPolarHBondContact CA-O 3.48Å; G48-V78 PolarHBondContact N-O 2.94Å; E76-V78 HydrophobicContact CG-CG2 4.43Å; V78-A98 CarbonylContact C-O 3.6Å; V78-A98 WeakPolarHBondContact CA-O 3.5Å; V78-A98 HydrophobicContact CB-CB 4.47Å; V78-A98 HydrophobicContact CG1-CB 4.25Å; V78-A98 HydrophobicContact CG2-CB 4.06Å; V78-A100 HydrophobicContact CG1-CB 3.71Å; V78-W128 HydrophobicContact CG1-CB 3.95Å; V78-W128 HydrophobicContact CG1-CG 3.96Å; V78-W128 HydrophobicContact CG2-CG 4.44Å; V78-I162 HydrophobicContact CG1-CD1 4.47Å
79	C	98.9	Very high	97.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.5	174.9	-65.4	0	0	0	0	111	W50 P81 L93 A98 V99 A100	W50-C79 HydrophobicContact CH2-CB 4.36Å; W50-C79 HydrophobicContact CZ2-CB 3.67Å; C79-P81 WeakPolarHBondContact O-CD 3.27Å; C79-L93 HydrophobicContact CB-CD1 4.2Å; C79-A98 PolarHBondContact N-O 2.76Å; C79-V99 CarbonylContact O-C 3.47Å; C79-V99 WeakPolarHBondContact O-CA 3.47Å; C79-A100 PolarHBondContact O-N 3.33Å
80	A	98.9	Very high	97.5	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.025	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	85.8	177.7	0	0	0	0	0	110.5	G48 W50 A100 Q102 V130	G48-A80 PolarHBondContact O-N 2.85Å; W50-A80 WeakPolarHBondContact CB-O 3.37Å; W50-A80 PolarHBondContact N-O 2.71Å; W50-A80 VanDerWaalsContact N-O 3.13Å; A80-A100 WeakPolarHBondContact CA-O 3.3Å; A80-A100 HydrophobicContact CB-CB 3.94Å; A80-Q102 HydrophobicContact CB-CG 3.93Å; A80-Q102 PolarHBondContact O-NE2 3.37Å; A80-V130 HydrophobicContact CB-CG2 4.12Å
81	P	98.9	Very high	97.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.222	C	C	.	.			trans	-67.3	162.3	172.1	29.8	-38.3	0	0	0	112.7	W50 C79 I86 A89 V99 A100 Q102	W50-P81 HydrophobicContact CD2-CB 4.41Å; W50-P81 VanDerWaalsContact CE3-CA 3.45Å; W50-P81 HydrophobicContact CE3-CB 3.48Å; W50-P81 VanDerWaalsContact CE3-CB 3.48Å; W50-P81 HydrophobicContact CZ3-CB 3.59Å; C79-P81 WeakPolarHBondContact O-CD 3.27Å; P81-I86 HydrophobicContact CG-CG1 4.09Å; P81-A89 HydrophobicContact CB-CB 4.19Å; P81-A89 HydrophobicContact CG-CB 3.84Å; P81-V99 HydrophobicContact CG-CG1 4.02Å; P81-A100 WeakPolarHBondContact CD-O 3.41Å; P81-Q102 WeakPolarHBondContact O-CG 3.27Å; P81-Q102 PolarHBondContact O-NE2 3.02Å
82	P	98.8	Very high	97.9	Very high	19 Å²	19	42 Å²	42	12%	0.123	24%	0.236	C	C	.	.			trans	-53.4	146.7	163.7	-18	25.2	0	0	0	111.1	K51 N53 A84 Y85 I86	K51-P82 WeakPolarHBondContact O-CG 3.23Å; N53-P82 VanDerWaalsContact O-CG 3.22Å; N53-P82 WeakPolarHBondContact O-CG 3.48Å; P82-A84 PolarHBondContact O-N 2.89Å; P82-Y85 HydrophobicContact CB-CD2 3.98Å; P82-Y85 HydrophobicContact CG-CD2 3.89Å; P82-Y85 HydrophobicContact CG-CE2 4.38Å; P82-Y85 PolarHBondContact O-N 3.22Å; P82-I86 PolarHBondContact O-N 3.34Å
83	T	98.6	Very high	98.1	Very high	71 Å²	71	41.9 Å²	41.9	44%	0.436	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-48.9	-40.8	-176.7	-57.1	0	0	0	0	113.8	Y85 I86 I116	T83-Y85 PolarHBondContact O-N 3.47Å; T83-I86 HydrophobicContact CG2-CD1 4.28Å; T83-I86 PolarHBondContact O-N 3.36Å; T83-I116 HydrophobicContact CG2-CD1 3.71Å; T83-I116 HydrophobicContact CG2-CG2 3.8Å
84	A	98.4	Very high	98.4	Very high	87 Å²	87	39.8 Å²	39.8	72%	0.719	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-62.4	-12.2	179.1	0	0	0	0	0	114.6	P82	P82-A84 PolarHBondContact O-N 2.89Å
85	Y	98.8	Very high	98.5	Very high	53 Å²	53	41.5 Å²	41.5	21%	0.208	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-124.9	11.2	-176.4	-53.6	-60.4	0	0	0	113.6	G54 K56 L59 P82 T83 F88 A89	G54-Y85 WeakPolarHBondContact O-CE2 3.48Å; K56-Y85 HydrophobicContact CG-CD1 4.17Å; K56-Y85 HydrophobicContact CG-CE1 3.91Å; L59-Y85 HydrophobicContact CD1-CD1 4.48Å; L59-Y85 HydrophobicContact CD1-CD2 3.61Å; L59-Y85 HydrophobicContact CD1-CE2 4.21Å; L59-Y85 HydrophobicContact CD1-CG 3.76Å; P82-Y85 HydrophobicContact CB-CD2 3.98Å; P82-Y85 HydrophobicContact CG-CD2 3.89Å; P82-Y85 HydrophobicContact CG-CE2 4.38Å; P82-Y85 PolarHBondContact O-N 3.22Å; T83-Y85 PolarHBondContact O-N 3.47Å; Y85-F88 PolarHBondContact O-N 3.35Å; Y85-A89 VanDerWaalsContact O-CB 3.25Å; Y85-A89 WeakPolarHBondContact O-CB 3.42Å; Y85-A89 PolarHBondContact O-N 3.37Å
86	I	98.7	Very high	98.4	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-57.7	-55.6	177.2	-67.5	171.2	0	0	0	110.4	P81 P82 T83 F88 A89 R90 V99 A101 I116 C124 A126	P81-I86 HydrophobicContact CG-CG1 4.09Å; P82-I86 PolarHBondContact O-N 3.34Å; T83-I86 HydrophobicContact CG2-CD1 4.28Å; T83-I86 PolarHBondContact O-N 3.36Å; I86-F88 PolarHBondContact O-N 2.87Å; I86-A89 PolarHBondContact O-N 3.03Å; I86-R90 WeakPolarHBondContact O-CB 3.2Å; I86-R90 PolarHBondContact O-N 3.35Å; I86-V99 HydrophobicContact CG2-CG1 4.07Å; I86-A101 HydrophobicContact CD1-CB 3.74Å; I86-I116 HydrophobicContact CD1-CD1 4.34Å; I86-C124 HydrophobicContact CG2-CB 3.71Å; I86-A126 HydrophobicContact CG2-CB 3.73Å
87	D	98.6	Very high	98.4	Very high	79 Å²	79	43.5 Å²	43.5	42%	0.422	23%	0.233	S	C	.	.	H	α-helix	trans	-61.3	-44.3	-179.9	-178.7	39.6	0	0	0	111.8	A89 R90 Q91 C124	D87-A89 PolarHBondContact O-N 2.98Å; D87-R90 PolarHBondContact O-N 2.72Å; D87-Q91 WeakPolarHBondContact O-CB 3.47Å; D87-Q91 VanDerWaalsContact O-CG 3.3Å; D87-Q91 WeakPolarHBondContact O-CG 3.48Å; D87-Q91 PolarHBondContact O-N 3.16Å; D87-Q91 PolarHBondContact OD1-NE2 3.48Å; D87-Q91 PolarHBondContact OD2-NE2 3Å; D87-C124 HydrophobicContact CB-CB 4.28Å
88	F	98.8	Very high	98.4	Very high	28 Å²	28	44 Å²	44	12%	0.123	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-45.7	174.5	171.3	-96.3	0	0	0	112.9	K56 L59 I63 Y85 I86 K92	K56-F88 HydrophobicContact CB-CE2 4.16Å; K56-F88 HydrophobicContact CB-CZ 4.07Å; K56-F88 HydrophobicContact CD-CD2 4.21Å; K56-F88 HydrophobicContact CD-CE2 4.24Å; K56-F88 HydrophobicContact CG-CD2 4.18Å; K56-F88 HydrophobicContact CG-CE2 4.07Å; K56-F88 HydrophobicContact CG-CG 4.45Å; K56-F88 HydrophobicContact CG-CZ 4.29Å; K56-F88 VanDerWaalsContact O-CZ 3.3Å; K56-F88 WeakPolarHBondContact O-CZ 3.39Å; L59-F88 HydrophobicContact CB-CE1 3.96Å; I63-F88 HydrophobicContact CD1-CD1 4.48Å; I63-F88 HydrophobicContact CD1-CE1 4.08Å; Y85-F88 PolarHBondContact O-N 3.35Å; I86-F88 PolarHBondContact O-N 2.87Å; F88-K92 HydrophobicContact CD2-CD 4.3Å; F88-K92 HydrophobicContact CE1-CD 4.27Å; F88-K92 HydrophobicContact CE2-CD 3.64Å; F88-K92 VanDerWaalsContact CE2-CE 3.41Å; F88-K92 HydrophobicContact CZ-CD 3.62Å; F88-K92 PolarHBondContact O-N 3.27Å
89	A	98.7	Very high	98.4	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.4	-43	179.6	0	0	0	0	0	110.7	W50 I63 P81 Y85 I86 D87 Q91 K92 L93	W50-A89 HydrophobicContact CH2-CB 4.44Å; W50-A89 HydrophobicContact CZ3-CB 4.34Å; I63-A89 HydrophobicContact CD1-CB 4.24Å; P81-A89 HydrophobicContact CB-CB 4.19Å; P81-A89 HydrophobicContact CG-CB 3.84Å; Y85-A89 VanDerWaalsContact O-CB 3.25Å; Y85-A89 WeakPolarHBondContact O-CB 3.42Å; Y85-A89 PolarHBondContact O-N 3.37Å; I86-A89 PolarHBondContact O-N 3.03Å; D87-A89 PolarHBondContact O-N 2.98Å; A89-Q91 PolarHBondContact O-N 3.29Å; A89-K92 PolarHBondContact O-N 3.17Å; A89-L93 HydrophobicContact CB-CD1 4.2Å; A89-L93 VanDerWaalsContact O-CB 3.31Å; A89-L93 WeakPolarHBondContact O-CB 3.36Å; A89-L93 WeakPolarHBondContact O-CG 3.44Å; A89-L93 PolarHBondContact O-N 3.01Å
90	R	98.6	Very high	98.4	Very high	44 Å²	44	44 Å²	44	17%	0.166	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-41.2	-179.8	-176.4	62.7	-75.1	162.4	6.8	112.3	I86 D87 K92 L93 D94 I97 V99 C124 G125	I86-R90 WeakPolarHBondContact O-CB 3.2Å; I86-R90 PolarHBondContact O-N 3.35Å; D87-R90 PolarHBondContact O-N 2.72Å; R90-K92 PolarHBondContact O-N 2.82Å; R90-L93 PolarHBondContact NH2-O 3.36Å; R90-D94 PolarHBondContact NH2-O 3.05Å; R90-D94 VanDerWaalsContact NH2-O 3.13Å; R90-I97 VanDerWaalsContact CZ-O 3.28Å; R90-I97 PolarHBondContact NH1-O 2.85Å; R90-I97 PolarHBondContact NH2-O 3.37Å; R90-V99 HydrophobicContact CB-CB 4.46Å; R90-V99 HydrophobicContact CB-CG2 4.12Å; R90-C124 WeakPolarHBondContact CG-O 3.43Å; R90-G125 WeakPolarHBondContact CD-O 3.49Å
91	Q	98.6	Very high	98.4	Very high	140 Å²	140	43.9 Å²	43.9	65%	0.654	24%	0.236	S	C	*	.	H	α-helix	trans	-64.3	-26.8	177	-72.7	175	28.7	0	0	113.5	D87 A89	D87-Q91 WeakPolarHBondContact O-CB 3.47Å; D87-Q91 VanDerWaalsContact O-CG 3.3Å; D87-Q91 WeakPolarHBondContact O-CG 3.48Å; D87-Q91 PolarHBondContact O-N 3.16Å; D87-Q91 PolarHBondContact OD1-NE2 3.48Å; D87-Q91 PolarHBondContact OD2-NE2 3Å; A89-Q91 PolarHBondContact O-N 3.29Å
92	K	98.6	Very high	98.4	Very high	109 Å²	109	45.7 Å²	45.7	47%	0.474	25%	0.245	S	C	.	.	H	α-helix	trans	-104.6	-29.3	-173.7	-70.1	-163	169.8	-151.4	0	114.8	I63 N67 F88 A89 R90	I63-K92 HydrophobicContact CD1-CB 4.19Å; I63-K92 HydrophobicContact CG2-CB 3.82Å; I63-K92 WeakPolarHBondContact CG2-O 3.3Å; N67-K92 PolarHBondContact ND2-O 2.84Å; F88-K92 HydrophobicContact CD2-CD 4.3Å; F88-K92 HydrophobicContact CE1-CD 4.27Å; F88-K92 HydrophobicContact CE2-CD 3.64Å; F88-K92 VanDerWaalsContact CE2-CE 3.41Å; F88-K92 HydrophobicContact CZ-CD 3.62Å; F88-K92 PolarHBondContact O-N 3.27Å; A89-K92 PolarHBondContact O-N 3.17Å; R90-K92 PolarHBondContact O-N 2.82Å
93	L	98.6	Very high	98.4	Very high	7 Å²	7	45.9 Å²	45.9	4%	0.037	25%	0.245	C	C	.	.	S	Bend	trans	-71.6	137.1	177.3	-81	163.2	0	0	0	110.2	I63 L66 C79 A89 R90 I97 V99	I63-L93 HydrophobicContact CB-CD2 4.32Å; I63-L93 HydrophobicContact CD1-CG 4.35Å; I63-L93 HydrophobicContact CG1-CD2 4Å; I63-L93 HydrophobicContact CG1-CG 3.95Å; I63-L93 HydrophobicContact CG2-CD2 3.89Å; I63-L93 HydrophobicContact CG2-CG 3.94Å; L66-L93 HydrophobicContact CB-CD2 4.29Å; L66-L93 HydrophobicContact CD1-CD2 4.22Å; C79-L93 HydrophobicContact CB-CD1 4.2Å; A89-L93 HydrophobicContact CB-CD1 4.2Å; A89-L93 VanDerWaalsContact O-CB 3.31Å; A89-L93 WeakPolarHBondContact O-CB 3.36Å; A89-L93 WeakPolarHBondContact O-CG 3.44Å; A89-L93 PolarHBondContact O-N 3.01Å; R90-L93 PolarHBondContact NH2-O 3.36Å; L93-I97 HydrophobicContact CD1-CG2 4.35Å; L93-I97 HydrophobicContact CD2-CB 4.32Å; L93-I97 HydrophobicContact CD2-CD1 4.03Å; L93-I97 HydrophobicContact CD2-CG2 4.11Å; L93-V99 HydrophobicContact CD1-CG2 3.68Å
94	D	97.8	Very high	98.4	Very high	51 Å²	51	42.6 Å²	42.6	27%	0.273	22%	0.224	S	C	.	.			trans	-48.4	132.8	166.9	-174.3	-40.5	0	0	0	109.4	N67 R90 K96 I97	N67-D94 WeakPolarHBondContact OD1-CB 3.48Å; N67-D94 PolarHBondContact OD1-N 3.38Å; R90-D94 PolarHBondContact NH2-O 3.05Å; R90-D94 VanDerWaalsContact NH2-O 3.13Å; D94-K96 HydrophobicContact CB-CD 4.39Å; D94-K96 HydrophobicContact CB-CG 4.15Å; D94-K96 PolarHBondContact O-N 3.28Å; D94-K96 VanDerWaalsContact OD1-CG 3.31Å; D94-K96 WeakPolarHBondContact OD1-CG 3.32Å; D94-K96 PolarHBondContact OD1-N 2.96Å; D94-K96 WeakPolarHBondContact OD2-CD 3.37Å; D94-K96 VanDerWaalsContact OD2-CE 3.3Å; D94-K96 WeakPolarHBondContact OD2-CE 3.35Å; D94-K96 IonicContact OD2-NZ 3.7Å; D94-K96 PolarHBondContact OD2-NZ 3.46Å; D94-I97 PolarHBondContact O-N 3.07Å
95	P	96.5	Very high	98.4	Very high	118 Å²	118	40.6 Å²	40.6	77%	0.766	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-22.5	-180	-28.6	35.7	0	0	0	114.9	I97	P95-I97 PolarHBondContact O-N 3.39Å
96	K	95.8	Very high	98.4	Very high	96 Å²	96	41.4 Å²	41.4	42%	0.417	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.5	174.5	79.3	-164.5	177.9	-143.8	0	113.8	N67 D94	N67-K96 PolarHBondContact O-NZ 3Å; D94-K96 HydrophobicContact CB-CD 4.39Å; D94-K96 HydrophobicContact CB-CG 4.15Å; D94-K96 PolarHBondContact O-N 3.28Å; D94-K96 VanDerWaalsContact OD1-CG 3.31Å; D94-K96 WeakPolarHBondContact OD1-CG 3.32Å; D94-K96 PolarHBondContact OD1-N 2.96Å; D94-K96 WeakPolarHBondContact OD2-CD 3.37Å; D94-K96 VanDerWaalsContact OD2-CE 3.3Å; D94-K96 WeakPolarHBondContact OD2-CE 3.35Å; D94-K96 IonicContact OD2-NZ 3.7Å; D94-K96 PolarHBondContact OD2-NZ 3.46Å
97	I	98.4	Very high	98.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.9	175.3	-58.9	173.4	0	0	0	107.3	L66 V77 R90 L93 D94 P95	L66-I97 HydrophobicContact CB-CD1 3.85Å; V77-I97 HydrophobicContact CB-CG1 4.41Å; V77-I97 HydrophobicContact CB-CG2 4.38Å; V77-I97 HydrophobicContact CG1-CG1 4.45Å; V77-I97 HydrophobicContact CG1-CG2 4Å; R90-I97 VanDerWaalsContact CZ-O 3.28Å; R90-I97 PolarHBondContact NH1-O 2.85Å; R90-I97 PolarHBondContact NH2-O 3.37Å; L93-I97 HydrophobicContact CD1-CG2 4.35Å; L93-I97 HydrophobicContact CD2-CB 4.32Å; L93-I97 HydrophobicContact CD2-CD1 4.03Å; L93-I97 HydrophobicContact CD2-CG2 4.11Å; D94-I97 PolarHBondContact O-N 3.07Å; P95-I97 PolarHBondContact O-N 3.39Å
98	A	98.8	Very high	98.4	Very high	14 Å²	14	43 Å²	43	12%	0.116	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	158.9	178.1	0	0	0	0	0	111.4	V77 V78 C79	V77-A98 PolarHBondContact O-N 2.83Å; V78-A98 CarbonylContact C-O 3.6Å; V78-A98 WeakPolarHBondContact CA-O 3.5Å; V78-A98 HydrophobicContact CB-CB 4.47Å; V78-A98 HydrophobicContact CG1-CB 4.25Å; V78-A98 HydrophobicContact CG2-CB 4.06Å; C79-A98 PolarHBondContact N-O 2.76Å
99	V	98.9	Very high	98.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.1	174.8	176.7	0	0	0	0	109.2	C79 P81 I86 R90 L93 A126 T127 W128	C79-V99 CarbonylContact O-C 3.47Å; C79-V99 WeakPolarHBondContact O-CA 3.47Å; P81-V99 HydrophobicContact CG-CG1 4.02Å; I86-V99 HydrophobicContact CG2-CG1 4.07Å; R90-V99 HydrophobicContact CB-CB 4.46Å; R90-V99 HydrophobicContact CB-CG2 4.12Å; L93-V99 HydrophobicContact CD1-CG2 3.68Å; V99-A126 HydrophobicContact CB-CB 4.19Å; V99-A126 HydrophobicContact CG1-CB 3.97Å; V99-A126 WeakPolarHBondContact O-CA 3.36Å; V99-A126 WeakPolarHBondContact O-CB 3.24Å; V99-T127 PolarHBondContact O-N 3.16Å; V99-W128 PolarHBondContact O-N 3.36Å
100	A	98.9	Very high	98.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	153.2	174.5	0	0	0	0	0	111.6	V78 C79 A80 P81 W128	V78-A100 HydrophobicContact CG1-CB 3.71Å; C79-A100 PolarHBondContact O-N 3.33Å; A80-A100 WeakPolarHBondContact CA-O 3.3Å; A80-A100 HydrophobicContact CB-CB 3.94Å; P81-A100 WeakPolarHBondContact CD-O 3.41Å; A100-W128 CarbonylContact C-O 3.54Å; A100-W128 WeakPolarHBondContact CA-O 3.14Å; A100-W128 HydrophobicContact CB-CB 3.53Å
101	A	98.9	Very high	98.3	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	155.5	157.9	0	0	0	0	0	110.9	I86 I116 I121 W128 V129 V130	I86-A101 HydrophobicContact CD1-CB 3.74Å; A101-I116 HydrophobicContact CB-CD1 4.25Å; A101-I121 HydrophobicContact CB-CD1 3.4Å; A101-I121 VanDerWaalsContact CB-CD1 3.4Å; A101-I121 HydrophobicContact CB-CG1 3.69Å; A101-I121 HydrophobicContact CB-CG2 4.04Å; A101-W128 PolarHBondContact N-O 3.02Å; A101-V129 HydrophobicContact CB-CB 4.44Å; A101-V129 HydrophobicContact CB-CG2 4.06Å; A101-V129 CarbonylContact O-C 3.54Å; A101-V129 WeakPolarHBondContact O-CA 3.39Å; A101-V130 PolarHBondContact O-N 2.67Å
102	Q	98.9	Very high	98.3	Very high	39 Å²	39	50.6 Å²	50.6	18%	0.182	29%	0.289	C	S	.	.	S	Bend	trans	-84.9	-16.7	178.3	-70	175.5	-2.9	0	0	114	K51 A80 P81 V130	K51-Q102 PolarHBondContact O-NE2 3.2Å; K51-Q102 PolarHBondContact O-OE1 3.03Å; A80-Q102 HydrophobicContact CB-CG 3.93Å; A80-Q102 PolarHBondContact O-NE2 3.37Å; P81-Q102 WeakPolarHBondContact O-CG 3.27Å; P81-Q102 PolarHBondContact O-NE2 3.02Å; Q102-V130 CarbonylContact C-O 3.6Å; Q102-V130 VanDerWaalsContact O-O 3.07Å
103	N	98.9	Very high	98.3	Very high	23 Å²	23	52.6 Å²	52.6	12%	0.123	31%	0.31	C	S	.	.			trans	-165.6	162.9	174.6	-165.5	17.7	0	0	0	109	L131 R136 E142 K150	N103-L131 WeakPolarHBondContact OD1-CD2 3.48Å; N103-R136 PolarHBondContact ND2-NE 2.88Å; N103-E142 PolarHBondContact ND2-OE1 3.06Å; N103-K150 PolarHBondContact ND2-NZ 3.03Å; N103-K150 PolarHBondContact OD1-NZ 2.94Å
104	C	98.9	Very high	98.3	Very high	1 Å²	1	56 Å²	56	1%	0.007	35%	0.347	C	S	.	.			trans	-150.7	175.5	165.7	74.8	0	0	0	0	110.7	I116 I121 V129 K150	C104-I116 CarbonylContact C-O 3.27Å; C104-I116 WeakPolarHBondContact CA-O 3.31Å; C104-I116 HydrophobicContact CB-CG1 4.42Å; C104-I121 HydrophobicContact CB-CD1 3.5Å; C104-V129 HydrophobicContact CB-CG2 4.11Å; C104-K150 WeakPolarHBondContact O-CD 3.5Å; C104-K150 WeakPolarHBondContact O-CE 3.35Å; C104-K150 PolarHBondContact O-NZ 3.46Å
105	Y	98.9	Very high	98.4	Very high	45 Å²	45	56.9 Å²	56.9	18%	0.176	35%	0.35	C	S	.	.			trans	-102.3	173.7	175.6	-151.3	-119.1	0	0	0	113.1	V107 F112 E115 I116 L146	Y105-V107 HydrophobicContact CD1-CG2 3.94Å; Y105-V107 HydrophobicContact CE1-CG2 4.35Å; Y105-F112 HydrophobicContact CD1-CB 4.42Å; Y105-F112 HydrophobicContact CD1-CD1 4.1Å; Y105-F112 HydrophobicContact CD1-CD2 4.19Å; Y105-F112 HydrophobicContact CD1-CE1 4.44Å; Y105-F112 AromaticContact CD1-CG 3.96Å; Y105-F112 HydrophobicContact CD1-CG 3.96Å; Y105-F112 HydrophobicContact CE1-CB 4.48Å; Y105-F112 AromaticContact CE1-CD1 3.37Å; Y105-F112 HydrophobicContact CE1-CD1 3.37Å; Y105-F112 HydrophobicContact CE1-CD2 4.1Å; Y105-F112 AromaticContact CE1-CE1 3.46Å; Y105-F112 HydrophobicContact CE1-CE1 3.46Å; Y105-F112 VanDerWaalsContact CE1-CE1 3.46Å; Y105-F112 HydrophobicContact CE1-CE2 4.18Å; Y105-F112 AromaticContact CE1-CG 3.71Å; Y105-F112 HydrophobicContact CE1-CG 3.71Å; Y105-F112 AromaticContact CE1-CZ 3.87Å; Y105-F112 HydrophobicContact CE1-CZ 3.87Å; Y105-F112 AromaticContact CZ-CD1 3.83Å; Y105-F112 AromaticContact CZ-CE1 3.97Å; Y105-E115 HydrophobicContact CD2-CG 3.86Å; Y105-E115 WeakPolarHBondContact CD2-OE2 3.45Å; Y105-E115 HydrophobicContact CE2-CG 4.42Å; Y105-E115 HydrophobicContact CG-CB 4.22Å; Y105-E115 HydrophobicContact CG-CG 4.01Å; Y105-I116 PolarHBondContact N-O 3.47Å; Y105-L146 HydrophobicContact CE2-CD1 4.36Å
106	K	98.8	Very high	98.5	Very high	70 Å²	70	52.8 Å²	52.8	30%	0.304	32%	0.321	S	S	.	.	S	Bend	trans	-93	7.5	-168.8	64.6	177.1	178.8	-171.4	0	115.3	L146 Q149 K150	K106-L146 HydrophobicContact CD-CD1 3.88Å; K106-Q149 HydrophobicContact CB-CB 4.09Å; K106-Q149 HydrophobicContact CD-CB 3.86Å; K106-Q149 HydrophobicContact CD-CG 4.48Å; K106-K150 HydrophobicContact CB-CG 4.15Å
107	V	98.6	Very high	98.6	Very high	52 Å²	52	48.6 Å²	48.6	32%	0.315	30%	0.303	S	S	.	.	S	Bend	trans	-141	158.1	177.6	-64.2	0	0	0	0	111.3	Y105 F112 S117 H153	Y105-V107 HydrophobicContact CD1-CG2 3.94Å; Y105-V107 HydrophobicContact CE1-CG2 4.35Å; V107-F112 HydrophobicContact CG2-CD2 3.9Å; V107-F112 HydrophobicContact CG2-CE2 3.51Å; V107-F112 HydrophobicContact CG2-CZ 4.26Å; V107-S117 VanDerWaalsContact O-CB 3.29Å; V107-S117 WeakPolarHBondContact O-CB 3.37Å; V107-H153 WeakPolarHBondContact CA-NE2 3.41Å; V107-H153 PolarHBondContact N-CD2 3.18Å; V107-H153 VanDerWaalsContact N-CD2 3.34Å
108	T	98.1	Very high	98.6	Very high	66 Å²	66	48.6 Å²	48.6	41%	0.405	30%	0.303	S	S	.	.	S	Bend	trans	-68	-38.5	-174.4	-49.4	0	0	0	0	113.1	S117 H153 E157	T108-S117 WeakPolarHBondContact O-CB 3.23Å; T108-S117 PolarHBondContact O-OG 3.34Å; T108-H153 PolarHBondContact N-NE2 2.92Å; T108-H153 PolarHBondContact OG1-CE1 2.85Å; T108-E157 PolarHBondContact OG1-OE1 2.88Å
109	N	97.9	Very high	98.6	Very high	127 Å²	127	49 Å²	49	68%	0.679	31%	0.309	S	S	*	.	S	Bend	trans	-160.3	169.2	176.5	58.9	62.1	0	0	0	110.7
110	G	98.1	Very high	98.6	Very high	54 Å²	54	53.8 Å²	53.8	56%	0.557	33%	0.333	S	S	*	.	S	Bend	trans	151.6	-169.3	174.5	0	0	0	0	0	113.7	F112	G110-F112 PolarHBondContact O-N 3.38Å
111	A	98.3	Very high	98.6	Very high	102 Å²	102	53.8 Å²	53.8	84%	0.843	33%	0.333	S	S	*	.	S	Bend	trans	-80.3	64.1	179.9	0	0	0	0	0	112.2
112	F	98.5	Very high	98.6	Very high	88 Å²	88	57.8 Å²	57.8	39%	0.386	35%	0.35	S	S	.	.			trans	-125.3	64.5	-178.6	-56.3	-77.7	0	0	0	110.6	Y105 V107 G110 G114 E115	Y105-F112 HydrophobicContact CD1-CB 4.42Å; Y105-F112 HydrophobicContact CD1-CD1 4.1Å; Y105-F112 HydrophobicContact CD1-CD2 4.19Å; Y105-F112 HydrophobicContact CD1-CE1 4.44Å; Y105-F112 AromaticContact CD1-CG 3.96Å; Y105-F112 HydrophobicContact CD1-CG 3.96Å; Y105-F112 HydrophobicContact CE1-CB 4.48Å; Y105-F112 AromaticContact CE1-CD1 3.37Å; Y105-F112 HydrophobicContact CE1-CD1 3.37Å; Y105-F112 HydrophobicContact CE1-CD2 4.1Å; Y105-F112 AromaticContact CE1-CE1 3.46Å; Y105-F112 HydrophobicContact CE1-CE1 3.46Å; Y105-F112 VanDerWaalsContact CE1-CE1 3.46Å; Y105-F112 HydrophobicContact CE1-CE2 4.18Å; Y105-F112 AromaticContact CE1-CG 3.71Å; Y105-F112 HydrophobicContact CE1-CG 3.71Å; Y105-F112 AromaticContact CE1-CZ 3.87Å; Y105-F112 HydrophobicContact CE1-CZ 3.87Å; Y105-F112 AromaticContact CZ-CD1 3.83Å; Y105-F112 AromaticContact CZ-CE1 3.97Å; V107-F112 HydrophobicContact CG2-CD2 3.9Å; V107-F112 HydrophobicContact CG2-CE2 3.51Å; V107-F112 HydrophobicContact CG2-CZ 4.26Å; G110-F112 PolarHBondContact O-N 3.38Å; F112-G114 PolarHBondContact O-N 2.73Å; F112-E115 HydrophobicContact CB-CB 4.08Å; F112-E115 HydrophobicContact CB-CG 4.15Å; F112-E115 WeakPolarHBondContact O-CB 3.36Å; F112-E115 PolarHBondContact O-N 2.87Å
113	T	98.6	Very high	98.6	Very high	152 Å²	152	62.9 Å²	62.9	93%	0.933	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	123.7	-176.9	-57.7	0	0	0	0	111.7
114	G	98.3	Very high	98.6	Very high	78 Å²	78	63.7 Å²	63.7	80%	0.804	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	-16.2	179.6	0	0	0	0	0	114.7	F112	F112-G114 PolarHBondContact O-N 2.73Å
115	E	98.8	Very high	98.6	Very high	70 Å²	70	65.3 Å²	65.3	33%	0.327	40%	0.403	S	S	.	.			trans	-85.1	159.2	175.3	-66.1	-64.6	122	0	0	112.2	Y105 F112	Y105-E115 HydrophobicContact CD2-CG 3.86Å; Y105-E115 WeakPolarHBondContact CD2-OE2 3.45Å; Y105-E115 HydrophobicContact CE2-CG 4.42Å; Y105-E115 HydrophobicContact CG-CB 4.22Å; Y105-E115 HydrophobicContact CG-CG 4.01Å; F112-E115 HydrophobicContact CB-CB 4.08Å; F112-E115 HydrophobicContact CB-CG 4.15Å; F112-E115 WeakPolarHBondContact O-CB 3.36Å; F112-E115 PolarHBondContact O-N 2.87Å
116	I	98.8	Very high	98.6	Very high	32 Å²	32	63.3 Å²	63.3	16%	0.164	40%	0.395	C	S	.	.			trans	-122.5	150.8	169.7	66.8	176.7	0	0	0	110.1	T83 I86 A101 C104 Y105 M120 I121	T83-I116 HydrophobicContact CG2-CD1 3.71Å; T83-I116 HydrophobicContact CG2-CG2 3.8Å; I86-I116 HydrophobicContact CD1-CD1 4.34Å; A101-I116 HydrophobicContact CB-CD1 4.25Å; C104-I116 CarbonylContact C-O 3.27Å; C104-I116 WeakPolarHBondContact CA-O 3.31Å; C104-I116 HydrophobicContact CB-CG1 4.42Å; Y105-I116 PolarHBondContact N-O 3.47Å; I116-M120 HydrophobicContact CB-SD 4.13Å; I116-M120 HydrophobicContact CG2-SD 4.39Å; I116-I121 HydrophobicContact CD1-CD1 4Å; I116-I121 HydrophobicContact CD1-CG1 3.8Å; I116-I121 HydrophobicContact CG1-CD1 4.34Å; I116-I121 HydrophobicContact CG1-CG1 4.4Å
117	S	98.9	Very high	98.6	Very high	7 Å²	7	63.3 Å²	63.3	5%	0.049	40%	0.401	C	S	.	.			trans	-99.9	160.5	177.1	70.1	0	0	0	0	112.5	V107 T108 G119 M120 I121	V107-S117 VanDerWaalsContact O-CB 3.29Å; V107-S117 WeakPolarHBondContact O-CB 3.37Å; T108-S117 WeakPolarHBondContact O-CB 3.23Å; T108-S117 PolarHBondContact O-OG 3.34Å; S117-G119 PolarHBondContact O-N 2.9Å; S117-M120 PolarHBondContact O-N 3.03Å; S117-M120 VanDerWaalsContact O-N 3.08Å; S117-M120 PolarHBondContact OG-N 3.37Å; S117-I121 WeakPolarHBondContact O-CG1 3.4Å; S117-I121 PolarHBondContact O-N 3.23Å
118	P	98.9	Very high	98.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-52.9	-33.9	170.4	-28.7	36.8	0	0	0	113.7	I121 K122 A154 E157 L159	P118-I121 PolarHBondContact O-N 2.87Å; P118-K122 WeakPolarHBondContact O-CG 3.3Å; P118-K122 PolarHBondContact O-N 3.4Å; P118-A154 HydrophobicContact CG-CB 4.27Å; P118-E157 HydrophobicContact CB-CB 3.57Å; P118-E157 HydrophobicContact CB-CG 3.84Å; P118-E157 HydrophobicContact CG-CB 4.42Å; P118-E157 HydrophobicContact CG-CG 4.36Å; P118-L159 HydrophobicContact CB-CD1 3.69Å; P118-L159 HydrophobicContact CB-CG 4.36Å; P118-L159 HydrophobicContact CG-CD1 4.5Å
119	G	98.6	Very high	98.6	Very high	23 Å²	23	58.6 Å²	58.6	24%	0.237	37%	0.37	C	S	.	.	H	α-helix	trans	-59.8	-46.2	175.1	0	0	0	0	0	112.7	S117 I121 K122 D123	S117-G119 PolarHBondContact O-N 2.9Å; G119-I121 VanDerWaalsContact C-N 3.32Å; G119-I121 PolarHBondContact O-N 3.46Å; G119-K122 PolarHBondContact O-N 3.43Å; G119-D123 WeakPolarHBondContact O-CB 3.46Å; G119-D123 PolarHBondContact O-N 2.88Å
120	M	98.9	Very high	98.7	Very high	100 Å²	100	52.6 Å²	52.6	49%	0.493	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-36.3	177.1	-63.7	172.3	-179.4	0	0	112.2	I116 S117 D123 C124	I116-M120 HydrophobicContact CB-SD 4.13Å; I116-M120 HydrophobicContact CG2-SD 4.39Å; S117-M120 PolarHBondContact O-N 3.03Å; S117-M120 VanDerWaalsContact O-N 3.08Å; S117-M120 PolarHBondContact OG-N 3.37Å; M120-D123 WeakPolarHBondContact O-CB 3.32Å; M120-D123 PolarHBondContact O-N 2.76Å; M120-C124 PolarHBondContact O-N 2.92Å; M120-C124 VanDerWaalsContact O-N 3.17Å; M120-C124 PolarHBondContact O-SG 2.84Å
121	I	98.9	Very high	98.7	Very high	1 Å²	1	50 Å²	50	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-46.8	177.9	-65	166.7	0	0	0	110.3	A101 C104 I116 S117 P118 G119 D123 C124 A126 V129 L159	A101-I121 HydrophobicContact CB-CD1 3.4Å; A101-I121 VanDerWaalsContact CB-CD1 3.4Å; A101-I121 HydrophobicContact CB-CG1 3.69Å; A101-I121 HydrophobicContact CB-CG2 4.04Å; C104-I121 HydrophobicContact CB-CD1 3.5Å; I116-I121 HydrophobicContact CD1-CD1 4Å; I116-I121 HydrophobicContact CD1-CG1 3.8Å; I116-I121 HydrophobicContact CG1-CD1 4.34Å; I116-I121 HydrophobicContact CG1-CG1 4.4Å; S117-I121 WeakPolarHBondContact O-CG1 3.4Å; S117-I121 PolarHBondContact O-N 3.23Å; P118-I121 PolarHBondContact O-N 2.87Å; G119-I121 VanDerWaalsContact C-N 3.32Å; G119-I121 PolarHBondContact O-N 3.46Å; I121-D123 VanDerWaalsContact C-N 3.32Å; I121-D123 PolarHBondContact O-N 3.02Å; I121-C124 PolarHBondContact O-N 2.93Å; I121-A126 HydrophobicContact CG2-CB 3.61Å; I121-A126 PolarHBondContact O-N 3.12Å; I121-A126 VanDerWaalsContact O-N 3.16Å; I121-V129 HydrophobicContact CD1-CB 4.45Å; I121-V129 HydrophobicContact CD1-CG2 4.27Å; I121-L159 HydrophobicContact CB-CD1 4.12Å; I121-L159 HydrophobicContact CD1-CD1 4.14Å; I121-L159 HydrophobicContact CG2-CD1 3.97Å; I121-L159 HydrophobicContact CG2-CD2 4.04Å
122	K	98.7	Very high	98.7	Very high	83 Å²	83	45.2 Å²	45.2	36%	0.361	27%	0.272	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.4	-71.8	-175.1	-65.7	179.9	0	112.5	P118 G119 C124 G125 E157 L159	P118-K122 WeakPolarHBondContact O-CG 3.3Å; P118-K122 PolarHBondContact O-N 3.4Å; G119-K122 PolarHBondContact O-N 3.43Å; K122-C124 PolarHBondContact O-N 2.95Å; K122-G125 WeakPolarHBondContact O-CA 3.11Å; K122-G125 PolarHBondContact O-N 2.79Å; K122-E157 VanDerWaalsContact CD-O 3.23Å; K122-E157 WeakPolarHBondContact CD-O 3.36Å; K122-E157 VanDerWaalsContact CE-O 3.27Å; K122-E157 WeakPolarHBondContact CE-O 3.43Å; K122-E157 PolarHBondContact NZ-O 3.37Å; K122-E157 IonicContact NZ-OE2 2.76Å; K122-E157 PolarHBondContact NZ-OE2 3.05Å; K122-L159 HydrophobicContact CD-CD2 4.39Å; K122-L159 HydrophobicContact CG-CD2 3.55Å; K122-L159 HydrophobicContact CG-CG 4.2Å
123	D	98.6	Very high	98.8	Very high	147 Å²	147	41.3 Å²	41.3	79%	0.786	26%	0.255	S	S	*	.	H	α-helix	trans	-61.1	-35.2	178.6	-169.8	55.4	0	0	0	111.8	G119 M120 I121 G125	G119-D123 WeakPolarHBondContact O-CB 3.46Å; G119-D123 PolarHBondContact O-N 2.88Å; M120-D123 WeakPolarHBondContact O-CB 3.32Å; M120-D123 PolarHBondContact O-N 2.76Å; I121-D123 VanDerWaalsContact C-N 3.32Å; I121-D123 PolarHBondContact O-N 3.02Å; D123-G125 PolarHBondContact O-N 2.85Å
124	C	98.6	Very high	98.7	Very high	40 Å²	40	34.7 Å²	34.7	27%	0.27	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	3.7	171.5	-64.2	0	0	0	0	114.1	I86 D87 R90 M120 I121 K122 A126	I86-C124 HydrophobicContact CG2-CB 3.71Å; D87-C124 HydrophobicContact CB-CB 4.28Å; R90-C124 WeakPolarHBondContact CG-O 3.43Å; M120-C124 PolarHBondContact O-N 2.92Å; M120-C124 VanDerWaalsContact O-N 3.17Å; M120-C124 PolarHBondContact O-SG 2.84Å; I121-C124 PolarHBondContact O-N 2.93Å; K122-C124 PolarHBondContact O-N 2.95Å; C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.97Å
125	G	98.4	Very high	98.7	Very high	35 Å²	35	34.1 Å²	34.1	36%	0.361	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	10.6	-179	0	0	0	0	0	115.2	R90 K122 D123	R90-G125 WeakPolarHBondContact CD-O 3.49Å; K122-G125 WeakPolarHBondContact O-CA 3.11Å; K122-G125 PolarHBondContact O-N 2.79Å; D123-G125 PolarHBondContact O-N 2.85Å
126	A	98.8	Very high	98.7	Very high	2 Å²	2	33 Å²	33	2%	0.017	18%	0.184	C	C	.	.			trans	-79.8	143.7	172	0	0	0	0	0	110.6	I86 V99 I121 C124	I86-A126 HydrophobicContact CG2-CB 3.73Å; V99-A126 HydrophobicContact CB-CB 4.19Å; V99-A126 HydrophobicContact CG1-CB 3.97Å; V99-A126 WeakPolarHBondContact O-CA 3.36Å; V99-A126 WeakPolarHBondContact O-CB 3.24Å; I121-A126 HydrophobicContact CG2-CB 3.61Å; I121-A126 PolarHBondContact O-N 3.12Å; I121-A126 VanDerWaalsContact O-N 3.16Å; C124-A126 VanDerWaalsContact C-N 3.29Å; C124-A126 PolarHBondContact O-N 2.97Å
127	T	98.8	Very high	98.7	Very high	71 Å²	71	32.6 Å²	32.6	44%	0.436	18%	0.18	S	C	.	.			trans	-115.6	-5.2	-172.3	54	0	0	0	0	113.3	V99 G160	V99-T127 PolarHBondContact O-N 3.16Å; T127-G160 PolarHBondContact O-N 2.87Å
128	W	98.9	Very high	98.7	Very high	19 Å²	19	36.1 Å²	36.1	7%	0.072	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.3	-176.2	-74	93.3	0	0	0	112.3	F45 E76 V78 V99 A100 A101 G160 I162 V199	F45-W128 HydrophobicContact CE2-CH2 4.2Å; F45-W128 HydrophobicContact CE2-CZ2 4.05Å; E76-W128 WeakPolarHBondContact OE1-CZ2 3.45Å; V78-W128 HydrophobicContact CG1-CB 3.95Å; V78-W128 HydrophobicContact CG1-CG 3.96Å; V78-W128 HydrophobicContact CG2-CG 4.44Å; V99-W128 PolarHBondContact O-N 3.36Å; A100-W128 CarbonylContact C-O 3.54Å; A100-W128 WeakPolarHBondContact CA-O 3.14Å; A100-W128 HydrophobicContact CB-CB 3.53Å; A101-W128 PolarHBondContact N-O 3.02Å; W128-G160 CarbonylContact C-O 3.58Å; W128-G160 VanDerWaalsContact CA-O 3.27Å; W128-G160 WeakPolarHBondContact CA-O 3.45Å; W128-G160 VanDerWaalsContact CE3-CA 3.41Å; W128-I162 HydrophobicContact CE3-CG1 3.88Å; W128-I162 HydrophobicContact CZ3-CG1 4.29Å; W128-V199 HydrophobicContact CH2-CG2 3.83Å; W128-V199 HydrophobicContact CZ3-CG2 3.87Å
129	V	98.9	Very high	98.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	139.5	166.6	61.6	0	0	0	0	110.8	A101 C104 I121 L131 A154 L159 G160 V161 I162	A101-V129 HydrophobicContact CB-CB 4.44Å; A101-V129 HydrophobicContact CB-CG2 4.06Å; A101-V129 CarbonylContact O-C 3.54Å; A101-V129 WeakPolarHBondContact O-CA 3.39Å; C104-V129 HydrophobicContact CB-CG2 4.11Å; I121-V129 HydrophobicContact CD1-CB 4.45Å; I121-V129 HydrophobicContact CD1-CG2 4.27Å; V129-L131 HydrophobicContact CG1-CD1 4.03Å; V129-L131 HydrophobicContact CG1-CG 4.08Å; V129-L131 HydrophobicContact CG2-CD2 4.07Å; V129-L131 HydrophobicContact CG2-CG 4.09Å; V129-A154 HydrophobicContact CG1-CB 3.81Å; V129-L159 HydrophobicContact CB-CD1 4.33Å; V129-L159 HydrophobicContact CG1-CD1 4.11Å; V129-G160 PolarHBondContact N-O 3.41Å; V129-V161 HydrophobicContact CG1-CG2 4.1Å; V129-V161 WeakPolarHBondContact O-CA 3.42Å; V129-I162 PolarHBondContact O-N 3.04Å
130	V	98.9	Very high	98.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	128.2	169.4	-175.7	0	0	0	0	108.6	A80 A101 Q102 H133 I162	A80-V130 HydrophobicContact CB-CG2 4.12Å; A101-V130 PolarHBondContact O-N 2.67Å; Q102-V130 CarbonylContact C-O 3.6Å; Q102-V130 VanDerWaalsContact O-O 3.07Å; V130-H133 HydrophobicContact CG1-CB 4.2Å; V130-I162 WeakPolarHBondContact CA-O 3.26Å; V130-I162 HydrophobicContact CG2-CB 4.29Å; V130-I162 HydrophobicContact CG2-CD1 4.05Å
131	L	98.9	Very high	98.6	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	145.2	-179.3	-70	176.7	0	0	0	111.2	N103 V129 H133 K150 V151 A154 V161 I162 A163 C164	N103-L131 WeakPolarHBondContact OD1-CD2 3.48Å; V129-L131 HydrophobicContact CG1-CD1 4.03Å; V129-L131 HydrophobicContact CG1-CG 4.08Å; V129-L131 HydrophobicContact CG2-CD2 4.07Å; V129-L131 HydrophobicContact CG2-CG 4.09Å; L131-H133 VanDerWaalsContact C-N 3.25Å; L131-H133 PolarHBondContact O-N 3.21Å; L131-K150 HydrophobicContact CD1-CB 3.88Å; L131-K150 HydrophobicContact CD2-CB 4Å; L131-K150 HydrophobicContact CD2-CD 4.09Å; L131-V151 HydrophobicContact CB-CG2 4.35Å; L131-V151 HydrophobicContact CD1-CG2 3.98Å; L131-A154 HydrophobicContact CD1-CB 4.18Å; L131-V161 HydrophobicContact CB-CG1 4.26Å; L131-V161 HydrophobicContact CD1-CG1 4Å; L131-V161 HydrophobicContact CD1-CG2 4.45Å; L131-V161 HydrophobicContact CG-CG1 4.4Å; L131-I162 PolarHBondContact N-O 3.45Å; L131-A163 WeakPolarHBondContact O-CA 3.36Å; L131-C164 PolarHBondContact O-N 3.23Å
132	G	98.8	Very high	98.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	68.7	20.1	-179	0	0	0	0	0	114.7	R137 C164	G132-R137 WeakPolarHBondContact O-CD 3.43Å; G132-R137 PolarHBondContact O-NE 3.18Å; G132-C164 WeakPolarHBondContact O-CB 3.42Å
133	H	98.8	Very high	98.6	Very high	6 Å²	6	44 Å²	44	3%	0.028	26%	0.255	C	S	.	.			trans	-54.7	144.7	173.7	-173	-97.2	0	0	0	110.9	N49 V130 L131 E135 R136 R137 E203	N49-H133 PolarHBondContact ND2-NE2 2.87Å; V130-H133 HydrophobicContact CG1-CB 4.2Å; L131-H133 VanDerWaalsContact C-N 3.25Å; L131-H133 PolarHBondContact O-N 3.21Å; H133-E135 IonicContact CE1-OE1 3.69Å; H133-E135 IonicContact CE1-OE2 3.71Å; H133-E135 PolarHBondContact CE1-OE2 3.2Å; H133-E135 PolarHBondContact ND1-N 3.29Å; H133-E135 IonicContact ND1-OE2 2.76Å; H133-E135 PolarHBondContact O-N 3.44Å; H133-E135 VanDerWaalsContact O-N 3.12Å; H133-R136 HydrophobicContact CB-CG 4.45Å; H133-R136 WeakPolarHBondContact O-CA 3.45Å; H133-R136 VanDerWaalsContact O-CB 3.31Å; H133-R136 WeakPolarHBondContact O-CB 3.17Å; H133-R136 PolarHBondContact O-N 3.15Å; H133-R137 PolarHBondContact O-N 3.24Å; H133-R137 VanDerWaalsContact O-N 3.14Å; H133-E203 IonicContact CD2-OE2 3.6Å; H133-E203 PolarHBondContact CD2-OE2 3.46Å; H133-E203 VanDerWaalsContact CD2-OE2 3.31Å; H133-E203 IonicContact NE2-OE2 2.71Å
134	S	98.1	Very high	98.6	Very high	13 Å²	13	39.8 Å²	39.8	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-53.8	-37.9	-174.6	66.7	0	0	0	0	113.3	R136 R137 H138 I208	S134-R136 VanDerWaalsContact C-N 3.32Å; S134-R136 PolarHBondContact O-N 3.47Å; S134-R137 PolarHBondContact O-N 2.74Å; S134-H138 WeakPolarHBondContact O-CB 3.37Å; S134-H138 PolarHBondContact O-CD2 3.09Å; S134-H138 PolarHBondContact O-N 3.39Å; S134-I208 WeakPolarHBondContact OG-CD1 3.41Å
135	E	98.5	Very high	98.6	Very high	66 Å²	66	44.1 Å²	44.1	31%	0.308	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-39.4	175.3	-69	160.9	-169.3	0	0	111.5	K51 H133 V139 F140	K51-E135 WeakPolarHBondContact CD-OE1 3.49Å; K51-E135 VanDerWaalsContact CE-OE1 3.24Å; K51-E135 WeakPolarHBondContact CE-OE1 3.23Å; K51-E135 IonicContact NZ-OE1 2.67Å; K51-E135 PolarHBondContact NZ-OE1 2.94Å; H133-E135 IonicContact CE1-OE1 3.69Å; H133-E135 IonicContact CE1-OE2 3.71Å; H133-E135 PolarHBondContact CE1-OE2 3.2Å; H133-E135 PolarHBondContact ND1-N 3.29Å; H133-E135 IonicContact ND1-OE2 2.76Å; H133-E135 PolarHBondContact O-N 3.44Å; H133-E135 VanDerWaalsContact O-N 3.12Å; E135-V139 WeakPolarHBondContact O-CA 3.49Å; E135-V139 WeakPolarHBondContact O-CB 3.31Å; E135-V139 PolarHBondContact O-N 3.14Å; E135-F140 WeakPolarHBondContact O-CD2 3.33Å; E135-F140 PolarHBondContact O-N 3.36Å
136	R	98.8	Very high	98.6	Very high	48 Å²	48	44.1 Å²	44.1	18%	0.181	24%	0.239	C	C	.	.	H	α-helix	trans	-65.8	-42.3	175.5	-64.8	-57.2	-52.7	155.4	0.7	111.7	N103 H133 S134 F140 G141 E142	N103-R136 PolarHBondContact ND2-NE 2.88Å; H133-R136 HydrophobicContact CB-CG 4.45Å; H133-R136 WeakPolarHBondContact O-CA 3.45Å; H133-R136 VanDerWaalsContact O-CB 3.31Å; H133-R136 WeakPolarHBondContact O-CB 3.17Å; H133-R136 PolarHBondContact O-N 3.15Å; S134-R136 VanDerWaalsContact C-N 3.32Å; S134-R136 PolarHBondContact O-N 3.47Å; R136-F140 VanDerWaalsContact NH1-CD1 3.31Å; R136-F140 CarbonylContact O-C 3.58Å; R136-F140 WeakPolarHBondContact O-CB 3.42Å; R136-F140 PolarHBondContact O-N 3.28Å; R136-G141 PolarHBondContact O-N 3Å; R136-G141 VanDerWaalsContact O-N 3.11Å; R136-E142 HydrophobicContact CB-CB 4.43Å; R136-E142 HydrophobicContact CB-CG 4.15Å; R136-E142 IonicContact CZ-OE1 3.79Å; R136-E142 IonicContact NE-OE1 3.4Å; R136-E142 PolarHBondContact NE-OE1 2.63Å; R136-E142 IonicContact NH2-OE1 3.55Å; R136-E142 PolarHBondContact NH2-OE1 3.21Å; R136-E142 PolarHBondContact O-N 3.22Å
137	R	98.6	Very high	98.6	Very high	22 Å²	22	44.1 Å²	44.1	8%	0.083	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-49.1	179.2	-65.5	175.5	-179.8	-83.5	6.7	112.2	G132 H133 S134 G141 D144 I147 C164	G132-R137 WeakPolarHBondContact O-CD 3.43Å; G132-R137 PolarHBondContact O-NE 3.18Å; H133-R137 PolarHBondContact O-N 3.24Å; H133-R137 VanDerWaalsContact O-N 3.14Å; S134-R137 PolarHBondContact O-N 2.74Å; R137-G141 VanDerWaalsContact O-CA 3.28Å; R137-G141 WeakPolarHBondContact O-CA 3.41Å; R137-G141 PolarHBondContact O-N 3.26Å; R137-D144 IonicContact CZ-OD1 3.55Å; R137-D144 IonicContact NH1-OD1 2.63Å; R137-D144 PolarHBondContact NH1-OD1 3.07Å; R137-D144 IonicContact NH2-OD1 3.31Å; R137-I147 HydrophobicContact CG-CD1 3.74Å; R137-C164 PolarHBondContact NH2-O 3.25Å
138	H	97.6	Very high	98.6	Very high	82 Å²	82	40.7 Å²	40.7	38%	0.38	22%	0.218	S	C	.	.	H	α-helix	trans	-102	-25.7	-165.3	-52.7	-48.2	0	0	0	114.3	S134 V205	S134-H138 WeakPolarHBondContact O-CB 3.37Å; S134-H138 PolarHBondContact O-CD2 3.09Å; S134-H138 PolarHBondContact O-N 3.39Å; H138-V205 WeakPolarHBondContact NE2-CG2 3.3Å
139	V	98.3	Very high	98.6	Very high	108 Å²	108	42.6 Å²	42.6	66%	0.655	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-41	175.9	-174.3	0	0	0	0	110.6	E135	E135-V139 WeakPolarHBondContact O-CA 3.49Å; E135-V139 WeakPolarHBondContact O-CB 3.31Å; E135-V139 PolarHBondContact O-N 3.14Å
140	F	98.7	Very high	98.6	Very high	134 Å²	134	42.6 Å²	42.6	59%	0.588	23%	0.228	S	C	*	.	S	Bend	trans	-105.2	-2.1	-175.9	-62.2	-86.4	0	0	0	114.6	E135 R136 E142	E135-F140 WeakPolarHBondContact O-CD2 3.33Å; E135-F140 PolarHBondContact O-N 3.36Å; R136-F140 VanDerWaalsContact NH1-CD1 3.31Å; R136-F140 CarbonylContact O-C 3.58Å; R136-F140 WeakPolarHBondContact O-CB 3.42Å; R136-F140 PolarHBondContact O-N 3.28Å; F140-E142 PolarHBondContact O-N 3.18Å
141	G	98.5	Very high	98.6	Very high	58 Å²	58	42.6 Å²	42.6	60%	0.598	23%	0.228	S	C	*	.			trans	70.3	27.8	172.4	0	0	0	0	0	115.1	R136 R137 S143	R136-G141 PolarHBondContact O-N 3Å; R136-G141 VanDerWaalsContact O-N 3.11Å; R137-G141 VanDerWaalsContact O-CA 3.28Å; R137-G141 WeakPolarHBondContact O-CA 3.41Å; R137-G141 PolarHBondContact O-N 3.26Å; G141-S143 PolarHBondContact O-N 3.39Å
142	E	98.8	Very high	98.6	Very high	10 Å²	10	44 Å²	44	5%	0.047	24%	0.24	C	C	.	.			trans	-66.5	119.9	172.6	-66.9	-163.2	-177.5	0	0	110.8	N103 R136 F140 L146 I147 K150	N103-E142 PolarHBondContact ND2-OE1 3.06Å; R136-E142 HydrophobicContact CB-CB 4.43Å; R136-E142 HydrophobicContact CB-CG 4.15Å; R136-E142 IonicContact CZ-OE1 3.79Å; R136-E142 IonicContact NE-OE1 3.4Å; R136-E142 PolarHBondContact NE-OE1 2.63Å; R136-E142 IonicContact NH2-OE1 3.55Å; R136-E142 PolarHBondContact NH2-OE1 3.21Å; R136-E142 PolarHBondContact O-N 3.22Å; F140-E142 PolarHBondContact O-N 3.18Å; E142-L146 HydrophobicContact CB-CD2 4.25Å; E142-L146 HydrophobicContact CG-CD2 4Å; E142-I147 HydrophobicContact CB-CD1 4.11Å; E142-I147 HydrophobicContact CB-CG1 4.17Å; E142-K150 VanDerWaalsContact CD-NZ 3.29Å; E142-K150 IonicContact OE1-NZ 3.52Å; E142-K150 PolarHBondContact OE1-NZ 3.46Å; E142-K150 IonicContact OE2-NZ 2.63Å; E142-K150 PolarHBondContact OE2-NZ 3.41Å
143	S	98.7	Very high	98.6	Very high	63 Å²	63	45.5 Å²	45.5	44%	0.441	25%	0.247	S	C	.	.			trans	-74.9	159.2	176.7	65.4	0	0	0	0	112.2	G141 E145 L146 I147	G141-S143 PolarHBondContact O-N 3.39Å; S143-E145 VanDerWaalsContact C-N 3.26Å; S143-E145 PolarHBondContact O-N 2.92Å; S143-L146 PolarHBondContact O-N 3.37Å; S143-L146 PolarHBondContact OG-N 3.48Å; S143-I147 WeakPolarHBondContact O-CD1 3.37Å; S143-I147 WeakPolarHBondContact O-CG1 3.48Å; S143-I147 PolarHBondContact O-N 3.38Å
144	D	98.4	Very high	98.6	Very high	57 Å²	57	45.2 Å²	45.2	31%	0.305	25%	0.246	S	C	.	.	H	α-helix	trans	-55.4	-42.6	173.1	-71.1	-46.1	0	0	0	111.9	R137 L146 I147 G148 V187	R137-D144 IonicContact CZ-OD1 3.55Å; R137-D144 IonicContact NH1-OD1 2.63Å; R137-D144 PolarHBondContact NH1-OD1 3.07Å; R137-D144 IonicContact NH2-OD1 3.31Å; D144-L146 PolarHBondContact O-N 3.12Å; D144-I147 PolarHBondContact O-N 3.37Å; D144-G148 PolarHBondContact O-N 3.44Å; D144-V187 HydrophobicContact CB-CB 4.14Å; D144-V187 HydrophobicContact CB-CG1 3.97Å; D144-V187 HydrophobicContact CB-CG2 3.99Å; D144-V187 WeakPolarHBondContact O-CG1 3.08Å
145	E	98.4	Very high	98.7	Very high	132 Å²	132	46 Å²	46	62%	0.617	25%	0.249	S	C	*	.	H	α-helix	trans	-58.9	-46.2	177.9	-170.3	-165.7	160.5	0	0	111.8	S143 I147 G148 Q149	S143-E145 VanDerWaalsContact C-N 3.26Å; S143-E145 PolarHBondContact O-N 2.92Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 3.2Å; E145-G148 PolarHBondContact O-N 3.31Å; E145-Q149 VanDerWaalsContact O-CG 3.32Å; E145-Q149 WeakPolarHBondContact O-CG 3.49Å; E145-Q149 PolarHBondContact O-N 3.08Å; E145-Q149 PolarHBondContact OE1-NE2 3.1Å; E145-Q149 VanDerWaalsContact OE1-NE2 3.13Å
146	L	98.9	Very high	98.7	Very high	34 Å²	34	47 Å²	47	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-41.2	177.8	176	60	0	0	0	111	Y105 K106 E142 S143 D144 Q149 K150	Y105-L146 HydrophobicContact CE2-CD1 4.36Å; K106-L146 HydrophobicContact CD-CD1 3.88Å; E142-L146 HydrophobicContact CB-CD2 4.25Å; E142-L146 HydrophobicContact CG-CD2 4Å; S143-L146 PolarHBondContact O-N 3.37Å; S143-L146 PolarHBondContact OG-N 3.48Å; D144-L146 PolarHBondContact O-N 3.12Å; L146-Q149 PolarHBondContact O-N 3.43Å; L146-K150 HydrophobicContact CD1-CG 4.42Å; L146-K150 HydrophobicContact CG-CD 4.32Å; L146-K150 WeakPolarHBondContact O-CG 3.15Å; L146-K150 PolarHBondContact O-N 3.24Å
147	I	98.9	Very high	98.6	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-64.8	-45.2	178.8	-69.4	160.4	0	0	0	110.3	R137 E142 S143 D144 E145 Q149 K150 V151	R137-I147 HydrophobicContact CG-CD1 3.74Å; E142-I147 HydrophobicContact CB-CD1 4.11Å; E142-I147 HydrophobicContact CB-CG1 4.17Å; S143-I147 WeakPolarHBondContact O-CD1 3.37Å; S143-I147 WeakPolarHBondContact O-CG1 3.48Å; S143-I147 PolarHBondContact O-N 3.38Å; D144-I147 PolarHBondContact O-N 3.37Å; E145-I147 VanDerWaalsContact C-N 3.31Å; E145-I147 PolarHBondContact O-N 3.2Å; I147-Q149 VanDerWaalsContact C-N 3.33Å; I147-Q149 PolarHBondContact O-N 2.88Å; I147-K150 WeakPolarHBondContact O-CB 3.33Å; I147-K150 PolarHBondContact O-N 3.05Å; I147-K150 VanDerWaalsContact O-N 3.12Å; I147-V151 HydrophobicContact CG2-CG2 4.41Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.23Å
148	G	98.8	Very high	98.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-55.2	-46.6	173.7	0	0	0	0	0	112.3	D144 E145 K150 V151 A152 N191	D144-G148 PolarHBondContact O-N 3.44Å; E145-G148 PolarHBondContact O-N 3.31Å; G148-K150 VanDerWaalsContact C-N 3.34Å; G148-K150 PolarHBondContact O-N 2.96Å; G148-V151 PolarHBondContact O-N 3.21Å; G148-A152 PolarHBondContact O-N 2.88Å; G148-N191 VanDerWaalsContact C-CG 3.5Å; G148-N191 WeakPolarHBondContact CA-ND2 3.47Å; G148-N191 WeakPolarHBondContact O-CB 3.46Å; G148-N191 PolarHBondContact O-OD1 3.25Å
149	Q	98.9	Very high	98.7	Very high	58 Å²	58	43.9 Å²	43.9	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-39.8	176	-69.6	167.3	-0.6	0	0	112.5	K106 E145 L146 I147 H153	K106-Q149 HydrophobicContact CB-CB 4.09Å; K106-Q149 HydrophobicContact CD-CB 3.86Å; K106-Q149 HydrophobicContact CD-CG 4.48Å; E145-Q149 VanDerWaalsContact O-CG 3.32Å; E145-Q149 WeakPolarHBondContact O-CG 3.49Å; E145-Q149 PolarHBondContact O-N 3.08Å; E145-Q149 PolarHBondContact OE1-NE2 3.1Å; E145-Q149 VanDerWaalsContact OE1-NE2 3.13Å; L146-Q149 PolarHBondContact O-N 3.43Å; I147-Q149 VanDerWaalsContact C-N 3.33Å; I147-Q149 PolarHBondContact O-N 2.88Å; Q149-H153 PolarHBondContact O-N 3.3Å; Q149-H153 VanDerWaalsContact O-N 3.12Å
150	K	98.9	Very high	98.7	Very high	1 Å²	1	39 Å²	39	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-42.9	175.7	-72	175.3	170.9	-151.4	0	111.9	N103 C104 K106 L131 E142 L146 I147 G148 H153 A154	N103-K150 PolarHBondContact ND2-NZ 3.03Å; N103-K150 PolarHBondContact OD1-NZ 2.94Å; C104-K150 WeakPolarHBondContact O-CD 3.5Å; C104-K150 WeakPolarHBondContact O-CE 3.35Å; C104-K150 PolarHBondContact O-NZ 3.46Å; K106-K150 HydrophobicContact CB-CG 4.15Å; L131-K150 HydrophobicContact CD1-CB 3.88Å; L131-K150 HydrophobicContact CD2-CB 4Å; L131-K150 HydrophobicContact CD2-CD 4.09Å; E142-K150 VanDerWaalsContact CD-NZ 3.29Å; E142-K150 IonicContact OE1-NZ 3.52Å; E142-K150 PolarHBondContact OE1-NZ 3.46Å; E142-K150 IonicContact OE2-NZ 2.63Å; E142-K150 PolarHBondContact OE2-NZ 3.41Å; L146-K150 HydrophobicContact CD1-CG 4.42Å; L146-K150 HydrophobicContact CG-CD 4.32Å; L146-K150 WeakPolarHBondContact O-CG 3.15Å; L146-K150 PolarHBondContact O-N 3.24Å; I147-K150 WeakPolarHBondContact O-CB 3.33Å; I147-K150 PolarHBondContact O-N 3.05Å; I147-K150 VanDerWaalsContact O-N 3.12Å; G148-K150 VanDerWaalsContact C-N 3.34Å; G148-K150 PolarHBondContact O-N 2.96Å; K150-H153 PolarHBondContact O-N 3.48Å; K150-A154 WeakPolarHBondContact O-CB 3.41Å; K150-A154 PolarHBondContact O-N 2.84Å
151	V	98.9	Very high	98.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.8	-49.9	176.3	172.5	0	0	0	0	110.3	L131 I147 G148 H153 A154 L155 V161 I188 V192	L131-V151 HydrophobicContact CB-CG2 4.35Å; L131-V151 HydrophobicContact CD1-CG2 3.98Å; I147-V151 HydrophobicContact CG2-CG2 4.41Å; I147-V151 WeakPolarHBondContact O-CG2 3.27Å; I147-V151 PolarHBondContact O-N 3.23Å; G148-V151 PolarHBondContact O-N 3.21Å; V151-H153 VanDerWaalsContact C-N 3.33Å; V151-H153 PolarHBondContact O-N 2.84Å; V151-A154 PolarHBondContact O-N 2.84Å; V151-L155 HydrophobicContact CG1-CD1 3.72Å; V151-L155 HydrophobicContact CG1-CG 4.34Å; V151-L155 WeakPolarHBondContact O-CB 3.11Å; V151-L155 WeakPolarHBondContact O-CG 3.25Å; V151-L155 PolarHBondContact O-N 2.9Å; V151-V161 HydrophobicContact CG1-CG1 4.44Å; V151-V161 HydrophobicContact CG2-CG1 4.09Å; V151-I188 HydrophobicContact CG1-CG2 4.4Å; V151-V192 HydrophobicContact CG1-CG2 3.72Å
152	A	98.8	Very high	98.7	Very high	31 Å²	31	29.9 Å²	29.9	26%	0.256	18%	0.18	S	C	.	.	H	α-helix	trans	-55.6	-48.2	178.4	0	0	0	0	0	111.7	G148 A156 N191	G148-A152 PolarHBondContact O-N 2.88Å; A152-A156 VanDerWaalsContact O-CB 3.3Å; A152-A156 WeakPolarHBondContact O-CB 3.47Å; A152-A156 PolarHBondContact O-N 3.2Å; A152-N191 HydrophobicContact CB-CB 4.07Å
153	H	98.9	Very high	98.7	Very high	31 Å²	31	29.4 Å²	29.4	14%	0.144	18%	0.178	C	C	.	.	H	α-helix	trans	-68.6	-42.2	-177.6	-172.2	50.7	0	0	0	112.6	V107 T108 Q149 K150 V151 L155 A156 E157	V107-H153 WeakPolarHBondContact CA-NE2 3.41Å; V107-H153 PolarHBondContact N-CD2 3.18Å; V107-H153 VanDerWaalsContact N-CD2 3.34Å; T108-H153 PolarHBondContact N-NE2 2.92Å; T108-H153 PolarHBondContact OG1-CE1 2.85Å; Q149-H153 PolarHBondContact O-N 3.3Å; Q149-H153 VanDerWaalsContact O-N 3.12Å; K150-H153 PolarHBondContact O-N 3.48Å; V151-H153 VanDerWaalsContact C-N 3.33Å; V151-H153 PolarHBondContact O-N 2.84Å; H153-L155 PolarHBondContact O-N 2.89Å; H153-A156 PolarHBondContact O-N 3.07Å; H153-E157 IonicContact CE1-OE1 3.57Å; H153-E157 WeakPolarHBondContact O-CB 3.3Å; H153-E157 WeakPolarHBondContact O-CG 3.39Å; H153-E157 PolarHBondContact O-N 3.31Å
154	A	98.9	Very high	98.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.2	-44.2	177.4	0	0	0	0	0	112.2	P118 V129 L131 K150 V151 E157 G158 L159 V161	P118-A154 HydrophobicContact CG-CB 4.27Å; V129-A154 HydrophobicContact CG1-CB 3.81Å; L131-A154 HydrophobicContact CD1-CB 4.18Å; K150-A154 WeakPolarHBondContact O-CB 3.41Å; K150-A154 PolarHBondContact O-N 2.84Å; V151-A154 PolarHBondContact O-N 2.84Å; A154-E157 PolarHBondContact O-N 2.91Å; A154-G158 PolarHBondContact O-N 2.78Å; A154-L159 PolarHBondContact O-N 2.98Å; A154-V161 HydrophobicContact CB-CG2 3.81Å
155	L	98.8	Very high	98.8	Very high	30 Å²	30	24 Å²	24	16%	0.157	14%	0.144	C	C	.	.	H	α-helix	trans	-66.9	-41.1	176.9	-69.7	173.2	0	0	0	112.1	V151 H153 E157 G158 V161 V192 K197 V198	V151-L155 HydrophobicContact CG1-CD1 3.72Å; V151-L155 HydrophobicContact CG1-CG 4.34Å; V151-L155 WeakPolarHBondContact O-CB 3.11Å; V151-L155 WeakPolarHBondContact O-CG 3.25Å; V151-L155 PolarHBondContact O-N 2.9Å; H153-L155 PolarHBondContact O-N 2.89Å; L155-E157 PolarHBondContact O-N 2.87Å; L155-G158 WeakPolarHBondContact O-CA 3.5Å; L155-G158 PolarHBondContact O-N 2.8Å; L155-V161 HydrophobicContact CD2-CB 4.36Å; L155-V161 HydrophobicContact CD2-CG2 3.82Å; L155-V161 HydrophobicContact CG-CG2 3.86Å; L155-V192 HydrophobicContact CD1-CB 4.31Å; L155-V192 HydrophobicContact CD1-CG1 4.09Å; L155-V192 HydrophobicContact CD1-CG2 3.79Å; L155-K197 HydrophobicContact CD2-CB 3.85Å; L155-V198 HydrophobicContact CD1-CG2 3.94Å; L155-V198 HydrophobicContact CD2-CG2 4.06Å
156	A	98.4	Very high	98.8	Very high	86 Å²	86	17.9 Å²	17.9	71%	0.711	12%	0.117	S	C	*	.	H	α-helix	trans	-61.7	-33.2	176.5	0	0	0	0	0	112.3	A152 H153 G158	A152-A156 VanDerWaalsContact O-CB 3.3Å; A152-A156 WeakPolarHBondContact O-CB 3.47Å; A152-A156 PolarHBondContact O-N 3.2Å; H153-A156 PolarHBondContact O-N 3.07Å; A156-G158 PolarHBondContact O-N 3.43Å
157	E	98.5	Very high	98.8	Very high	52 Å²	52	16.3 Å²	16.3	24%	0.243	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	173.5	-72.5	-77.5	174.9	0	0	112.6	T108 P118 K122 H153 A154 L155	T108-E157 PolarHBondContact OG1-OE1 2.88Å; P118-E157 HydrophobicContact CB-CB 3.57Å; P118-E157 HydrophobicContact CB-CG 3.84Å; P118-E157 HydrophobicContact CG-CB 4.42Å; P118-E157 HydrophobicContact CG-CG 4.36Å; K122-E157 VanDerWaalsContact CD-O 3.23Å; K122-E157 WeakPolarHBondContact CD-O 3.36Å; K122-E157 VanDerWaalsContact CE-O 3.27Å; K122-E157 WeakPolarHBondContact CE-O 3.43Å; K122-E157 PolarHBondContact NZ-O 3.37Å; K122-E157 IonicContact NZ-OE2 2.76Å; K122-E157 PolarHBondContact NZ-OE2 3.05Å; H153-E157 IonicContact CE1-OE1 3.57Å; H153-E157 WeakPolarHBondContact O-CB 3.3Å; H153-E157 WeakPolarHBondContact O-CG 3.39Å; H153-E157 PolarHBondContact O-N 3.31Å; A154-E157 PolarHBondContact O-N 2.91Å; L155-E157 PolarHBondContact O-N 2.87Å
158	G	98.3	Very high	98.7	Very high	32 Å²	32	19.9 Å²	19.9	33%	0.33	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	90	7.2	171.5	0	0	0	0	0	115.6	A154 L155 A156 K197	A154-G158 PolarHBondContact O-N 2.78Å; L155-G158 WeakPolarHBondContact O-CA 3.5Å; L155-G158 PolarHBondContact O-N 2.8Å; A156-G158 PolarHBondContact O-N 3.43Å; G158-K197 PolarHBondContact O-NZ 3.27Å
159	L	98.8	Very high	98.5	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	14%	0.143	C	C	.	.			trans	-70.2	150.9	171.5	-66.9	-179.8	0	0	0	111.1	P118 I121 K122 V129 A154	P118-L159 HydrophobicContact CB-CD1 3.69Å; P118-L159 HydrophobicContact CB-CG 4.36Å; P118-L159 HydrophobicContact CG-CD1 4.5Å; I121-L159 HydrophobicContact CB-CD1 4.12Å; I121-L159 HydrophobicContact CD1-CD1 4.14Å; I121-L159 HydrophobicContact CG2-CD1 3.97Å; I121-L159 HydrophobicContact CG2-CD2 4.04Å; K122-L159 HydrophobicContact CD-CD2 4.39Å; K122-L159 HydrophobicContact CG-CD2 3.55Å; K122-L159 HydrophobicContact CG-CG 4.2Å; V129-L159 HydrophobicContact CB-CD1 4.33Å; V129-L159 HydrophobicContact CG1-CD1 4.11Å; A154-L159 PolarHBondContact O-N 2.98Å
160	G	98.9	Very high	98.3	Very high	5 Å²	5	25.5 Å²	25.5	5%	0.052	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	147.8	158.3	0	0	0	0	0	111.1	T127 W128 V129 K197	T127-G160 PolarHBondContact O-N 2.87Å; W128-G160 CarbonylContact C-O 3.58Å; W128-G160 VanDerWaalsContact CA-O 3.27Å; W128-G160 WeakPolarHBondContact CA-O 3.45Å; W128-G160 VanDerWaalsContact CE3-CA 3.41Å; V129-G160 PolarHBondContact N-O 3.41Å; G160-K197 CarbonylContact C-O 3.6Å; G160-K197 VanDerWaalsContact CA-O 3.3Å; G160-K197 WeakPolarHBondContact CA-O 3.23Å
161	V	98.9	Very high	98.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.2	179.3	179.3	0	0	0	0	110.6	V129 L131 V151 A154 L155 A163 K197 V198 V199	V129-V161 HydrophobicContact CG1-CG2 4.1Å; V129-V161 WeakPolarHBondContact O-CA 3.42Å; L131-V161 HydrophobicContact CB-CG1 4.26Å; L131-V161 HydrophobicContact CD1-CG1 4Å; L131-V161 HydrophobicContact CD1-CG2 4.45Å; L131-V161 HydrophobicContact CG-CG1 4.4Å; V151-V161 HydrophobicContact CG1-CG1 4.44Å; V151-V161 HydrophobicContact CG2-CG1 4.09Å; A154-V161 HydrophobicContact CB-CG2 3.81Å; L155-V161 HydrophobicContact CD2-CB 4.36Å; L155-V161 HydrophobicContact CD2-CG2 3.82Å; L155-V161 HydrophobicContact CG-CG2 3.86Å; V161-A163 HydrophobicContact CG1-CB 4.05Å; V161-K197 PolarHBondContact N-O 3.3Å; V161-V198 WeakPolarHBondContact O-CA 3.48Å; V161-V199 PolarHBondContact O-N 3.04Å
162	I	98.9	Very high	98.1	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	98.8	164.1	-55	165.2	0	0	0	106.2	F45 V78 W128 V129 V130 L131 V199 A201 I245 L268	F45-I162 HydrophobicContact CE1-CD1 3.93Å; F45-I162 HydrophobicContact CE1-CG1 4.2Å; F45-I162 HydrophobicContact CZ-CD1 3.78Å; F45-I162 HydrophobicContact CZ-CG1 3.95Å; V78-I162 HydrophobicContact CG1-CD1 4.47Å; W128-I162 HydrophobicContact CE3-CG1 3.88Å; W128-I162 HydrophobicContact CZ3-CG1 4.29Å; V129-I162 PolarHBondContact O-N 3.04Å; V130-I162 WeakPolarHBondContact CA-O 3.26Å; V130-I162 HydrophobicContact CG2-CB 4.29Å; V130-I162 HydrophobicContact CG2-CD1 4.05Å; L131-I162 PolarHBondContact N-O 3.45Å; I162-V199 CarbonylContact C-O 3.57Å; I162-V199 WeakPolarHBondContact CA-O 3.42Å; I162-V199 HydrophobicContact CG1-CB 4.45Å; I162-A201 HydrophobicContact CG2-CB 3.96Å; I162-I245 HydrophobicContact CG2-CD1 4.19Å; I162-L268 HydrophobicContact CG2-CD2 4.1Å
163	A	98.9	Very high	97.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	115.2	-176.1	0	0	0	0	0	110.3	L131 V161 I188 V199 L200 A201	L131-A163 WeakPolarHBondContact O-CA 3.36Å; V161-A163 HydrophobicContact CG1-CB 4.05Å; A163-I188 HydrophobicContact CB-CD1 3.85Å; A163-I188 HydrophobicContact CB-CG1 4.41Å; A163-I188 HydrophobicContact CB-CG2 4.26Å; A163-V199 PolarHBondContact N-O 2.98Å; A163-L200 HydrophobicContact CB-CD2 4.21Å; A163-L200 WeakPolarHBondContact O-CA 3.41Å; A163-A201 PolarHBondContact O-N 3.38Å
164	C	98.9	Very high	97.8	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.7	-176.1	-55.8	0	0	0	0	112.3	L131 G132 R137 A201 E203	L131-C164 PolarHBondContact O-N 3.23Å; G132-C164 WeakPolarHBondContact O-CB 3.42Å; R137-C164 PolarHBondContact NH2-O 3.25Å; C164-A201 WeakPolarHBondContact CA-O 3.44Å; C164-A201 HydrophobicContact CB-CB 4.46Å; C164-E203 PolarHBondContact SG-OE2 3.4Å
165	I	98.9	Very high	97.7	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158.3	175.5	62.2	179.4	0	0	0	109.4	V181 Q184 T185 I188 A201 E203 L226	I165-V181 HydrophobicContact CD1-CB 4.26Å; I165-Q184 HydrophobicContact CB-CB 4.18Å; I165-Q184 VanDerWaalsContact CB-OE1 3.29Å; I165-Q184 HydrophobicContact CG2-CB 3.7Å; I165-T185 WeakPolarHBondContact CD1-OG1 3.43Å; I165-I188 HydrophobicContact CG2-CD1 3.64Å; I165-A201 PolarHBondContact N-O 2.88Å; I165-E203 PolarHBondContact O-N 3.38Å; I165-L226 HydrophobicContact CD1-CD1 3.81Å; I165-L226 HydrophobicContact CD1-CD2 3.67Å; I165-L226 HydrophobicContact CD1-CG 4.42Å
166	G	98.4	Very high	97.7	Very high	4 Å²	4	43 Å²	43	4%	0.041	26%	0.259	C	S	.	.			trans	163.7	154.9	177.8	0	0	0	0	0	112.6	Q184	G166-Q184 PolarHBondContact O-NE2 3.34Å
167	E	98.3	Very high	97.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.231	C	C	.	.			trans	-98	156.5	179.4	86.2	-63	168.8	0	0	112.2	E171 R172 T177 V180 Y202 V205 W206	E167-E171 VanDerWaalsContact CA-OE2 3.25Å; E167-E171 WeakPolarHBondContact CA-OE2 3.4Å; E167-E171 HydrophobicContact CB-CB 4.05Å; E167-E171 WeakPolarHBondContact CB-OE2 3.43Å; E167-E171 HydrophobicContact CG-CB 4.4Å; E167-R172 HydrophobicContact CG-CB 3.95Å; E167-R172 WeakPolarHBondContact OE1-CD 3.46Å; E167-T177 HydrophobicContact CG-CG2 3.95Å; E167-V180 HydrophobicContact CB-CB 4.06Å; E167-V180 HydrophobicContact CB-CG1 3.97Å; E167-V180 HydrophobicContact CB-CG2 4.42Å; E167-Y202 WeakPolarHBondContact OE2-CE2 3.22Å; E167-Y202 PolarHBondContact OE2-OH 3.47Å; E167-V205 WeakPolarHBondContact O-CB 3.16Å; E167-V205 WeakPolarHBondContact O-CG2 3.22Å; E167-V205 PolarHBondContact O-N 2.88Å; E167-W206 PolarHBondContact OE1-NE1 3.45Å
168	K	97.2	Very high	97.7	Very high	78 Å²	78	41.5 Å²	41.5	34%	0.339	24%	0.239	S	C	.	.			trans	-80.3	168.3	171	-61.9	175.3	-173	161.6	0	111.9	D170 E171 R172 V205	K168-D170 WeakPolarHBondContact CB-OD1 3.42Å; K168-D170 PolarHBondContact O-N 2.84Å; K168-E171 HydrophobicContact CB-CB 4.48Å; K168-E171 HydrophobicContact CB-CG 4.19Å; K168-E171 PolarHBondContact N-OE2 3.26Å; K168-E171 PolarHBondContact O-N 3.22Å; K168-R172 PolarHBondContact O-N 2.87Å; K168-V205 HydrophobicContact CG-CB 4.46Å; K168-V205 HydrophobicContact CG-CG2 4.36Å
169	L	94.5	Very high	97.7	Very high	77 Å²	77	45.6 Å²	45.6	40%	0.403	25%	0.247	S	C	.	.	H	α-helix	trans	-61.2	-44.6	-179.3	-173.8	57.8	0	0	0	112.3	E171 R172 E173 W206	L169-E171 VanDerWaalsContact C-N 3.34Å; L169-E171 PolarHBondContact O-N 3.31Å; L169-R172 WeakPolarHBondContact O-CB 3.45Å; L169-R172 PolarHBondContact O-N 2.87Å; L169-E173 HydrophobicContact CD1-CG 4.33Å; L169-E173 HydrophobicContact CG-CG 4.41Å; L169-E173 WeakPolarHBondContact O-CB 3.49Å; L169-E173 WeakPolarHBondContact O-CG 3.47Å; L169-E173 PolarHBondContact O-N 2.83Å; L169-W206 HydrophobicContact CB-CB 3.84Å; L169-W206 HydrophobicContact CB-CG 4.37Å; L169-W206 HydrophobicContact CD1-CB 4.09Å; L169-W206 HydrophobicContact CD1-CG 4.07Å; L169-W206 HydrophobicContact CG-CB 4.46Å
170	D	96.2	Very high	97.7	Very high	99 Å²	99	46.1 Å²	46.1	53%	0.529	25%	0.25	S	S	.	.	H	α-helix	trans	-64.6	-37.8	179.1	57.3	-41.6	0	0	0	112.1	K168 R172 E173 A174	K168-D170 WeakPolarHBondContact CB-OD1 3.42Å; K168-D170 PolarHBondContact O-N 2.84Å; D170-R172 VanDerWaalsContact C-N 3.34Å; D170-E173 PolarHBondContact O-N 3.09Å; D170-A174 VanDerWaalsContact O-CB 3.22Å; D170-A174 WeakPolarHBondContact O-CB 3.33Å; D170-A174 PolarHBondContact O-N 2.92Å
171	E	97.6	Very high	97.7	Very high	38 Å²	38	46 Å²	46	18%	0.178	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-39	174.2	-66	165.5	177.5	0	0	111.4	E167 K168 L169 G175 I176 V180	E167-E171 VanDerWaalsContact CA-OE2 3.25Å; E167-E171 WeakPolarHBondContact CA-OE2 3.4Å; E167-E171 HydrophobicContact CB-CB 4.05Å; E167-E171 WeakPolarHBondContact CB-OE2 3.43Å; E167-E171 HydrophobicContact CG-CB 4.4Å; K168-E171 HydrophobicContact CB-CB 4.48Å; K168-E171 HydrophobicContact CB-CG 4.19Å; K168-E171 PolarHBondContact N-OE2 3.26Å; K168-E171 PolarHBondContact O-N 3.22Å; L169-E171 VanDerWaalsContact C-N 3.34Å; L169-E171 PolarHBondContact O-N 3.31Å; E171-G175 PolarHBondContact O-N 2.86Å; E171-I176 HydrophobicContact CB-CD1 4.16Å; E171-I176 HydrophobicContact CB-CG1 3.96Å; E171-I176 HydrophobicContact CG-CD1 4.16Å; E171-I176 WeakPolarHBondContact O-CG1 3.39Å; E171-I176 PolarHBondContact O-N 2.78Å; E171-V180 HydrophobicContact CB-CG2 4.15Å; E171-V180 HydrophobicContact CG-CG2 4.14Å
172	R	94.9	Very high	97.7	Very high	72 Å²	72	48.2 Å²	48.2	27%	0.272	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-47.2	174.3	-176.1	165.7	-163.9	-132.4	-13.3	112.5	E167 K168 L169 D170 A174 G175 Q218	E167-R172 HydrophobicContact CG-CB 3.95Å; E167-R172 WeakPolarHBondContact OE1-CD 3.46Å; K168-R172 PolarHBondContact O-N 2.87Å; L169-R172 WeakPolarHBondContact O-CB 3.45Å; L169-R172 PolarHBondContact O-N 2.87Å; D170-R172 VanDerWaalsContact C-N 3.34Å; R172-A174 PolarHBondContact O-N 3.17Å; R172-G175 PolarHBondContact O-N 2.96Å; R172-Q218 VanDerWaalsContact NH2-CG 3.26Å
173	E	93.3	Very high	97.6	Very high	149 Å²	149	53 Å²	53	70%	0.696	28%	0.281	S	S	*	.	H	α-helix	trans	-63.5	-29.5	178.6	-72.7	174.8	169.1	0	0	112	L169 D170 G175	L169-E173 HydrophobicContact CD1-CG 4.33Å; L169-E173 HydrophobicContact CG-CG 4.41Å; L169-E173 WeakPolarHBondContact O-CB 3.49Å; L169-E173 WeakPolarHBondContact O-CG 3.47Å; L169-E173 PolarHBondContact O-N 2.83Å; D170-E173 PolarHBondContact O-N 3.09Å; E173-G175 VanDerWaalsContact C-N 3.26Å; E173-G175 PolarHBondContact O-N 2.8Å
174	A	97.7	Very high	97.6	Very high	69 Å²	69	53.8 Å²	53.8	57%	0.57	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.3	172	0	0	0	0	0	114.2	D170 R172 I176	D170-A174 VanDerWaalsContact O-CB 3.22Å; D170-A174 WeakPolarHBondContact O-CB 3.33Å; D170-A174 PolarHBondContact O-N 2.92Å; R172-A174 PolarHBondContact O-N 3.17Å; A174-I176 VanDerWaalsContact C-N 3.34Å; A174-I176 HydrophobicContact CB-CG1 4.23Å; A174-I176 PolarHBondContact O-N 3.49Å
175	G	97.4	Very high	97.6	Very high	66 Å²	66	53.7 Å²	53.7	68%	0.68	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	24	178.7	0	0	0	0	0	114.3	E171 R172 E173	E171-G175 PolarHBondContact O-N 2.86Å; R172-G175 PolarHBondContact O-N 2.96Å; E173-G175 VanDerWaalsContact C-N 3.26Å; E173-G175 PolarHBondContact O-N 2.8Å
176	I	98.3	Very high	97.6	Very high	67 Å²	67	58.2 Å²	58.2	34%	0.344	30%	0.303	S	S	.	.			trans	-110	17.6	-176.5	62.2	165.3	0	0	0	113.8	E171 A174 E178 K179 V180	E171-I176 HydrophobicContact CB-CD1 4.16Å; E171-I176 HydrophobicContact CB-CG1 3.96Å; E171-I176 HydrophobicContact CG-CD1 4.16Å; E171-I176 WeakPolarHBondContact O-CG1 3.39Å; E171-I176 PolarHBondContact O-N 2.78Å; A174-I176 VanDerWaalsContact C-N 3.34Å; A174-I176 HydrophobicContact CB-CG1 4.23Å; A174-I176 PolarHBondContact O-N 3.49Å; I176-E178 VanDerWaalsContact C-N 3.32Å; I176-E178 PolarHBondContact O-N 3.37Å; I176-K179 HydrophobicContact CB-CB 4.37Å; I176-K179 WeakPolarHBondContact O-CB 3.48Å; I176-K179 PolarHBondContact O-N 3.06Å; I176-K179 VanDerWaalsContact O-N 3.13Å; I176-V180 HydrophobicContact CD1-CG2 4.38Å; I176-V180 HydrophobicContact CG1-CG2 4.47Å; I176-V180 PolarHBondContact O-N 3.09Å; I176-V180 VanDerWaalsContact O-N 3.13Å
177	T	98.3	Very high	97.6	Very high	20 Å²	20	59.9 Å²	59.9	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-48.2	-51.1	177.2	-60.2	0	0	0	0	112.2	E167 K179 V180 V181 V222	E167-T177 HydrophobicContact CG-CG2 3.95Å; T177-K179 PolarHBondContact O-N 2.92Å; T177-V180 PolarHBondContact O-N 3.16Å; T177-V181 HydrophobicContact CG2-CG1 4.49Å; T177-V181 WeakPolarHBondContact O-CG2 3.33Å; T177-V181 PolarHBondContact O-N 2.84Å; T177-V222 HydrophobicContact CG2-CG2 3.99Å
178	E	98.3	Very high	97.6	Very high	85 Å²	85	60 Å²	60	40%	0.397	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-46.4	-179.8	-75	-177.9	-137.4	0	0	112.6	I176 V180 V181 F182 K225	I176-E178 VanDerWaalsContact C-N 3.32Å; I176-E178 PolarHBondContact O-N 3.37Å; E178-V180 VanDerWaalsContact C-N 3.32Å; E178-V180 PolarHBondContact O-N 2.87Å; E178-V181 PolarHBondContact O-N 3.39Å; E178-F182 HydrophobicContact CB-CD2 4.35Å; E178-F182 HydrophobicContact CB-CE2 4.07Å; E178-F182 HydrophobicContact CB-CZ 4.42Å; E178-F182 HydrophobicContact CG-CE2 4.48Å; E178-F182 HydrophobicContact CG-CZ 4.45Å; E178-F182 WeakPolarHBondContact O-CB 3.35Å; E178-F182 WeakPolarHBondContact O-CD2 3.18Å; E178-F182 WeakPolarHBondContact O-CG 3.43Å; E178-F182 PolarHBondContact O-N 3.47Å; E178-K225 HydrophobicContact CG-CD 3.73Å; E178-K225 VanDerWaalsContact OE1-CD 3.32Å; E178-K225 WeakPolarHBondContact OE1-CD 3.47Å; E178-K225 WeakPolarHBondContact OE1-CE 3.31Å; E178-K225 IonicContact OE1-NZ 2.67Å; E178-K225 PolarHBondContact OE1-NZ 2.87Å
179	K	98.5	Very high	97.6	Very high	118 Å²	118	57 Å²	57	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-56.6	-50	179.2	179.4	-174.5	172.4	-173.7	0	110.2	I176 T177 F182 E183	I176-K179 HydrophobicContact CB-CB 4.37Å; I176-K179 WeakPolarHBondContact O-CB 3.48Å; I176-K179 PolarHBondContact O-N 3.06Å; I176-K179 VanDerWaalsContact O-N 3.13Å; T177-K179 PolarHBondContact O-N 2.92Å; K179-F182 PolarHBondContact O-N 3Å; K179-E183 WeakPolarHBondContact CE-OE1 3.38Å; K179-E183 WeakPolarHBondContact CG-OE1 3.38Å; K179-E183 WeakPolarHBondContact O-CB 3.47Å; K179-E183 VanDerWaalsContact O-CG 3.28Å; K179-E183 WeakPolarHBondContact O-CG 3.36Å; K179-E183 PolarHBondContact O-N 3.28Å
180	V	98.6	Very high	97.8	Very high	13 Å²	13	58.4 Å²	58.4	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-51.6	-177.8	175.3	0	0	0	0	111.2	E167 E171 I176 T177 E178 F182 E183 Q184	E167-V180 HydrophobicContact CB-CB 4.06Å; E167-V180 HydrophobicContact CB-CG1 3.97Å; E167-V180 HydrophobicContact CB-CG2 4.42Å; E171-V180 HydrophobicContact CB-CG2 4.15Å; E171-V180 HydrophobicContact CG-CG2 4.14Å; I176-V180 HydrophobicContact CD1-CG2 4.38Å; I176-V180 HydrophobicContact CG1-CG2 4.47Å; I176-V180 PolarHBondContact O-N 3.09Å; I176-V180 VanDerWaalsContact O-N 3.13Å; T177-V180 PolarHBondContact O-N 3.16Å; E178-V180 VanDerWaalsContact C-N 3.32Å; E178-V180 PolarHBondContact O-N 2.87Å; V180-F182 VanDerWaalsContact C-N 3.33Å; V180-F182 PolarHBondContact O-N 3.18Å; V180-E183 PolarHBondContact O-N 3.34Å; V180-Q184 WeakPolarHBondContact O-CG 3.31Å; V180-Q184 PolarHBondContact O-N 3.44Å; V180-Q184 VanDerWaalsContact O-N 3.09Å
181	V	98.7	Very high	97.9	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.012	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-31.8	-176.6	-58.5	0	0	0	0	112.1	I165 T177 E178 T185 Y202 V222 L226	I165-V181 HydrophobicContact CD1-CB 4.26Å; T177-V181 HydrophobicContact CG2-CG1 4.49Å; T177-V181 WeakPolarHBondContact O-CG2 3.33Å; T177-V181 PolarHBondContact O-N 2.84Å; E178-V181 PolarHBondContact O-N 3.39Å; V181-T185 WeakPolarHBondContact O-CB 3.26Å; V181-T185 PolarHBondContact O-N 3.04Å; V181-T185 PolarHBondContact O-OG1 3.21Å; V181-Y202 HydrophobicContact CG1-CD2 4.21Å; V181-Y202 HydrophobicContact CG1-CE2 4.1Å; V181-V222 HydrophobicContact CG2-CG1 4.35Å; V181-L226 HydrophobicContact CB-CD2 4.25Å; V181-L226 HydrophobicContact CG2-CD2 4.03Å; V181-L226 HydrophobicContact CG2-CG 4.43Å
182	F	98.8	Very high	98	Very high	47 Å²	47	55.1 Å²	55.1	21%	0.206	30%	0.295	C	S	.	.	H	α-helix	trans	-72	-39.9	175.4	-67.8	-11.2	0	0	0	112.6	E178 K179 V180 T185 K186 K225 L226 W229	E178-F182 HydrophobicContact CB-CD2 4.35Å; E178-F182 HydrophobicContact CB-CE2 4.07Å; E178-F182 HydrophobicContact CB-CZ 4.42Å; E178-F182 HydrophobicContact CG-CE2 4.48Å; E178-F182 HydrophobicContact CG-CZ 4.45Å; E178-F182 WeakPolarHBondContact O-CB 3.35Å; E178-F182 WeakPolarHBondContact O-CD2 3.18Å; E178-F182 WeakPolarHBondContact O-CG 3.43Å; E178-F182 PolarHBondContact O-N 3.47Å; K179-F182 PolarHBondContact O-N 3Å; V180-F182 VanDerWaalsContact C-N 3.33Å; V180-F182 PolarHBondContact O-N 3.18Å; F182-T185 PolarHBondContact O-N 3.48Å; F182-K186 VanDerWaalsContact O-CB 3.23Å; F182-K186 WeakPolarHBondContact O-CB 3.35Å; F182-K186 PolarHBondContact O-N 3.19Å; F182-K225 HydrophobicContact CE1-CB 4.37Å; F182-K225 HydrophobicContact CZ-CB 4.1Å; F182-L226 HydrophobicContact CD1-CD2 4.19Å; F182-L226 HydrophobicContact CE1-CD2 4.3Å; F182-W229 HydrophobicContact CD1-CB 3.97Å; F182-W229 AromaticContact CD1-CD1 3.53Å; F182-W229 AromaticContact CD1-CG 3.8Å; F182-W229 HydrophobicContact CD1-CG 3.8Å; F182-W229 AromaticContact CD2-CD1 3.71Å; F182-W229 HydrophobicContact CE1-CB 3.68Å; F182-W229 AromaticContact CE1-CD1 3.94Å; F182-W229 HydrophobicContact CE1-CG 4.02Å; F182-W229 AromaticContact CG-CD1 3.41Å; F182-W229 VanDerWaalsContact CG-CD1 3.41Å; F182-W229 HydrophobicContact CG-CG 4.15Å; F182-W229 AromaticContact CG-NE1 3.92Å; F182-W229 HydrophobicContact CZ-CB 4.14Å
183	E	98.6	Very high	98	Very high	103 Å²	103	61.8 Å²	61.8	48%	0.481	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-47.1	175	-76.4	172.5	175	0	0	110.8	K179 V180 K186 V187	K179-E183 WeakPolarHBondContact CE-OE1 3.38Å; K179-E183 WeakPolarHBondContact CG-OE1 3.38Å; K179-E183 WeakPolarHBondContact O-CB 3.47Å; K179-E183 VanDerWaalsContact O-CG 3.28Å; K179-E183 WeakPolarHBondContact O-CG 3.36Å; K179-E183 PolarHBondContact O-N 3.28Å; V180-E183 PolarHBondContact O-N 3.34Å; E183-K186 PolarHBondContact O-N 3.34Å; E183-V187 PolarHBondContact O-N 3.46Å
184	Q	98.8	Very high	98	Very high	16 Å²	16	58.9 Å²	58.9	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-43.1	176.6	-65.9	173.7	0.7	0	0	112.2	I165 G166 V180 K186 V187 I188	I165-Q184 HydrophobicContact CB-CB 4.18Å; I165-Q184 VanDerWaalsContact CB-OE1 3.29Å; I165-Q184 HydrophobicContact CG2-CB 3.7Å; G166-Q184 PolarHBondContact O-NE2 3.34Å; V180-Q184 WeakPolarHBondContact O-CG 3.31Å; V180-Q184 PolarHBondContact O-N 3.44Å; V180-Q184 VanDerWaalsContact O-N 3.09Å; Q184-K186 VanDerWaalsContact C-N 3.33Å; Q184-K186 PolarHBondContact O-N 2.82Å; Q184-V187 PolarHBondContact O-N 3.46Å; Q184-I188 PolarHBondContact O-N 3.12Å
185	T	98.8	Very high	98	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.2	-38.9	177.8	-58.2	0	0	0	0	111.3	I165 V181 F182 V187 I188 A189 L200 L226 W229 L230	I165-T185 WeakPolarHBondContact CD1-OG1 3.43Å; V181-T185 WeakPolarHBondContact O-CB 3.26Å; V181-T185 PolarHBondContact O-N 3.04Å; V181-T185 PolarHBondContact O-OG1 3.21Å; F182-T185 PolarHBondContact O-N 3.48Å; T185-V187 PolarHBondContact O-N 2.96Å; T185-I188 PolarHBondContact O-N 3.41Å; T185-A189 WeakPolarHBondContact O-CB 3.29Å; T185-A189 PolarHBondContact O-N 2.76Å; T185-L200 HydrophobicContact CG2-CD1 4.14Å; T185-L226 WeakPolarHBondContact OG1-CD2 3.27Å; T185-W229 HydrophobicContact CG2-CD2 4.33Å; T185-W229 HydrophobicContact CG2-CE3 3.6Å; T185-W229 HydrophobicContact CG2-CH2 4.26Å; T185-W229 HydrophobicContact CG2-CZ3 3.57Å; T185-L230 HydrophobicContact CG2-CD2 4.5Å
186	K	98.8	Very high	98	Very high	99 Å²	99	57 Å²	57	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-58.6	-47.6	176.8	176.3	166.8	169	40.2	0	111.6	F182 E183 Q184 I188 A189 D190 W229	F182-K186 VanDerWaalsContact O-CB 3.23Å; F182-K186 WeakPolarHBondContact O-CB 3.35Å; F182-K186 PolarHBondContact O-N 3.19Å; E183-K186 PolarHBondContact O-N 3.34Å; Q184-K186 VanDerWaalsContact C-N 3.33Å; Q184-K186 PolarHBondContact O-N 2.82Å; K186-I188 VanDerWaalsContact C-N 3.28Å; K186-I188 PolarHBondContact O-N 2.85Å; K186-A189 WeakPolarHBondContact O-CB 3.45Å; K186-A189 PolarHBondContact O-N 2.9Å; K186-A189 VanDerWaalsContact O-N 3.12Å; K186-D190 VanDerWaalsContact NZ-CG 3.25Å; K186-D190 IonicContact NZ-OD1 3.66Å; K186-D190 PolarHBondContact NZ-OD1 2.88Å; K186-D190 IonicContact NZ-OD2 2.78Å; K186-D190 PolarHBondContact NZ-OD2 3.03Å; K186-D190 VanDerWaalsContact O-CG 3.24Å; K186-D190 PolarHBondContact O-N 2.96Å; K186-W229 HydrophobicContact CB-CH2 4.15Å; K186-W229 HydrophobicContact CB-CZ2 3.72Å; K186-W229 HydrophobicContact CG-CZ2 4.32Å
187	V	97.6	Very high	98	Very high	40 Å²	40	58 Å²	58	24%	0.242	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-36.5	-178.7	177.6	0	0	0	0	111.6	D144 E183 Q184 T185 N191	D144-V187 HydrophobicContact CB-CB 4.14Å; D144-V187 HydrophobicContact CB-CG1 3.97Å; D144-V187 HydrophobicContact CB-CG2 3.99Å; D144-V187 WeakPolarHBondContact O-CG1 3.08Å; E183-V187 PolarHBondContact O-N 3.46Å; Q184-V187 PolarHBondContact O-N 3.46Å; T185-V187 PolarHBondContact O-N 2.96Å; V187-N191 PolarHBondContact O-ND2 3.39Å
188	I	98.2	Very high	98	Very high	2 Å²	2	57 Å²	57	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-52	170.8	-67.5	158.5	0	0	0	109.8	V151 A163 I165 Q184 T185 K186 D190 N191 V192 L200	V151-I188 HydrophobicContact CG1-CG2 4.4Å; A163-I188 HydrophobicContact CB-CD1 3.85Å; A163-I188 HydrophobicContact CB-CG1 4.41Å; A163-I188 HydrophobicContact CB-CG2 4.26Å; I165-I188 HydrophobicContact CG2-CD1 3.64Å; Q184-I188 PolarHBondContact O-N 3.12Å; T185-I188 PolarHBondContact O-N 3.41Å; K186-I188 VanDerWaalsContact C-N 3.28Å; K186-I188 PolarHBondContact O-N 2.85Å; I188-D190 VanDerWaalsContact C-N 3.33Å; I188-D190 PolarHBondContact O-N 3.34Å; I188-N191 CarbonylContact O-C 3.59Å; I188-N191 WeakPolarHBondContact O-CA 3.5Å; I188-N191 WeakPolarHBondContact O-CB 3.33Å; I188-N191 PolarHBondContact O-N 3.35Å; I188-V192 HydrophobicContact CG2-CG2 3.93Å; I188-V192 VanDerWaalsContact O-CG2 3.27Å; I188-V192 WeakPolarHBondContact O-CG2 3.38Å; I188-V192 PolarHBondContact O-N 2.86Å; I188-L200 HydrophobicContact CD1-CD2 4.29Å
189	A	98.6	Very high	98.1	Very high	16 Å²	16	53 Å²	53	13%	0.132	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-40.7	-176.6	0	0	0	0	0	113.4	T185 K186 N191 V192 W195 W229 V234	T185-A189 WeakPolarHBondContact O-CB 3.29Å; T185-A189 PolarHBondContact O-N 2.76Å; K186-A189 WeakPolarHBondContact O-CB 3.45Å; K186-A189 PolarHBondContact O-N 2.9Å; K186-A189 VanDerWaalsContact O-N 3.12Å; A189-N191 PolarHBondContact O-N 2.86Å; A189-V192 PolarHBondContact O-N 3.03Å; A189-V192 VanDerWaalsContact O-N 3.1Å; A189-W195 HydrophobicContact CB-CH2 4.18Å; A189-W195 HydrophobicContact CB-CZ2 3.62Å; A189-W229 HydrophobicContact CB-CH2 3.71Å; A189-W229 HydrophobicContact CB-CZ3 3.91Å; A189-V234 HydrophobicContact CB-CG2 4.46Å
190	D	98.4	Very high	98.1	Very high	105 Å²	105	47.4 Å²	47.4	56%	0.561	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.6	177.1	-68.3	-18.2	0	0	0	112.4	K186 I188	K186-D190 VanDerWaalsContact NZ-CG 3.25Å; K186-D190 IonicContact NZ-OD1 3.66Å; K186-D190 PolarHBondContact NZ-OD1 2.88Å; K186-D190 IonicContact NZ-OD2 2.78Å; K186-D190 PolarHBondContact NZ-OD2 3.03Å; K186-D190 VanDerWaalsContact O-CG 3.24Å; K186-D190 PolarHBondContact O-N 2.96Å; I188-D190 VanDerWaalsContact C-N 3.33Å; I188-D190 PolarHBondContact O-N 3.34Å
191	N	98.4	Very high	98.1	Very high	54 Å²	54	46.8 Å²	46.8	29%	0.289	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-2.2	-179.7	-76.3	-81.7	0	0	0	114	G148 A152 V187 I188 A189	G148-N191 VanDerWaalsContact C-CG 3.5Å; G148-N191 WeakPolarHBondContact CA-ND2 3.47Å; G148-N191 WeakPolarHBondContact O-CB 3.46Å; G148-N191 PolarHBondContact O-OD1 3.25Å; A152-N191 HydrophobicContact CB-CB 4.07Å; V187-N191 PolarHBondContact O-ND2 3.39Å; I188-N191 CarbonylContact O-C 3.59Å; I188-N191 WeakPolarHBondContact O-CA 3.5Å; I188-N191 WeakPolarHBondContact O-CB 3.33Å; I188-N191 PolarHBondContact O-N 3.35Å; A189-N191 PolarHBondContact O-N 2.86Å
192	V	98.3	Very high	98.1	Very high	14 Å²	14	46.8 Å²	46.8	9%	0.085	23%	0.234	C	C	.	.			trans	-105.8	117.9	-177.4	175.9	0	0	0	0	110.2	V151 L155 I188 A189 D194 W195 V198	V151-V192 HydrophobicContact CG1-CG2 3.72Å; L155-V192 HydrophobicContact CD1-CB 4.31Å; L155-V192 HydrophobicContact CD1-CG1 4.09Å; L155-V192 HydrophobicContact CD1-CG2 3.79Å; I188-V192 HydrophobicContact CG2-CG2 3.93Å; I188-V192 VanDerWaalsContact O-CG2 3.27Å; I188-V192 WeakPolarHBondContact O-CG2 3.38Å; I188-V192 PolarHBondContact O-N 2.86Å; A189-V192 PolarHBondContact O-N 3.03Å; A189-V192 VanDerWaalsContact O-N 3.1Å; V192-D194 WeakPolarHBondContact CG1-O 3.47Å; V192-W195 HydrophobicContact CB-CZ2 4.33Å; V192-W195 HydrophobicContact CG1-CB 4.49Å; V192-W195 HydrophobicContact CG1-CD2 3.83Å; V192-W195 HydrophobicContact CG1-CG 3.73Å; V192-W195 HydrophobicContact CG1-CZ2 4.46Å; V192-V198 HydrophobicContact CG1-CG2 3.92Å; V192-V198 HydrophobicContact CG2-CG2 4.12Å
193	K	94.9	Very high	98	Very high	213 Å²	213	45 Å²	45	93%	0.926	23%	0.227	S	C	*	.	S	Bend	trans	-91.6	-31.2	172.8	-61.3	-176.2	-178.9	-179.3	0	113.1
194	D	94.2	Very high	97.9	Very high	88 Å²	88	40.1 Å²	40.1	47%	0.471	20%	0.204	S	C	.	.			trans	-131.9	114.1	-179.7	176.5	13.5	0	0	0	109.5	V192 S196	V192-D194 WeakPolarHBondContact CG1-O 3.47Å; D194-S196 VanDerWaalsContact C-N 3.34Å; D194-S196 WeakPolarHBondContact OD1-CB 3.48Å; D194-S196 PolarHBondContact OD1-N 2.83Å; D194-S196 PolarHBondContact OD1-OG 3.06Å; D194-S196 PolarHBondContact OD2-OG 3.12Å
195	W	98.2	Very high	97.7	Very high	15 Å²	15	41.1 Å²	41.1	6%	0.057	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-82.9	-9.6	-179.2	-76.1	81.7	0	0	0	113.4	A189 V192 K197 V198 L200 L230 V234 V238 T242	A189-W195 HydrophobicContact CB-CH2 4.18Å; A189-W195 HydrophobicContact CB-CZ2 3.62Å; V192-W195 HydrophobicContact CB-CZ2 4.33Å; V192-W195 HydrophobicContact CG1-CB 4.49Å; V192-W195 HydrophobicContact CG1-CD2 3.83Å; V192-W195 HydrophobicContact CG1-CG 3.73Å; V192-W195 HydrophobicContact CG1-CZ2 4.46Å; W195-K197 PolarHBondContact O-N 2.84Å; W195-V198 HydrophobicContact CE3-CB 4.06Å; W195-V198 HydrophobicContact CE3-CG1 4.02Å; W195-V198 HydrophobicContact CZ3-CG1 4.03Å; W195-V198 PolarHBondContact O-N 3.38Å; W195-L200 HydrophobicContact CH2-CD1 4.48Å; W195-L200 HydrophobicContact CZ3-CD1 4Å; W195-L200 HydrophobicContact CZ3-CG 4.2Å; W195-L230 HydrophobicContact CE3-CD2 4.32Å; W195-L230 HydrophobicContact CH2-CD2 3.41Å; W195-L230 VanDerWaalsContact CH2-CD2 3.41Å; W195-L230 HydrophobicContact CZ2-CD2 3.93Å; W195-L230 HydrophobicContact CZ3-CD2 3.64Å; W195-V234 HydrophobicContact CZ2-CG2 3.9Å; W195-V238 HydrophobicContact CB-CG1 3.81Å; W195-V238 HydrophobicContact CB-CG2 3.99Å; W195-V238 HydrophobicContact CD2-CG1 3.58Å; W195-V238 HydrophobicContact CE3-CG1 4.01Å; W195-V238 HydrophobicContact CG-CB 4.41Å; W195-V238 HydrophobicContact CG-CG1 3.48Å; W195-V238 VanDerWaalsContact CG-CG1 3.48Å; W195-V238 HydrophobicContact CG-CG2 3.99Å; W195-T242 HydrophobicContact CE3-CG2 4.04Å; W195-T242 HydrophobicContact CZ3-CG2 4.3Å
196	S	97.3	Very high	97.5	Very high	81 Å²	81	42.6 Å²	42.6	57%	0.566	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-60.1	-23.9	-178.1	73.4	0	0	0	0	113.3	D194	D194-S196 VanDerWaalsContact C-N 3.34Å; D194-S196 WeakPolarHBondContact OD1-CB 3.48Å; D194-S196 PolarHBondContact OD1-N 2.83Å; D194-S196 PolarHBondContact OD1-OG 3.06Å; D194-S196 PolarHBondContact OD2-OG 3.12Å
197	K	97.6	Very high	97.1	Very high	87 Å²	87	37.9 Å²	37.9	38%	0.378	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-105.6	11.7	179.1	-71.8	-169.6	176.6	-175.9	0	114	L155 G158 G160 V161 W195	L155-K197 HydrophobicContact CD2-CB 3.85Å; G158-K197 PolarHBondContact O-NZ 3.27Å; G160-K197 CarbonylContact C-O 3.6Å; G160-K197 VanDerWaalsContact CA-O 3.3Å; G160-K197 WeakPolarHBondContact CA-O 3.23Å; V161-K197 PolarHBondContact N-O 3.3Å; W195-K197 PolarHBondContact O-N 2.84Å
198	V	98.8	Very high	96.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.4	178.9	-178.6	0	0	0	0	110.6	L155 V161 V192 W195 R243	L155-V198 HydrophobicContact CD1-CG2 3.94Å; L155-V198 HydrophobicContact CD2-CG2 4.06Å; V161-V198 WeakPolarHBondContact O-CA 3.48Å; V192-V198 HydrophobicContact CG1-CG2 3.92Å; V192-V198 HydrophobicContact CG2-CG2 4.12Å; W195-V198 HydrophobicContact CE3-CB 4.06Å; W195-V198 HydrophobicContact CE3-CG1 4.02Å; W195-V198 HydrophobicContact CZ3-CG1 4.03Å; W195-V198 PolarHBondContact O-N 3.38Å; V198-R243 PolarHBondContact O-NH2 2.64Å
199	V	98.9	Very high	95.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.7	163.4	178.1	0	0	0	0	106.6	F45 W128 V161 I162 A163 R243 I245	F45-V199 HydrophobicContact CD1-CG1 4.23Å; F45-V199 HydrophobicContact CD2-CG2 4.05Å; F45-V199 HydrophobicContact CE1-CG1 4.37Å; F45-V199 HydrophobicContact CE2-CG2 3.94Å; F45-V199 HydrophobicContact CG-CG2 4.36Å; F45-V199 HydrophobicContact CZ-CG2 4.17Å; W128-V199 HydrophobicContact CH2-CG2 3.83Å; W128-V199 HydrophobicContact CZ3-CG2 3.87Å; V161-V199 PolarHBondContact O-N 3.04Å; I162-V199 CarbonylContact C-O 3.57Å; I162-V199 WeakPolarHBondContact CA-O 3.42Å; I162-V199 HydrophobicContact CG1-CB 4.45Å; A163-V199 PolarHBondContact N-O 2.98Å; V199-R243 HydrophobicContact CG1-CB 4.35Å; V199-R243 HydrophobicContact CG2-CB 4.45Å; V199-I245 HydrophobicContact CG1-CB 4.42Å; V199-I245 HydrophobicContact CG1-CD1 3.7Å; V199-I245 HydrophobicContact CG1-CG1 3.81Å; V199-I245 HydrophobicContact CG1-CG2 3.84Å
200	L	98.9	Very high	94.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.6	171.4	-74.5	175.8	0	0	0	109	A163 T185 I188 W195 L230 R243 I244 I245	A163-L200 HydrophobicContact CB-CD2 4.21Å; A163-L200 WeakPolarHBondContact O-CA 3.41Å; T185-L200 HydrophobicContact CG2-CD1 4.14Å; I188-L200 HydrophobicContact CD1-CD2 4.29Å; W195-L200 HydrophobicContact CH2-CD1 4.48Å; W195-L200 HydrophobicContact CZ3-CD1 4Å; W195-L200 HydrophobicContact CZ3-CG 4.2Å; L200-L230 HydrophobicContact CD1-CD1 4.12Å; L200-L230 HydrophobicContact CD1-CD2 4.32Å; L200-R243 PolarHBondContact N-O 3.47Å; L200-I244 HydrophobicContact CB-CG2 4.43Å; L200-I244 CarbonylContact O-C 3.58Å; L200-I244 WeakPolarHBondContact O-CA 3.5Å; L200-I245 PolarHBondContact O-N 2.99Å
201	A	98.9	Very high	93.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	106.5	173.9	0	0	0	0	0	109.5	I162 A163 C164 I165 E203 I245 L268	I162-A201 HydrophobicContact CG2-CB 3.96Å; A163-A201 PolarHBondContact O-N 3.38Å; C164-A201 WeakPolarHBondContact CA-O 3.44Å; C164-A201 HydrophobicContact CB-CB 4.46Å; I165-A201 PolarHBondContact N-O 2.88Å; A201-E203 HydrophobicContact CB-CG 4.27Å; A201-E203 PolarHBondContact O-N 2.82Å; A201-I245 CarbonylContact C-O 3.42Å; A201-I245 WeakPolarHBondContact CA-O 3.25Å; A201-I245 HydrophobicContact CB-CD1 4Å; A201-I245 HydrophobicContact CB-CG1 3.68Å; A201-L268 HydrophobicContact CB-CB 4.39Å; A201-L268 HydrophobicContact CB-CD2 3.89Å
202	Y	98.8	Very high	93.1	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.9	170.4	168	-121.4	0	0	0	109.1	E167 V181 P204 V222 H223 I245 Y246 G247	E167-Y202 WeakPolarHBondContact OE2-CE2 3.22Å; E167-Y202 PolarHBondContact OE2-OH 3.47Å; V181-Y202 HydrophobicContact CG1-CD2 4.21Å; V181-Y202 HydrophobicContact CG1-CE2 4.1Å; Y202-P204 HydrophobicContact CE1-CG 4.03Å; Y202-P204 HydrophobicContact CE2-CB 4.35Å; Y202-P204 HydrophobicContact CE2-CG 4.18Å; Y202-V222 HydrophobicContact CD1-CB 4.09Å; Y202-V222 HydrophobicContact CD1-CG1 3.92Å; Y202-V222 HydrophobicContact CD2-CG1 3.84Å; Y202-V222 HydrophobicContact CE1-CB 3.64Å; Y202-V222 HydrophobicContact CE1-CG1 3.75Å; Y202-V222 HydrophobicContact CE1-CG2 4.01Å; Y202-V222 HydrophobicContact CE2-CB 4.39Å; Y202-V222 HydrophobicContact CE2-CG1 3.68Å; Y202-V222 HydrophobicContact CG-CG1 3.95Å; Y202-H223 AromaticContact CD1-CD2 3.66Å; Y202-H223 AromaticContact CD1-NE2 3.69Å; Y202-I245 PolarHBondContact N-O 3.33Å; Y202-Y246 HydrophobicContact CD1-CD2 4.19Å; Y202-Y246 HydrophobicContact CE1-CD2 4.43Å; Y202-Y246 WeakPolarHBondContact O-CA 3.46Å; Y202-G247 PolarHBondContact O-N 3.24Å
203	E	97.8	Very high	92.4	Very high	10 Å²	10	47.1 Å²	47.1	5%	0.047	27%	0.272	C	S	.	.			trans	-129.4	88.1	-178.3	-51.7	-166.2	94.7	0	0	110.6	H133 C164 I165 A201 V205 I208 G247 L268	H133-E203 IonicContact CD2-OE2 3.6Å; H133-E203 PolarHBondContact CD2-OE2 3.46Å; H133-E203 VanDerWaalsContact CD2-OE2 3.31Å; H133-E203 IonicContact NE2-OE2 2.71Å; C164-E203 PolarHBondContact SG-OE2 3.4Å; I165-E203 PolarHBondContact O-N 3.38Å; A201-E203 HydrophobicContact CB-CG 4.27Å; A201-E203 PolarHBondContact O-N 2.82Å; E203-V205 PolarHBondContact O-N 2.91Å; E203-V205 VanDerWaalsContact O-N 3.13Å; E203-I208 HydrophobicContact CB-CD1 3.87Å; E203-I208 HydrophobicContact CB-CG1 4.36Å; E203-G247 WeakPolarHBondContact CA-O 3.37Å; E203-L268 WeakPolarHBondContact OE2-CD2 3.45Å
204	P	95.7	Very high	92.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.23	C	C	.	.			trans	-55	123.9	174.6	10.2	-17.3	0	0	0	109.7	Y202 W206 A207 Y246	Y202-P204 HydrophobicContact CE1-CG 4.03Å; Y202-P204 HydrophobicContact CE2-CB 4.35Å; Y202-P204 HydrophobicContact CE2-CG 4.18Å; P204-W206 HydrophobicContact CB-CD2 4.22Å; P204-W206 VanDerWaalsContact CB-CE2 3.49Å; P204-W206 HydrophobicContact CB-CG 4.41Å; P204-W206 HydrophobicContact CB-CZ2 3.79Å; P204-W206 VanDerWaalsContact CB-NE1 3.26Å; P204-W206 HydrophobicContact CG-CZ2 4.06Å; P204-W206 PolarHBondContact O-N 2.87Å; P204-W206 VanDerWaalsContact O-N 3.11Å; P204-A207 HydrophobicContact CB-CB 4.44Å; P204-A207 HydrophobicContact CG-CB 4.11Å; P204-A207 WeakPolarHBondContact O-CB 3.39Å; P204-A207 PolarHBondContact O-N 3.37Å; P204-Y246 HydrophobicContact CG-CE2 4.15Å
205	V	95.4	Very high	92.2	Very high	38 Å²	38	35.8 Å²	35.8	23%	0.23	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-59.6	-34.8	-168.3	-179.3	0	0	0	0	111	H138 E167 K168 E203 A207 I208	H138-V205 WeakPolarHBondContact NE2-CG2 3.3Å; E167-V205 WeakPolarHBondContact O-CB 3.16Å; E167-V205 WeakPolarHBondContact O-CG2 3.22Å; E167-V205 PolarHBondContact O-N 2.88Å; K168-V205 HydrophobicContact CG-CB 4.46Å; K168-V205 HydrophobicContact CG-CG2 4.36Å; E203-V205 PolarHBondContact O-N 2.91Å; E203-V205 VanDerWaalsContact O-N 3.13Å; V205-A207 PolarHBondContact O-N 3.31Å; V205-I208 PolarHBondContact O-N 2.84Å
206	W	93.8	Very high	92.1	Very high	30 Å²	30	35.7 Å²	35.7	11%	0.114	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-68.5	-15.2	178.5	58.5	-95.8	0	0	0	114.3	E167 L169 P204 T210 A214	E167-W206 PolarHBondContact OE1-NE1 3.45Å; L169-W206 HydrophobicContact CB-CB 3.84Å; L169-W206 HydrophobicContact CB-CG 4.37Å; L169-W206 HydrophobicContact CD1-CB 4.09Å; L169-W206 HydrophobicContact CD1-CG 4.07Å; L169-W206 HydrophobicContact CG-CB 4.46Å; P204-W206 HydrophobicContact CB-CD2 4.22Å; P204-W206 VanDerWaalsContact CB-CE2 3.49Å; P204-W206 HydrophobicContact CB-CG 4.41Å; P204-W206 HydrophobicContact CB-CZ2 3.79Å; P204-W206 VanDerWaalsContact CB-NE1 3.26Å; P204-W206 HydrophobicContact CG-CZ2 4.06Å; P204-W206 PolarHBondContact O-N 2.87Å; P204-W206 VanDerWaalsContact O-N 3.11Å; W206-T210 VanDerWaalsContact O-CG2 3.28Å; W206-T210 WeakPolarHBondContact O-CG2 3.47Å; W206-T210 PolarHBondContact O-OG1 3.42Å; W206-A214 HydrophobicContact CH2-CB 3.84Å; W206-A214 HydrophobicContact CZ2-CB 4.41Å
207	A	90.3	Very high	92.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-94.4	-7.5	175.7	0	0	0	0	0	113.3	P204 V205 G209 K212 G248 S249	P204-A207 HydrophobicContact CB-CB 4.44Å; P204-A207 HydrophobicContact CG-CB 4.11Å; P204-A207 WeakPolarHBondContact O-CB 3.39Å; P204-A207 PolarHBondContact O-N 3.37Å; V205-A207 PolarHBondContact O-N 3.31Å; A207-G209 PolarHBondContact O-N 2.81Å; A207-K212 WeakPolarHBondContact CA-O 3.41Å; A207-K212 VanDerWaalsContact CB-O 3.28Å; A207-K212 WeakPolarHBondContact CB-O 3.32Å; A207-G248 CarbonylContact O-C 3.4Å; A207-G248 VanDerWaalsContact O-C 3.27Å; A207-G248 VanDerWaalsContact O-CA 3.3Å; A207-G248 WeakPolarHBondContact O-CA 3.28Å; A207-S249 WeakPolarHBondContact O-CB 3.45Å; A207-S249 PolarHBondContact O-N 3.42Å; A207-S249 VanDerWaalsContact O-N 3.14Å; A207-S249 PolarHBondContact O-OG 3.4Å
208	I	87.3	Confident	92.2	Very high	28 Å²	28	35.3 Å²	35.3	14%	0.144	22%	0.217	C	C	.	.	S	Bend	trans	-85.3	107.8	-174.4	-59	173.5	0	0	0	110.3	S134 E203 V205 T210	S134-I208 WeakPolarHBondContact OG-CD1 3.41Å; E203-I208 HydrophobicContact CB-CD1 3.87Å; E203-I208 HydrophobicContact CB-CG1 4.36Å; V205-I208 PolarHBondContact O-N 2.84Å; I208-T210 PolarHBondContact O-N 2.63Å
209	G	78.4	Confident	92.1	Very high	76 Å²	76	35.3 Å²	35.3	78%	0.784	22%	0.217	S	C	*	.	S	Bend	trans	73.5	6.1	173.9	0	0	0	0	0	115.1	A207	A207-G209 PolarHBondContact O-N 2.81Å
210	T	80.8	Confident	92.1	Very high	77 Å²	77	36.2 Å²	36.2	47%	0.472	22%	0.221	S	C	.	.	S	Bend	trans	-92	-11.9	-179.3	60.7	0	0	0	0	113.3	W206 I208 K212	W206-T210 VanDerWaalsContact O-CG2 3.28Å; W206-T210 WeakPolarHBondContact O-CG2 3.47Å; W206-T210 PolarHBondContact O-OG1 3.42Å; I208-T210 PolarHBondContact O-N 2.63Å; T210-K212 PolarHBondContact O-N 2.92Å; T210-K212 PolarHBondContact OG1-N 2.91Å
211	G	79.1	Confident	92.1	Very high	65 Å²	65	40.6 Å²	40.6	67%	0.67	24%	0.241	S	C	*	.	S	Bend	trans	73.4	-1.9	-170.1	0	0	0	0	0	113.6	S249	G211-S249 PolarHBondContact N-OG 2.74Å
212	K	82.3	Confident	92	Very high	136 Å²	136	41.1 Å²	41.1	59%	0.591	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-86.6	119.2	169.2	-62.5	-175.3	178.6	-177.1	0	108.1	A207 T210 S249	A207-K212 WeakPolarHBondContact CA-O 3.41Å; A207-K212 VanDerWaalsContact CB-O 3.28Å; A207-K212 WeakPolarHBondContact CB-O 3.32Å; T210-K212 PolarHBondContact O-N 2.92Å; T210-K212 PolarHBondContact OG1-N 2.91Å; K212-S249 PolarHBondContact O-OG 3.4Å
213	T	82.7	Confident	92	Very high	43 Å²	43	41 Å²	41	26%	0.264	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-102.8	139.9	174.9	-46.8	0	0	0	0	108.1	Y246 S249 L258	T213-Y246 HydrophobicContact CG2-CE1 4.09Å; T213-S249 VanDerWaalsContact OG1-CB 3.25Å; T213-S249 WeakPolarHBondContact OG1-CB 3.41Å; T213-S249 PolarHBondContact OG1-O 3.47Å; T213-L258 HydrophobicContact CG2-CD1 4.09Å
214	A	89.4	Confident	92.1	Very high	3 Å²	3	46.1 Å²	46.1	3%	0.025	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-58.6	143.3	167.1	0	0	0	0	0	109.5	W206 Q218 Y246	W206-A214 HydrophobicContact CH2-CB 3.84Å; W206-A214 HydrophobicContact CZ2-CB 4.41Å; A214-Q218 HydrophobicContact CB-CB 4.12Å; A214-Y246 HydrophobicContact CB-CE2 3.71Å; A214-Y246 WeakPolarHBondContact CB-OH 3.37Å; A214-Y246 PolarHBondContact N-OH 3.39Å
215	T	96	Very high	92.2	Very high	61 Å²	61	49.1 Å²	49.1	37%	0.374	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-65.8	155.9	171.7	73.9	0	0	0	0	109.2	Q217 Q218 A219	T215-Q217 PolarHBondContact O-N 3.27Å; T215-Q217 VanDerWaalsContact O-N 3.14Å; T215-Q217 PolarHBondContact OG1-OE1 3.06Å; T215-Q218 VanDerWaalsContact N-OE1 3.12Å; T215-Q218 WeakPolarHBondContact O-CB 3.3Å; T215-Q218 PolarHBondContact O-N 3.32Å; T215-Q218 VanDerWaalsContact OG1-CG 3.31Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.07Å; T215-Q218 PolarHBondContact OG1-N 2.82Å; T215-A219 PolarHBondContact O-N 3.13Å
216	P	97.1	Very high	92.4	Very high	12 Å²	12	47.3 Å²	47.3	8%	0.078	27%	0.27	C	S	.	.	H	α-helix	trans	-53.3	-36.9	176.9	-26	33.7	0	0	0	113.2	A219 Q220 E257 L258 Q261	P216-A219 PolarHBondContact O-N 3.27Å; P216-Q220 VanDerWaalsContact O-CB 3.26Å; P216-Q220 WeakPolarHBondContact O-CB 3.34Å; P216-Q220 PolarHBondContact O-N 2.81Å; P216-E257 HydrophobicContact CB-CG 4.45Å; P216-E257 HydrophobicContact CG-CB 4.15Å; P216-E257 HydrophobicContact CG-CG 3.63Å; P216-L258 HydrophobicContact CB-CD2 4.42Å; P216-L258 HydrophobicContact CG-CD2 4.38Å; P216-Q261 HydrophobicContact CB-CG 3.81Å
217	Q	97.9	Very high	92.6	Very high	111 Å²	111	46.6 Å²	46.6	52%	0.519	27%	0.267	S	S	.	.	H	α-helix	trans	-67.2	-37.4	178.1	-60.8	73.1	29.3	0	0	112	T215 E221	T215-Q217 PolarHBondContact O-N 3.27Å; T215-Q217 VanDerWaalsContact O-N 3.14Å; T215-Q217 PolarHBondContact OG1-OE1 3.06Å; Q217-E221 VanDerWaalsContact O-CB 3.3Å; Q217-E221 WeakPolarHBondContact O-CB 3.5Å; Q217-E221 PolarHBondContact O-N 2.77Å
218	Q	97.1	Very high	93	Very high	49 Å²	49	48.2 Å²	48.2	23%	0.229	28%	0.284	C	S	.	.	H	α-helix	trans	-68.4	-40.2	176.5	-68.1	171.3	-9.5	0	0	111.7	R172 A214 T215 V222	R172-Q218 VanDerWaalsContact NH2-CG 3.26Å; A214-Q218 HydrophobicContact CB-CB 4.12Å; T215-Q218 VanDerWaalsContact N-OE1 3.12Å; T215-Q218 WeakPolarHBondContact O-CB 3.3Å; T215-Q218 PolarHBondContact O-N 3.32Å; T215-Q218 VanDerWaalsContact OG1-CG 3.31Å; T215-Q218 WeakPolarHBondContact OG1-CG 3.07Å; T215-Q218 PolarHBondContact OG1-N 2.82Å; Q218-V222 PolarHBondContact O-N 3.22Å
219	A	97.7	Very high	93.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-47.8	174.7	0	0	0	0	0	111.1	T215 P216 E221 V222 H223 Y246 L258 V264	T215-A219 PolarHBondContact O-N 3.13Å; P216-A219 PolarHBondContact O-N 3.27Å; A219-E221 PolarHBondContact O-N 2.96Å; A219-V222 PolarHBondContact O-N 2.97Å; A219-H223 WeakPolarHBondContact O-CB 3.31Å; A219-H223 PolarHBondContact O-CD2 2.81Å; A219-H223 PolarHBondContact O-N 3.35Å; A219-Y246 HydrophobicContact CB-CD2 3.85Å; A219-Y246 HydrophobicContact CB-CE2 4.27Å; A219-Y246 HydrophobicContact CB-CG 4.28Å; A219-L258 HydrophobicContact CB-CD2 4.02Å; A219-V264 HydrophobicContact CB-CG2 4.33Å
220	Q	98.6	Very high	94.6	Very high	20 Å²	20	44.6 Å²	44.6	9%	0.093	25%	0.245	C	C	.	.	H	α-helix	trans	-57.4	-48.2	177.6	173.9	55.2	33.5	0	0	112	P216 V222 H223 E224 Q261 P262 D263	P216-Q220 VanDerWaalsContact O-CB 3.26Å; P216-Q220 WeakPolarHBondContact O-CB 3.34Å; P216-Q220 PolarHBondContact O-N 2.81Å; Q220-V222 VanDerWaalsContact C-N 3.33Å; Q220-V222 PolarHBondContact O-N 2.87Å; Q220-H223 PolarHBondContact O-N 3.46Å; Q220-E224 WeakPolarHBondContact O-CB 3.14Å; Q220-E224 PolarHBondContact O-N 2.89Å; Q220-Q261 HydrophobicContact CB-CB 4.08Å; Q220-Q261 HydrophobicContact CB-CG 4.08Å; Q220-P262 VanDerWaalsContact OE1-CD 3.28Å; Q220-D263 PolarHBondContact NE2-OD2 3.26Å
221	E	98.4	Very high	95.4	Very high	92 Å²	92	46.1 Å²	46.1	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-55.4	-47.7	-179.7	179.7	-173.1	180	0	0	111.8	Q217 A219 K225	Q217-E221 VanDerWaalsContact O-CB 3.3Å; Q217-E221 WeakPolarHBondContact O-CB 3.5Å; Q217-E221 PolarHBondContact O-N 2.77Å; A219-E221 PolarHBondContact O-N 2.96Å; E221-K225 HydrophobicContact CG-CD 4.21Å; E221-K225 WeakPolarHBondContact O-CB 3.24Å; E221-K225 WeakPolarHBondContact O-CD 3.46Å; E221-K225 VanDerWaalsContact O-CG 3.24Å; E221-K225 WeakPolarHBondContact O-CG 3.32Å; E221-K225 PolarHBondContact O-N 3.19Å; E221-K225 VanDerWaalsContact O-N 3.16Å; E221-K225 IonicContact OE1-NZ 2.67Å; E221-K225 PolarHBondContact OE1-NZ 2.64Å
222	V	98.6	Very high	96.4	Very high	11 Å²	11	47.8 Å²	47.8	7%	0.067	25%	0.246	C	C	.	.	H	α-helix	trans	-72.2	-38.9	-178.4	178.9	0	0	0	0	111.4	T177 V181 Y202 Q218 A219 Q220 K225 L226	T177-V222 HydrophobicContact CG2-CG2 3.99Å; V181-V222 HydrophobicContact CG2-CG1 4.35Å; Y202-V222 HydrophobicContact CD1-CB 4.09Å; Y202-V222 HydrophobicContact CD1-CG1 3.92Å; Y202-V222 HydrophobicContact CD2-CG1 3.84Å; Y202-V222 HydrophobicContact CE1-CB 3.64Å; Y202-V222 HydrophobicContact CE1-CG1 3.75Å; Y202-V222 HydrophobicContact CE1-CG2 4.01Å; Y202-V222 HydrophobicContact CE2-CB 4.39Å; Y202-V222 HydrophobicContact CE2-CG1 3.68Å; Y202-V222 HydrophobicContact CG-CG1 3.95Å; Q218-V222 PolarHBondContact O-N 3.22Å; A219-V222 PolarHBondContact O-N 2.97Å; Q220-V222 VanDerWaalsContact C-N 3.33Å; Q220-V222 PolarHBondContact O-N 2.87Å; V222-K225 PolarHBondContact O-N 3.23Å; V222-L226 HydrophobicContact CG1-CD1 3.95Å; V222-L226 HydrophobicContact CG1-CG 4.33Å; V222-L226 WeakPolarHBondContact O-CB 3.22Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 2.92Å
223	H	98.8	Very high	97.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-43.1	177.2	-80.2	-133.6	0	0	0	112.4	Y202 A219 Q220 K225 L226 R227 I244 I245 D263	Y202-H223 AromaticContact CD1-CD2 3.66Å; Y202-H223 AromaticContact CD1-NE2 3.69Å; A219-H223 WeakPolarHBondContact O-CB 3.31Å; A219-H223 PolarHBondContact O-CD2 2.81Å; A219-H223 PolarHBondContact O-N 3.35Å; Q220-H223 PolarHBondContact O-N 3.46Å; H223-K225 VanDerWaalsContact C-N 3.34Å; H223-K225 PolarHBondContact O-N 3.36Å; H223-L226 PolarHBondContact O-N 3.4Å; H223-R227 WeakPolarHBondContact O-CB 3.45Å; H223-R227 PolarHBondContact O-N 3.16Å; H223-I244 HydrophobicContact CB-CG2 4.47Å; H223-I244 VanDerWaalsContact CE1-C 3.5Å; H223-I244 PolarHBondContact CE1-O 3.06Å; H223-I244 WeakPolarHBondContact ND1-CG2 3.28Å; H223-I244 PolarHBondContact ND1-O 2.78Å; H223-I244 VanDerWaalsContact ND1-O 3.17Å; H223-I245 VanDerWaalsContact CE1-C 3.47Å; H223-D263 HydrophobicContact CB-CB 3.72Å; H223-D263 PolarHBondContact ND1-O 3.38Å
224	E	98.8	Very high	97.9	Very high	116 Å²	116	46.5 Å²	46.5	54%	0.542	25%	0.246	S	C	.	.	H	α-helix	trans	-60.5	-45	175.9	-175.5	178.7	171.8	0	0	110.9	Q220 R227 G228	Q220-E224 WeakPolarHBondContact O-CB 3.14Å; Q220-E224 PolarHBondContact O-N 2.89Å; E224-R227 PolarHBondContact O-N 3.35Å; E224-G228 PolarHBondContact O-N 3.37Å
225	K	98.8	Very high	98.3	Very high	64 Å²	64	48.5 Å²	48.5	28%	0.278	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-42.3	176.7	-72.5	172.9	-178.9	179.8	0	112.6	E178 F182 E221 V222 H223 R227 G228 W229	E178-K225 HydrophobicContact CG-CD 3.73Å; E178-K225 VanDerWaalsContact OE1-CD 3.32Å; E178-K225 WeakPolarHBondContact OE1-CD 3.47Å; E178-K225 WeakPolarHBondContact OE1-CE 3.31Å; E178-K225 IonicContact OE1-NZ 2.67Å; E178-K225 PolarHBondContact OE1-NZ 2.87Å; F182-K225 HydrophobicContact CE1-CB 4.37Å; F182-K225 HydrophobicContact CZ-CB 4.1Å; E221-K225 HydrophobicContact CG-CD 4.21Å; E221-K225 WeakPolarHBondContact O-CB 3.24Å; E221-K225 WeakPolarHBondContact O-CD 3.46Å; E221-K225 VanDerWaalsContact O-CG 3.24Å; E221-K225 WeakPolarHBondContact O-CG 3.32Å; E221-K225 PolarHBondContact O-N 3.19Å; E221-K225 VanDerWaalsContact O-N 3.16Å; E221-K225 IonicContact OE1-NZ 2.67Å; E221-K225 PolarHBondContact OE1-NZ 2.64Å; V222-K225 PolarHBondContact O-N 3.23Å; H223-K225 VanDerWaalsContact C-N 3.34Å; H223-K225 PolarHBondContact O-N 3.36Å; K225-R227 VanDerWaalsContact C-N 3.33Å; K225-G228 PolarHBondContact O-N 2.99Å; K225-W229 WeakPolarHBondContact O-CB 3.49Å; K225-W229 PolarHBondContact O-N 3.27Å
226	L	98.9	Very high	98.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-40.6	173.6	-77.2	167.9	0	0	0	111.6	I165 V181 F182 T185 V222 H223 W229 L230 I244	I165-L226 HydrophobicContact CD1-CD1 3.81Å; I165-L226 HydrophobicContact CD1-CD2 3.67Å; I165-L226 HydrophobicContact CD1-CG 4.42Å; V181-L226 HydrophobicContact CB-CD2 4.25Å; V181-L226 HydrophobicContact CG2-CD2 4.03Å; V181-L226 HydrophobicContact CG2-CG 4.43Å; F182-L226 HydrophobicContact CD1-CD2 4.19Å; F182-L226 HydrophobicContact CE1-CD2 4.3Å; T185-L226 WeakPolarHBondContact OG1-CD2 3.27Å; V222-L226 HydrophobicContact CG1-CD1 3.95Å; V222-L226 HydrophobicContact CG1-CG 4.33Å; V222-L226 WeakPolarHBondContact O-CB 3.22Å; V222-L226 WeakPolarHBondContact O-CG 3.3Å; V222-L226 PolarHBondContact O-N 2.92Å; H223-L226 PolarHBondContact O-N 3.4Å; L226-W229 WeakPolarHBondContact O-CB 3.42Å; L226-W229 PolarHBondContact O-N 3.46Å; L226-L230 WeakPolarHBondContact O-CG 3.44Å; L226-L230 PolarHBondContact O-N 3.17Å; L226-I244 HydrophobicContact CB-CD1 3.92Å; L226-I244 HydrophobicContact CD1-CG2 4.18Å
227	R	98.8	Very high	98.4	Very high	15 Å²	15	52.3 Å²	52.3	6%	0.057	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-41.9	175.6	-162.4	176.3	-55.5	-78.4	-0.3	111.4	H223 E224 K225 W229 L230 K231 A239 T242 I244 D263 D265	H223-R227 WeakPolarHBondContact O-CB 3.45Å; H223-R227 PolarHBondContact O-N 3.16Å; E224-R227 PolarHBondContact O-N 3.35Å; K225-R227 VanDerWaalsContact C-N 3.33Å; R227-W229 VanDerWaalsContact C-N 3.3Å; R227-W229 PolarHBondContact O-N 2.76Å; R227-L230 PolarHBondContact O-N 2.91Å; R227-K231 WeakPolarHBondContact O-CB 3.32Å; R227-K231 PolarHBondContact O-N 3.06Å; R227-A239 WeakPolarHBondContact CD-O 3.34Å; R227-A239 HydrophobicContact CG-CB 4.04Å; R227-A239 WeakPolarHBondContact CG-O 3.35Å; R227-A239 PolarHBondContact NH1-O 3.19Å; R227-A239 WeakPolarHBondContact O-CB 3.41Å; R227-T242 PolarHBondContact NH1-O 3.25Å; R227-I244 HydrophobicContact CB-CD1 4.09Å; R227-D263 VanDerWaalsContact CD-OD1 3.31Å; R227-D263 WeakPolarHBondContact CD-OD1 3.42Å; R227-D263 IonicContact CZ-OD1 2.74Å; R227-D263 IonicContact NE-OD1 2.68Å; R227-D263 PolarHBondContact NE-OD1 2.67Å; R227-D263 PolarHBondContact NH2-O 3.39Å; R227-D263 IonicContact NH2-OD1 3.1Å; R227-D265 IonicContact CZ-OD2 2.9Å; R227-D265 IonicContact NH1-OD2 3.49Å; R227-D265 IonicContact NH2-OD1 2.64Å; R227-D265 IonicContact NH2-OD2 3.31Å; R227-D265 PolarHBondContact NH2-OD2 3.23Å
228	G	98.8	Very high	98.4	Very high	33 Å²	33	48 Å²	48	34%	0.34	27%	0.265	S	S	.	.	H	α-helix	trans	-60.8	-37.6	171.8	0	0	0	0	0	113	E224 K225 K231 S232	E224-G228 PolarHBondContact O-N 3.37Å; K225-G228 PolarHBondContact O-N 2.99Å; G228-K231 PolarHBondContact O-N 3.36Å; G228-S232 WeakPolarHBondContact O-CB 3.17Å; G228-S232 PolarHBondContact O-N 2.98Å; G228-S232 VanDerWaalsContact O-N 3.07Å; G228-S232 PolarHBondContact O-OG 3.36Å
229	W	98.8	Very high	98.5	Very high	29 Å²	29	45.7 Å²	45.7	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-48.2	174	-171.5	97.6	0	0	0	111.5	F182 T185 K186 A189 K225 L226 R227 K231 S232 N233 V234	F182-W229 HydrophobicContact CD1-CB 3.97Å; F182-W229 AromaticContact CD1-CD1 3.53Å; F182-W229 AromaticContact CD1-CG 3.8Å; F182-W229 HydrophobicContact CD1-CG 3.8Å; F182-W229 AromaticContact CD2-CD1 3.71Å; F182-W229 HydrophobicContact CE1-CB 3.68Å; F182-W229 AromaticContact CE1-CD1 3.94Å; F182-W229 HydrophobicContact CE1-CG 4.02Å; F182-W229 AromaticContact CG-CD1 3.41Å; F182-W229 VanDerWaalsContact CG-CD1 3.41Å; F182-W229 HydrophobicContact CG-CG 4.15Å; F182-W229 AromaticContact CG-NE1 3.92Å; F182-W229 HydrophobicContact CZ-CB 4.14Å; T185-W229 HydrophobicContact CG2-CD2 4.33Å; T185-W229 HydrophobicContact CG2-CE3 3.6Å; T185-W229 HydrophobicContact CG2-CH2 4.26Å; T185-W229 HydrophobicContact CG2-CZ3 3.57Å; K186-W229 HydrophobicContact CB-CH2 4.15Å; K186-W229 HydrophobicContact CB-CZ2 3.72Å; K186-W229 HydrophobicContact CG-CZ2 4.32Å; A189-W229 HydrophobicContact CB-CH2 3.71Å; A189-W229 HydrophobicContact CB-CZ3 3.91Å; K225-W229 WeakPolarHBondContact O-CB 3.49Å; K225-W229 PolarHBondContact O-N 3.27Å; L226-W229 WeakPolarHBondContact O-CB 3.42Å; L226-W229 PolarHBondContact O-N 3.46Å; R227-W229 VanDerWaalsContact C-N 3.3Å; R227-W229 PolarHBondContact O-N 2.76Å; W229-K231 VanDerWaalsContact C-N 3.28Å; W229-K231 PolarHBondContact O-N 3.01Å; W229-S232 PolarHBondContact O-N 3.14Å; W229-N233 HydrophobicContact CD2-CB 4.16Å; W229-N233 HydrophobicContact CE3-CB 4.17Å; W229-N233 HydrophobicContact CH2-CB 3.76Å; W229-N233 HydrophobicContact CZ2-CB 3.79Å; W229-N233 HydrophobicContact CZ3-CB 3.97Å; W229-N233 PolarHBondContact NE1-ND2 3.43Å; W229-N233 WeakPolarHBondContact O-CB 3.19Å; W229-N233 PolarHBondContact O-N 3.1Å; W229-N233 PolarHBondContact O-ND2 3.14Å; W229-V234 HydrophobicContact CZ3-CG2 4.24Å
230	L	98.8	Very high	98.5	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-39.9	176.1	-70.8	174.4	0	0	0	111.8	T185 W195 L200 L226 R227 S232 V234 S235 V238 A239 T242 I244	T185-L230 HydrophobicContact CG2-CD2 4.5Å; W195-L230 HydrophobicContact CE3-CD2 4.32Å; W195-L230 HydrophobicContact CH2-CD2 3.41Å; W195-L230 VanDerWaalsContact CH2-CD2 3.41Å; W195-L230 HydrophobicContact CZ2-CD2 3.93Å; W195-L230 HydrophobicContact CZ3-CD2 3.64Å; L200-L230 HydrophobicContact CD1-CD1 4.12Å; L200-L230 HydrophobicContact CD1-CD2 4.32Å; L226-L230 WeakPolarHBondContact O-CG 3.44Å; L226-L230 PolarHBondContact O-N 3.17Å; R227-L230 PolarHBondContact O-N 2.91Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 2.87Å; L230-V234 HydrophobicContact CD2-CG2 4.12Å; L230-V234 WeakPolarHBondContact O-CA 3.18Å; L230-V234 VanDerWaalsContact O-CB 3.32Å; L230-V234 WeakPolarHBondContact O-CB 3.33Å; L230-V234 PolarHBondContact O-N 3.39Å; L230-S235 PolarHBondContact O-N 3.35Å; L230-V238 HydrophobicContact CD2-CG1 4.41Å; L230-A239 HydrophobicContact CB-CB 4.01Å; L230-T242 HydrophobicContact CD1-CG2 4.04Å; L230-I244 HydrophobicContact CD1-CD1 4.32Å
231	K	98.7	Very high	98.5	Very high	109 Å²	109	51.4 Å²	51.4	47%	0.474	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-45.2	177.4	172.3	175.2	173.9	141.9	0	111.4	R227 G228 W229 E236 A239	R227-K231 WeakPolarHBondContact O-CB 3.32Å; R227-K231 PolarHBondContact O-N 3.06Å; G228-K231 PolarHBondContact O-N 3.36Å; W229-K231 VanDerWaalsContact C-N 3.28Å; W229-K231 PolarHBondContact O-N 3.01Å; K231-E236 WeakPolarHBondContact CD-OE2 3.36Å; K231-E236 WeakPolarHBondContact CE-OE2 3.28Å; K231-E236 WeakPolarHBondContact CG-OE2 3.4Å; K231-E236 IonicContact NZ-OE1 3.75Å; K231-E236 IonicContact NZ-OE2 3.65Å; K231-E236 PolarHBondContact NZ-OE2 2.96Å; K231-A239 HydrophobicContact CB-CB 3.7Å
232	S	98.6	Very high	98.5	Very high	99 Å²	99	47.1 Å²	47.1	69%	0.692	27%	0.269	S	S	*	.	H	α-helix	trans	-80	-31.9	-174.2	-53.4	0	0	0	0	113.3	G228 W229 L230	G228-S232 WeakPolarHBondContact O-CB 3.17Å; G228-S232 PolarHBondContact O-N 2.98Å; G228-S232 VanDerWaalsContact O-N 3.07Å; G228-S232 PolarHBondContact O-OG 3.36Å; W229-S232 PolarHBondContact O-N 3.14Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 2.87Å
233	N	98.6	Very high	98.5	Very high	100 Å²	100	47.8 Å²	47.8	54%	0.535	27%	0.271	S	S	.	.	H	α-helix	trans	-108	-15.3	-171.4	-64.2	-87.2	0	0	0	113.8	W229	W229-N233 HydrophobicContact CD2-CB 4.16Å; W229-N233 HydrophobicContact CE3-CB 4.17Å; W229-N233 HydrophobicContact CH2-CB 3.76Å; W229-N233 HydrophobicContact CZ2-CB 3.79Å; W229-N233 HydrophobicContact CZ3-CB 3.97Å; W229-N233 PolarHBondContact NE1-ND2 3.43Å; W229-N233 WeakPolarHBondContact O-CB 3.19Å; W229-N233 PolarHBondContact O-N 3.1Å; W229-N233 PolarHBondContact O-ND2 3.14Å
234	V	98.3	Very high	98.5	Very high	53 Å²	53	47.8 Å²	47.8	32%	0.321	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-72.8	178.4	-169	0	0	0	0	110.7	A189 W195 W229 L230 V238	A189-V234 HydrophobicContact CB-CG2 4.46Å; W195-V234 HydrophobicContact CZ2-CG2 3.9Å; W229-V234 HydrophobicContact CZ3-CG2 4.24Å; L230-V234 HydrophobicContact CD2-CG2 4.12Å; L230-V234 WeakPolarHBondContact O-CA 3.18Å; L230-V234 VanDerWaalsContact O-CB 3.32Å; L230-V234 WeakPolarHBondContact O-CB 3.33Å; L230-V234 PolarHBondContact O-N 3.39Å; V234-V238 HydrophobicContact CB-CB 4.29Å; V234-V238 HydrophobicContact CB-CG1 4.17Å; V234-V238 HydrophobicContact CG1-CB 3.9Å; V234-V238 HydrophobicContact CG1-CG1 3.89Å; V234-V238 HydrophobicContact CG1-CG2 3.74Å
235	S	98.4	Very high	98.5	Very high	44 Å²	44	42.3 Å²	42.3	31%	0.308	25%	0.245	S	C	.	.			trans	-177.8	160.7	171.6	61.1	0	0	0	0	111	L230 A237 V238 A239	L230-S235 PolarHBondContact O-N 3.35Å; S235-A237 VanDerWaalsContact C-N 3.29Å; S235-A237 PolarHBondContact O-N 3.21Å; S235-V238 PolarHBondContact O-N 3.37Å; S235-V238 WeakPolarHBondContact OG-CG2 3.39Å; S235-V238 PolarHBondContact OG-N 3.49Å; S235-V238 VanDerWaalsContact OG-N 3.16Å; S235-A239 PolarHBondContact O-N 2.8Å
236	E	97.9	Very high	98.5	Very high	82 Å²	82	39.2 Å²	39.2	38%	0.383	23%	0.232	S	C	.	.	H	α-helix	trans	-53.9	-45.3	169.2	-176	67.6	-139.7	0	0	111.9	K231 V238 A239 Q240	K231-E236 WeakPolarHBondContact CD-OE2 3.36Å; K231-E236 WeakPolarHBondContact CE-OE2 3.28Å; K231-E236 WeakPolarHBondContact CG-OE2 3.4Å; K231-E236 IonicContact NZ-OE1 3.75Å; K231-E236 IonicContact NZ-OE2 3.65Å; K231-E236 PolarHBondContact NZ-OE2 2.96Å; E236-V238 VanDerWaalsContact C-N 3.34Å; E236-V238 PolarHBondContact O-N 2.84Å; E236-A239 WeakPolarHBondContact O-CB 3.02Å; E236-A239 PolarHBondContact O-N 3.26Å; E236-Q240 HydrophobicContact CG-CG 4.37Å; E236-Q240 WeakPolarHBondContact O-CG 3.31Å; E236-Q240 PolarHBondContact O-N 3.32Å; E236-Q240 WeakPolarHBondContact OE1-CG 3.19Å; E236-Q240 PolarHBondContact OE1-NE2 3.31Å
237	A	97.8	Very high	98.4	Very high	71 Å²	71	39.2 Å²	39.2	59%	0.587	23%	0.232	S	C	*	.	H	α-helix	trans	-61.9	-41.3	-177.6	0	0	0	0	0	112.2	S235 Q240 S241	S235-A237 VanDerWaalsContact C-N 3.29Å; S235-A237 PolarHBondContact O-N 3.21Å; A237-Q240 PolarHBondContact O-N 3.04Å; A237-S241 WeakPolarHBondContact O-CB 3.37Å; A237-S241 PolarHBondContact O-N 3.13Å; A237-S241 VanDerWaalsContact O-N 3.13Å; A237-S241 PolarHBondContact O-OG 2.85Å
238	V	98.3	Very high	98	Very high	20 Å²	20	38.8 Å²	38.8	12%	0.121	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-43.4	175.1	168.7	0	0	0	0	110.8	W195 L230 V234 S235 E236 Q240 S241 T242	W195-V238 HydrophobicContact CB-CG1 3.81Å; W195-V238 HydrophobicContact CB-CG2 3.99Å; W195-V238 HydrophobicContact CD2-CG1 3.58Å; W195-V238 HydrophobicContact CE3-CG1 4.01Å; W195-V238 HydrophobicContact CG-CB 4.41Å; W195-V238 HydrophobicContact CG-CG1 3.48Å; W195-V238 VanDerWaalsContact CG-CG1 3.48Å; W195-V238 HydrophobicContact CG-CG2 3.99Å; L230-V238 HydrophobicContact CD2-CG1 4.41Å; V234-V238 HydrophobicContact CB-CB 4.29Å; V234-V238 HydrophobicContact CB-CG1 4.17Å; V234-V238 HydrophobicContact CG1-CB 3.9Å; V234-V238 HydrophobicContact CG1-CG1 3.89Å; V234-V238 HydrophobicContact CG1-CG2 3.74Å; S235-V238 PolarHBondContact O-N 3.37Å; S235-V238 WeakPolarHBondContact OG-CG2 3.39Å; S235-V238 PolarHBondContact OG-N 3.49Å; S235-V238 VanDerWaalsContact OG-N 3.16Å; E236-V238 VanDerWaalsContact C-N 3.34Å; E236-V238 PolarHBondContact O-N 2.84Å; V238-Q240 VanDerWaalsContact C-N 3.31Å; V238-Q240 PolarHBondContact O-N 3.45Å; V238-S241 PolarHBondContact O-N 3.19Å; V238-S241 PolarHBondContact O-OG 3.03Å; V238-T242 WeakPolarHBondContact CG1-OG1 3.28Å; V238-T242 VanDerWaalsContact O-CB 3.23Å; V238-T242 WeakPolarHBondContact O-CB 3.32Å; V238-T242 PolarHBondContact O-N 3.01Å; V238-T242 PolarHBondContact O-OG1 3.44Å
239	A	98.4	Very high	97.6	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-40.1	178	0	0	0	0	0	112.6	R227 L230 K231 S235 E236	R227-A239 WeakPolarHBondContact CD-O 3.34Å; R227-A239 HydrophobicContact CG-CB 4.04Å; R227-A239 WeakPolarHBondContact CG-O 3.35Å; R227-A239 PolarHBondContact NH1-O 3.19Å; R227-A239 WeakPolarHBondContact O-CB 3.41Å; L230-A239 HydrophobicContact CB-CB 4.01Å; K231-A239 HydrophobicContact CB-CB 3.7Å; S235-A239 PolarHBondContact O-N 2.8Å; E236-A239 WeakPolarHBondContact O-CB 3.02Å; E236-A239 PolarHBondContact O-N 3.26Å
240	Q	97.9	Very high	97.4	Very high	70 Å²	70	37.4 Å²	37.4	33%	0.327	22%	0.221	S	C	.	.	H	α-helix	trans	-77.2	-27.1	-179	-65.1	-55.3	-27	0	0	113.8	R42 E236 A237 V238	R42-Q240 WeakPolarHBondContact CD-O 3.3Å; R42-Q240 WeakPolarHBondContact CG-O 3.41Å; R42-Q240 PolarHBondContact NH1-O 3.34Å; E236-Q240 HydrophobicContact CG-CG 4.37Å; E236-Q240 WeakPolarHBondContact O-CG 3.31Å; E236-Q240 PolarHBondContact O-N 3.32Å; E236-Q240 WeakPolarHBondContact OE1-CG 3.19Å; E236-Q240 PolarHBondContact OE1-NE2 3.31Å; A237-Q240 PolarHBondContact O-N 3.04Å; V238-Q240 VanDerWaalsContact C-N 3.31Å; V238-Q240 PolarHBondContact O-N 3.45Å
241	S	98	Very high	97.3	Very high	70 Å²	70	39.6 Å²	39.6	49%	0.49	23%	0.234	S	C	.	.	H	α-helix	trans	-99.1	-26.4	-175.9	58.9	0	0	0	0	114.6	A237 V238 R243	A237-S241 WeakPolarHBondContact O-CB 3.37Å; A237-S241 PolarHBondContact O-N 3.13Å; A237-S241 VanDerWaalsContact O-N 3.13Å; A237-S241 PolarHBondContact O-OG 2.85Å; V238-S241 PolarHBondContact O-N 3.19Å; V238-S241 PolarHBondContact O-OG 3.03Å; S241-R243 PolarHBondContact O-N 2.68Å
242	T	98.6	Very high	97.2	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	22%	0.222	C	C	.	.	S	Bend	trans	-69	128.2	-179.7	-58.2	0	0	0	0	110	R42 W195 R227 L230 V238	R42-T242 VanDerWaalsContact CD-O 3.26Å; R42-T242 WeakPolarHBondContact CD-O 3.31Å; W195-T242 HydrophobicContact CE3-CG2 4.04Å; W195-T242 HydrophobicContact CZ3-CG2 4.3Å; R227-T242 PolarHBondContact NH1-O 3.25Å; L230-T242 HydrophobicContact CD1-CG2 4.04Å; V238-T242 WeakPolarHBondContact CG1-OG1 3.28Å; V238-T242 VanDerWaalsContact O-CB 3.23Å; V238-T242 WeakPolarHBondContact O-CB 3.32Å; V238-T242 PolarHBondContact O-N 3.01Å; V238-T242 PolarHBondContact O-OG1 3.44Å
243	R	98.9	Very high	97.1	Very high	26 Å²	26	35.2 Å²	35.2	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.5	172.3	-64.8	149.2	-62.5	172.4	4.3	108.8	R42 K43 E76 V198 V199 L200 S241 D265	R42-R243 HydrophobicContact CB-CG 4.24Å; K43-R243 WeakPolarHBondContact O-CD 3.4Å; E76-R243 IonicContact OE2-NH1 2.79Å; E76-R243 PolarHBondContact OE2-NH1 3.04Å; V198-R243 PolarHBondContact O-NH2 2.64Å; V199-R243 HydrophobicContact CG1-CB 4.35Å; V199-R243 HydrophobicContact CG2-CB 4.45Å; L200-R243 PolarHBondContact N-O 3.47Å; S241-R243 PolarHBondContact O-N 2.68Å; R243-D265 WeakPolarHBondContact CA-OD2 3.48Å; R243-D265 HydrophobicContact CB-CB 3.91Å; R243-D265 HydrophobicContact CG-CB 4.22Å
244	I	98.9	Very high	96.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111	171.1	-47.7	178.2	0	0	0	107.1	L200 H223 L226 R227 L230 D265	L200-I244 HydrophobicContact CB-CG2 4.43Å; L200-I244 CarbonylContact O-C 3.58Å; L200-I244 WeakPolarHBondContact O-CA 3.5Å; H223-I244 HydrophobicContact CB-CG2 4.47Å; H223-I244 VanDerWaalsContact CE1-C 3.5Å; H223-I244 PolarHBondContact CE1-O 3.06Å; H223-I244 WeakPolarHBondContact ND1-CG2 3.28Å; H223-I244 PolarHBondContact ND1-O 2.78Å; H223-I244 VanDerWaalsContact ND1-O 3.17Å; L226-I244 HydrophobicContact CB-CD1 3.92Å; L226-I244 HydrophobicContact CD1-CG2 4.18Å; R227-I244 HydrophobicContact CB-CD1 4.09Å; L230-I244 HydrophobicContact CD1-CD1 4.32Å; I244-D265 PolarHBondContact N-OD2 3.14Å; I244-D265 WeakPolarHBondContact O-CB 2.91Å; I244-D265 PolarHBondContact O-N 2.63Å
245	I	98.9	Very high	96.9	Very high	0 Å²	0	30 Å²	30	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	146.5	-177.7	66.6	177.2	0	0	0	110.6	F45 I162 V199 L200 A201 Y202 H223 G266 L268	F45-I245 HydrophobicContact CB-CG2 3.99Å; F45-I245 HydrophobicContact CD1-CD1 3.82Å; F45-I245 HydrophobicContact CD1-CG2 4.03Å; F45-I245 HydrophobicContact CE1-CD1 3.99Å; F45-I245 HydrophobicContact CG-CG2 4.39Å; I162-I245 HydrophobicContact CG2-CD1 4.19Å; V199-I245 HydrophobicContact CG1-CB 4.42Å; V199-I245 HydrophobicContact CG1-CD1 3.7Å; V199-I245 HydrophobicContact CG1-CG1 3.81Å; V199-I245 HydrophobicContact CG1-CG2 3.84Å; L200-I245 PolarHBondContact O-N 2.99Å; A201-I245 CarbonylContact C-O 3.42Å; A201-I245 WeakPolarHBondContact CA-O 3.25Å; A201-I245 HydrophobicContact CB-CD1 4Å; A201-I245 HydrophobicContact CB-CG1 3.68Å; Y202-I245 PolarHBondContact N-O 3.33Å; H223-I245 VanDerWaalsContact CE1-C 3.47Å; I245-G266 WeakPolarHBondContact CA-O 3.16Å; I245-G266 WeakPolarHBondContact CB-O 3.31Å; I245-L268 HydrophobicContact CD1-CB 3.83Å; I245-L268 HydrophobicContact CG1-CB 4.44Å
246	Y	98.8	Very high	96.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136	177	170.6	-98.6	0	0	0	110.5	Y202 P204 T213 A214 A219 G248 V250 L258 G266 F267 L268	Y202-Y246 HydrophobicContact CD1-CD2 4.19Å; Y202-Y246 HydrophobicContact CE1-CD2 4.43Å; Y202-Y246 WeakPolarHBondContact O-CA 3.46Å; P204-Y246 HydrophobicContact CG-CE2 4.15Å; T213-Y246 HydrophobicContact CG2-CE1 4.09Å; A214-Y246 HydrophobicContact CB-CE2 3.71Å; A214-Y246 WeakPolarHBondContact CB-OH 3.37Å; A214-Y246 PolarHBondContact N-OH 3.39Å; A219-Y246 HydrophobicContact CB-CD2 3.85Å; A219-Y246 HydrophobicContact CB-CE2 4.27Å; A219-Y246 HydrophobicContact CB-CG 4.28Å; Y246-G248 VanDerWaalsContact CE1-O 3.31Å; Y246-G248 WeakPolarHBondContact CE1-O 3.47Å; Y246-G248 PolarHBondContact OH-O 2.95Å; Y246-V250 HydrophobicContact CD1-CG2 3.54Å; Y246-V250 HydrophobicContact CE1-CG2 3.57Å; Y246-L258 HydrophobicContact CD1-CD1 4.01Å; Y246-L258 HydrophobicContact CD1-CD2 4.28Å; Y246-L258 HydrophobicContact CE1-CD1 3.94Å; Y246-L258 HydrophobicContact CE1-CD2 4.36Å; Y246-G266 PolarHBondContact N-O 3.09Å; Y246-F267 HydrophobicContact CD1-CD1 4.3Å; Y246-F267 CarbonylContact O-C 3.44Å; Y246-F267 WeakPolarHBondContact O-CA 3.03Å; Y246-L268 PolarHBondContact O-N 3.41Å
247	G	96.4	Very high	96.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.8	169.2	0	0	0	0	0	112.1	Y202 E203 L268	Y202-G247 PolarHBondContact O-N 3.24Å; E203-G247 WeakPolarHBondContact CA-O 3.37Å; G247-L268 VanDerWaalsContact CA-O 3.31Å; G247-L268 WeakPolarHBondContact CA-O 3.24Å
248	G	89.3	Confident	96.8	Very high	6 Å²	6	32 Å²	32	6%	0.062	19%	0.189	C	C	.	.	S	Bend	trans	121.8	100.9	-175	0	0	0	0	0	112.4	A207 Y246 V250	A207-G248 CarbonylContact O-C 3.4Å; A207-G248 VanDerWaalsContact O-C 3.27Å; A207-G248 VanDerWaalsContact O-CA 3.3Å; A207-G248 WeakPolarHBondContact O-CA 3.28Å; Y246-G248 VanDerWaalsContact CE1-O 3.31Å; Y246-G248 WeakPolarHBondContact CE1-O 3.47Å; Y246-G248 PolarHBondContact OH-O 2.95Å; G248-V250 PolarHBondContact O-N 3.37Å; G248-V250 VanDerWaalsContact O-N 3.14Å
249	S	91.7	Very high	96.8	Very high	25 Å²	25	31.3 Å²	31.3	18%	0.175	19%	0.186	C	C	.	.	S	Bend	trans	52.2	35.1	176.3	-58	0	0	0	0	114.9	A207 G211 K212 T213	A207-S249 WeakPolarHBondContact O-CB 3.45Å; A207-S249 PolarHBondContact O-N 3.42Å; A207-S249 VanDerWaalsContact O-N 3.14Å; A207-S249 PolarHBondContact O-OG 3.4Å; G211-S249 PolarHBondContact N-OG 2.74Å; K212-S249 PolarHBondContact O-OG 3.4Å; T213-S249 VanDerWaalsContact OG1-CB 3.25Å; T213-S249 WeakPolarHBondContact OG1-CB 3.41Å; T213-S249 PolarHBondContact OG1-O 3.47Å
250	V	95.2	Very high	96.7	Very high	7 Å²	7	35.1 Å²	35.1	4%	0.042	21%	0.212	C	C	.	.			trans	-69.9	131.8	168.4	-177.1	0	0	0	0	109.3	Y246 G248 C255 L258 F267 V269 I281	Y246-V250 HydrophobicContact CD1-CG2 3.54Å; Y246-V250 HydrophobicContact CE1-CG2 3.57Å; G248-V250 PolarHBondContact O-N 3.37Å; G248-V250 VanDerWaalsContact O-N 3.14Å; V250-C255 HydrophobicContact CG1-CB 4.12Å; V250-L258 HydrophobicContact CG2-CD1 4.38Å; V250-F267 HydrophobicContact CG1-CB 4.36Å; V250-F267 HydrophobicContact CG1-CD1 4.01Å; V250-F267 HydrophobicContact CG1-CD2 4.21Å; V250-F267 HydrophobicContact CG1-CE1 4.4Å; V250-F267 HydrophobicContact CG1-CG 3.92Å; V250-F267 HydrophobicContact CG2-CB 4.45Å; V250-F267 HydrophobicContact CG2-CD1 3.83Å; V250-F267 HydrophobicContact CG2-CE1 4.47Å; V250-F267 HydrophobicContact CG2-CG 4.3Å; V250-V269 HydrophobicContact CB-CG2 4.45Å; V250-V269 HydrophobicContact CG1-CG2 4.44Å; V250-I281 HydrophobicContact CG1-CD1 4.25Å; V250-I281 HydrophobicContact CG1-CG1 4.49Å; V250-I281 HydrophobicContact CG1-CG2 4.06Å
251	T	96.4	Very high	96.7	Very high	46 Å²	46	33.4 Å²	33.4	28%	0.282	20%	0.204	S	C	.	.			trans	-132.9	169.8	176.6	68.6	0	0	0	0	110	A253 T254 C255	T251-A253 PolarHBondContact O-N 3.31Å; T251-A253 PolarHBondContact OG1-N 3.01Å; T251-T254 PolarHBondContact N-OG1 3.4Å; T251-T254 VanDerWaalsContact N-OG1 3.1Å; T251-T254 PolarHBondContact O-N 3.12Å; T251-T254 PolarHBondContact O-OG1 2.88Å; T251-T254 PolarHBondContact OG1-N 3.33Å; T251-T254 PolarHBondContact OG1-OG1 2.88Å; T251-C255 WeakPolarHBondContact O-CB 3.5Å; T251-C255 PolarHBondContact O-N 3.44Å
252	G	96.4	Very high	96.7	Very high	22 Å²	22	34.3 Å²	34.3	23%	0.227	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-25.5	173.7	0	0	0	0	0	113.3	C255	G252-C255 PolarHBondContact O-SG 3.01Å; G252-C255 VanDerWaalsContact O-SG 3.34Å
253	A	95.4	Very high	96.7	Very high	94 Å²	94	35.3 Å²	35.3	78%	0.777	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-29.7	178.8	0	0	0	0	0	113.5	T251	T251-A253 PolarHBondContact O-N 3.31Å; T251-A253 PolarHBondContact OG1-N 3.01Å
254	T	95.3	Very high	96.7	Very high	42 Å²	42	34 Å²	34	26%	0.258	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-17.8	-175	59.2	0	0	0	0	113.6	T251 K256 E257 L258	T251-T254 PolarHBondContact N-OG1 3.4Å; T251-T254 VanDerWaalsContact N-OG1 3.1Å; T251-T254 PolarHBondContact O-N 3.12Å; T251-T254 PolarHBondContact O-OG1 2.88Å; T251-T254 PolarHBondContact OG1-N 3.33Å; T251-T254 PolarHBondContact OG1-OG1 2.88Å; T254-K256 PolarHBondContact O-N 3.4Å; T254-E257 PolarHBondContact O-N 3.13Å; T254-L258 PolarHBondContact O-N 3.25Å
255	C	97.4	Very high	96.7	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.007	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-38.1	-170.6	65.2	0	0	0	0	113.7	V250 T251 G252 L258 A259 F267 I281 A284	V250-C255 HydrophobicContact CG1-CB 4.12Å; T251-C255 WeakPolarHBondContact O-CB 3.5Å; T251-C255 PolarHBondContact O-N 3.44Å; G252-C255 PolarHBondContact O-SG 3.01Å; G252-C255 VanDerWaalsContact O-SG 3.34Å; C255-L258 PolarHBondContact O-N 3.13Å; C255-A259 WeakPolarHBondContact O-CB 3.42Å; C255-A259 PolarHBondContact O-N 2.63Å; C255-F267 HydrophobicContact CB-CE2 3.8Å; C255-F267 HydrophobicContact CB-CZ 4.19Å; C255-F267 VanDerWaalsContact O-CZ 3.27Å; C255-F267 WeakPolarHBondContact O-CZ 3.46Å; C255-I281 HydrophobicContact CB-CB 4.39Å; C255-I281 HydrophobicContact CB-CG1 4.12Å; C255-I281 HydrophobicContact CB-CG2 4.11Å; C255-A284 HydrophobicContact CB-CB 3.91Å
256	K	97.8	Very high	96.6	Very high	120 Å²	120	34.3 Å²	34.3	52%	0.522	21%	0.21	S	C	.	.	H	α-helix	trans	-66.3	-43.1	-177.1	-64.7	-156.7	176	-147.9	0	112.4	T254 A259 S260 Q286	T254-K256 PolarHBondContact O-N 3.4Å; K256-A259 PolarHBondContact O-N 3.39Å; K256-S260 PolarHBondContact O-N 3.11Å; K256-S260 VanDerWaalsContact O-N 3.09Å; K256-Q286 PolarHBondContact NZ-O 3.49Å
257	E	97.1	Very high	96.7	Very high	117 Å²	117	34.3 Å²	34.3	55%	0.547	21%	0.21	S	C	.	.	H	α-helix	trans	-67.9	-40.9	180	-159.5	-173.3	167.5	0	0	111.1	P216 T254 S260	P216-E257 HydrophobicContact CB-CG 4.45Å; P216-E257 HydrophobicContact CG-CB 4.15Å; P216-E257 HydrophobicContact CG-CG 3.63Å; T254-E257 PolarHBondContact O-N 3.13Å; E257-S260 PolarHBondContact O-N 2.87Å; E257-S260 PolarHBondContact O-OG 3.34Å
258	L	97.4	Very high	96.8	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-43.8	173.6	-72.9	162.2	0	0	0	112.2	T213 P216 A219 Y246 V250 T254 C255 S260 Q261 F267	T213-L258 HydrophobicContact CG2-CD1 4.09Å; P216-L258 HydrophobicContact CB-CD2 4.42Å; P216-L258 HydrophobicContact CG-CD2 4.38Å; A219-L258 HydrophobicContact CB-CD2 4.02Å; Y246-L258 HydrophobicContact CD1-CD1 4.01Å; Y246-L258 HydrophobicContact CD1-CD2 4.28Å; Y246-L258 HydrophobicContact CE1-CD1 3.94Å; Y246-L258 HydrophobicContact CE1-CD2 4.36Å; V250-L258 HydrophobicContact CG2-CD1 4.38Å; T254-L258 PolarHBondContact O-N 3.25Å; C255-L258 PolarHBondContact O-N 3.13Å; L258-S260 PolarHBondContact O-N 3.14Å; L258-Q261 WeakPolarHBondContact O-CB 3.16Å; L258-Q261 WeakPolarHBondContact O-CG 3.42Å; L258-Q261 PolarHBondContact O-N 2.68Å; L258-F267 HydrophobicContact CB-CE1 3.65Å; L258-F267 HydrophobicContact CB-CZ 3.81Å; L258-F267 HydrophobicContact CD1-CE1 4.28Å
259	A	97.7	Very high	97.2	Very high	6 Å²	6	34.2 Å²	34.2	5%	0.05	21%	0.208	C	C	.	.	H	α-helix	trans	-69.9	-15.2	-179.2	0	0	0	0	0	113.5	F44 C255 K256 F267 A284 K285	F44-A259 HydrophobicContact CE2-CB 4.02Å; F44-A259 HydrophobicContact CZ-CB 3.8Å; C255-A259 WeakPolarHBondContact O-CB 3.42Å; C255-A259 PolarHBondContact O-N 2.63Å; K256-A259 PolarHBondContact O-N 3.39Å; A259-F267 HydrophobicContact CB-CE2 4.12Å; A259-F267 HydrophobicContact CB-CZ 3.84Å; A259-A284 HydrophobicContact CB-CB 3.95Å; A259-K285 HydrophobicContact CB-CG 4.14Å; A259-K285 VanDerWaalsContact O-CE 3.25Å; A259-K285 WeakPolarHBondContact O-CE 3.34Å
260	S	97.2	Very high	97.5	Very high	81 Å²	81	34 Å²	34	57%	0.566	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-16	174.4	76.9	0	0	0	0	113.2	K256 E257 L258	K256-S260 PolarHBondContact O-N 3.11Å; K256-S260 VanDerWaalsContact O-N 3.09Å; E257-S260 PolarHBondContact O-N 2.87Å; E257-S260 PolarHBondContact O-OG 3.34Å; L258-S260 PolarHBondContact O-N 3.14Å
261	Q	98.3	Very high	97.6	Very high	34 Å²	34	36.1 Å²	36.1	16%	0.159	23%	0.233	C	C	.	.	S	Bend	trans	-74.2	132.4	178.3	-58.5	-55.3	-55.2	0	0	110.7	P216 Q220 L258 D263 V264	P216-Q261 HydrophobicContact CB-CG 3.81Å; Q220-Q261 HydrophobicContact CB-CB 4.08Å; Q220-Q261 HydrophobicContact CB-CG 4.08Å; L258-Q261 WeakPolarHBondContact O-CB 3.16Å; L258-Q261 WeakPolarHBondContact O-CG 3.42Å; L258-Q261 PolarHBondContact O-N 2.68Å; Q261-D263 VanDerWaalsContact C-N 3.3Å; Q261-D263 PolarHBondContact O-N 3.26Å; Q261-V264 HydrophobicContact CB-CB 4.07Å; Q261-V264 HydrophobicContact CB-CG2 3.67Å; Q261-V264 HydrophobicContact CG-CG2 4.4Å; Q261-V264 PolarHBondContact O-N 3.47Å
262	P	97.5	Very high	97.6	Very high	88 Å²	88	34.3 Å²	34.3	57%	0.571	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-27.2	-169.1	24.9	-35.1	0	0	0	114.5	R42 Q220	R42-P262 PolarHBondContact NH2-O 3.07Å; Q220-P262 VanDerWaalsContact OE1-CD 3.28Å
263	D	98.4	Very high	97.7	Very high	23 Å²	23	33.2 Å²	33.2	12%	0.123	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.4	-179.6	-66.4	-82	0	0	0	113.4	Q220 H223 R227 Q261 D265	Q220-D263 PolarHBondContact NE2-OD2 3.26Å; H223-D263 HydrophobicContact CB-CB 3.72Å; H223-D263 PolarHBondContact ND1-O 3.38Å; R227-D263 VanDerWaalsContact CD-OD1 3.31Å; R227-D263 WeakPolarHBondContact CD-OD1 3.42Å; R227-D263 IonicContact CZ-OD1 2.74Å; R227-D263 IonicContact NE-OD1 2.68Å; R227-D263 PolarHBondContact NE-OD1 2.67Å; R227-D263 PolarHBondContact NH2-O 3.39Å; R227-D263 IonicContact NH2-OD1 3.1Å; Q261-D263 VanDerWaalsContact C-N 3.3Å; Q261-D263 PolarHBondContact O-N 3.26Å; D263-D265 PolarHBondContact O-N 2.97Å
264	V	98.6	Very high	97.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.189	C	C	.	.			trans	-89.8	101.6	173.3	179.8	0	0	0	0	109.4	A219 Q261 G266 F267	A219-V264 HydrophobicContact CB-CG2 4.33Å; Q261-V264 HydrophobicContact CB-CB 4.07Å; Q261-V264 HydrophobicContact CB-CG2 3.67Å; Q261-V264 HydrophobicContact CG-CG2 4.4Å; Q261-V264 PolarHBondContact O-N 3.47Å; V264-G266 VanDerWaalsContact C-N 3.29Å; V264-G266 PolarHBondContact O-N 3.11Å; V264-F267 HydrophobicContact CG1-CE1 4.04Å
265	D	98.8	Very high	97.9	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.027	20%	0.199	C	C	.	.			trans	-89.1	5.8	-174.9	-58.6	-47.9	0	0	0	113.2	R42 F44 F45 R227 R243 I244 D263	R42-D265 WeakPolarHBondContact CD-OD2 3.3Å; R42-D265 IonicContact CZ-OD1 3.86Å; R42-D265 VanDerWaalsContact NE-CG 3.28Å; R42-D265 IonicContact NE-OD1 2.67Å; R42-D265 PolarHBondContact NE-OD1 3.16Å; R42-D265 IonicContact NE-OD2 2.72Å; R42-D265 PolarHBondContact NE-OD2 3.21Å; R42-D265 IonicContact NH2-OD1 3.2Å; F44-D265 CarbonylContact C-O 3.51Å; F44-D265 WeakPolarHBondContact CA-O 3.18Å; F44-D265 VanDerWaalsContact CD2-O 3.24Å; F44-D265 WeakPolarHBondContact CD2-O 3.48Å; F45-D265 PolarHBondContact N-O 3.32Å; R227-D265 IonicContact CZ-OD2 2.9Å; R227-D265 IonicContact NH1-OD2 3.49Å; R227-D265 IonicContact NH2-OD1 2.64Å; R227-D265 IonicContact NH2-OD2 3.31Å; R227-D265 PolarHBondContact NH2-OD2 3.23Å; R243-D265 WeakPolarHBondContact CA-OD2 3.48Å; R243-D265 HydrophobicContact CB-CB 3.91Å; R243-D265 HydrophobicContact CG-CB 4.22Å; I244-D265 PolarHBondContact N-OD2 3.14Å; I244-D265 WeakPolarHBondContact O-CB 2.91Å; I244-D265 PolarHBondContact O-N 2.63Å; D263-D265 PolarHBondContact O-N 2.97Å
266	G	98.8	Very high	97.8	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.4	-158.4	179.9	0	0	0	0	0	114.2	F45 I245 Y246 V264	F45-G266 CarbonylContact O-C 3.34Å; F45-G266 WeakPolarHBondContact O-CA 3.17Å; I245-G266 WeakPolarHBondContact CA-O 3.16Å; I245-G266 WeakPolarHBondContact CB-O 3.31Å; Y246-G266 PolarHBondContact N-O 3.09Å; V264-G266 VanDerWaalsContact C-N 3.29Å; V264-G266 PolarHBondContact O-N 3.11Å
267	F	98.9	Very high	97.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.6	-168.8	-54.8	-59	0	0	0	114.8	F44 F45 V46 G47 Y246 V250 C255 L258 A259 V264 V269 I281 A284	F44-F267 HydrophobicContact CE1-CD2 4.38Å; F44-F267 HydrophobicContact CE1-CE2 4.27Å; F44-F267 AromaticContact CZ-CD2 3.96Å; F44-F267 HydrophobicContact CZ-CD2 3.96Å; F44-F267 AromaticContact CZ-CE2 3.59Å; F44-F267 HydrophobicContact CZ-CE2 3.59Å; F44-F267 HydrophobicContact CZ-CZ 4.25Å; F45-F267 PolarHBondContact O-N 3.05Å; V46-F267 WeakPolarHBondContact CA-O 3.47Å; V46-F267 HydrophobicContact CG2-CD2 4.46Å; G47-F267 PolarHBondContact N-O 3.46Å; Y246-F267 HydrophobicContact CD1-CD1 4.3Å; Y246-F267 CarbonylContact O-C 3.44Å; Y246-F267 WeakPolarHBondContact O-CA 3.03Å; V250-F267 HydrophobicContact CG1-CB 4.36Å; V250-F267 HydrophobicContact CG1-CD1 4.01Å; V250-F267 HydrophobicContact CG1-CD2 4.21Å; V250-F267 HydrophobicContact CG1-CE1 4.4Å; V250-F267 HydrophobicContact CG1-CG 3.92Å; V250-F267 HydrophobicContact CG2-CB 4.45Å; V250-F267 HydrophobicContact CG2-CD1 3.83Å; V250-F267 HydrophobicContact CG2-CE1 4.47Å; V250-F267 HydrophobicContact CG2-CG 4.3Å; C255-F267 HydrophobicContact CB-CE2 3.8Å; C255-F267 HydrophobicContact CB-CZ 4.19Å; C255-F267 VanDerWaalsContact O-CZ 3.27Å; C255-F267 WeakPolarHBondContact O-CZ 3.46Å; L258-F267 HydrophobicContact CB-CE1 3.65Å; L258-F267 HydrophobicContact CB-CZ 3.81Å; L258-F267 HydrophobicContact CD1-CE1 4.28Å; A259-F267 HydrophobicContact CB-CE2 4.12Å; A259-F267 HydrophobicContact CB-CZ 3.84Å; V264-F267 HydrophobicContact CG1-CE1 4.04Å; F267-V269 HydrophobicContact CB-CG2 3.75Å; F267-I281 HydrophobicContact CB-CG2 4.39Å; F267-I281 HydrophobicContact CD2-CG2 3.5Å; F267-I281 VanDerWaalsContact CD2-CG2 3.5Å; F267-I281 HydrophobicContact CE2-CG2 4.16Å; F267-I281 HydrophobicContact CG-CG2 4.23Å; F267-A284 HydrophobicContact CE2-CB 3.92Å
268	L	98.8	Very high	97.9	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.9	158.4	-169	57	0	0	0	109.2	N49 I162 A201 E203 I245 Y246 G247	N49-L268 HydrophobicContact CB-CD1 4.23Å; I162-L268 HydrophobicContact CG2-CD2 4.1Å; A201-L268 HydrophobicContact CB-CB 4.39Å; A201-L268 HydrophobicContact CB-CD2 3.89Å; E203-L268 WeakPolarHBondContact OE2-CD2 3.45Å; I245-L268 HydrophobicContact CD1-CB 3.83Å; I245-L268 HydrophobicContact CG1-CB 4.44Å; Y246-L268 PolarHBondContact O-N 3.41Å; G247-L268 VanDerWaalsContact CA-O 3.31Å; G247-L268 WeakPolarHBondContact CA-O 3.24Å
269	V	98.6	Very high	97.9	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.9	-166.3	-172	0	0	0	0	110.2	V46 G47 G48 N49 V250 F267 A272 S273 F278 I281	V46-V269 HydrophobicContact CG1-CG2 4.4Å; G47-V269 PolarHBondContact O-N 2.83Å; G48-V269 CarbonylContact C-O 3.55Å; N49-V269 PolarHBondContact N-O 2.87Å; V250-V269 HydrophobicContact CB-CG2 4.45Å; V250-V269 HydrophobicContact CG1-CG2 4.44Å; F267-V269 HydrophobicContact CB-CG2 3.75Å; V269-A272 HydrophobicContact CG1-CB 3.62Å; V269-S273 WeakPolarHBondContact O-CB 3.25Å; V269-S273 PolarHBondContact O-OG 2.84Å; V269-F278 HydrophobicContact CB-CD2 4.15Å; V269-F278 HydrophobicContact CB-CE2 3.82Å; V269-F278 HydrophobicContact CG1-CD2 4.16Å; V269-F278 HydrophobicContact CG1-CE2 4.34Å; V269-F278 HydrophobicContact CG2-CD2 4.26Å; V269-F278 HydrophobicContact CG2-CE2 3.84Å; V269-I281 HydrophobicContact CG1-CD1 3.9Å; V269-I281 HydrophobicContact CG2-CD1 4.3Å; V269-I281 HydrophobicContact CG2-CG2 3.95Å
270	G	97.6	Very high	97.9	Very high	20 Å²	20	35.6 Å²	35.6	21%	0.206	22%	0.217	C	C	.	.	S	Bend	trans	-82.4	-107.4	174.1	0	0	0	0	0	112.4	A272 S273	G270-A272 VanDerWaalsContact C-N 3.29Å; G270-A272 PolarHBondContact O-N 3.3Å; G270-A272 VanDerWaalsContact O-N 3.16Å; G270-S273 VanDerWaalsContact O-CB 3.31Å; G270-S273 WeakPolarHBondContact O-CB 3.48Å; G270-S273 PolarHBondContact O-N 3.28Å; G270-S273 PolarHBondContact O-OG 2.84Å
271	G	96.6	Very high	98	Very high	51 Å²	51	31.7 Å²	31.7	53%	0.526	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-58	-32.1	-171	0	0	0	0	0	115.8	S273 L274	G271-S273 PolarHBondContact O-N 3.15Å; G271-L274 PolarHBondContact O-N 2.67Å
272	A	97.6	Very high	98	Very high	8 Å²	8	30.2 Å²	30.2	7%	0.066	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-69.9	-20.8	176.2	0	0	0	0	0	113	V269 G270 L274 K275 E277 I281	V269-A272 HydrophobicContact CG1-CB 3.62Å; G270-A272 VanDerWaalsContact C-N 3.29Å; G270-A272 PolarHBondContact O-N 3.3Å; G270-A272 VanDerWaalsContact O-N 3.16Å; A272-L274 PolarHBondContact O-N 3.13Å; A272-K275 PolarHBondContact O-N 2.93Å; A272-E277 HydrophobicContact CB-CG 4.1Å; A272-E277 WeakPolarHBondContact CB-OE1 3.49Å; A272-I281 HydrophobicContact CB-CD1 3.87Å
273	S	98.4	Very high	98	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-69.9	-13.4	176.4	73.2	0	0	0	0	114	V269 G270 G271 K275	V269-S273 WeakPolarHBondContact O-CB 3.25Å; V269-S273 PolarHBondContact O-OG 2.84Å; G270-S273 VanDerWaalsContact O-CB 3.31Å; G270-S273 WeakPolarHBondContact O-CB 3.48Å; G270-S273 PolarHBondContact O-N 3.28Å; G270-S273 PolarHBondContact O-OG 2.84Å; G271-S273 PolarHBondContact O-N 3.15Å; S273-K275 VanDerWaalsContact C-N 3.33Å
274	L	97.9	Very high	97.9	Very high	57 Å²	57	27 Å²	27	30%	0.298	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-93.4	6.9	176.8	-60.5	172.2	0	0	0	112.5	W50 N53 L62 G271 A272	W50-L274 HydrophobicContact CB-CD2 3.83Å; W50-L274 HydrophobicContact CD2-CD2 4.47Å; W50-L274 HydrophobicContact CG-CD2 3.79Å; N53-L274 HydrophobicContact CB-CD1 3.59Å; N53-L274 HydrophobicContact CB-CD2 4.28Å; L62-L274 HydrophobicContact CD2-CD2 4.22Å; G271-L274 PolarHBondContact O-N 2.67Å; A272-L274 PolarHBondContact O-N 3.13Å
275	K	97.1	Very high	97.7	Very high	106 Å²	106	31.6 Å²	31.6	46%	0.461	18%	0.182	S	C	.	.	S	Bend	trans	-128.8	160.2	-172.6	-62.3	179.8	-167.7	171.1	0	110.9	A272 S273 E277 F278	A272-K275 PolarHBondContact O-N 2.93Å; S273-K275 VanDerWaalsContact C-N 3.33Å; K275-E277 HydrophobicContact CB-CG 3.92Å; K275-E277 HydrophobicContact CD-CG 4.33Å; K275-E277 WeakPolarHBondContact CD-OE1 3.49Å; K275-E277 IonicContact NZ-OE1 3.91Å; K275-E277 PolarHBondContact NZ-OE1 2.74Å; K275-E277 PolarHBondContact O-N 3.29Å; K275-F278 WeakPolarHBondContact O-CB 3.46Å; K275-F278 PolarHBondContact O-N 2.84Å; K275-F278 VanDerWaalsContact O-N 3.09Å
276	P	95.9	Very high	97.1	Very high	96 Å²	96	38 Å²	38	62%	0.623	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.5	176	-26.8	35.9	0	0	0	114.1	F278 V279	P276-F278 PolarHBondContact O-N 3.2Å; P276-V279 WeakPolarHBondContact O-CB 3.48Å; P276-V279 PolarHBondContact O-N 3Å
277	E	96.9	Very high	97.1	Very high	52 Å²	52	39.9 Å²	39.9	24%	0.243	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-14.2	178.1	68.8	-177.9	-179	0	0	113.7	A272 K275 V279 D280 I281	A272-E277 HydrophobicContact CB-CG 4.1Å; A272-E277 WeakPolarHBondContact CB-OE1 3.49Å; K275-E277 HydrophobicContact CB-CG 3.92Å; K275-E277 HydrophobicContact CD-CG 4.33Å; K275-E277 WeakPolarHBondContact CD-OE1 3.49Å; K275-E277 IonicContact NZ-OE1 3.91Å; K275-E277 PolarHBondContact NZ-OE1 2.74Å; K275-E277 PolarHBondContact O-N 3.29Å; E277-V279 PolarHBondContact O-N 3.48Å; E277-D280 WeakPolarHBondContact O-CB 3.28Å; E277-D280 PolarHBondContact O-N 3.01Å; E277-I281 WeakPolarHBondContact O-CG1 3.03Å; E277-I281 PolarHBondContact O-N 3.21Å
278	F	98.4	Very high	97	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.6	-31	171.4	-168	-133.9	0	0	0	112.4	V46 L66 V77 V269 K275 P276 D280 I281 I282	V46-F278 HydrophobicContact CG1-CD2 4.42Å; V46-F278 HydrophobicContact CG1-CE2 3.48Å; V46-F278 VanDerWaalsContact CG1-CE2 3.48Å; V46-F278 HydrophobicContact CG1-CZ 3.78Å; L66-F278 HydrophobicContact CD2-CD1 3.76Å; L66-F278 HydrophobicContact CD2-CE1 4.41Å; V77-F278 HydrophobicContact CG1-CE1 4.41Å; V269-F278 HydrophobicContact CB-CD2 4.15Å; V269-F278 HydrophobicContact CB-CE2 3.82Å; V269-F278 HydrophobicContact CG1-CD2 4.16Å; V269-F278 HydrophobicContact CG1-CE2 4.34Å; V269-F278 HydrophobicContact CG2-CD2 4.26Å; V269-F278 HydrophobicContact CG2-CE2 3.84Å; K275-F278 WeakPolarHBondContact O-CB 3.46Å; K275-F278 PolarHBondContact O-N 2.84Å; K275-F278 VanDerWaalsContact O-N 3.09Å; P276-F278 PolarHBondContact O-N 3.2Å; F278-D280 VanDerWaalsContact C-N 3.32Å; F278-I281 HydrophobicContact CD2-CB 4.47Å; F278-I281 HydrophobicContact CD2-CD1 4.44Å; F278-I281 PolarHBondContact O-N 3.27Å; F278-I282 HydrophobicContact CD1-CD1 3.98Å; F278-I282 HydrophobicContact CE1-CD1 3.93Å; F278-I282 HydrophobicContact CE1-CG1 4.46Å; F278-I282 HydrophobicContact CG-CD1 4.48Å; F278-I282 HydrophobicContact CZ-CD1 4.42Å; F278-I282 HydrophobicContact CZ-CG1 4.47Å; F278-I282 WeakPolarHBondContact O-CG1 3.22Å; F278-I282 PolarHBondContact O-N 3.45Å
279	V	97.8	Very high	96.9	Very high	27 Å²	27	44.1 Å²	44.1	16%	0.164	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-37.8	174.3	177.4	0	0	0	0	111.1	T65 L66 A69 P276 E277 I281 I282 N283	T65-V279 HydrophobicContact CG2-CG2 4.42Å; L66-V279 HydrophobicContact CD2-CG2 4.27Å; A69-V279 HydrophobicContact CB-CB 4.38Å; A69-V279 HydrophobicContact CB-CG1 3.76Å; A69-V279 HydrophobicContact CB-CG2 3.66Å; P276-V279 WeakPolarHBondContact O-CB 3.48Å; P276-V279 PolarHBondContact O-N 3Å; E277-V279 PolarHBondContact O-N 3.48Å; V279-I281 VanDerWaalsContact C-N 3.3Å; V279-I281 PolarHBondContact O-N 3.37Å; V279-I282 PolarHBondContact O-N 2.86Å; V279-N283 PolarHBondContact O-N 3.23Å; V279-N283 VanDerWaalsContact O-N 3.14Å; V279-N283 PolarHBondContact O-ND2 2.95Å
280	D	97.9	Very high	96.8	Very high	94 Å²	94	46.6 Å²	46.6	50%	0.503	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-37.2	175.6	-56	-42.4	0	0	0	110.8	E277 F278 N283 A284	E277-D280 WeakPolarHBondContact O-CB 3.28Å; E277-D280 PolarHBondContact O-N 3.01Å; F278-D280 VanDerWaalsContact C-N 3.32Å; D280-N283 CarbonylContact O-C 3.56Å; D280-N283 PolarHBondContact O-N 3.23Å; D280-A284 PolarHBondContact O-N 2.93Å
281	I	98.4	Very high	96.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-40	176.6	-57.7	167.7	0	0	0	111.6	V46 V250 C255 F267 V269 A272 E277 F278 V279 N283 A284	V46-I281 HydrophobicContact CG1-CG2 4.11Å; V250-I281 HydrophobicContact CG1-CD1 4.25Å; V250-I281 HydrophobicContact CG1-CG1 4.49Å; V250-I281 HydrophobicContact CG1-CG2 4.06Å; C255-I281 HydrophobicContact CB-CB 4.39Å; C255-I281 HydrophobicContact CB-CG1 4.12Å; C255-I281 HydrophobicContact CB-CG2 4.11Å; F267-I281 HydrophobicContact CB-CG2 4.39Å; F267-I281 HydrophobicContact CD2-CG2 3.5Å; F267-I281 VanDerWaalsContact CD2-CG2 3.5Å; F267-I281 HydrophobicContact CE2-CG2 4.16Å; F267-I281 HydrophobicContact CG-CG2 4.23Å; V269-I281 HydrophobicContact CG1-CD1 3.9Å; V269-I281 HydrophobicContact CG2-CD1 4.3Å; V269-I281 HydrophobicContact CG2-CG2 3.95Å; A272-I281 HydrophobicContact CB-CD1 3.87Å; E277-I281 WeakPolarHBondContact O-CG1 3.03Å; E277-I281 PolarHBondContact O-N 3.21Å; F278-I281 HydrophobicContact CD2-CB 4.47Å; F278-I281 HydrophobicContact CD2-CD1 4.44Å; F278-I281 PolarHBondContact O-N 3.27Å; V279-I281 VanDerWaalsContact C-N 3.3Å; V279-I281 PolarHBondContact O-N 3.37Å; I281-N283 PolarHBondContact O-N 3.26Å; I281-A284 VanDerWaalsContact O-CB 3.23Å; I281-A284 WeakPolarHBondContact O-CB 3.07Å; I281-A284 PolarHBondContact O-N 3.34Å; I281-A284 VanDerWaalsContact O-N 3.15Å
282	I	98.4	Very high	96.7	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-58.6	-33.9	172.4	-71.1	164.7	0	0	0	111.1	V46 L66 V71 T75 V77 F278 V279	V46-I282 HydrophobicContact CB-CG1 4.28Å; V46-I282 HydrophobicContact CG1-CG1 3.98Å; L66-I282 HydrophobicContact CD2-CD1 4.41Å; V71-I282 HydrophobicContact CG1-CG2 4.1Å; V71-I282 HydrophobicContact CG2-CG2 4.4Å; T75-I282 HydrophobicContact CG2-CG2 4.13Å; T75-I282 PolarHBondContact OG1-O 2.73Å; V77-I282 HydrophobicContact CG1-CD1 3.8Å; V77-I282 HydrophobicContact CG1-CG1 4.2Å; V77-I282 HydrophobicContact CG2-CD1 4.11Å; V77-I282 HydrophobicContact CG2-CG1 4Å; V77-I282 HydrophobicContact CG2-CG2 3.8Å; F278-I282 HydrophobicContact CD1-CD1 3.98Å; F278-I282 HydrophobicContact CE1-CD1 3.93Å; F278-I282 HydrophobicContact CE1-CG1 4.46Å; F278-I282 HydrophobicContact CG-CD1 4.48Å; F278-I282 HydrophobicContact CZ-CD1 4.42Å; F278-I282 HydrophobicContact CZ-CG1 4.47Å; F278-I282 WeakPolarHBondContact O-CG1 3.22Å; F278-I282 PolarHBondContact O-N 3.45Å; V279-I282 PolarHBondContact O-N 2.86Å
283	N	97.5	Very high	96.6	Very high	37 Å²	37	50.9 Å²	50.9	20%	0.198	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	18	179.8	-69.6	-62.4	0	0	0	113.6	K70 P72 V279 D280 I281 K285 Q286	K70-N283 PolarHBondContact O-ND2 3.45Å; K70-N283 PolarHBondContact O-OD1 3.34Å; P72-N283 VanDerWaalsContact CD-OD1 3.22Å; P72-N283 WeakPolarHBondContact CD-OD1 3.42Å; P72-N283 WeakPolarHBondContact CG-OD1 3.39Å; V279-N283 PolarHBondContact O-N 3.23Å; V279-N283 VanDerWaalsContact O-N 3.14Å; V279-N283 PolarHBondContact O-ND2 2.95Å; D280-N283 CarbonylContact O-C 3.56Å; D280-N283 PolarHBondContact O-N 3.23Å; I281-N283 PolarHBondContact O-N 3.26Å; N283-K285 PolarHBondContact O-N 3.45Å; N283-K285 VanDerWaalsContact O-N 3.09Å; N283-Q286 HydrophobicContact CB-CB 4.38Å; N283-Q286 HydrophobicContact CB-CG 4.09Å; N283-Q286 WeakPolarHBondContact O-CB 3.48Å; N283-Q286 PolarHBondContact O-N 2.87Å
284	A	97.5	Very high	96.5	Very high	6 Å²	6	54.8 Å²	54.8	5%	0.05	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.6	-172.5	0	0	0	0	0	114.9	F44 C255 A259 F267 D280 I281	F44-A284 HydrophobicContact CE1-CB 4.18Å; F44-A284 HydrophobicContact CZ-CB 4.22Å; C255-A284 HydrophobicContact CB-CB 3.91Å; A259-A284 HydrophobicContact CB-CB 3.95Å; F267-A284 HydrophobicContact CE2-CB 3.92Å; D280-A284 PolarHBondContact O-N 2.93Å; I281-A284 VanDerWaalsContact O-CB 3.23Å; I281-A284 WeakPolarHBondContact O-CB 3.07Å; I281-A284 PolarHBondContact O-N 3.34Å; I281-A284 VanDerWaalsContact O-N 3.15Å
285	K	94.4	Very high	96.4	Very high	96 Å²	96	54.7 Å²	54.7	42%	0.417	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	6.6	176.3	-70.4	-162.2	168.4	-177.1	0	114.3	F44 A259 N283	F44-K285 HydrophobicContact CB-CD 4.34Å; F44-K285 HydrophobicContact CD1-CG 4.44Å; F44-K285 HydrophobicContact CD2-CD 3.64Å; F44-K285 HydrophobicContact CD2-CG 4.13Å; F44-K285 HydrophobicContact CE1-CG 4.41Å; F44-K285 HydrophobicContact CE2-CD 3.97Å; F44-K285 VanDerWaalsContact CE2-CE 3.46Å; F44-K285 HydrophobicContact CE2-CG 4.06Å; F44-K285 HydrophobicContact CG-CD 3.97Å; F44-K285 HydrophobicContact CG-CG 4.3Å; F44-K285 HydrophobicContact CZ-CG 4.21Å; A259-K285 HydrophobicContact CB-CG 4.14Å; A259-K285 VanDerWaalsContact O-CE 3.25Å; A259-K285 WeakPolarHBondContact O-CE 3.34Å; N283-K285 PolarHBondContact O-N 3.45Å; N283-K285 VanDerWaalsContact O-N 3.09Å
286	Q	86.4	Confident	96.3	Very high	139 Å²	139	50 Å²	50	65%	0.65	26%	0.26	S	S	*	.			trans	-96.6	0	177	-51.4	-64.9	-59.2	0	0	112.2	P72 K256 N283	P72-Q286 HydrophobicContact CB-CG 4.45Å; P72-Q286 HydrophobicContact CG-CG 3.69Å; K256-Q286 PolarHBondContact NZ-O 3.49Å; N283-Q286 HydrophobicContact CB-CB 4.38Å; N283-Q286 HydrophobicContact CB-CG 4.09Å; N283-Q286 WeakPolarHBondContact O-CB 3.48Å; N283-Q286 PolarHBondContact O-N 2.87Å

Retrieved 286 of 286 residues in 863.1 ms (Link to these results)

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