A0A096LXZ0_POEFO Loading...

Anthrax toxin receptor 1

Plays a role in cell attachment and migration. Interacts with extracellular matrix proteins and with the actin cytoskeleton and thereby plays an important role in normal extracellular matrix (ECM) homeostasis. Mediates adhesion of cells to type 1 collagen and gelatin, reorganization of the actin cytoskeleton and promotes cell spreading. Plays a role in the angiogenic response of cultured umbilical vein endothelial cells. May also act as a receptor for PLAU. Upon ligand binding, stimulates the phosphorylation of EGFR and ERK1/2.

AlphaFold DB , UniProt , Accession A0A096LXZ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 218 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	37.7	Very low	39	Very low	245 Å²	245	164.8 Å²	164.8	100%	1.207	83%	0.833	S	S	*	*				0	124	0	-65.1	-177.3	-83.3	0	0	106.8
2	A	38	Very low	38.9	Very low	77 Å²	77	157.6 Å²	157.6	64%	0.636	82%	0.817	S	S	*	*			cis	-171.2	131.6	-5.6	0	0	0	0	0	104.4
3	W	32	Very low	39.1	Very low	236 Å²	236	160.9 Å²	160.9	89%	0.894	82%	0.822	S	S	*	*			trans	71.9	140.2	141.4	-66.1	49.4	0	0	0	117.7
4	T	37.6	Very low	39.2	Very low	103 Å²	103	155.7 Å²	155.7	63%	0.632	82%	0.815	S	S	*	*			cis	-171.8	143.1	-0.4	13.3	0	0	0	0	107.7
5	Q	43.9	Very low	39.2	Very low	185 Å²	185	152.9 Å²	152.9	86%	0.864	81%	0.814	S	S	*	*			trans	19.6	152.4	133.2	-57.7	-128.9	-16	0	0	119.8
6	A	40.7	Very low	39.3	Very low	76 Å²	76	154.2 Å²	154.2	63%	0.628	82%	0.82	S	S	*	*			cis	176.4	153.4	-4.3	0	0	0	0	0	105.9
7	R	38.7	Very low	39.3	Very low	251 Å²	251	149.6 Å²	149.6	95%	0.947	82%	0.818	S	S	*	*				154.3	136.1	126	-84.9	-174.6	171.2	-170.8	-2.3	113.5
8	L	39.4	Very low	39.8	Very low	153 Å²	153	151.6 Å²	151.6	80%	0.801	82%	0.817	S	S	*	*			trans	-66.7	145.6	176.7	-150.9	79.9	0	0	0	112
9	L	40.6	Very low	40.3	Very low	173 Å²	173	153.9 Å²	153.9	91%	0.906	82%	0.819	S	S	*	*			trans	-168.9	137.5	137.6	-102.5	152.2	0	0	0	111.5
10	L	38.2	Very low	40.4	Very low	146 Å²	146	152.8 Å²	152.8	76%	0.764	81%	0.813	S	S	*	*			trans	-75.4	158.1	-173.6	-72.2	134.5	0	0	0	113.8
11	L	42.2	Very low	40.3	Very low	168 Å²	168	152.5 Å²	152.5	88%	0.88	81%	0.811	S	S	*	*			trans	150	98.8	132.2	-77.4	164.9	0	0	0	108.8
12	A	37.6	Very low	40.5	Very low	78 Å²	78	147.2 Å²	147.2	65%	0.645	80%	0.797	S	S	*	*				91.1	121.3	71.8	0	0	0	0	0	114.8
13	F	42	Very low	40.8	Very low	201 Å²	201	149.2 Å²	149.2	88%	0.882	80%	0.801	S	S	*	*			trans	64.4	112.4	162	-63.6	-84.1	0	0	0	119.6
14	A	40	Very low	41.3	Very low	88 Å²	88	144 Å²	144	73%	0.727	80%	0.797	S	S	*	*				76.8	112.3	62.9	0	0	0	0	0	114.5
15	S	40	Very low	41.3	Very low	113 Å²	113	145.7 Å²	145.7	79%	0.79	81%	0.807	S	S	*	*				-175.3	129.6	127.1	44.1	0	0	0	0	112.9
16	L	40.7	Very low	41.1	Very low	174 Å²	174	145.8 Å²	145.8	91%	0.911	81%	0.808	S	S	*	*			trans	40.2	108.7	147.1	-82.8	72.3	0	0	0	120.6
17	G	38.6	Very low	41.2	Very low	76 Å²	76	146 Å²	146	78%	0.784	82%	0.817	S	S	*	*			trans	-103.4	139.9	134.7	0	0	0	0	0	109.3
18	F	48	Very low	41.2	Very low	186 Å²	186	143.1 Å²	143.1	82%	0.816	81%	0.814	S	S	*	*				175.3	123.8	113.1	-161.8	-116.5	0	0	0	109.6	L20	F18-L20 HydrophobicContact CD1-CD1 4.41Å; F18-L20 HydrophobicContact CE1-CD1 3.69Å; F18-L20 HydrophobicContact CZ-CD1 4.25Å
19	F	49.2	Very low	41.3	Very low	195 Å²	195	141 Å²	141	86%	0.855	81%	0.81	S	S	*	*			trans	-77.9	129	177.5	-138.7	-98.8	0	0	0	108.4
20	L	42.2	Very low	41.2	Very low	132 Å²	132	138.8 Å²	138.8	69%	0.691	81%	0.805	S	S	*	*			trans	-157.2	109.8	162	-137.1	74.6	0	0	0	114	F18	F18-L20 HydrophobicContact CD1-CD1 4.41Å; F18-L20 HydrophobicContact CE1-CD1 3.69Å; F18-L20 HydrophobicContact CZ-CD1 4.25Å
21	L	39.3	Very low	41.1	Very low	147 Å²	147	135.1 Å²	135.1	77%	0.77	80%	0.803	S	S	*	*			trans	52.5	114.1	144.9	-65.2	164.2	0	0	0	120.8
22	C	42.3	Very low	40.7	Very low	134 Å²	134	135.9 Å²	135.9	91%	0.905	80%	0.802	S	S	*	*			trans	-73.9	127.8	159.3	-65	0	0	0	0	111.5
23	V	43.6	Very low	40.6	Very low	119 Å²	119	140.7 Å²	140.7	72%	0.721	81%	0.812	S	S	*	*			trans	-133.6	132.3	156.8	-178.3	0	0	0	0	106.8
24	P	41.8	Very low	40.3	Very low	127 Å²	127	139.7 Å²	139.7	83%	0.825	81%	0.81	S	S	*	*			trans	-81.6	128.4	177.3	32.3	-28.7	0	0	0	109.6
25	V	38.7	Very low	40.4	Very low	138 Å²	138	143.5 Å²	143.5	84%	0.836	81%	0.812	S	S	*	*			trans	-109.5	129.2	169.5	172.7	0	0	0	0	108.3
26	E	39.7	Very low	40.4	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.874	81%	0.814	S	S	*	*			trans	-61.6	138.4	179	-82.4	153.7	116.5	0	0	113.6
27	G	43	Very low	40.5	Very low	80 Å²	80	146.1 Å²	146.1	83%	0.825	81%	0.807	S	S	*	*			trans	38.2	95.2	147.9	0	0	0	0	0	119.6
28	E	37.3	Very low	40.6	Very low	191 Å²	191	150.4 Å²	150.4	89%	0.893	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-86.4	146.1	154.1	-95.3	-175.1	123.6	0	0	111
29	P	42.9	Very low	40.2	Very low	109 Å²	109	147.2 Å²	147.2	71%	0.708	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.4	155.9	176.3	31.9	-32.5	0	0	0	110.5	G31	P29-G31 PolarHBondContact O-N 3.21Å
30	P	38.3	Very low	40	Very low	125 Å²	125	145.2 Å²	145.2	81%	0.812	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-63.9	124.6	177.7	-10.8	25.5	0	0	0	109.2	E32	P30-E32 PolarHBondContact O-N 3.09Å
31	G	34.8	Very low	39.9	Very low	70 Å²	70	143.5 Å²	143.5	72%	0.722	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-55.1	124.2	170.8	0	0	0	0	0	109.9	P29 Q33	P29-G31 PolarHBondContact O-N 3.21Å; G31-Q33 PolarHBondContact O-N 3.26Å; G31-Q33 VanDerWaalsContact O-N 3.09Å
32	E	34.8	Very low	40.7	Very low	183 Å²	183	140.4 Å²	140.4	86%	0.855	79%	0.787	S	S	*	*			trans	-55.7	113.5	167.5	-70.9	172.8	159.9	0	0	107.5	P30 Q34	P30-E32 PolarHBondContact O-N 3.09Å; E32-Q34 PolarHBondContact O-N 3.04Å
33	Q	35.3	Very low	41.1	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	78%	0.779	S	S	*	*			trans	-61.4	108.6	159.1	-68.2	179.4	-12.7	0	0	105	G31 E35	G31-Q33 PolarHBondContact O-N 3.26Å; G31-Q33 VanDerWaalsContact O-N 3.09Å; Q33-E35 PolarHBondContact O-N 2.83Å
34	Q	35.3	Very low	41.9	Very low	180 Å²	180	137 Å²	137	84%	0.841	76%	0.756	S	S	*	*			trans	-63	91	163.6	-75.4	177.2	-27.2	0	0	106.2	E32 E36	E32-Q34 PolarHBondContact O-N 3.04Å; Q34-E36 VanDerWaalsContact C-N 3.26Å; Q34-E36 PolarHBondContact O-N 2.77Å
35	E	42.7	Very low	43.6	Very low	168 Å²	168	132.7 Å²	132.7	79%	0.785	73%	0.731	S	S	*	*			trans	-56.1	105.8	146.8	-78.8	178.8	164.7	0	0	104.4	Q33 E37	Q33-E35 PolarHBondContact O-N 2.83Å; E35-E37 PolarHBondContact O-N 3.05Å
36	E	40.1	Very low	45.9	Very low	176 Å²	176	128.3 Å²	128.3	82%	0.822	70%	0.701	S	S	*	*			trans	-57	91.8	155.7	-72.6	179.8	169.9	0	0	104.9	Q34 E38	Q34-E36 VanDerWaalsContact C-N 3.26Å; Q34-E36 PolarHBondContact O-N 2.77Å; E36-E38 PolarHBondContact O-N 2.76Å
37	E	42.7	Very low	48.5	Very low	165 Å²	165	119.4 Å²	119.4	77%	0.771	66%	0.659	S	S	*	*			trans	-56.2	91.3	153	-79.4	-172.9	165.2	0	0	104.2	E35 T39	E35-E37 PolarHBondContact O-N 3.05Å; E37-T39 PolarHBondContact O-N 2.69Å
38	E	40.5	Very low	51	Low	166 Å²	166	115.8 Å²	115.8	78%	0.776	62%	0.621	S	S	*	*			trans	-53.6	92.8	152	-77.2	-165.1	179.8	0	0	104.2	E36 M40	E36-E38 PolarHBondContact O-N 2.76Å; E38-M40 PolarHBondContact O-N 2.71Å
39	T	40.2	Very low	53.9	Low	119 Å²	119	106.7 Å²	106.7	73%	0.73	58%	0.579	S	S	*	*			trans	-55.8	92	161.2	50.6	0	0	0	0	104.6	E37 S41	E37-T39 PolarHBondContact O-N 2.69Å; T39-S41 PolarHBondContact O-N 2.8Å
40	M	43.9	Very low	56.5	Low	153 Å²	153	101.6 Å²	101.6	75%	0.754	55%	0.545	S	S	*	.			trans	-56.9	99.2	167.5	-82	-174	68.9	0	0	103.8	E38 C42	E38-M40 PolarHBondContact O-N 2.71Å; M40-C42 PolarHBondContact O-N 3.38Å
41	S	41	Very low	59.4	Low	97 Å²	97	95.6 Å²	95.6	68%	0.678	51%	0.507	S	S	*	.			trans	-64.2	85.7	173.6	167.7	0	0	0	0	106.3	T39 Q43	T39-S41 PolarHBondContact O-N 2.8Å; S41-Q43 PolarHBondContact O-N 2.75Å
42	C	55.3	Low	62.4	Low	81 Å²	81	92.3 Å²	92.3	55%	0.547	47%	0.472	S	S	.	.			trans	-72.2	60.9	174.7	-72.1	0	0	0	0	110.3	M40 V218	M40-C42 PolarHBondContact O-N 3.38Å; C42-V218 PolarHBondContact SG-O 2.73Å; C42-V218 VanDerWaalsContact SG-O 3.38Å
43	Q	51.6	Low	65.4	Low	159 Å²	159	83.6 Å²	83.6	74%	0.743	43%	0.432	S	S	*	.			trans	-114.6	40.3	162.7	-70.1	-175.1	-20.3	0	0	109	S41	S41-Q43 PolarHBondContact O-N 2.75Å
44	G	60.3	Low	68.3	Low	24 Å²	24	77.1 Å²	77.1	25%	0.247	40%	0.401	C	S	.	.			trans	-74.4	131.8	171.5	0	0	0	0	0	109.5	F46	G44-F46 VanDerWaalsContact O-CD2 3.24Å; G44-F46 WeakPolarHBondContact O-CD2 3.19Å; G44-F46 VanDerWaalsContact O-CE2 3.29Å; G44-F46 WeakPolarHBondContact O-CE2 3.24Å
45	A	77.6	Confident	71.2	Confident	36 Å²	36	68.5 Å²	68.5	30%	0.298	36%	0.361	S	S	.	.			trans	-65.2	153.5	161.6	0	0	0	0	0	109.1	M80 T144 A145	A45-M80 CarbonylContact C-O 3.53Å; A45-M80 VanDerWaalsContact CA-O 3.28Å; A45-M80 WeakPolarHBondContact CA-O 3.21Å; A45-T144 HydrophobicContact CB-CG2 3.75Å; A45-T144 WeakPolarHBondContact O-CA 3.37Å; A45-T144 WeakPolarHBondContact O-CG2 3.29Å; A45-A145 PolarHBondContact O-N 2.95Å
46	F	86.9	Confident	73.7	Confident	46 Å²	46	62.3 Å²	62.3	20%	0.202	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.2	-178.5	-75.1	-92.5	0	0	0	110.8	G44 M80 L81 R82 A145 V218	G44-F46 VanDerWaalsContact O-CD2 3.24Å; G44-F46 WeakPolarHBondContact O-CD2 3.19Å; G44-F46 VanDerWaalsContact O-CE2 3.29Å; G44-F46 WeakPolarHBondContact O-CE2 3.24Å; F46-M80 PolarHBondContact N-O 3.11Å; F46-L81 WeakPolarHBondContact O-CA 3.38Å; F46-R82 PolarHBondContact O-N 2.77Å; F46-A145 HydrophobicContact CD1-CB 3.64Å; F46-A145 HydrophobicContact CE1-CB 3.65Å; F46-A145 HydrophobicContact CG-CB 4.46Å; F46-A145 HydrophobicContact CZ-CB 4.48Å; F46-V218 HydrophobicContact CE1-CB 3.9Å; F46-V218 HydrophobicContact CE1-CG1 3.81Å; F46-V218 HydrophobicContact CE1-CG2 4.39Å; F46-V218 HydrophobicContact CZ-CB 3.61Å; F46-V218 HydrophobicContact CZ-CG1 3.52Å
47	D	93.5	Very high	76.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113	176.6	-66	-23.9	0	0	0	110.1	Y49 R82 L98 T144 A145 V147	D47-Y49 HydrophobicContact CB-CD2 4.47Å; D47-Y49 HydrophobicContact CB-CE2 3.61Å; D47-R82 WeakPolarHBondContact OD1-CB 3.46Å; D47-R82 IonicContact OD1-CZ 3.73Å; D47-R82 VanDerWaalsContact OD1-CZ 3.22Å; D47-R82 IonicContact OD1-NE 2.76Å; D47-R82 PolarHBondContact OD1-NE 3.2Å; D47-R82 IonicContact OD1-NH2 3.91Å; D47-R82 PolarHBondContact OD1-NH2 3.02Å; D47-R82 IonicContact OD2-CZ 3.83Å; D47-R82 IonicContact OD2-NE 3.26Å; D47-R82 IonicContact OD2-NH2 2.78Å; D47-R82 PolarHBondContact OD2-NH2 3.45Å; D47-L98 HydrophobicContact CB-CD1 3.97Å; D47-L98 HydrophobicContact CB-CD2 4.19Å; D47-T144 HydrophobicContact CB-CG2 4.25Å; D47-T144 WeakPolarHBondContact OD1-CG2 3.41Å; D47-T144 WeakPolarHBondContact OD2-CG2 3.2Å; D47-A145 PolarHBondContact N-O 2.76Å; D47-V147 PolarHBondContact O-N 3.18Å
48	L	95.2	Very high	78.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.1	175.8	-65.9	-170.9	0	0	0	111.4	F50 L81 R82 M83 S84 V147 I149 I215	L48-F50 HydrophobicContact CB-CE2 4.31Å; L48-F50 HydrophobicContact CD1-CZ 4.48Å; L48-L81 HydrophobicContact CD1-CD1 3.82Å; L48-L81 HydrophobicContact CD1-CD2 4.07Å; L48-L81 HydrophobicContact CD1-CG 4.27Å; L48-L81 HydrophobicContact CG-CD1 4.21Å; L48-L81 HydrophobicContact CG-CD2 4.39Å; L48-L81 HydrophobicContact CG-CG 4.34Å; L48-R82 PolarHBondContact N-O 3.23Å; L48-M83 HydrophobicContact CB-CB 4.22Å; L48-M83 CarbonylContact O-C 3.45Å; L48-M83 WeakPolarHBondContact O-CA 3.5Å; L48-S84 PolarHBondContact O-N 3.36Å; L48-V147 WeakPolarHBondContact CA-O 3.38Å; L48-V147 HydrophobicContact CD2-CB 3.74Å; L48-V147 HydrophobicContact CD2-CG1 4.21Å; L48-V147 HydrophobicContact CD2-CG2 4.35Å; L48-I149 HydrophobicContact CD2-CD1 4.46Å; L48-I215 HydrophobicContact CD1-CD1 4.35Å
49	Y	98.1	Very high	81.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	107.3	175	-56.8	-90.8	0	0	0	109.7	D47 L98 A130 Q133 I134 V147 I148 I149	D47-Y49 HydrophobicContact CB-CD2 4.47Å; D47-Y49 HydrophobicContact CB-CE2 3.61Å; Y49-L98 HydrophobicContact CE1-CB 4.37Å; Y49-L98 HydrophobicContact CE1-CD1 4.05Å; Y49-L98 HydrophobicContact CE1-CD2 4.32Å; Y49-L98 HydrophobicContact CE1-CG 4.5Å; Y49-L98 WeakPolarHBondContact OH-CD2 3.32Å; Y49-A130 HydrophobicContact CD1-CB 4.47Å; Y49-A130 HydrophobicContact CG-CB 4.39Å; Y49-Q133 HydrophobicContact CD1-CB 4.41Å; Y49-Q133 HydrophobicContact CE1-CB 3.61Å; Y49-I134 HydrophobicContact CD2-CD1 4.16Å; Y49-I134 HydrophobicContact CD2-CG1 3.99Å; Y49-I134 HydrophobicContact CE1-CG1 4.21Å; Y49-I134 HydrophobicContact CE2-CD1 4.05Å; Y49-I134 HydrophobicContact CE2-CG1 3.39Å; Y49-V147 PolarHBondContact N-O 3.3Å; Y49-I148 WeakPolarHBondContact O-CA 3.48Å; Y49-I149 PolarHBondContact O-N 3.27Å
50	F	98.3	Very high	83.7	Confident	1 Å²	1	48 Å²	48	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.7	173.3	-70.6	-79.4	0	0	0	109.9	L48 L52 V69 L72 M83 S84 F85 I86 I149 L151	L48-F50 HydrophobicContact CB-CE2 4.31Å; L48-F50 HydrophobicContact CD1-CZ 4.48Å; F50-L52 HydrophobicContact CB-CD2 3.97Å; F50-L52 HydrophobicContact CB-CG 4.19Å; F50-V69 HydrophobicContact CD1-CG1 4.31Å; F50-V69 HydrophobicContact CD1-CG2 3.91Å; F50-V69 HydrophobicContact CD2-CG1 4.23Å; F50-V69 HydrophobicContact CE1-CG1 4.5Å; F50-V69 HydrophobicContact CE1-CG2 4.33Å; F50-V69 HydrophobicContact CE2-CG1 4.41Å; F50-V69 HydrophobicContact CG-CG1 4.17Å; F50-V69 HydrophobicContact CG-CG2 4.34Å; F50-L72 HydrophobicContact CE1-CD1 3.77Å; F50-L72 HydrophobicContact CZ-CB 4.12Å; F50-L72 HydrophobicContact CZ-CD1 3.95Å; F50-M83 HydrophobicContact CE2-CB 4.38Å; F50-S84 PolarHBondContact N-O 3.44Å; F50-F85 HydrophobicContact CB-CD1 4.12Å; F50-F85 AromaticContact CD2-CD1 3.72Å; F50-F85 HydrophobicContact CD2-CD1 3.72Å; F50-F85 AromaticContact CD2-CE1 3.62Å; F50-F85 HydrophobicContact CD2-CE1 3.62Å; F50-F85 HydrophobicContact CE2-CE1 4.06Å; F50-F85 HydrophobicContact CG-CD1 4.25Å; F50-F85 HydrophobicContact CG-CE1 4.44Å; F50-I86 WeakPolarHBondContact O-CA 3.5Å; F50-I86 WeakPolarHBondContact O-CB 3.39Å; F50-I86 PolarHBondContact O-N 3.48Å; F50-I86 VanDerWaalsContact O-O 3.12Å; F50-I149 HydrophobicContact CD1-CB 4.09Å; F50-I149 HydrophobicContact CD1-CD1 4.45Å; F50-I149 HydrophobicContact CD1-CG2 4.37Å; F50-I149 HydrophobicContact CE1-CB 4.22Å; F50-I149 HydrophobicContact CE1-CD1 3.79Å; F50-I149 HydrophobicContact CE1-CG2 4.37Å; F50-I149 HydrophobicContact CZ-CD1 4.16Å; F50-L151 HydrophobicContact CD1-CD1 4.16Å
51	V	98.6	Very high	86.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	102.2	178.5	179.4	0	0	0	0	108.7	I86 F88 A130 I148 I149 A150 L151	V51-I86 HydrophobicContact CG2-CB 4.46Å; V51-I86 HydrophobicContact CG2-CD1 4.23Å; V51-F88 HydrophobicContact CG1-CD1 3.63Å; V51-F88 HydrophobicContact CG1-CE1 3.8Å; V51-A130 HydrophobicContact CG2-CB 4.11Å; V51-I148 HydrophobicContact CB-CG2 4.39Å; V51-I148 HydrophobicContact CG2-CG2 3.8Å; V51-I149 PolarHBondContact N-O 2.92Å; V51-A150 HydrophobicContact CB-CB 4.4Å; V51-A150 CarbonylContact O-C 3.59Å; V51-A150 VanDerWaalsContact O-CA 3.26Å; V51-A150 WeakPolarHBondContact O-CA 3.39Å; V51-L151 PolarHBondContact O-N 2.81Å
52	L	98.4	Very high	88.7	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.3	-160.8	-52.3	178.5	0	0	0	111.5	F50 K54 W62 I65 V69 I86 V87 F88 L112 L151	F50-L52 HydrophobicContact CB-CD2 3.97Å; F50-L52 HydrophobicContact CB-CG 4.19Å; L52-K54 PolarHBondContact O-N 3.46Å; L52-W62 HydrophobicContact CB-CH2 4.24Å; L52-W62 HydrophobicContact CB-CZ3 4.31Å; L52-W62 HydrophobicContact CD1-CH2 4.39Å; L52-I65 HydrophobicContact CB-CG2 4.26Å; L52-I65 HydrophobicContact CD2-CG2 3.97Å; L52-V69 HydrophobicContact CD1-CG2 3.95Å; L52-V69 HydrophobicContact CD2-CG2 3.56Å; L52-V69 HydrophobicContact CG-CG2 4.4Å; L52-I86 WeakPolarHBondContact CB-O 3.08Å; L52-I86 WeakPolarHBondContact CG-O 3.17Å; L52-I86 PolarHBondContact N-O 3.07Å; L52-V87 HydrophobicContact CB-CG1 4.22Å; L52-V87 HydrophobicContact CD1-CG1 4.46Å; L52-V87 CarbonylContact O-C 3.54Å; L52-V87 VanDerWaalsContact O-CA 3.28Å; L52-V87 WeakPolarHBondContact O-CA 2.94Å; L52-F88 WeakPolarHBondContact O-CD1 3.36Å; L52-F88 PolarHBondContact O-N 3.46Å; L52-L112 HydrophobicContact CD1-CD1 3.81Å; L52-L112 HydrophobicContact CD1-CD2 3.65Å; L52-L112 HydrophobicContact CD1-CG 4.4Å; L52-L151 HydrophobicContact CD2-CB 4Å; L52-L151 HydrophobicContact CD2-CD1 3.34Å; L52-L151 HydrophobicContact CD2-CG 4.18Å
53	D	97.4	Very high	90.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	120.4	173.3	-164.4	-20.4	0	0	0	110.1	S55 V58 W62 I65 F88 T121 L151 T152	D53-S55 WeakPolarHBondContact OD1-CA 2.99Å; D53-S55 WeakPolarHBondContact OD1-CB 3.4Å; D53-S55 PolarHBondContact OD1-N 3.25Å; D53-S55 PolarHBondContact OD1-OG 3.36Å; D53-V58 HydrophobicContact CB-CG1 4.47Å; D53-V58 HydrophobicContact CB-CG2 4.39Å; D53-V58 WeakPolarHBondContact O-CG2 3.02Å; D53-W62 VanDerWaalsContact O-CZ3 3.25Å; D53-W62 WeakPolarHBondContact O-CZ3 3.17Å; D53-I65 WeakPolarHBondContact O-CD1 3.22Å; D53-F88 HydrophobicContact CB-CE1 3.95Å; D53-F88 HydrophobicContact CB-CE2 3.95Å; D53-F88 HydrophobicContact CB-CZ 3.47Å; D53-F88 VanDerWaalsContact CB-CZ 3.47Å; D53-T121 WeakPolarHBondContact OD2-CG2 3.28Å; D53-L151 WeakPolarHBondContact CB-O 3.34Å; D53-L151 PolarHBondContact N-O 3.18Å; D53-T152 WeakPolarHBondContact OD2-CB 3.2Å; D53-T152 PolarHBondContact OD2-OG1 3.48Å
54	K	97.5	Very high	92.5	Very high	43 Å²	43	36.4 Å²	36.4	19%	0.187	20%	0.197	C	C	.	.			trans	-119.8	25.9	170.2	69.3	163.4	-171.9	73.5	0	111.5	L52 W62 V87 F88 S89 V115 P117 G118	L52-K54 PolarHBondContact O-N 3.46Å; K54-W62 HydrophobicContact CB-CE3 4.2Å; K54-W62 HydrophobicContact CB-CH2 4.32Å; K54-W62 HydrophobicContact CB-CZ3 3.79Å; K54-V87 HydrophobicContact CD-CB 3.86Å; K54-V87 HydrophobicContact CD-CG2 3.78Å; K54-V87 HydrophobicContact CG-CB 4.05Å; K54-V87 HydrophobicContact CG-CG2 4.44Å; K54-F88 VanDerWaalsContact CG-O 3.29Å; K54-F88 WeakPolarHBondContact CG-O 3.43Å; K54-F88 PolarHBondContact N-O 3.29Å; K54-S89 PolarHBondContact NZ-OG 2.78Å; K54-V115 HydrophobicContact CB-CG1 3.87Å; K54-V115 HydrophobicContact CD-CG1 3.52Å; K54-V115 HydrophobicContact CG-CG1 4.33Å; K54-P117 CarbonylContact O-C 3.58Å; K54-P117 WeakPolarHBondContact O-CA 3.18Å; K54-G118 PolarHBondContact O-N 2.96Å
55	S	96.1	Very high	94.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-67.2	174	177.2	68.5	0	0	0	0	112.2	D53 S57 V58 D120 T121	D53-S55 WeakPolarHBondContact OD1-CA 2.99Å; D53-S55 WeakPolarHBondContact OD1-CB 3.4Å; D53-S55 PolarHBondContact OD1-N 3.25Å; D53-S55 PolarHBondContact OD1-OG 3.36Å; S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 3.41Å; S55-S57 PolarHBondContact OG-OG 3.29Å; S55-S57 VanDerWaalsContact OG-OG 3.06Å; S55-V58 VanDerWaalsContact O-CG2 3.3Å; S55-V58 WeakPolarHBondContact O-CG2 3.27Å; S55-D120 VanDerWaalsContact CB-O 3.27Å; S55-D120 WeakPolarHBondContact CB-O 3.5Å; S55-T121 VanDerWaalsContact CB-OG1 3.29Å; S55-T121 WeakPolarHBondContact CB-OG1 3.15Å; S55-T121 PolarHBondContact OG-OG1 3.03Å
56	G	94.4	Very high	95	Very high	38 Å²	38	35 Å²	35	39%	0.392	18%	0.177	S	C	.	.	S	Bend	trans	-64.4	-28.5	179.3	0	0	0	0	0	114.2	V58 K59 G119	G56-V58 VanDerWaalsContact C-N 3.32Å; G56-V58 PolarHBondContact O-N 2.92Å; G56-K59 WeakPolarHBondContact O-CB 3.42Å; G56-K59 PolarHBondContact O-N 3.38Å; G56-G119 PolarHBondContact N-O 3.43Å
57	S	92.8	Very high	95.4	Very high	38 Å²	38	35 Å²	35	27%	0.266	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-31.8	-176.3	60.4	0	0	0	0	112.3	S55 D153	S55-S57 VanDerWaalsContact C-N 3.28Å; S55-S57 PolarHBondContact O-N 3.41Å; S55-S57 PolarHBondContact OG-OG 3.29Å; S55-S57 VanDerWaalsContact OG-OG 3.06Å; S57-D153 WeakPolarHBondContact CB-OD2 3.36Å; S57-D153 PolarHBondContact OG-OD1 3.05Å; S57-D153 PolarHBondContact OG-OD2 2.93Å
58	V	93.8	Very high	95.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	9.5	178.5	-61.2	0	0	0	0	114.3	D53 S55 G56 H60 H61 W62 I65 D153	D53-V58 HydrophobicContact CB-CG1 4.47Å; D53-V58 HydrophobicContact CB-CG2 4.39Å; D53-V58 WeakPolarHBondContact O-CG2 3.02Å; S55-V58 VanDerWaalsContact O-CG2 3.3Å; S55-V58 WeakPolarHBondContact O-CG2 3.27Å; G56-V58 VanDerWaalsContact C-N 3.32Å; G56-V58 PolarHBondContact O-N 2.92Å; V58-H60 VanDerWaalsContact C-N 3.25Å; V58-H60 PolarHBondContact O-N 3.29Å; V58-H60 VanDerWaalsContact O-N 3.12Å; V58-H61 CarbonylContact O-C 3.46Å; V58-H61 WeakPolarHBondContact O-CA 3.43Å; V58-H61 PolarHBondContact O-N 3.2Å; V58-W62 PolarHBondContact O-N 2.98Å; V58-I65 HydrophobicContact CB-CD1 4.12Å; V58-I65 HydrophobicContact CG1-CD1 4.31Å; V58-I65 HydrophobicContact CG2-CD1 4.28Å; V58-D153 HydrophobicContact CG1-CB 4.04Å; V58-D153 WeakPolarHBondContact CG1-OD2 3.38Å
59	K	93.8	Very high	95.3	Very high	124 Å²	124	35.3 Å²	35.3	54%	0.539	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-38.4	-174.1	-178.4	-179.8	178.3	-178.1	0	114.5	G56 H61 P117	G56-K59 WeakPolarHBondContact O-CB 3.42Å; G56-K59 PolarHBondContact O-N 3.38Å; K59-H61 VanDerWaalsContact C-N 3.34Å; K59-P117 HydrophobicContact CB-CB 4.18Å; K59-P117 HydrophobicContact CG-CB 4.44Å
60	H	94.2	Very high	95.1	Very high	163 Å²	163	38.6 Å²	38.6	76%	0.755	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.4	179.5	-62.6	-64.7	0	0	0	113.6	V58	V58-H60 VanDerWaalsContact C-N 3.25Å; V58-H60 PolarHBondContact O-N 3.29Å; V58-H60 VanDerWaalsContact O-N 3.12Å
61	H	94	Very high	94.7	Very high	50 Å²	50	43.4 Å²	43.4	23%	0.231	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	2.5	-177	-61.9	-74.7	0	0	0	113.3	V58 K59 N63 E64 I65 V183	V58-H61 CarbonylContact O-C 3.46Å; V58-H61 WeakPolarHBondContact O-CA 3.43Å; V58-H61 PolarHBondContact O-N 3.2Å; K59-H61 VanDerWaalsContact C-N 3.34Å; H61-N63 PolarHBondContact O-N 3.22Å; H61-E64 IonicContact CE1-OE1 3.98Å; H61-E64 IonicContact CG-OE1 3.93Å; H61-E64 IonicContact ND1-OE1 2.74Å; H61-E64 PolarHBondContact ND1-OE1 3.42Å; H61-E64 WeakPolarHBondContact O-CB 3.25Å; H61-E64 PolarHBondContact O-N 2.97Å; H61-I65 PolarHBondContact O-N 3.48Å; H61-V183 HydrophobicContact CB-CG1 3.55Å
62	W	95.5	Very high	94.2	Very high	10 Å²	10	43.4 Å²	43.4	4%	0.038	22%	0.22	C	C	.	.	H	α-helix	trans	-56	-36.3	178.5	-179.9	-108.9	0	0	0	113	L52 D53 K54 V58 E64 I65 Y66 V87 L112 V115 P117	L52-W62 HydrophobicContact CB-CH2 4.24Å; L52-W62 HydrophobicContact CB-CZ3 4.31Å; L52-W62 HydrophobicContact CD1-CH2 4.39Å; D53-W62 VanDerWaalsContact O-CZ3 3.25Å; D53-W62 WeakPolarHBondContact O-CZ3 3.17Å; K54-W62 HydrophobicContact CB-CE3 4.2Å; K54-W62 HydrophobicContact CB-CH2 4.32Å; K54-W62 HydrophobicContact CB-CZ3 3.79Å; V58-W62 PolarHBondContact O-N 2.98Å; W62-E64 PolarHBondContact O-N 3.36Å; W62-I65 HydrophobicContact CE3-CB 4.26Å; W62-I65 HydrophobicContact CE3-CD1 4.17Å; W62-I65 HydrophobicContact CE3-CG2 4.25Å; W62-I65 HydrophobicContact CH2-CG2 4.48Å; W62-I65 HydrophobicContact CZ3-CB 4.47Å; W62-I65 HydrophobicContact CZ3-CD1 4.5Å; W62-I65 HydrophobicContact CZ3-CG2 3.95Å; W62-I65 PolarHBondContact O-N 2.84Å; W62-Y66 WeakPolarHBondContact O-CB 3.41Å; W62-Y66 PolarHBondContact O-N 2.79Å; W62-V87 HydrophobicContact CH2-CG1 4.09Å; W62-L112 HydrophobicContact CH2-CD2 4.35Å; W62-L112 HydrophobicContact CZ2-CD2 4.31Å; W62-L112 VanDerWaalsContact CZ2-O 3.31Å; W62-L112 WeakPolarHBondContact CZ2-O 3.4Å; W62-L112 PolarHBondContact NE1-O 3.27Å; W62-L112 VanDerWaalsContact NE1-O 3.14Å; W62-V115 HydrophobicContact CD2-CG1 4.49Å; W62-V115 HydrophobicContact CH2-CB 4.21Å; W62-V115 HydrophobicContact CH2-CG1 3.94Å; W62-V115 HydrophobicContact CZ2-CB 3.46Å; W62-V115 VanDerWaalsContact CZ2-CB 3.46Å; W62-V115 HydrophobicContact CZ2-CG1 3.64Å; W62-V115 HydrophobicContact CZ2-CG2 3.95Å; W62-V115 HydrophobicContact CZ3-CG1 4.46Å; W62-P117 HydrophobicContact CB-CG 3.49Å; W62-P117 VanDerWaalsContact CB-CG 3.49Å; W62-P117 HydrophobicContact CD2-CG 4.1Å; W62-P117 HydrophobicContact CE3-CG 4.37Å; W62-P117 HydrophobicContact CG-CG 3.71Å
63	N	93.9	Very high	93.9	Very high	114 Å²	114	43.4 Å²	43.4	61%	0.61	22%	0.22	S	C	*	.	H	α-helix	trans	-61.2	-31.4	176.3	-72.6	-16.3	0	0	0	112.5	H61 S67	H61-N63 PolarHBondContact O-N 3.22Å; N63-S67 WeakPolarHBondContact O-CB 3.3Å; N63-S67 PolarHBondContact O-N 3.44Å; N63-S67 PolarHBondContact O-OG 2.86Å
64	E	92.4	Very high	93.4	Very high	72 Å²	72	48.1 Å²	48.1	34%	0.336	24%	0.242	S	C	.	.	H	α-helix	trans	-70.5	-45.8	175.4	-62.2	173.6	-133.6	0	0	110.6	H61 W62 S67 F68 V204	H61-E64 IonicContact CE1-OE1 3.98Å; H61-E64 IonicContact CG-OE1 3.93Å; H61-E64 IonicContact ND1-OE1 2.74Å; H61-E64 PolarHBondContact ND1-OE1 3.42Å; H61-E64 WeakPolarHBondContact O-CB 3.25Å; H61-E64 PolarHBondContact O-N 2.97Å; W62-E64 PolarHBondContact O-N 3.36Å; E64-S67 PolarHBondContact O-N 3.46Å; E64-F68 WeakPolarHBondContact O-CB 3.16Å; E64-F68 PolarHBondContact O-N 3.44Å; E64-V204 HydrophobicContact CB-CG2 4.45Å; E64-V204 WeakPolarHBondContact OE2-CG1 3.46Å
65	I	94.7	Very high	92.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-52.7	176	-63.1	174.5	0	0	0	110.3	L52 D53 V58 H61 W62 S67 F68 V69 L151 V183	L52-I65 HydrophobicContact CB-CG2 4.26Å; L52-I65 HydrophobicContact CD2-CG2 3.97Å; D53-I65 WeakPolarHBondContact O-CD1 3.22Å; V58-I65 HydrophobicContact CB-CD1 4.12Å; V58-I65 HydrophobicContact CG1-CD1 4.31Å; V58-I65 HydrophobicContact CG2-CD1 4.28Å; H61-I65 PolarHBondContact O-N 3.48Å; W62-I65 HydrophobicContact CE3-CB 4.26Å; W62-I65 HydrophobicContact CE3-CD1 4.17Å; W62-I65 HydrophobicContact CE3-CG2 4.25Å; W62-I65 HydrophobicContact CH2-CG2 4.48Å; W62-I65 HydrophobicContact CZ3-CB 4.47Å; W62-I65 HydrophobicContact CZ3-CD1 4.5Å; W62-I65 HydrophobicContact CZ3-CG2 3.95Å; W62-I65 PolarHBondContact O-N 2.84Å; I65-S67 PolarHBondContact O-N 3.04Å; I65-F68 WeakPolarHBondContact O-CB 3.47Å; I65-F68 PolarHBondContact O-N 3.02Å; I65-V69 WeakPolarHBondContact O-CG2 3.44Å; I65-V69 PolarHBondContact O-N 3.32Å; I65-V69 VanDerWaalsContact O-N 3.13Å; I65-L151 HydrophobicContact CG1-CB 4.47Å; I65-L151 HydrophobicContact CG2-CB 4.02Å; I65-L151 HydrophobicContact CG2-CD2 4.2Å; I65-V183 HydrophobicContact CD1-CG2 4.11Å; I65-V183 HydrophobicContact CG1-CG1 4.49Å; I65-V183 HydrophobicContact CG1-CG2 3.7Å
66	Y	96.3	Very high	92	Very high	32 Å²	32	50.4 Å²	50.4	13%	0.125	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-47.8	178.7	165.4	-110.8	0	0	0	111.7	W62 F68 V69 K70 L109 L112 N113	W62-Y66 WeakPolarHBondContact O-CB 3.41Å; W62-Y66 PolarHBondContact O-N 2.79Å; Y66-F68 VanDerWaalsContact C-N 3.27Å; Y66-F68 PolarHBondContact O-N 3.1Å; Y66-V69 PolarHBondContact O-N 3.13Å; Y66-K70 HydrophobicContact CE1-CD 4.26Å; Y66-K70 HydrophobicContact CE2-CB 4.36Å; Y66-K70 WeakPolarHBondContact O-CB 3.31Å; Y66-K70 PolarHBondContact O-N 2.85Å; Y66-L109 WeakPolarHBondContact CE2-O 3.43Å; Y66-L112 HydrophobicContact CD2-CB 4.09Å; Y66-L112 HydrophobicContact CE2-CB 4.48Å; Y66-N113 HydrophobicContact CD2-CB 4.33Å; Y66-N113 HydrophobicContact CE1-CB 4.2Å; Y66-N113 WeakPolarHBondContact CE1-OD1 3.37Å; Y66-N113 HydrophobicContact CE2-CB 3.76Å
67	S	93.8	Very high	91.2	Very high	45 Å²	45	54.2 Å²	54.2	32%	0.315	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-39.4	179.8	-63	0	0	0	0	111.2	N63 E64 I65 K70 H71	N63-S67 WeakPolarHBondContact O-CB 3.3Å; N63-S67 PolarHBondContact O-N 3.44Å; N63-S67 PolarHBondContact O-OG 2.86Å; E64-S67 PolarHBondContact O-N 3.46Å; I65-S67 PolarHBondContact O-N 3.04Å; S67-K70 PolarHBondContact O-N 3.18Å; S67-H71 WeakPolarHBondContact O-CB 3.23Å; S67-H71 PolarHBondContact O-N 2.96Å; S67-H71 PolarHBondContact O-ND1 3.28Å
68	F	92.6	Very high	90.6	Very high	10 Å²	10	54.8 Å²	54.8	4%	0.044	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-51.1	176.4	-175.8	-88	0	0	0	112.1	E64 I65 Y66 K70 H71 L72 I149 L151 V181 V204 F208 L211	E64-F68 WeakPolarHBondContact O-CB 3.16Å; E64-F68 PolarHBondContact O-N 3.44Å; I65-F68 WeakPolarHBondContact O-CB 3.47Å; I65-F68 PolarHBondContact O-N 3.02Å; Y66-F68 VanDerWaalsContact C-N 3.27Å; Y66-F68 PolarHBondContact O-N 3.1Å; F68-K70 PolarHBondContact O-N 3.33Å; F68-H71 PolarHBondContact O-N 2.75Å; F68-L72 HydrophobicContact CD1-CD1 3.73Å; F68-L72 HydrophobicContact CE1-CD1 3.26Å; F68-L72 HydrophobicContact CE1-CG 4.35Å; F68-L72 HydrophobicContact CZ-CD1 3.84Å; F68-L72 PolarHBondContact O-N 3.37Å; F68-L72 VanDerWaalsContact O-N 3.14Å; F68-I149 HydrophobicContact CE1-CG2 4.25Å; F68-L151 HydrophobicContact CB-CD2 4.01Å; F68-L151 HydrophobicContact CD1-CD1 4.11Å; F68-L151 HydrophobicContact CD1-CD2 3.54Å; F68-L151 HydrophobicContact CD1-CG 4.38Å; F68-L151 HydrophobicContact CE1-CD1 4.25Å; F68-L151 HydrophobicContact CE1-CD2 4.07Å; F68-L151 HydrophobicContact CG-CD2 3.84Å; F68-V181 HydrophobicContact CE1-CG2 4.1Å; F68-V181 HydrophobicContact CE2-CG1 4.01Å; F68-V181 HydrophobicContact CE2-CG2 4.47Å; F68-V181 HydrophobicContact CZ-CB 4.39Å; F68-V181 HydrophobicContact CZ-CG1 4.03Å; F68-V181 HydrophobicContact CZ-CG2 3.71Å; F68-V204 HydrophobicContact CB-CG2 4.35Å; F68-V204 HydrophobicContact CD2-CG2 4.12Å; F68-F208 HydrophobicContact CE2-CB 4.37Å; F68-L211 HydrophobicContact CE1-CD1 3.86Å; F68-L211 HydrophobicContact CZ-CD1 3.43Å; F68-L211 VanDerWaalsContact CZ-CD1 3.43Å; F68-L211 HydrophobicContact CZ-CG 4.41Å
69	V	94.4	Very high	89.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-45.9	179.1	178.5	0	0	0	0	110.6	F50 L52 I65 Y66 H71 L72 A73 F85 L109 L112 L151	F50-V69 HydrophobicContact CD1-CG1 4.31Å; F50-V69 HydrophobicContact CD1-CG2 3.91Å; F50-V69 HydrophobicContact CD2-CG1 4.23Å; F50-V69 HydrophobicContact CE1-CG1 4.5Å; F50-V69 HydrophobicContact CE1-CG2 4.33Å; F50-V69 HydrophobicContact CE2-CG1 4.41Å; F50-V69 HydrophobicContact CG-CG1 4.17Å; F50-V69 HydrophobicContact CG-CG2 4.34Å; L52-V69 HydrophobicContact CD1-CG2 3.95Å; L52-V69 HydrophobicContact CD2-CG2 3.56Å; L52-V69 HydrophobicContact CG-CG2 4.4Å; I65-V69 WeakPolarHBondContact O-CG2 3.44Å; I65-V69 PolarHBondContact O-N 3.32Å; I65-V69 VanDerWaalsContact O-N 3.13Å; Y66-V69 PolarHBondContact O-N 3.13Å; V69-H71 PolarHBondContact O-N 3.42Å; V69-L72 PolarHBondContact O-N 3.14Å; V69-A73 WeakPolarHBondContact O-CB 3.22Å; V69-A73 PolarHBondContact O-N 2.78Å; V69-F85 HydrophobicContact CG1-CD1 4.02Å; V69-F85 HydrophobicContact CG1-CE1 3.58Å; V69-F85 HydrophobicContact CG1-CZ 4.07Å; V69-L109 HydrophobicContact CG1-CD2 4.2Å; V69-L112 HydrophobicContact CG1-CD1 3.98Å; V69-L151 HydrophobicContact CG2-CD1 4.24Å
70	K	94.6	Very high	89.1	Confident	70 Å²	70	58.4 Å²	58.4	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-56.7	-50.3	177.5	-177.8	-177.1	175	-174	0	111.7	Y66 S67 F68 L72 A73 E74 L109	Y66-K70 HydrophobicContact CE1-CD 4.26Å; Y66-K70 HydrophobicContact CE2-CB 4.36Å; Y66-K70 WeakPolarHBondContact O-CB 3.31Å; Y66-K70 PolarHBondContact O-N 2.85Å; S67-K70 PolarHBondContact O-N 3.18Å; F68-K70 PolarHBondContact O-N 3.33Å; K70-L72 VanDerWaalsContact C-N 3.32Å; K70-L72 PolarHBondContact O-N 3.3Å; K70-A73 PolarHBondContact O-N 3.07Å; K70-E74 VanDerWaalsContact CE-CD 3.48Å; K70-E74 WeakPolarHBondContact CE-OE1 3.44Å; K70-E74 HydrophobicContact CG-CG 4.32Å; K70-E74 IonicContact NZ-OE1 3.02Å; K70-E74 WeakPolarHBondContact O-CB 3.33Å; K70-E74 WeakPolarHBondContact O-CG 3.39Å; K70-E74 PolarHBondContact O-N 2.92Å; K70-L109 HydrophobicContact CB-CD2 4.16Å
71	H	89.9	Confident	88.8	Confident	101 Å²	101	51 Å²	51	47%	0.468	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-38.4	-179.5	-70.9	126.2	0	0	0	112.6	S67 F68 V69 K75 F208	S67-H71 WeakPolarHBondContact O-CB 3.23Å; S67-H71 PolarHBondContact O-N 2.96Å; S67-H71 PolarHBondContact O-ND1 3.28Å; F68-H71 PolarHBondContact O-N 2.75Å; V69-H71 PolarHBondContact O-N 3.42Å; H71-K75 VanDerWaalsContact O-CB 3.27Å; H71-K75 WeakPolarHBondContact O-CB 3.5Å; H71-K75 PolarHBondContact O-N 3.14Å; H71-F208 HydrophobicContact CB-CD2 4.26Å; H71-F208 HydrophobicContact CB-CE2 3.85Å; H71-F208 HydrophobicContact CB-CZ 4.39Å
72	L	88.4	Confident	88.8	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-68.8	-48.1	175.8	-68.5	172.2	0	0	0	111.1	F50 F68 V69 K70 E74 K75 F76 F208 L211	F50-L72 HydrophobicContact CE1-CD1 3.77Å; F50-L72 HydrophobicContact CZ-CB 4.12Å; F50-L72 HydrophobicContact CZ-CD1 3.95Å; F68-L72 HydrophobicContact CD1-CD1 3.73Å; F68-L72 HydrophobicContact CE1-CD1 3.26Å; F68-L72 HydrophobicContact CE1-CG 4.35Å; F68-L72 HydrophobicContact CZ-CD1 3.84Å; F68-L72 PolarHBondContact O-N 3.37Å; F68-L72 VanDerWaalsContact O-N 3.14Å; V69-L72 PolarHBondContact O-N 3.14Å; K70-L72 VanDerWaalsContact C-N 3.32Å; K70-L72 PolarHBondContact O-N 3.3Å; L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.82Å; L72-K75 PolarHBondContact O-N 2.8Å; L72-F76 HydrophobicContact CB-CD2 4.15Å; L72-F76 HydrophobicContact CB-CE2 4.05Å; L72-F76 HydrophobicContact CD2-CD2 4.47Å; L72-F76 HydrophobicContact CD2-CE2 3.56Å; L72-F76 HydrophobicContact CD2-CZ 4.26Å; L72-F76 HydrophobicContact CG-CE2 4.35Å; L72-F76 WeakPolarHBondContact O-CD2 3.22Å; L72-F76 PolarHBondContact O-N 3.25Å; L72-F208 HydrophobicContact CD2-CD2 3.57Å; L72-F208 HydrophobicContact CD2-CE2 3.67Å; L72-F208 HydrophobicContact CG-CD2 4.07Å; L72-F208 HydrophobicContact CG-CE2 4.22Å; L72-L211 HydrophobicContact CD1-CD1 3.96Å
73	A	90.9	Very high	88.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-39.6	-179.9	0	0	0	0	0	112.6	V69 K70 M83 F85 R102 I105 L109	V69-A73 WeakPolarHBondContact O-CB 3.22Å; V69-A73 PolarHBondContact O-N 2.78Å; K70-A73 PolarHBondContact O-N 3.07Å; A73-M83 HydrophobicContact CB-CE 4.13Å; A73-M83 HydrophobicContact CB-SD 3.71Å; A73-F85 HydrophobicContact CB-CZ 4.39Å; A73-R102 PolarHBondContact O-NH2 2.98Å; A73-R102 VanDerWaalsContact O-NH2 3.14Å; A73-I105 HydrophobicContact CB-CG2 4.25Å; A73-L109 HydrophobicContact CB-CD1 4.01Å; A73-L109 HydrophobicContact CB-CD2 4.24Å
74	E	88.3	Confident	89	Confident	99 Å²	99	44.5 Å²	44.5	46%	0.463	23%	0.226	S	C	.	.	H	α-helix	trans	-73	-34.9	177	-71.6	177.9	162.8	0	0	112.7	K70 L72 I77	K70-E74 VanDerWaalsContact CE-CD 3.48Å; K70-E74 WeakPolarHBondContact CE-OE1 3.44Å; K70-E74 HydrophobicContact CG-CG 4.32Å; K70-E74 IonicContact NZ-OE1 3.02Å; K70-E74 WeakPolarHBondContact O-CB 3.33Å; K70-E74 WeakPolarHBondContact O-CG 3.39Å; K70-E74 PolarHBondContact O-N 2.92Å; L72-E74 VanDerWaalsContact C-N 3.3Å; L72-E74 PolarHBondContact O-N 2.82Å; E74-I77 WeakPolarHBondContact O-CG1 3.38Å
75	K	83.8	Confident	89.3	Confident	72 Å²	72	41 Å²	41	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-71.5	-39.1	177.9	-168	-168.4	178.4	-140.9	0	111.8	H71 L72 I77 F208 R212 D216	H71-K75 VanDerWaalsContact O-CB 3.27Å; H71-K75 WeakPolarHBondContact O-CB 3.5Å; H71-K75 PolarHBondContact O-N 3.14Å; L72-K75 PolarHBondContact O-N 2.8Å; K75-I77 PolarHBondContact O-N 3.43Å; K75-F208 HydrophobicContact CD-CE2 4.49Å; K75-F208 HydrophobicContact CD-CZ 3.98Å; K75-R212 HydrophobicContact CD-CG 4.14Å; K75-R212 VanDerWaalsContact CE-CZ 3.41Å; K75-R212 VanDerWaalsContact CE-NH2 3.31Å; K75-R212 VanDerWaalsContact NZ-CG 3.33Å; K75-D216 IonicContact NZ-OD2 2.83Å
76	F	80.1	Confident	89.5	Confident	18 Å²	18	41 Å²	41	8%	0.079	21%	0.21	C	C	.	.			trans	-90.6	93.7	-175.8	-62.8	-59.8	0	0	0	111.2	L72 L81 R102 I215	L72-F76 HydrophobicContact CB-CD2 4.15Å; L72-F76 HydrophobicContact CB-CE2 4.05Å; L72-F76 HydrophobicContact CD2-CD2 4.47Å; L72-F76 HydrophobicContact CD2-CE2 3.56Å; L72-F76 HydrophobicContact CD2-CZ 4.26Å; L72-F76 HydrophobicContact CG-CE2 4.35Å; L72-F76 WeakPolarHBondContact O-CD2 3.22Å; L72-F76 PolarHBondContact O-N 3.25Å; F76-L81 HydrophobicContact CB-CD1 3.94Å; F76-L81 HydrophobicContact CB-CD2 4.27Å; F76-L81 HydrophobicContact CD1-CD1 4.49Å; F76-L81 HydrophobicContact CG-CD1 4.11Å; F76-R102 PolarHBondContact O-NH1 3.16Å; F76-R102 PolarHBondContact O-NH2 3.26Å; F76-I215 HydrophobicContact CD1-CG2 4.1Å; F76-I215 HydrophobicContact CD2-CD1 4.47Å; F76-I215 HydrophobicContact CE1-CB 4Å; F76-I215 HydrophobicContact CE1-CD1 4.25Å; F76-I215 HydrophobicContact CE1-CG2 3.46Å; F76-I215 VanDerWaalsContact CE1-CG2 3.46Å; F76-I215 HydrophobicContact CE2-CD1 3.53Å; F76-I215 HydrophobicContact CZ-CB 3.88Å; F76-I215 HydrophobicContact CZ-CD1 3.41Å; F76-I215 VanDerWaalsContact CZ-CD1 3.41Å; F76-I215 HydrophobicContact CZ-CG1 4.23Å; F76-I215 HydrophobicContact CZ-CG2 3.77Å
77	I	77	Confident	89.6	Confident	119 Å²	119	39.6 Å²	39.6	61%	0.61	21%	0.205	S	C	*	.			trans	-101.2	4	-179.3	-36.3	179.8	0	0	0	112.4	E74 K75 R102	E74-I77 WeakPolarHBondContact O-CG1 3.38Å; K75-I77 PolarHBondContact O-N 3.43Å; I77-R102 VanDerWaalsContact CA-NH2 3.31Å
78	S	79.6	Confident	89.8	Confident	50 Å²	50	37.4 Å²	37.4	35%	0.35	19%	0.19	S	C	.	.			trans	-61.5	129.6	177.1	-177.4	0	0	0	0	110.5	M80 L81	S78-M80 PolarHBondContact O-N 2.87Å; S78-M80 PolarHBondContact OG-N 3.31Å; S78-L81 PolarHBondContact O-N 3.44Å; S78-L81 VanDerWaalsContact O-N 3.13Å
79	P	75.2	Confident	90	Very high	106 Å²	106	37.2 Å²	37.2	69%	0.688	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-15.2	174	29.2	-34.9	0	0	0	112.4	L81	P79-L81 PolarHBondContact O-N 3.01Å
80	M	81.6	Confident	90.1	Very high	93 Å²	93	40.5 Å²	40.5	46%	0.458	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-4	174.6	-57.4	-169.4	-63.1	0	0	112.7	A45 F46 S78	A45-M80 CarbonylContact C-O 3.53Å; A45-M80 VanDerWaalsContact CA-O 3.28Å; A45-M80 WeakPolarHBondContact CA-O 3.21Å; F46-M80 PolarHBondContact N-O 3.11Å; S78-M80 PolarHBondContact O-N 2.87Å; S78-M80 PolarHBondContact OG-N 3.31Å
81	L	87.8	Confident	90.2	Very high	9 Å²	9	44.2 Å²	44.2	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	120.1	-179.8	-171.6	146	0	0	0	110.6	F46 L48 F76 S78 P79 M83	F46-L81 WeakPolarHBondContact O-CA 3.38Å; L48-L81 HydrophobicContact CD1-CD1 3.82Å; L48-L81 HydrophobicContact CD1-CD2 4.07Å; L48-L81 HydrophobicContact CD1-CG 4.27Å; L48-L81 HydrophobicContact CG-CD1 4.21Å; L48-L81 HydrophobicContact CG-CD2 4.39Å; L48-L81 HydrophobicContact CG-CG 4.34Å; F76-L81 HydrophobicContact CB-CD1 3.94Å; F76-L81 HydrophobicContact CB-CD2 4.27Å; F76-L81 HydrophobicContact CD1-CD1 4.49Å; F76-L81 HydrophobicContact CG-CD1 4.11Å; S78-L81 PolarHBondContact O-N 3.44Å; S78-L81 VanDerWaalsContact O-N 3.13Å; P79-L81 PolarHBondContact O-N 3.01Å; L81-M83 HydrophobicContact CD2-CE 3.52Å
82	R	94	Very high	90.5	Very high	35 Å²	35	40 Å²	40	13%	0.132	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	151.3	170.9	-55.1	-171.6	-62.6	171.2	1.5	109.2	F46 D47 L48 L98 T99 E100 E137	F46-R82 PolarHBondContact O-N 2.77Å; D47-R82 WeakPolarHBondContact OD1-CB 3.46Å; D47-R82 IonicContact OD1-CZ 3.73Å; D47-R82 VanDerWaalsContact OD1-CZ 3.22Å; D47-R82 IonicContact OD1-NE 2.76Å; D47-R82 PolarHBondContact OD1-NE 3.2Å; D47-R82 IonicContact OD1-NH2 3.91Å; D47-R82 PolarHBondContact OD1-NH2 3.02Å; D47-R82 IonicContact OD2-CZ 3.83Å; D47-R82 IonicContact OD2-NE 3.26Å; D47-R82 IonicContact OD2-NH2 2.78Å; D47-R82 PolarHBondContact OD2-NH2 3.45Å; L48-R82 PolarHBondContact N-O 3.23Å; R82-L98 HydrophobicContact CB-CD1 3.67Å; R82-L98 HydrophobicContact CB-CG 3.87Å; R82-T99 VanDerWaalsContact CA-O 3.32Å; R82-T99 WeakPolarHBondContact CA-O 3.49Å; R82-E100 VanDerWaalsContact CD-OE2 3.3Å; R82-E100 WeakPolarHBondContact CD-OE2 3.15Å; R82-E100 HydrophobicContact CG-CB 4.01Å; R82-E137 IonicContact CZ-OE2 3.72Å; R82-E137 VanDerWaalsContact CZ-OE2 3.26Å; R82-E137 IonicContact NH1-OE2 3.48Å; R82-E137 PolarHBondContact NH1-OE2 2.86Å; R82-E137 IonicContact NH2-OE2 3.63Å; R82-E137 PolarHBondContact NH2-OE2 3.13Å
83	M	95.6	Very high	91	Very high	1 Å²	1	46 Å²	46	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.4	174.8	67.1	-171.9	69.9	0	0	113	L48 F50 A73 L81 F85 M96 L98 T99 I105	L48-M83 HydrophobicContact CB-CB 4.22Å; L48-M83 CarbonylContact O-C 3.45Å; L48-M83 WeakPolarHBondContact O-CA 3.5Å; F50-M83 HydrophobicContact CE2-CB 4.38Å; A73-M83 HydrophobicContact CB-CE 4.13Å; A73-M83 HydrophobicContact CB-SD 3.71Å; L81-M83 HydrophobicContact CD2-CE 3.52Å; M83-F85 HydrophobicContact CG-CE1 4.08Å; M83-F85 HydrophobicContact CG-CZ 4.23Å; M83-F85 HydrophobicContact SD-CE1 3.74Å; M83-F85 HydrophobicContact SD-CZ 3.63Å; M83-M96 HydrophobicContact CG-CE 3.69Å; M83-M96 WeakPolarHBondContact O-CE 3.45Å; M83-L98 WeakPolarHBondContact O-CA 3.41Å; M83-T99 PolarHBondContact N-O 3.11Å; M83-T99 PolarHBondContact O-N 2.89Å; M83-I105 HydrophobicContact CE-CD1 3.92Å; M83-I105 HydrophobicContact CE-CG2 4.4Å; M83-I105 HydrophobicContact CG-CD1 3.89Å; M83-I105 HydrophobicContact CG-CG1 3.81Å; M83-I105 HydrophobicContact SD-CB 4.43Å; M83-I105 HydrophobicContact SD-CD1 3.95Å; M83-I105 HydrophobicContact SD-CG1 3.93Å; M83-I105 HydrophobicContact SD-CG2 3.61Å
84	S	98.4	Very high	91.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143.1	171.4	177.4	0	0	0	0	109.7	L48 F50 M96 Q133	L48-S84 PolarHBondContact O-N 3.36Å; F50-S84 PolarHBondContact N-O 3.44Å; S84-M96 WeakPolarHBondContact CA-O 3.32Å; S84-M96 PolarHBondContact OG-O 3.23Å; S84-Q133 PolarHBondContact OG-NE2 2.93Å; S84-Q133 PolarHBondContact OG-OE1 3.41Å
85	F	98.8	Very high	91.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.7	174.6	-58.5	-29.8	0	0	0	110	F50 V69 A73 M83 I95 M96 I105 L109 L112	F50-F85 HydrophobicContact CB-CD1 4.12Å; F50-F85 AromaticContact CD2-CD1 3.72Å; F50-F85 HydrophobicContact CD2-CD1 3.72Å; F50-F85 AromaticContact CD2-CE1 3.62Å; F50-F85 HydrophobicContact CD2-CE1 3.62Å; F50-F85 HydrophobicContact CE2-CE1 4.06Å; F50-F85 HydrophobicContact CG-CD1 4.25Å; F50-F85 HydrophobicContact CG-CE1 4.44Å; V69-F85 HydrophobicContact CG1-CD1 4.02Å; V69-F85 HydrophobicContact CG1-CE1 3.58Å; V69-F85 HydrophobicContact CG1-CZ 4.07Å; A73-F85 HydrophobicContact CB-CZ 4.39Å; M83-F85 HydrophobicContact CG-CE1 4.08Å; M83-F85 HydrophobicContact CG-CZ 4.23Å; M83-F85 HydrophobicContact SD-CE1 3.74Å; M83-F85 HydrophobicContact SD-CZ 3.63Å; F85-I95 HydrophobicContact CB-CB 4.23Å; F85-I95 PolarHBondContact O-N 2.95Å; F85-M96 HydrophobicContact CB-CB 4.08Å; F85-M96 HydrophobicContact CD1-CE 4.11Å; F85-M96 HydrophobicContact CD2-CB 3.99Å; F85-M96 HydrophobicContact CD2-CE 3.49Å; F85-M96 VanDerWaalsContact CD2-CE 3.49Å; F85-M96 HydrophobicContact CD2-SD 3.91Å; F85-M96 HydrophobicContact CE1-CE 4.06Å; F85-M96 HydrophobicContact CE2-CE 3.43Å; F85-M96 VanDerWaalsContact CE2-CE 3.43Å; F85-M96 HydrophobicContact CE2-SD 3.92Å; F85-M96 HydrophobicContact CG-CB 4.3Å; F85-M96 HydrophobicContact CG-CE 3.83Å; F85-M96 HydrophobicContact CZ-CE 3.73Å; F85-M96 PolarHBondContact N-O 2.88Å; F85-M96 PolarHBondContact O-N 2.8Å; F85-M96 VanDerWaalsContact O-N 3.13Å; F85-I105 HydrophobicContact CZ-CG2 4.31Å; F85-L109 HydrophobicContact CE2-CD2 3.96Å; F85-L109 HydrophobicContact CE2-CG 3.93Å; F85-L109 HydrophobicContact CZ-CD2 3.85Å; F85-L109 HydrophobicContact CZ-CG 4.09Å; F85-L112 HydrophobicContact CB-CD1 3.96Å; F85-L112 HydrophobicContact CB-CD2 4.39Å; F85-L112 HydrophobicContact CB-CG 4.33Å; F85-L112 HydrophobicContact CD1-CD1 4.13Å; F85-L112 HydrophobicContact CD2-CD1 3.59Å; F85-L112 HydrophobicContact CD2-CG 4.17Å; F85-L112 HydrophobicContact CE2-CD1 4.08Å; F85-L112 HydrophobicContact CG-CD1 3.63Å; F85-L112 HydrophobicContact CG-CG 4.38Å
86	I	98.9	Very high	92.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.2	-178.9	-56.4	164.3	0	0	0	107.2	F50 V51 L52 K93 I94 M129 A130	F50-I86 WeakPolarHBondContact O-CA 3.5Å; F50-I86 WeakPolarHBondContact O-CB 3.39Å; F50-I86 PolarHBondContact O-N 3.48Å; F50-I86 VanDerWaalsContact O-O 3.12Å; V51-I86 HydrophobicContact CG2-CB 4.46Å; V51-I86 HydrophobicContact CG2-CD1 4.23Å; L52-I86 WeakPolarHBondContact CB-O 3.08Å; L52-I86 WeakPolarHBondContact CG-O 3.17Å; L52-I86 PolarHBondContact N-O 3.07Å; I86-K93 WeakPolarHBondContact CA-O 3.3Å; I86-I94 HydrophobicContact CG1-CG1 4.35Å; I86-M129 HydrophobicContact CD1-CB 4.2Å; I86-M129 HydrophobicContact CG2-CB 3.95Å; I86-M129 HydrophobicContact CG2-SD 4.05Å; I86-A130 HydrophobicContact CD1-CB 3.76Å
87	V	98.6	Very high	93.4	Very high	1 Å²	1	47 Å²	47	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	147.4	173.6	-60.6	0	0	0	0	109.9	L52 K54 W62 G92 K93 I95 L112 V115	L52-V87 HydrophobicContact CB-CG1 4.22Å; L52-V87 HydrophobicContact CD1-CG1 4.46Å; L52-V87 CarbonylContact O-C 3.54Å; L52-V87 VanDerWaalsContact O-CA 3.28Å; L52-V87 WeakPolarHBondContact O-CA 2.94Å; K54-V87 HydrophobicContact CD-CB 3.86Å; K54-V87 HydrophobicContact CD-CG2 3.78Å; K54-V87 HydrophobicContact CG-CB 4.05Å; K54-V87 HydrophobicContact CG-CG2 4.44Å; W62-V87 HydrophobicContact CH2-CG1 4.09Å; V87-G92 CarbonylContact O-C 2.8Å; V87-G92 WeakPolarHBondContact O-CA 3.32Å; V87-K93 HydrophobicContact CG2-CB 3.96Å; V87-K93 PolarHBondContact N-O 2.84Å; V87-K93 PolarHBondContact O-N 2.77Å; V87-I95 HydrophobicContact CB-CG1 4.4Å; V87-I95 HydrophobicContact CG1-CD1 4.48Å; V87-I95 HydrophobicContact CG1-CG1 3.74Å; V87-I95 HydrophobicContact CG2-CD1 3.91Å; V87-I95 HydrophobicContact CG2-CG1 3.83Å; V87-L112 HydrophobicContact CG1-CD2 3.68Å; V87-V115 HydrophobicContact CG1-CG2 4.44Å
88	F	98.1	Very high	94.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	144.6	173.3	71.2	-91.2	0	0	0	111.9	V51 L52 D53 K54 Q91 T121 M123	V51-F88 HydrophobicContact CG1-CD1 3.63Å; V51-F88 HydrophobicContact CG1-CE1 3.8Å; L52-F88 WeakPolarHBondContact O-CD1 3.36Å; L52-F88 PolarHBondContact O-N 3.46Å; D53-F88 HydrophobicContact CB-CE1 3.95Å; D53-F88 HydrophobicContact CB-CE2 3.95Å; D53-F88 HydrophobicContact CB-CZ 3.47Å; D53-F88 VanDerWaalsContact CB-CZ 3.47Å; K54-F88 VanDerWaalsContact CG-O 3.29Å; K54-F88 WeakPolarHBondContact CG-O 3.43Å; K54-F88 PolarHBondContact N-O 3.29Å; F88-Q91 WeakPolarHBondContact CA-O 3.36Å; F88-T121 HydrophobicContact CE2-CG2 3.89Å; F88-M123 VanDerWaalsContact CD2-CA 3.46Å; F88-M123 HydrophobicContact CD2-CB 4.21Å; F88-M123 HydrophobicContact CE1-CB 4.44Å; F88-M123 HydrophobicContact CE1-CE 4.44Å; F88-M123 HydrophobicContact CE1-CG 4.26Å; F88-M123 VanDerWaalsContact CE2-CA 3.47Å; F88-M123 HydrophobicContact CE2-CB 3.69Å; F88-M123 HydrophobicContact CE2-CG 4.36Å; F88-M123 HydrophobicContact CZ-CB 3.81Å; F88-M123 HydrophobicContact CZ-CE 3.85Å; F88-M123 HydrophobicContact CZ-CG 3.98Å
89	S	96.7	Very high	95.1	Very high	6 Å²	6	41.8 Å²	41.8	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-147.1	-112.1	159.3	63.6	0	0	0	0	108.9	K54 Q91 G118 D120 C122	K54-S89 PolarHBondContact NZ-OG 2.78Å; S89-Q91 PolarHBondContact N-O 2.98Å; S89-Q91 PolarHBondContact O-N 2.95Å; S89-G118 WeakPolarHBondContact CB-O 3.14Å; S89-G118 PolarHBondContact OG-O 3.06Å; S89-D120 CarbonylContact C-O 3.46Å; S89-D120 WeakPolarHBondContact CA-O 3.43Å; S89-D120 WeakPolarHBondContact CB-O 3.25Å; S89-C122 WeakPolarHBondContact O-CA 3.33Å; S89-C122 WeakPolarHBondContact O-CB 3.43Å; S89-C122 PolarHBondContact O-N 3.34Å
90	T	95.6	Very high	95.9	Very high	68 Å²	68	42 Å²	42	42%	0.417	21%	0.208	S	C	.	.	S	Bend	trans	-63.8	-24.7	168.8	-56.4	0	0	0	0	111.5	G119 D120 L125	T90-G119 WeakPolarHBondContact OG1-CA 3.36Å; T90-D120 PolarHBondContact N-O 2.85Å; T90-D120 PolarHBondContact OG1-N 3.2Å; T90-L125 WeakPolarHBondContact O-CD1 3.33Å
91	Q	96.1	Very high	96.5	Very high	149 Å²	149	41.4 Å²	41.4	70%	0.696	21%	0.207	S	C	*	.	S	Bend	trans	-133.6	150	176.9	-64.4	177.2	-4.9	0	0	109.5	F88 S89	F88-Q91 WeakPolarHBondContact CA-O 3.36Å; S89-Q91 PolarHBondContact N-O 2.98Å; S89-Q91 PolarHBondContact O-N 2.95Å
92	G	97.5	Very high	96.8	Very high	13 Å²	13	44.7 Å²	44.7	13%	0.134	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	149.5	163.4	0	0	0	0	0	110.6	V87 M129	V87-G92 CarbonylContact O-C 2.8Å; V87-G92 WeakPolarHBondContact O-CA 3.32Å; G92-M129 WeakPolarHBondContact O-CE 3.5Å
93	K	98.4	Very high	96.9	Very high	126 Å²	126	50 Å²	50	55%	0.548	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	132.9	168.9	-179.1	179.4	177.2	-173.6	0	110.5	I86 V87 I95 M129	I86-K93 WeakPolarHBondContact CA-O 3.3Å; V87-K93 HydrophobicContact CG2-CB 3.96Å; V87-K93 PolarHBondContact N-O 2.84Å; V87-K93 PolarHBondContact O-N 2.77Å; K93-I95 HydrophobicContact CD-CD1 4.02Å; K93-I95 HydrophobicContact CG-CD1 4.31Å; K93-I95 PolarHBondContact O-N 2.87Å; K93-M129 VanDerWaalsContact C-SD 3.56Å; K93-M129 VanDerWaalsContact CA-SD 3.56Å; K93-M129 PolarHBondContact N-SD 3.16Å
94	I	98.8	Very high	96.9	Very high	46 Å²	46	51.2 Å²	51.2	24%	0.236	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.7	166.5	-53.7	176.1	0	0	0	107.5	I86 M96 E97 M129 Q133	I86-I94 HydrophobicContact CG1-CG1 4.35Å; I94-M96 VanDerWaalsContact CG2-C 3.44Å; I94-M96 WeakPolarHBondContact CG2-O 3.43Å; I94-E97 WeakPolarHBondContact CD1-OE1 3.07Å; I94-E97 HydrophobicContact CG2-CG 4.18Å; I94-M129 HydrophobicContact CD1-CB 4.27Å; I94-M129 HydrophobicContact CG1-CB 4Å; I94-M129 HydrophobicContact CG1-CG 4.17Å; I94-M129 HydrophobicContact CG1-SD 3.79Å; I94-Q133 HydrophobicContact CD1-CG 4.49Å
95	I	98.6	Very high	96.8	Very high	40 Å²	40	51.5 Å²	51.5	21%	0.205	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-36.4	173	-62.5	-61.3	0	0	0	109.8	F85 V87 K93 A111 L112	F85-I95 HydrophobicContact CB-CB 4.23Å; F85-I95 PolarHBondContact O-N 2.95Å; V87-I95 HydrophobicContact CB-CG1 4.4Å; V87-I95 HydrophobicContact CG1-CD1 4.48Å; V87-I95 HydrophobicContact CG1-CG1 3.74Å; V87-I95 HydrophobicContact CG2-CD1 3.91Å; V87-I95 HydrophobicContact CG2-CG1 3.83Å; K93-I95 HydrophobicContact CD-CD1 4.02Å; K93-I95 HydrophobicContact CG-CD1 4.31Å; K93-I95 PolarHBondContact O-N 2.87Å; I95-A111 HydrophobicContact CG2-CB 3.64Å; I95-L112 HydrophobicContact CB-CD2 4.39Å; I95-L112 HydrophobicContact CG1-CD2 4.1Å; I95-L112 HydrophobicContact CG2-CD2 4.3Å; I95-L112 HydrophobicContact CG2-CG 4.34Å
96	M	98.6	Very high	96.7	Very high	16 Å²	16	54.5 Å²	54.5	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	120.9	178.4	-174.6	-177.8	77.1	0	0	109.5	M83 S84 F85 I94 T99 I105	M83-M96 HydrophobicContact CG-CE 3.69Å; M83-M96 WeakPolarHBondContact O-CE 3.45Å; S84-M96 WeakPolarHBondContact CA-O 3.32Å; S84-M96 PolarHBondContact OG-O 3.23Å; F85-M96 HydrophobicContact CB-CB 4.08Å; F85-M96 HydrophobicContact CD1-CE 4.11Å; F85-M96 HydrophobicContact CD2-CB 3.99Å; F85-M96 HydrophobicContact CD2-CE 3.49Å; F85-M96 VanDerWaalsContact CD2-CE 3.49Å; F85-M96 HydrophobicContact CD2-SD 3.91Å; F85-M96 HydrophobicContact CE1-CE 4.06Å; F85-M96 HydrophobicContact CE2-CE 3.43Å; F85-M96 VanDerWaalsContact CE2-CE 3.43Å; F85-M96 HydrophobicContact CE2-SD 3.92Å; F85-M96 HydrophobicContact CG-CB 4.3Å; F85-M96 HydrophobicContact CG-CE 3.83Å; F85-M96 HydrophobicContact CZ-CE 3.73Å; F85-M96 PolarHBondContact N-O 2.88Å; F85-M96 PolarHBondContact O-N 2.8Å; F85-M96 VanDerWaalsContact O-N 3.13Å; I94-M96 VanDerWaalsContact CG2-C 3.44Å; I94-M96 WeakPolarHBondContact CG2-O 3.43Å; M96-T99 HydrophobicContact CE-CG2 4.3Å; M96-T99 HydrophobicContact CG-CG2 4.3Å; M96-T99 HydrophobicContact SD-CG2 4.14Å; M96-I105 HydrophobicContact CE-CB 4.49Å; M96-I105 HydrophobicContact CE-CG1 3.86Å; M96-I105 WeakPolarHBondContact SD-CA 2.85Å; M96-I105 HydrophobicContact SD-CB 4.4Å; M96-I105 HydrophobicContact SD-CG1 4.13Å
97	E	98.3	Very high	96.7	Very high	110 Å²	110	60.3 Å²	60.3	51%	0.514	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	159	171.7	-64.5	-68.5	173.8	0	0	110.6	I94 T99 Q133	I94-E97 WeakPolarHBondContact CD1-OE1 3.07Å; I94-E97 HydrophobicContact CG2-CG 4.18Å; E97-T99 PolarHBondContact O-N 2.83Å; E97-Q133 PolarHBondContact OE2-OE1 2.86Å
98	L	96.9	Very high	96.7	Very high	25 Å²	25	60.4 Å²	60.4	13%	0.131	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	122.4	178.3	-174.1	73.2	0	0	0	111.7	D47 Y49 R82 M83 E137	D47-L98 HydrophobicContact CB-CD1 3.97Å; D47-L98 HydrophobicContact CB-CD2 4.19Å; Y49-L98 HydrophobicContact CE1-CB 4.37Å; Y49-L98 HydrophobicContact CE1-CD1 4.05Å; Y49-L98 HydrophobicContact CE1-CD2 4.32Å; Y49-L98 HydrophobicContact CE1-CG 4.5Å; Y49-L98 WeakPolarHBondContact OH-CD2 3.32Å; R82-L98 HydrophobicContact CB-CD1 3.67Å; R82-L98 HydrophobicContact CB-CG 3.87Å; M83-L98 WeakPolarHBondContact O-CA 3.41Å; L98-E137 HydrophobicContact CD2-CG 3.59Å
99	T	94.8	Very high	96.7	Very high	34 Å²	34	61.1 Å²	61.1	21%	0.209	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	149.9	-179.5	-167.7	0	0	0	0	112.7	R82 M83 M96 E97 N101 A104 I105	R82-T99 VanDerWaalsContact CA-O 3.32Å; R82-T99 WeakPolarHBondContact CA-O 3.49Å; M83-T99 PolarHBondContact N-O 3.11Å; M83-T99 PolarHBondContact O-N 2.89Å; M96-T99 HydrophobicContact CE-CG2 4.3Å; M96-T99 HydrophobicContact CG-CG2 4.3Å; M96-T99 HydrophobicContact SD-CG2 4.14Å; E97-T99 PolarHBondContact O-N 2.83Å; T99-N101 WeakPolarHBondContact OG1-CB 3.5Å; T99-N101 PolarHBondContact OG1-N 2.85Å; T99-A104 HydrophobicContact CG2-CB 3.96Å; T99-I105 HydrophobicContact CG2-CG1 4.15Å
100	E	92.8	Very high	96.8	Very high	111 Å²	111	68.4 Å²	68.4	52%	0.519	33%	0.334	S	S	.	.			trans	-88.6	-11.4	164	58.4	-139.7	-140.2	0	0	112.9	R82 R102	R82-E100 VanDerWaalsContact CD-OE2 3.3Å; R82-E100 WeakPolarHBondContact CD-OE2 3.15Å; R82-E100 HydrophobicContact CG-CB 4.01Å; E100-R102 PolarHBondContact O-N 2.77Å; E100-R102 VanDerWaalsContact O-N 3.17Å
101	N	94.3	Very high	96.9	Very high	79 Å²	79	67.2 Å²	67.2	42%	0.422	33%	0.332	S	S	.	.			trans	-67.8	116	-173.8	-177.6	-36.1	0	0	0	110.8	T99 E103 A104 I105	T99-N101 WeakPolarHBondContact OG1-CB 3.5Å; T99-N101 PolarHBondContact OG1-N 2.85Å; N101-E103 VanDerWaalsContact C-N 3.35Å; N101-E103 PolarHBondContact O-N 2.76Å; N101-E103 WeakPolarHBondContact OD1-CA 3.28Å; N101-E103 WeakPolarHBondContact OD1-CB 3.44Å; N101-E103 PolarHBondContact OD1-N 2.99Å; N101-A104 HydrophobicContact CB-CB 4Å; N101-A104 PolarHBondContact O-N 2.91Å; N101-A104 PolarHBondContact OD1-N 2.7Å; N101-A104 VanDerWaalsContact OD1-N 3.15Å; N101-I105 WeakPolarHBondContact O-CG1 3.41Å; N101-I105 PolarHBondContact O-N 2.83Å
102	R	92.8	Very high	97	Very high	79 Å²	79	60.1 Å²	60.1	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-69.6	-28.8	-175.2	-52.4	-57.9	-81.3	177.7	0.1	113.7	A73 F76 I77 E100 T106	A73-R102 PolarHBondContact O-NH2 2.98Å; A73-R102 VanDerWaalsContact O-NH2 3.14Å; F76-R102 PolarHBondContact O-NH1 3.16Å; F76-R102 PolarHBondContact O-NH2 3.26Å; I77-R102 VanDerWaalsContact CA-NH2 3.31Å; E100-R102 PolarHBondContact O-N 2.77Å; E100-R102 VanDerWaalsContact O-N 3.17Å; R102-T106 WeakPolarHBondContact O-CB 3.38Å; R102-T106 PolarHBondContact O-N 2.84Å; R102-T106 PolarHBondContact O-OG1 2.89Å
103	E	95.6	Very high	97	Very high	145 Å²	145	63.2 Å²	63.2	68%	0.678	31%	0.312	S	S	*	.	H	α-helix	trans	-68.4	-46.7	173.4	-63.4	-178.5	169.8	0	0	109.8	N101 I105 T106 E107	N101-E103 VanDerWaalsContact C-N 3.35Å; N101-E103 PolarHBondContact O-N 2.76Å; N101-E103 WeakPolarHBondContact OD1-CA 3.28Å; N101-E103 WeakPolarHBondContact OD1-CB 3.44Å; N101-E103 PolarHBondContact OD1-N 2.99Å; E103-I105 VanDerWaalsContact C-N 3.34Å; E103-I105 PolarHBondContact O-N 3.49Å; E103-T106 WeakPolarHBondContact O-CB 3.42Å; E103-T106 PolarHBondContact O-N 3.13Å; E103-T106 VanDerWaalsContact O-N 3.11Å; E103-E107 WeakPolarHBondContact O-CG 3.35Å; E103-E107 PolarHBondContact O-N 3.38Å
104	A	97.1	Very high	97	Very high	28 Å²	28	62.7 Å²	62.7	23%	0.231	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-42.1	175	0	0	0	0	0	111.8	T99 N101 T106 E107 G108	T99-A104 HydrophobicContact CG2-CB 3.96Å; N101-A104 HydrophobicContact CB-CB 4Å; N101-A104 PolarHBondContact O-N 2.91Å; N101-A104 PolarHBondContact OD1-N 2.7Å; N101-A104 VanDerWaalsContact OD1-N 3.15Å; A104-T106 VanDerWaalsContact C-N 3.33Å; A104-T106 PolarHBondContact O-N 3.27Å; A104-E107 PolarHBondContact O-N 3.42Å; A104-G108 PolarHBondContact O-N 2.94Å
105	I	96.4	Very high	96.9	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-43.4	173.7	-68.6	162.2	0	0	0	111.5	A73 M83 F85 M96 T99 N101 E103 E107 G108 L109	A73-I105 HydrophobicContact CB-CG2 4.25Å; M83-I105 HydrophobicContact CE-CD1 3.92Å; M83-I105 HydrophobicContact CE-CG2 4.4Å; M83-I105 HydrophobicContact CG-CD1 3.89Å; M83-I105 HydrophobicContact CG-CG1 3.81Å; M83-I105 HydrophobicContact SD-CB 4.43Å; M83-I105 HydrophobicContact SD-CD1 3.95Å; M83-I105 HydrophobicContact SD-CG1 3.93Å; M83-I105 HydrophobicContact SD-CG2 3.61Å; F85-I105 HydrophobicContact CZ-CG2 4.31Å; M96-I105 HydrophobicContact CE-CB 4.49Å; M96-I105 HydrophobicContact CE-CG1 3.86Å; M96-I105 WeakPolarHBondContact SD-CA 2.85Å; M96-I105 HydrophobicContact SD-CB 4.4Å; M96-I105 HydrophobicContact SD-CG1 4.13Å; T99-I105 HydrophobicContact CG2-CG1 4.15Å; N101-I105 WeakPolarHBondContact O-CG1 3.41Å; N101-I105 PolarHBondContact O-N 2.83Å; E103-I105 VanDerWaalsContact C-N 3.34Å; E103-I105 PolarHBondContact O-N 3.49Å; I105-E107 VanDerWaalsContact C-N 3.34Å; I105-E107 PolarHBondContact O-N 2.88Å; I105-G108 PolarHBondContact O-N 3.47Å; I105-L109 HydrophobicContact CG2-CD1 4.33Å; I105-L109 WeakPolarHBondContact O-CG 3.47Å; I105-L109 PolarHBondContact O-N 3.28Å
106	T	96.7	Very high	96.9	Very high	64 Å²	64	66.7 Å²	66.7	39%	0.393	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177.5	-58.8	0	0	0	0	111.4	R102 E103 A104 L109 R110	R102-T106 WeakPolarHBondContact O-CB 3.38Å; R102-T106 PolarHBondContact O-N 2.84Å; R102-T106 PolarHBondContact O-OG1 2.89Å; E103-T106 WeakPolarHBondContact O-CB 3.42Å; E103-T106 PolarHBondContact O-N 3.13Å; E103-T106 VanDerWaalsContact O-N 3.11Å; A104-T106 VanDerWaalsContact C-N 3.33Å; A104-T106 PolarHBondContact O-N 3.27Å; T106-L109 PolarHBondContact O-N 3.35Å; T106-R110 WeakPolarHBondContact O-CG 3.08Å; T106-R110 PolarHBondContact O-N 3.07Å; T106-R110 VanDerWaalsContact O-N 3.1Å
107	E	98.2	Very high	96.8	Very high	121 Å²	121	66.8 Å²	66.8	57%	0.565	34%	0.338	S	S	*	.	H	α-helix	trans	-66.9	-41.3	174.9	-70.2	-179	176.2	0	0	112.2	E103 A104 I105 L109 R110 A111	E103-E107 WeakPolarHBondContact O-CG 3.35Å; E103-E107 PolarHBondContact O-N 3.38Å; A104-E107 PolarHBondContact O-N 3.42Å; I105-E107 VanDerWaalsContact C-N 3.34Å; I105-E107 PolarHBondContact O-N 2.88Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 2.9Å; E107-R110 WeakPolarHBondContact O-CB 3.4Å; E107-R110 PolarHBondContact O-N 2.65Å; E107-A111 PolarHBondContact O-N 2.92Å
108	G	98.4	Very high	96.7	Very high	4 Å²	4	62.9 Å²	62.9	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-41.4	174.2	0	0	0	0	0	112.2	A104 I105 A111 L112	A104-G108 PolarHBondContact O-N 2.94Å; I105-G108 PolarHBondContact O-N 3.47Å; G108-A111 PolarHBondContact O-N 2.97Å; G108-L112 WeakPolarHBondContact O-CG 3.43Å; G108-L112 PolarHBondContact O-N 3.17Å
109	L	98.3	Very high	96.6	Very high	15 Å²	15	63.9 Å²	63.9	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-64.5	-40.9	174.3	-73.2	172.5	0	0	0	111.9	Y66 V69 K70 A73 F85 I105 T106 E107 L112 N113	Y66-L109 WeakPolarHBondContact CE2-O 3.43Å; V69-L109 HydrophobicContact CG1-CD2 4.2Å; K70-L109 HydrophobicContact CB-CD2 4.16Å; A73-L109 HydrophobicContact CB-CD1 4.01Å; A73-L109 HydrophobicContact CB-CD2 4.24Å; F85-L109 HydrophobicContact CE2-CD2 3.96Å; F85-L109 HydrophobicContact CE2-CG 3.93Å; F85-L109 HydrophobicContact CZ-CD2 3.85Å; F85-L109 HydrophobicContact CZ-CG 4.09Å; I105-L109 HydrophobicContact CG2-CD1 4.33Å; I105-L109 WeakPolarHBondContact O-CG 3.47Å; I105-L109 PolarHBondContact O-N 3.28Å; T106-L109 PolarHBondContact O-N 3.35Å; E107-L109 VanDerWaalsContact C-N 3.33Å; E107-L109 PolarHBondContact O-N 2.9Å; L109-L112 PolarHBondContact O-N 3.29Å; L109-N113 PolarHBondContact O-N 3.46Å
110	R	98.3	Very high	96.5	Very high	158 Å²	158	65.8 Å²	65.8	60%	0.596	35%	0.353	S	S	*	.	H	α-helix	trans	-61.8	-45	173.4	-69.2	174.2	-170.6	158.3	3.8	111	T106 E107 L112 N113 D114	T106-R110 WeakPolarHBondContact O-CG 3.08Å; T106-R110 PolarHBondContact O-N 3.07Å; T106-R110 VanDerWaalsContact O-N 3.1Å; E107-R110 WeakPolarHBondContact O-CB 3.4Å; E107-R110 PolarHBondContact O-N 2.65Å; R110-L112 VanDerWaalsContact C-N 3.32Å; R110-L112 PolarHBondContact O-N 2.93Å; R110-N113 WeakPolarHBondContact O-CB 3.09Å; R110-N113 PolarHBondContact O-N 2.66Å; R110-D114 PolarHBondContact O-N 2.98Å
111	A	98.4	Very high	96.6	Very high	44 Å²	44	61.1 Å²	61.1	36%	0.364	33%	0.332	S	S	.	.	H	α-helix	trans	-62.5	-38	177.3	0	0	0	0	0	112.4	I95 E107 G108 D114 V115	I95-A111 HydrophobicContact CG2-CB 3.64Å; E107-A111 PolarHBondContact O-N 2.92Å; G108-A111 PolarHBondContact O-N 2.97Å; A111-D114 PolarHBondContact O-N 3.17Å; A111-V115 PolarHBondContact O-N 2.77Å
112	L	98.1	Very high	96.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.9	-40.4	173.3	-76.4	179.8	0	0	0	112.6	L52 W62 Y66 V69 F85 V87 I95 G108 L109 R110 D114 V115	L52-L112 HydrophobicContact CD1-CD1 3.81Å; L52-L112 HydrophobicContact CD1-CD2 3.65Å; L52-L112 HydrophobicContact CD1-CG 4.4Å; W62-L112 HydrophobicContact CH2-CD2 4.35Å; W62-L112 HydrophobicContact CZ2-CD2 4.31Å; W62-L112 VanDerWaalsContact CZ2-O 3.31Å; W62-L112 WeakPolarHBondContact CZ2-O 3.4Å; W62-L112 PolarHBondContact NE1-O 3.27Å; W62-L112 VanDerWaalsContact NE1-O 3.14Å; Y66-L112 HydrophobicContact CD2-CB 4.09Å; Y66-L112 HydrophobicContact CE2-CB 4.48Å; V69-L112 HydrophobicContact CG1-CD1 3.98Å; F85-L112 HydrophobicContact CB-CD1 3.96Å; F85-L112 HydrophobicContact CB-CD2 4.39Å; F85-L112 HydrophobicContact CB-CG 4.33Å; F85-L112 HydrophobicContact CD1-CD1 4.13Å; F85-L112 HydrophobicContact CD2-CD1 3.59Å; F85-L112 HydrophobicContact CD2-CG 4.17Å; F85-L112 HydrophobicContact CE2-CD1 4.08Å; F85-L112 HydrophobicContact CG-CD1 3.63Å; F85-L112 HydrophobicContact CG-CG 4.38Å; V87-L112 HydrophobicContact CG1-CD2 3.68Å; I95-L112 HydrophobicContact CB-CD2 4.39Å; I95-L112 HydrophobicContact CG1-CD2 4.1Å; I95-L112 HydrophobicContact CG2-CD2 4.3Å; I95-L112 HydrophobicContact CG2-CG 4.34Å; G108-L112 WeakPolarHBondContact O-CG 3.43Å; G108-L112 PolarHBondContact O-N 3.17Å; L109-L112 PolarHBondContact O-N 3.29Å; R110-L112 VanDerWaalsContact C-N 3.32Å; R110-L112 PolarHBondContact O-N 2.93Å; L112-D114 PolarHBondContact O-N 2.75Å; L112-V115 HydrophobicContact CD2-CG2 4.44Å; L112-V115 WeakPolarHBondContact O-CB 3.31Å; L112-V115 PolarHBondContact O-N 3.42Å; L112-V115 VanDerWaalsContact O-N 3.16Å
113	N	97.7	Very high	96.8	Very high	77 Å²	77	54.6 Å²	54.6	41%	0.412	30%	0.304	S	S	.	.	H	α-helix	trans	-58.2	-33.4	177	-176.1	82.7	0	0	0	112.2	Y66 L109 R110	Y66-N113 HydrophobicContact CD2-CB 4.33Å; Y66-N113 HydrophobicContact CE1-CB 4.2Å; Y66-N113 WeakPolarHBondContact CE1-OD1 3.37Å; Y66-N113 HydrophobicContact CE2-CB 3.76Å; L109-N113 PolarHBondContact O-N 3.46Å; R110-N113 WeakPolarHBondContact O-CB 3.09Å; R110-N113 PolarHBondContact O-N 2.66Å
114	D	97.4	Very high	96.9	Very high	116 Å²	116	49 Å²	49	62%	0.62	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	0.2	-177.1	-61.3	-17.7	0	0	0	113.4	R110 A111 L112 I116	R110-D114 PolarHBondContact O-N 2.98Å; A111-D114 PolarHBondContact O-N 3.17Å; L112-D114 PolarHBondContact O-N 2.75Å; D114-I116 PolarHBondContact O-N 2.78Å
115	V	97.7	Very high	96.9	Very high	21 Å²	21	49.9 Å²	49.9	13%	0.127	28%	0.28	C	S	.	.			trans	-64.3	131.1	176	168.5	0	0	0	0	110.1	K54 W62 V87 A111 L112 P117	K54-V115 HydrophobicContact CB-CG1 3.87Å; K54-V115 HydrophobicContact CD-CG1 3.52Å; K54-V115 HydrophobicContact CG-CG1 4.33Å; W62-V115 HydrophobicContact CD2-CG1 4.49Å; W62-V115 HydrophobicContact CH2-CB 4.21Å; W62-V115 HydrophobicContact CH2-CG1 3.94Å; W62-V115 HydrophobicContact CZ2-CB 3.46Å; W62-V115 VanDerWaalsContact CZ2-CB 3.46Å; W62-V115 HydrophobicContact CZ2-CG1 3.64Å; W62-V115 HydrophobicContact CZ2-CG2 3.95Å; W62-V115 HydrophobicContact CZ3-CG1 4.46Å; V87-V115 HydrophobicContact CG1-CG2 4.44Å; A111-V115 PolarHBondContact O-N 2.77Å; L112-V115 HydrophobicContact CD2-CG2 4.44Å; L112-V115 WeakPolarHBondContact O-CB 3.31Å; L112-V115 PolarHBondContact O-N 3.42Å; L112-V115 VanDerWaalsContact O-N 3.16Å; V115-P117 WeakPolarHBondContact O-CD 3.41Å
116	I	97.3	Very high	97	Very high	148 Å²	148	49.7 Å²	49.7	76%	0.759	28%	0.279	S	S	*	.			trans	-100.7	113.9	173.9	-56.6	175.3	0	0	0	108.3	D114	D114-I116 PolarHBondContact O-N 2.78Å
117	P	97.2	Very high	97.1	Very high	18 Å²	18	46.6 Å²	46.6	12%	0.117	26%	0.26	C	S	.	.			trans	-66.8	144.3	177.8	-20	31.1	0	0	0	112.9	K54 K59 W62 V115	K54-P117 CarbonylContact O-C 3.58Å; K54-P117 WeakPolarHBondContact O-CA 3.18Å; K59-P117 HydrophobicContact CB-CB 4.18Å; K59-P117 HydrophobicContact CG-CB 4.44Å; W62-P117 HydrophobicContact CB-CG 3.49Å; W62-P117 VanDerWaalsContact CB-CG 3.49Å; W62-P117 HydrophobicContact CD2-CG 4.1Å; W62-P117 HydrophobicContact CE3-CG 4.37Å; W62-P117 HydrophobicContact CG-CG 3.71Å; V115-P117 WeakPolarHBondContact O-CD 3.41Å
118	G	95.6	Very high	97.1	Very high	28 Å²	28	45.2 Å²	45.2	29%	0.289	25%	0.253	S	S	.	.			trans	164.1	161.8	177.8	0	0	0	0	0	113.1	K54 S89	K54-G118 PolarHBondContact O-N 2.96Å; S89-G118 WeakPolarHBondContact CB-O 3.14Å; S89-G118 PolarHBondContact OG-O 3.06Å
119	G	94.7	Very high	97.1	Very high	46 Å²	46	47.5 Å²	47.5	47%	0.474	26%	0.264	S	S	.	.	S	Bend	trans	96	-174.2	-176.4	0	0	0	0	0	113	G56 T90	G56-G119 PolarHBondContact N-O 3.43Å; T90-G119 WeakPolarHBondContact OG1-CA 3.36Å
120	D	93.4	Very high	97.2	Very high	74 Å²	74	46.8 Å²	46.8	40%	0.396	26%	0.26	S	S	.	.			trans	-74.6	177.4	176.7	-69.3	-66.8	0	0	0	111.9	S55 S89 T90 K157	S55-D120 VanDerWaalsContact CB-O 3.27Å; S55-D120 WeakPolarHBondContact CB-O 3.5Å; S89-D120 CarbonylContact C-O 3.46Å; S89-D120 WeakPolarHBondContact CA-O 3.43Å; S89-D120 WeakPolarHBondContact CB-O 3.25Å; T90-D120 PolarHBondContact N-O 2.85Å; T90-D120 PolarHBondContact OG1-N 3.2Å; D120-K157 IonicContact OD1-NZ 2.76Å; D120-K157 PolarHBondContact OD1-NZ 2.97Å
121	T	94.3	Very high	97.2	Very high	14 Å²	14	39.3 Å²	39.3	9%	0.086	23%	0.232	C	C	.	.			trans	-110.9	78.1	-177.7	-43.9	0	0	0	0	110.7	D53 S55 F88 M123 L156 Q160	D53-T121 WeakPolarHBondContact OD2-CG2 3.28Å; S55-T121 VanDerWaalsContact CB-OG1 3.29Å; S55-T121 WeakPolarHBondContact CB-OG1 3.15Å; S55-T121 PolarHBondContact OG-OG1 3.03Å; F88-T121 HydrophobicContact CE2-CG2 3.89Å; T121-M123 PolarHBondContact O-N 2.85Å; T121-L156 HydrophobicContact CG2-CD2 3.67Å; T121-L156 WeakPolarHBondContact O-CD2 3.48Å; T121-Q160 PolarHBondContact O-OE1 3.44Å
122	C	95.6	Very high	97.2	Very high	21 Å²	21	40 Å²	40	14%	0.142	24%	0.237	C	C	.	.			trans	-98.4	70.4	178.7	-56.2	0	0	0	0	111.4	S89 N124 L125	S89-C122 WeakPolarHBondContact O-CA 3.33Å; S89-C122 WeakPolarHBondContact O-CB 3.43Å; S89-C122 PolarHBondContact O-N 3.34Å; C122-N124 PolarHBondContact O-N 3.21Å; C122-L125 HydrophobicContact CB-CD1 3.75Å; C122-L125 HydrophobicContact CB-CG 4.01Å; C122-L125 WeakPolarHBondContact O-CB 3.44Å; C122-L125 PolarHBondContact O-N 3.15Å; C122-L125 VanDerWaalsContact O-N 3.08Å
123	M	96.6	Very high	97.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56	-34.5	-178.1	177	-178.4	-80.4	0	0	113.6	F88 T121 L125 G126 L127 T152 L156 A164 I194	F88-M123 VanDerWaalsContact CD2-CA 3.46Å; F88-M123 HydrophobicContact CD2-CB 4.21Å; F88-M123 HydrophobicContact CE1-CB 4.44Å; F88-M123 HydrophobicContact CE1-CE 4.44Å; F88-M123 HydrophobicContact CE1-CG 4.26Å; F88-M123 VanDerWaalsContact CE2-CA 3.47Å; F88-M123 HydrophobicContact CE2-CB 3.69Å; F88-M123 HydrophobicContact CE2-CG 4.36Å; F88-M123 HydrophobicContact CZ-CB 3.81Å; F88-M123 HydrophobicContact CZ-CE 3.85Å; F88-M123 HydrophobicContact CZ-CG 3.98Å; T121-M123 PolarHBondContact O-N 2.85Å; M123-L125 PolarHBondContact O-N 2.88Å; M123-L125 VanDerWaalsContact O-N 3.11Å; M123-G126 PolarHBondContact O-N 3.42Å; M123-L127 HydrophobicContact CG-CD1 4.02Å; M123-L127 HydrophobicContact CG-CG 4.26Å; M123-L127 PolarHBondContact O-N 3.04Å; M123-L127 VanDerWaalsContact O-N 3.09Å; M123-L127 HydrophobicContact SD-CD1 4.35Å; M123-T152 HydrophobicContact CE-CG2 3.25Å; M123-L156 HydrophobicContact CB-CD1 4.49Å; M123-L156 HydrophobicContact CB-CD2 3.91Å; M123-L156 HydrophobicContact CE-CD1 4.48Å; M123-L156 HydrophobicContact SD-CD1 4.13Å; M123-A164 HydrophobicContact CB-CB 4.12Å; M123-A164 HydrophobicContact CG-CB 4.23Å; M123-A164 HydrophobicContact SD-CB 4.19Å; M123-I194 HydrophobicContact SD-CG1 4.34Å; M123-I194 HydrophobicContact SD-CG2 3.85Å
124	N	97.1	Very high	97.1	Very high	27 Å²	27	37 Å²	37	14%	0.144	22%	0.221	C	C	.	.	H	α-helix	trans	-52.8	-34.5	177.4	67.7	-71.5	0	0	0	112.5	C122 L127 E128 E167	C122-N124 PolarHBondContact O-N 3.21Å; N124-L127 PolarHBondContact O-N 3.37Å; N124-E128 WeakPolarHBondContact O-CB 3.26Å; N124-E128 PolarHBondContact O-N 2.93Å; N124-E167 HydrophobicContact CB-CG 4.2Å
125	L	98	Very high	97	Very high	47 Å²	47	37.3 Å²	37.3	25%	0.246	21%	0.214	C	C	.	.	H	α-helix	trans	-71.2	-32.1	179.7	-58.8	179	0	0	0	112.4	T90 C122 M123 M129	T90-L125 WeakPolarHBondContact O-CD1 3.33Å; C122-L125 HydrophobicContact CB-CD1 3.75Å; C122-L125 HydrophobicContact CB-CG 4.01Å; C122-L125 WeakPolarHBondContact O-CB 3.44Å; C122-L125 PolarHBondContact O-N 3.15Å; C122-L125 VanDerWaalsContact O-N 3.08Å; M123-L125 PolarHBondContact O-N 2.88Å; M123-L125 VanDerWaalsContact O-N 3.11Å; L125-M129 WeakPolarHBondContact O-CG 3.38Å; L125-M129 PolarHBondContact O-N 2.96Å
126	G	98.4	Very high	96.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-70.9	-42.5	173.2	0	0	0	0	0	111.8	M123 M129 A130	M123-G126 PolarHBondContact O-N 3.42Å; G126-M129 PolarHBondContact O-N 3.43Å; G126-A130 PolarHBondContact O-N 3.39Å; G126-A130 VanDerWaalsContact O-N 3.15Å
127	L	98.6	Very high	96.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-39.2	175.9	-68	170.6	0	0	0	112.1	M123 N124 M129 A130 N131 I148 A164 E167 A168 I194	M123-L127 HydrophobicContact CG-CD1 4.02Å; M123-L127 HydrophobicContact CG-CG 4.26Å; M123-L127 PolarHBondContact O-N 3.04Å; M123-L127 VanDerWaalsContact O-N 3.09Å; M123-L127 HydrophobicContact SD-CD1 4.35Å; N124-L127 PolarHBondContact O-N 3.37Å; L127-M129 VanDerWaalsContact C-N 3.29Å; L127-M129 PolarHBondContact O-N 3.01Å; L127-A130 PolarHBondContact O-N 3.33Å; L127-N131 WeakPolarHBondContact O-CB 3.07Å; L127-N131 PolarHBondContact O-N 2.92Å; L127-N131 PolarHBondContact O-ND2 3.35Å; L127-I148 HydrophobicContact CD2-CD1 4.28Å; L127-I148 HydrophobicContact CD2-CG2 4.09Å; L127-A164 HydrophobicContact CD1-CB 4.44Å; L127-A164 WeakPolarHBondContact CD1-O 3.44Å; L127-E167 HydrophobicContact CB-CB 3.62Å; L127-E167 HydrophobicContact CD1-CB 4.15Å; L127-A168 HydrophobicContact CD1-CB 4.08Å; L127-I194 HydrophobicContact CD1-CG2 4.38Å
128	E	98.6	Very high	96.3	Very high	92 Å²	92	38.2 Å²	38.2	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-58.8	-40.8	175.3	-175.9	179.1	175.8	0	0	111.7	N124 N131 A132	N124-E128 WeakPolarHBondContact O-CB 3.26Å; N124-E128 PolarHBondContact O-N 2.93Å; E128-N131 PolarHBondContact O-N 3.36Å; E128-A132 WeakPolarHBondContact O-CB 3.42Å; E128-A132 PolarHBondContact O-N 3.28Å
129	M	98.8	Very high	95.9	Very high	52 Å²	52	46 Å²	46	26%	0.256	24%	0.235	S	C	.	.	H	α-helix	trans	-67.1	-39.2	176.4	-71.3	-178.8	171.2	0	0	112.8	I86 G92 K93 I94 L125 G126 L127 Q133	I86-M129 HydrophobicContact CD1-CB 4.2Å; I86-M129 HydrophobicContact CG2-CB 3.95Å; I86-M129 HydrophobicContact CG2-SD 4.05Å; G92-M129 WeakPolarHBondContact O-CE 3.5Å; K93-M129 VanDerWaalsContact C-SD 3.56Å; K93-M129 VanDerWaalsContact CA-SD 3.56Å; K93-M129 PolarHBondContact N-SD 3.16Å; I94-M129 HydrophobicContact CD1-CB 4.27Å; I94-M129 HydrophobicContact CG1-CB 4Å; I94-M129 HydrophobicContact CG1-CG 4.17Å; I94-M129 HydrophobicContact CG1-SD 3.79Å; L125-M129 WeakPolarHBondContact O-CG 3.38Å; L125-M129 PolarHBondContact O-N 2.96Å; G126-M129 PolarHBondContact O-N 3.43Å; L127-M129 VanDerWaalsContact C-N 3.29Å; L127-M129 PolarHBondContact O-N 3.01Å; M129-Q133 PolarHBondContact O-N 3.14Å
130	A	98.6	Very high	95.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.5	-47.8	173.3	0	0	0	0	0	110.6	Y49 V51 I86 G126 L127 A132 Q133 I134 I148	Y49-A130 HydrophobicContact CD1-CB 4.47Å; Y49-A130 HydrophobicContact CG-CB 4.39Å; V51-A130 HydrophobicContact CG2-CB 4.11Å; I86-A130 HydrophobicContact CD1-CB 3.76Å; G126-A130 PolarHBondContact O-N 3.39Å; G126-A130 VanDerWaalsContact O-N 3.15Å; L127-A130 PolarHBondContact O-N 3.33Å; A130-A132 VanDerWaalsContact C-N 3.26Å; A130-A132 PolarHBondContact O-N 2.95Å; A130-Q133 PolarHBondContact O-N 3.02Å; A130-Q133 VanDerWaalsContact O-N 3.12Å; A130-I134 VanDerWaalsContact O-CG1 3.31Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 2.95Å; A130-I148 HydrophobicContact CB-CD1 3.85Å; A130-I148 HydrophobicContact CB-CG1 4.32Å
131	N	98.4	Very high	94.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.5	-39.5	177.9	-72.5	-18.7	0	0	0	112.4	L127 E128 Y135 E167 A171 L174	L127-N131 WeakPolarHBondContact O-CB 3.07Å; L127-N131 PolarHBondContact O-N 2.92Å; L127-N131 PolarHBondContact O-ND2 3.35Å; E128-N131 PolarHBondContact O-N 3.36Å; N131-Y135 VanDerWaalsContact O-CB 3.26Å; N131-Y135 WeakPolarHBondContact O-CB 3.41Å; N131-Y135 PolarHBondContact O-N 3.24Å; N131-E167 PolarHBondContact ND2-O 3.39Å; N131-E167 PolarHBondContact ND2-OE2 3.31Å; N131-A171 WeakPolarHBondContact OD1-CA 3.37Å; N131-A171 WeakPolarHBondContact OD1-CB 3.34Å; N131-A171 PolarHBondContact OD1-N 3.09Å; N131-L174 HydrophobicContact CB-CD1 4.13Å
132	A	98.3	Very high	92.9	Very high	58 Å²	58	53 Å²	53	48%	0.479	27%	0.271	S	S	.	.	H	α-helix	trans	-63.3	-44.8	177.3	0	0	0	0	0	112.1	E128 A130 H136	E128-A132 WeakPolarHBondContact O-CB 3.42Å; E128-A132 PolarHBondContact O-N 3.28Å; A130-A132 VanDerWaalsContact C-N 3.26Å; A130-A132 PolarHBondContact O-N 2.95Å; A132-H136 PolarHBondContact O-N 3.42Å; A132-H136 VanDerWaalsContact O-N 3.15Å
133	Q	97.7	Very high	91.4	Very high	16 Å²	16	62.9 Å²	62.9	8%	0.075	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-45.9	176.1	-70.2	-178.2	73.7	0	0	111.4	Y49 S84 I94 E97 M129 A130 Y135 H136 E137	Y49-Q133 HydrophobicContact CD1-CB 4.41Å; Y49-Q133 HydrophobicContact CE1-CB 3.61Å; S84-Q133 PolarHBondContact OG-NE2 2.93Å; S84-Q133 PolarHBondContact OG-OE1 3.41Å; I94-Q133 HydrophobicContact CD1-CG 4.49Å; E97-Q133 PolarHBondContact OE2-OE1 2.86Å; M129-Q133 PolarHBondContact O-N 3.14Å; A130-Q133 PolarHBondContact O-N 3.02Å; A130-Q133 VanDerWaalsContact O-N 3.12Å; Q133-Y135 VanDerWaalsContact C-N 3.32Å; Q133-Y135 PolarHBondContact O-N 2.84Å; Q133-H136 WeakPolarHBondContact O-CB 3.45Å; Q133-H136 PolarHBondContact O-N 3.31Å; Q133-H136 VanDerWaalsContact O-N 3.07Å; Q133-E137 WeakPolarHBondContact O-CG 3.37Å; Q133-E137 PolarHBondContact O-N 3.39Å
134	I	96.5	Very high	90.5	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.6	-46	177.7	-65.3	159.2	0	0	0	110.8	Y49 A130 H136 E137 N138 I148 L174 A176	Y49-I134 HydrophobicContact CD2-CD1 4.16Å; Y49-I134 HydrophobicContact CD2-CG1 3.99Å; Y49-I134 HydrophobicContact CE1-CG1 4.21Å; Y49-I134 HydrophobicContact CE2-CD1 4.05Å; Y49-I134 HydrophobicContact CE2-CG1 3.39Å; A130-I134 VanDerWaalsContact O-CG1 3.31Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 2.95Å; I134-H136 VanDerWaalsContact C-N 3.27Å; I134-H136 PolarHBondContact O-N 2.97Å; I134-E137 PolarHBondContact O-N 3.46Å; I134-N138 WeakPolarHBondContact O-CB 3.47Å; I134-N138 PolarHBondContact O-N 3.09Å; I134-I148 HydrophobicContact CD1-CD1 3.94Å; I134-I148 HydrophobicContact CD1-CG1 4.16Å; I134-L174 HydrophobicContact CB-CD1 4.41Å; I134-L174 HydrophobicContact CG2-CB 3.73Å; I134-L174 HydrophobicContact CG2-CD1 4.26Å; I134-A176 HydrophobicContact CD1-CB 3.83Å
135	Y	95.6	Very high	90.1	Very high	121 Å²	121	64.6 Å²	64.6	48%	0.475	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-37.1	177.6	178.4	-96.8	0	0	0	112.5	N131 Q133 R139 L174	N131-Y135 VanDerWaalsContact O-CB 3.26Å; N131-Y135 WeakPolarHBondContact O-CB 3.41Å; N131-Y135 PolarHBondContact O-N 3.24Å; Q133-Y135 VanDerWaalsContact C-N 3.32Å; Q133-Y135 PolarHBondContact O-N 2.84Å; Y135-R139 WeakPolarHBondContact O-CG 3.39Å; Y135-L174 HydrophobicContact CD2-CD2 3.98Å
136	H	94.3	Very high	89.8	Confident	109 Å²	109	62.5 Å²	62.5	51%	0.505	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-50.9	174.6	179.2	-90.9	0	0	0	111.2	A132 Q133 I134 N138 R139 V140	A132-H136 PolarHBondContact O-N 3.42Å; A132-H136 VanDerWaalsContact O-N 3.15Å; Q133-H136 WeakPolarHBondContact O-CB 3.45Å; Q133-H136 PolarHBondContact O-N 3.31Å; Q133-H136 VanDerWaalsContact O-N 3.07Å; I134-H136 VanDerWaalsContact C-N 3.27Å; I134-H136 PolarHBondContact O-N 2.97Å; H136-N138 PolarHBondContact O-N 2.84Å; H136-R139 WeakPolarHBondContact O-CB 3.33Å; H136-R139 PolarHBondContact O-N 3.22Å; H136-R139 VanDerWaalsContact O-N 3.09Å; H136-V140 PolarHBondContact O-N 2.89Å
137	E	92.4	Very high	89.7	Confident	26 Å²	26	63.4 Å²	63.4	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-41.4	-176.9	-65.9	-51.7	112	0	0	112.5	R82 L98 Q133 I134 R139 V140 T141	R82-E137 IonicContact CZ-OE2 3.72Å; R82-E137 VanDerWaalsContact CZ-OE2 3.26Å; R82-E137 IonicContact NH1-OE2 3.48Å; R82-E137 PolarHBondContact NH1-OE2 2.86Å; R82-E137 IonicContact NH2-OE2 3.63Å; R82-E137 PolarHBondContact NH2-OE2 3.13Å; L98-E137 HydrophobicContact CD2-CG 3.59Å; Q133-E137 WeakPolarHBondContact O-CG 3.37Å; Q133-E137 PolarHBondContact O-N 3.39Å; I134-E137 PolarHBondContact O-N 3.46Å; E137-R139 PolarHBondContact O-N 2.97Å; E137-V140 PolarHBondContact O-N 2.9Å; E137-T141 PolarHBondContact O-N 2.91Å; E137-T141 PolarHBondContact O-OG1 2.78Å
138	N	89.9	Confident	89.6	Confident	71 Å²	71	63.4 Å²	63.4	38%	0.38	32%	0.316	S	S	.	.	H	α-helix	trans	-58	-18.1	176.3	-78.3	-10.5	0	0	0	114.2	I134 H136 L174	I134-N138 WeakPolarHBondContact O-CB 3.47Å; I134-N138 PolarHBondContact O-N 3.09Å; H136-N138 PolarHBondContact O-N 2.84Å; N138-L174 PolarHBondContact ND2-O 2.74Å
139	R	87.4	Confident	89.5	Confident	191 Å²	191	59.1 Å²	59.1	72%	0.721	30%	0.296	S	S	*	.	H	α-helix	trans	-95.2	-21.1	177.5	-63.1	179.3	70.8	-170.1	2.7	113.2	Y135 H136 E137	Y135-R139 WeakPolarHBondContact O-CG 3.39Å; H136-R139 WeakPolarHBondContact O-CB 3.33Å; H136-R139 PolarHBondContact O-N 3.22Å; H136-R139 VanDerWaalsContact O-N 3.09Å; E137-R139 PolarHBondContact O-N 2.97Å
140	V	83	Confident	89.4	Confident	98 Å²	98	56.6 Å²	56.6	59%	0.594	28%	0.284	S	S	*	.	H	α-helix	trans	-101.8	-37.3	-173.7	179.2	0	0	0	0	110.7	H136 E137	H136-V140 PolarHBondContact O-N 2.89Å; E137-V140 PolarHBondContact O-N 2.9Å
141	T	73.7	Confident	89.3	Confident	39 Å²	39	56.6 Å²	56.6	24%	0.239	28%	0.284	C	S	.	.	S	Bend	trans	-113.1	138.8	-177.5	82	0	0	0	0	110.3	E137 T144	E137-T141 PolarHBondContact O-N 2.91Å; E137-T141 PolarHBondContact O-OG1 2.78Å; T141-T144 PolarHBondContact OG1-OG1 2.92Å
142	T	63.5	Low	89.1	Confident	144 Å²	144	56.6 Å²	56.6	88%	0.883	28%	0.284	S	S	*	.	S	Bend	trans	-92.4	104.2	168.8	49.3	0	0	0	0	108
143	R	65	Low	88.6	Confident	229 Å²	229	54 Å²	54	86%	0.864	26%	0.261	S	S	*	.			trans	88.4	62	161.5	-150	179.2	-167.2	114.9	-3.1	116.9
144	T	75.6	Confident	87.6	Confident	22 Å²	22	53.3 Å²	53.3	14%	0.135	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-101	137.1	163.9	-34.4	0	0	0	0	109.8	A45 D47 T141	A45-T144 HydrophobicContact CB-CG2 3.75Å; A45-T144 WeakPolarHBondContact O-CA 3.37Å; A45-T144 WeakPolarHBondContact O-CG2 3.29Å; D47-T144 HydrophobicContact CB-CG2 4.25Å; D47-T144 WeakPolarHBondContact OD1-CG2 3.41Å; D47-T144 WeakPolarHBondContact OD2-CG2 3.2Å; T141-T144 PolarHBondContact OG1-OG1 2.92Å
145	A	88.8	Confident	86.9	Confident	41 Å²	41	58 Å²	58	34%	0.339	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	123	170.7	0	0	0	0	0	109.3	A45 F46 D47	A45-A145 PolarHBondContact O-N 2.95Å; F46-A145 HydrophobicContact CD1-CB 3.64Å; F46-A145 HydrophobicContact CE1-CB 3.65Å; F46-A145 HydrophobicContact CG-CB 4.46Å; F46-A145 HydrophobicContact CZ-CB 4.48Å; D47-A145 PolarHBondContact N-O 2.76Å
146	S	93.7	Very high	86.2	Confident	4 Å²	4	53 Å²	53	3%	0.028	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.1	178.1	-58.9	0	0	0	0	111.1	A176 I177	S146-A176 CarbonylContact O-C 3.54Å; S146-A176 VanDerWaalsContact O-CA 3.23Å; S146-A176 WeakPolarHBondContact O-CA 3.25Å; S146-I177 PolarHBondContact O-N 2.66Å
147	V	94.6	Very high	85.6	Confident	19 Å²	19	54 Å²	54	12%	0.115	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.4	178.5	-177.2	0	0	0	0	109.6	D47 L48 Y49 I149 I177 Y179	D47-V147 PolarHBondContact O-N 3.18Å; L48-V147 WeakPolarHBondContact CA-O 3.38Å; L48-V147 HydrophobicContact CD2-CB 3.74Å; L48-V147 HydrophobicContact CD2-CG1 4.21Å; L48-V147 HydrophobicContact CD2-CG2 4.35Å; Y49-V147 PolarHBondContact N-O 3.3Å; V147-I149 HydrophobicContact CG1-CG1 4.27Å; V147-I177 WeakPolarHBondContact CA-O 3.39Å; V147-Y179 HydrophobicContact CG1-CD2 3.44Å; V147-Y179 VanDerWaalsContact CG1-CD2 3.44Å; V147-Y179 HydrophobicContact CG1-CE2 3.6Å
148	I	97.5	Very high	85	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.9	171.7	-60.7	-178.7	0	0	0	108.4	Y49 V51 L127 A130 I134 A171 A176 I177 V178 Y179	Y49-I148 WeakPolarHBondContact O-CA 3.48Å; V51-I148 HydrophobicContact CB-CG2 4.39Å; V51-I148 HydrophobicContact CG2-CG2 3.8Å; L127-I148 HydrophobicContact CD2-CD1 4.28Å; L127-I148 HydrophobicContact CD2-CG2 4.09Å; A130-I148 HydrophobicContact CB-CD1 3.85Å; A130-I148 HydrophobicContact CB-CG1 4.32Å; I134-I148 HydrophobicContact CD1-CD1 3.94Å; I134-I148 HydrophobicContact CD1-CG1 4.16Å; I148-A171 HydrophobicContact CD1-CB 3.55Å; I148-A176 HydrophobicContact CG1-CB 4.45Å; I148-I177 PolarHBondContact N-O 3.4Å; I148-V178 HydrophobicContact CB-CG1 4.45Å; I148-V178 HydrophobicContact CB-CG2 4.45Å; I148-V178 HydrophobicContact CD1-CG2 4.45Å; I148-V178 HydrophobicContact CG2-CG1 4.43Å; I148-Y179 PolarHBondContact O-N 2.65Å
149	I	96.4	Very high	84.4	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	101.6	170.4	-57	166.5	0	0	0	107.4	L48 Y49 F50 V51 F68 V147 L151 V181 L211	L48-I149 HydrophobicContact CD2-CD1 4.46Å; Y49-I149 PolarHBondContact O-N 3.27Å; F50-I149 HydrophobicContact CD1-CB 4.09Å; F50-I149 HydrophobicContact CD1-CD1 4.45Å; F50-I149 HydrophobicContact CD1-CG2 4.37Å; F50-I149 HydrophobicContact CE1-CB 4.22Å; F50-I149 HydrophobicContact CE1-CD1 3.79Å; F50-I149 HydrophobicContact CE1-CG2 4.37Å; F50-I149 HydrophobicContact CZ-CD1 4.16Å; V51-I149 PolarHBondContact N-O 2.92Å; F68-I149 HydrophobicContact CE1-CG2 4.25Å; V147-I149 HydrophobicContact CG1-CG1 4.27Å; I149-L151 HydrophobicContact CG2-CD1 3.93Å; I149-V181 HydrophobicContact CG2-CG2 3.88Å; I149-L211 HydrophobicContact CD1-CD1 3.92Å; I149-L211 HydrophobicContact CG1-CD1 4.45Å; I149-L211 HydrophobicContact CG2-CD1 4.13Å
150	A	97.1	Very high	84.3	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.2	176.8	0	0	0	0	0	110.7	V51 Y179 C180 V181	V51-A150 HydrophobicContact CB-CB 4.4Å; V51-A150 CarbonylContact O-C 3.59Å; V51-A150 VanDerWaalsContact O-CA 3.26Å; V51-A150 WeakPolarHBondContact O-CA 3.39Å; A150-Y179 PolarHBondContact N-O 3.33Å; A150-C180 CarbonylContact O-C 3.51Å; A150-C180 WeakPolarHBondContact O-CA 3.43Å; A150-V181 PolarHBondContact O-N 3.15Å
151	L	96.3	Very high	84.5	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.5	175.8	-74.5	102.5	0	0	0	110	F50 V51 L52 D53 I65 F68 V69 I149 V181	F50-L151 HydrophobicContact CD1-CD1 4.16Å; V51-L151 PolarHBondContact O-N 2.81Å; L52-L151 HydrophobicContact CD2-CB 4Å; L52-L151 HydrophobicContact CD2-CD1 3.34Å; L52-L151 HydrophobicContact CD2-CG 4.18Å; D53-L151 WeakPolarHBondContact CB-O 3.34Å; D53-L151 PolarHBondContact N-O 3.18Å; I65-L151 HydrophobicContact CG1-CB 4.47Å; I65-L151 HydrophobicContact CG2-CB 4.02Å; I65-L151 HydrophobicContact CG2-CD2 4.2Å; F68-L151 HydrophobicContact CB-CD2 4.01Å; F68-L151 HydrophobicContact CD1-CD1 4.11Å; F68-L151 HydrophobicContact CD1-CD2 3.54Å; F68-L151 HydrophobicContact CD1-CG 4.38Å; F68-L151 HydrophobicContact CE1-CD1 4.25Å; F68-L151 HydrophobicContact CE1-CD2 4.07Å; F68-L151 HydrophobicContact CG-CD2 3.84Å; V69-L151 HydrophobicContact CG2-CD1 4.24Å; I149-L151 HydrophobicContact CG2-CD1 3.93Å; L151-V181 WeakPolarHBondContact CA-O 3.46Å; L151-V181 HydrophobicContact CD2-CB 4.2Å; L151-V181 HydrophobicContact CD2-CG1 4.21Å; L151-V181 HydrophobicContact CG-CB 4.02Å
152	T	94.1	Very high	85.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	162.1	-177.7	-179.4	0	0	0	0	110.9	D53 M123 G154 V181 G182 V183 L191	D53-T152 WeakPolarHBondContact OD2-CB 3.2Å; D53-T152 PolarHBondContact OD2-OG1 3.48Å; M123-T152 HydrophobicContact CE-CG2 3.25Å; T152-G154 VanDerWaalsContact C-N 3.26Å; T152-G154 PolarHBondContact OG1-N 3.17Å; T152-V181 PolarHBondContact N-O 3.12Å; T152-G182 CarbonylContact O-C 3.46Å; T152-G182 WeakPolarHBondContact O-CA 3.31Å; T152-V183 PolarHBondContact O-N 3.33Å; T152-L191 HydrophobicContact CG2-CD1 4.41Å; T152-L191 HydrophobicContact CG2-CD2 3.49Å; T152-L191 VanDerWaalsContact CG2-CD2 3.49Å
153	D	87.4	Confident	86.9	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.011	25%	0.248	C	C	.	.			trans	-82.2	-3.9	165.4	60.9	12.2	0	0	0	113	S57 V58 E155 V183 K184 F186	S57-D153 WeakPolarHBondContact CB-OD2 3.36Å; S57-D153 PolarHBondContact OG-OD1 3.05Å; S57-D153 PolarHBondContact OG-OD2 2.93Å; V58-D153 HydrophobicContact CG1-CB 4.04Å; V58-D153 WeakPolarHBondContact CG1-OD2 3.38Å; D153-E155 PolarHBondContact O-N 3.2Å; D153-E155 PolarHBondContact OD1-N 3.1Å; D153-E155 VanDerWaalsContact OD1-N 3.12Å; D153-V183 WeakPolarHBondContact CA-O 3.46Å; D153-V183 WeakPolarHBondContact CB-O 3.36Å; D153-K184 HydrophobicContact CB-CB 4.47Å; D153-F186 WeakPolarHBondContact O-CA 3.39Å; D153-F186 VanDerWaalsContact O-CB 3.25Å; D153-F186 WeakPolarHBondContact O-CB 3.4Å
154	G	77.6	Confident	88.4	Confident	2 Å²	2	43.3 Å²	43.3	2%	0.021	21%	0.207	C	C	.	.			trans	70.1	16	177.2	0	0	0	0	0	114.1	T152 L156 Q190	T152-G154 VanDerWaalsContact C-N 3.26Å; T152-G154 PolarHBondContact OG1-N 3.17Å; G154-L156 PolarHBondContact O-N 3.34Å; G154-Q190 PolarHBondContact O-OE1 2.78Å
155	E	80.9	Confident	89.3	Confident	98 Å²	98	45 Å²	45	46%	0.458	21%	0.213	S	C	.	.			trans	-78.2	62.7	173.7	-67.8	-172.2	-172.3	0	0	110.9	D153 K184	D153-E155 PolarHBondContact O-N 3.2Å; D153-E155 PolarHBondContact OD1-N 3.1Å; D153-E155 VanDerWaalsContact OD1-N 3.12Å; E155-K184 IonicContact OE1-NZ 3.74Å; E155-K184 PolarHBondContact OE1-NZ 2.64Å
156	L	80.1	Confident	89.7	Confident	16 Å²	16	50.9 Å²	50.9	8%	0.084	23%	0.227	C	C	.	.			trans	-87.8	131.4	176.6	-65	170.8	0	0	0	110.7	T121 M123 G154 Q160 Y161 A164	T121-L156 HydrophobicContact CG2-CD2 3.67Å; T121-L156 WeakPolarHBondContact O-CD2 3.48Å; M123-L156 HydrophobicContact CB-CD1 4.49Å; M123-L156 HydrophobicContact CB-CD2 3.91Å; M123-L156 HydrophobicContact CE-CD1 4.48Å; M123-L156 HydrophobicContact SD-CD1 4.13Å; G154-L156 PolarHBondContact O-N 3.34Å; L156-Q160 HydrophobicContact CD2-CB 4.41Å; L156-Y161 HydrophobicContact CB-CD2 4.42Å; L156-Y161 HydrophobicContact CD1-CD2 4.16Å; L156-A164 HydrophobicContact CD1-CB 4.29Å
157	K	83	Confident	90	Very high	130 Å²	130	52.4 Å²	52.4	57%	0.565	23%	0.233	S	C	*	.			trans	-70.2	150.5	169	-62.4	171.5	-176.2	163.7	0	109.2	D120 R159 Q160 Y161	D120-K157 IonicContact OD1-NZ 2.76Å; D120-K157 PolarHBondContact OD1-NZ 2.97Å; K157-R159 VanDerWaalsContact C-N 3.32Å; K157-R159 PolarHBondContact O-N 3.44Å; K157-R159 VanDerWaalsContact O-N 3.08Å; K157-Q160 CarbonylContact O-C 3.51Å; K157-Q160 WeakPolarHBondContact O-CA 3.4Å; K157-Q160 WeakPolarHBondContact O-CB 3.41Å; K157-Q160 PolarHBondContact O-N 3.46Å; K157-Y161 PolarHBondContact O-N 3.11Å
158	E	78.9	Confident	90.1	Very high	162 Å²	162	51.5 Å²	51.5	76%	0.757	23%	0.227	S	C	*	.	H	α-helix	trans	-45.3	-48	-175	-168.8	177.9	-167.1	0	0	114.2	Q160 Y161 D162	E158-Q160 PolarHBondContact O-N 2.9Å; E158-Y161 WeakPolarHBondContact O-CB 3.46Å; E158-Y161 PolarHBondContact O-N 3.31Å; E158-D162 PolarHBondContact O-N 3.25Å; E158-D162 VanDerWaalsContact O-N 3.12Å
159	R	77.3	Confident	90.2	Very high	220 Å²	220	57.6 Å²	57.6	83%	0.83	26%	0.256	S	S	*	.	H	α-helix	trans	-67.9	-33.2	177.8	-65.6	-171.3	-175.8	-174.9	1.5	114.3	K157 Y161 T163	K157-R159 VanDerWaalsContact C-N 3.32Å; K157-R159 PolarHBondContact O-N 3.44Å; K157-R159 VanDerWaalsContact O-N 3.08Å; R159-Y161 VanDerWaalsContact C-N 3.34Å; R159-T163 PolarHBondContact O-OG1 3.15Å
160	Q	85.6	Confident	90.2	Very high	28 Å²	28	62.9 Å²	62.9	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-75.1	-31.1	177.4	-68.9	168.4	-30.5	0	0	110.8	T121 L156 K157 E158 T163 A164	T121-Q160 PolarHBondContact O-OE1 3.44Å; L156-Q160 HydrophobicContact CD2-CB 4.41Å; K157-Q160 CarbonylContact O-C 3.51Å; K157-Q160 WeakPolarHBondContact O-CA 3.4Å; K157-Q160 WeakPolarHBondContact O-CB 3.41Å; K157-Q160 PolarHBondContact O-N 3.46Å; E158-Q160 PolarHBondContact O-N 2.9Å; Q160-T163 PolarHBondContact O-OG1 2.88Å; Q160-T163 VanDerWaalsContact O-OG1 3.07Å; Q160-A164 VanDerWaalsContact O-CB 3.26Å; Q160-A164 WeakPolarHBondContact O-CB 3.48Å; Q160-A164 PolarHBondContact O-N 2.91Å
161	Y	87.9	Confident	90.3	Very high	41 Å²	41	62.9 Å²	62.9	16%	0.161	28%	0.276	C	S	.	.	H	α-helix	trans	-66.1	-49.2	175.5	179.4	-104.3	0	0	0	111.7	L156 K157 E158 R159 T163 A164 Q165 Q190 T193	L156-Y161 HydrophobicContact CB-CD2 4.42Å; L156-Y161 HydrophobicContact CD1-CD2 4.16Å; K157-Y161 PolarHBondContact O-N 3.11Å; E158-Y161 WeakPolarHBondContact O-CB 3.46Å; E158-Y161 PolarHBondContact O-N 3.31Å; R159-Y161 VanDerWaalsContact C-N 3.34Å; Y161-T163 VanDerWaalsContact C-N 3.31Å; Y161-T163 PolarHBondContact O-N 3.49Å; Y161-A164 PolarHBondContact O-N 2.79Å; Y161-Q165 HydrophobicContact CE1-CG 4.4Å; Y161-Q165 WeakPolarHBondContact O-CG 3.48Å; Y161-Q165 PolarHBondContact O-N 2.93Å; Y161-Q165 PolarHBondContact OH-NE2 2.89Å; Y161-Q190 HydrophobicContact CD2-CB 4.39Å; Y161-Q190 HydrophobicContact CD2-CG 4.44Å; Y161-Q190 HydrophobicContact CE2-CB 3.69Å; Y161-Q190 HydrophobicContact CE2-CG 3.85Å; Y161-T193 VanDerWaalsContact CE2-OG1 3.28Å; Y161-T193 WeakPolarHBondContact CE2-OG1 3.33Å; Y161-T193 WeakPolarHBondContact OH-CB 3.4Å; Y161-T193 WeakPolarHBondContact OH-CG2 3.26Å; Y161-T193 PolarHBondContact OH-OG1 3.12Å
162	D	92.1	Very high	90.3	Very high	72 Å²	72	66.4 Å²	66.4	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-58.5	-41.2	177.8	-73.3	-12.2	0	0	0	112.8	E158 R166	E158-D162 PolarHBondContact O-N 3.25Å; E158-D162 VanDerWaalsContact O-N 3.12Å; D162-R166 WeakPolarHBondContact O-CG 3.38Å; D162-R166 PolarHBondContact O-N 3.41Å
163	T	95.1	Very high	90.4	Very high	51 Å²	51	70.9 Å²	70.9	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-72.9	-36.8	178.9	54.4	0	0	0	0	111.7	R159 Q160 Y161 R166 E167	R159-T163 PolarHBondContact O-OG1 3.15Å; Q160-T163 PolarHBondContact O-OG1 2.88Å; Q160-T163 VanDerWaalsContact O-OG1 3.07Å; Y161-T163 VanDerWaalsContact C-N 3.31Å; Y161-T163 PolarHBondContact O-N 3.49Å; T163-R166 PolarHBondContact O-N 3.41Å; T163-E167 PolarHBondContact O-N 3.32Å; T163-E167 VanDerWaalsContact O-N 3.11Å
164	A	96	Very high	90.8	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.2	-42	174.7	0	0	0	0	0	111.5	M123 L127 L156 Q160 Y161 R166 E167 A168 I194	M123-A164 HydrophobicContact CB-CB 4.12Å; M123-A164 HydrophobicContact CG-CB 4.23Å; M123-A164 HydrophobicContact SD-CB 4.19Å; L127-A164 HydrophobicContact CD1-CB 4.44Å; L127-A164 WeakPolarHBondContact CD1-O 3.44Å; L156-A164 HydrophobicContact CD1-CB 4.29Å; Q160-A164 VanDerWaalsContact O-CB 3.26Å; Q160-A164 WeakPolarHBondContact O-CB 3.48Å; Q160-A164 PolarHBondContact O-N 2.91Å; Y161-A164 PolarHBondContact O-N 2.79Å; A164-R166 VanDerWaalsContact C-N 3.33Å; A164-R166 PolarHBondContact O-N 2.9Å; A164-E167 PolarHBondContact O-N 3.27Å; A164-A168 WeakPolarHBondContact O-CB 3.26Å; A164-A168 PolarHBondContact O-N 3.47Å; A164-I194 HydrophobicContact CB-CD1 3.76Å
165	Q	95.8	Very high	91.6	Very high	58 Å²	58	75.1 Å²	75.1	27%	0.271	36%	0.356	S	S	.	.	H	α-helix	trans	-58.8	-42.9	175	-76.2	-175.5	-23.9	0	0	112.4	Y161 A168 Q169 T193 I194	Y161-Q165 HydrophobicContact CE1-CG 4.4Å; Y161-Q165 WeakPolarHBondContact O-CG 3.48Å; Y161-Q165 PolarHBondContact O-N 2.93Å; Y161-Q165 PolarHBondContact OH-NE2 2.89Å; Q165-A168 PolarHBondContact O-N 2.9Å; Q165-Q169 WeakPolarHBondContact O-CB 3.44Å; Q165-Q169 PolarHBondContact O-N 2.92Å; Q165-T193 PolarHBondContact NE2-OG1 3.3Å; Q165-I194 HydrophobicContact CB-CD1 4.31Å; Q165-I194 HydrophobicContact CG-CD1 3.62Å
166	R	97.1	Very high	92.2	Very high	165 Å²	165	70.6 Å²	70.6	62%	0.623	34%	0.336	S	S	*	.	H	α-helix	trans	-64.1	-43.8	177.8	-69.3	176.7	-158	-171	5	112.1	D162 T163 A164 Q169 R170	D162-R166 WeakPolarHBondContact O-CG 3.38Å; D162-R166 PolarHBondContact O-N 3.41Å; T163-R166 PolarHBondContact O-N 3.41Å; A164-R166 VanDerWaalsContact C-N 3.33Å; A164-R166 PolarHBondContact O-N 2.9Å; R166-Q169 PolarHBondContact O-N 3.11Å; R166-R170 WeakPolarHBondContact O-CB 3.45Å; R166-R170 PolarHBondContact O-N 3.19Å
167	E	98.3	Very high	92.9	Very high	35 Å²	35	73 Å²	73	16%	0.164	35%	0.348	C	S	.	.	H	α-helix	trans	-70.1	-32.8	178	-69.8	-56.4	136.5	0	0	112.3	N124 L127 N131 T163 A164 R170 A171	N124-E167 HydrophobicContact CB-CG 4.2Å; L127-E167 HydrophobicContact CB-CB 3.62Å; L127-E167 HydrophobicContact CD1-CB 4.15Å; N131-E167 PolarHBondContact ND2-O 3.39Å; N131-E167 PolarHBondContact ND2-OE2 3.31Å; T163-E167 PolarHBondContact O-N 3.32Å; T163-E167 VanDerWaalsContact O-N 3.11Å; A164-E167 PolarHBondContact O-N 3.27Å; E167-R170 WeakPolarHBondContact O-CB 3.36Å; E167-R170 PolarHBondContact O-N 2.88Å; E167-R170 IonicContact OE1-NH1 3.98Å; E167-R170 WeakPolarHBondContact OE2-CD 3.42Å; E167-R170 IonicContact OE2-NH1 3.38Å; E167-R170 PolarHBondContact OE2-NH1 3.11Å; E167-A171 PolarHBondContact O-N 3.36Å
168	A	98	Very high	93.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-41.1	171.7	0	0	0	0	0	111.8	L127 A164 Q165 R170 A171 R172 I194	L127-A168 HydrophobicContact CD1-CB 4.08Å; A164-A168 WeakPolarHBondContact O-CB 3.26Å; A164-A168 PolarHBondContact O-N 3.47Å; Q165-A168 PolarHBondContact O-N 2.9Å; A168-R170 VanDerWaalsContact C-N 3.27Å; A168-R170 PolarHBondContact O-N 3.33Å; A168-A171 WeakPolarHBondContact O-CB 3.03Å; A168-A171 PolarHBondContact O-N 3.48Å; A168-R172 PolarHBondContact O-N 2.94Å; A168-I194 HydrophobicContact CB-CG2 4.01Å; A168-I194 WeakPolarHBondContact CB-O 3.46Å
169	Q	98.2	Very high	94.4	Very high	129 Å²	129	59.9 Å²	59.9	60%	0.603	29%	0.288	S	S	*	.	H	α-helix	trans	-62.6	-37.5	173	-175.1	178.5	5	0	0	111.6	Q165 R166 R172 S173	Q165-Q169 WeakPolarHBondContact O-CB 3.44Å; Q165-Q169 PolarHBondContact O-N 2.92Å; R166-Q169 PolarHBondContact O-N 3.11Å; Q169-R172 PolarHBondContact O-N 3.41Å; Q169-S173 PolarHBondContact O-N 3.15Å
170	R	98.4	Very high	95.2	Very high	111 Å²	111	49.4 Å²	49.4	42%	0.419	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-43.1	173.7	-175	-179.5	178.5	-168.7	-1.4	111.4	R166 E167 A168 R172 S173 L174	R166-R170 WeakPolarHBondContact O-CB 3.45Å; R166-R170 PolarHBondContact O-N 3.19Å; E167-R170 WeakPolarHBondContact O-CB 3.36Å; E167-R170 PolarHBondContact O-N 2.88Å; E167-R170 IonicContact OE1-NH1 3.98Å; E167-R170 WeakPolarHBondContact OE2-CD 3.42Å; E167-R170 IonicContact OE2-NH1 3.38Å; E167-R170 PolarHBondContact OE2-NH1 3.11Å; A168-R170 VanDerWaalsContact C-N 3.27Å; A168-R170 PolarHBondContact O-N 3.33Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R170-R172 PolarHBondContact O-N 2.85Å; R170-S173 WeakPolarHBondContact CA-OG 3.49Å; R170-S173 PolarHBondContact O-N 2.94Å; R170-S173 VanDerWaalsContact O-N 3.15Å; R170-S173 PolarHBondContact O-OG 3.07Å; R170-L174 WeakPolarHBondContact O-CG 3.42Å; R170-L174 PolarHBondContact O-N 2.97Å; R170-L174 VanDerWaalsContact O-N 3.14Å
171	A	98.2	Very high	95.6	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55.4	-49.3	174	0	0	0	0	0	111.6	N131 I148 E167 A168 S173 L174 G175 A176 V178	N131-A171 WeakPolarHBondContact OD1-CA 3.37Å; N131-A171 WeakPolarHBondContact OD1-CB 3.34Å; N131-A171 PolarHBondContact OD1-N 3.09Å; I148-A171 HydrophobicContact CD1-CB 3.55Å; E167-A171 PolarHBondContact O-N 3.36Å; A168-A171 WeakPolarHBondContact O-CB 3.03Å; A168-A171 PolarHBondContact O-N 3.48Å; A171-S173 VanDerWaalsContact C-N 3.32Å; A171-S173 PolarHBondContact O-N 3.28Å; A171-L174 WeakPolarHBondContact O-CA 3.38Å; A171-L174 WeakPolarHBondContact O-CB 3.3Å; A171-L174 PolarHBondContact O-N 2.83Å; A171-G175 PolarHBondContact O-N 3.12Å; A171-A176 HydrophobicContact CB-CB 4.28Å; A171-A176 WeakPolarHBondContact O-CB 3.04Å; A171-A176 PolarHBondContact O-N 3.04Å; A171-A176 VanDerWaalsContact O-N 3.11Å; A171-V178 HydrophobicContact CB-CG2 4.01Å
172	R	97	Very high	95.8	Very high	74 Å²	74	46.1 Å²	46.1	28%	0.279	24%	0.235	S	C	.	.	H	α-helix	trans	-58.1	-41.9	175.5	-74.9	-176.8	-80.1	-83	5.3	112.9	A168 Q169 R170 L174 G175 A176 V178 I194 D196	A168-R172 PolarHBondContact O-N 2.94Å; Q169-R172 PolarHBondContact O-N 3.41Å; R170-R172 VanDerWaalsContact C-N 3.34Å; R170-R172 PolarHBondContact O-N 2.85Å; R172-L174 PolarHBondContact O-N 3.37Å; R172-G175 PolarHBondContact O-N 3.2Å; R172-A176 WeakPolarHBondContact CA-O 3.28Å; R172-V178 HydrophobicContact CG-CG2 4.33Å; R172-I194 PolarHBondContact NH1-O 3.28Å; R172-D196 WeakPolarHBondContact CD-OD1 3.35Å; R172-D196 WeakPolarHBondContact CG-OD1 3.46Å; R172-D196 IonicContact CZ-OD1 2.99Å; R172-D196 IonicContact NE-OD1 2.7Å; R172-D196 IonicContact NH1-OD1 3.22Å; R172-D196 PolarHBondContact NH1-OD1 3.14Å
173	S	96.6	Very high	95.7	Very high	95 Å²	95	42.7 Å²	42.7	66%	0.664	22%	0.217	S	C	*	.	H	α-helix	trans	-64.8	-21.6	177.2	76.2	0	0	0	0	113.6	Q169 R170 A171 G175	Q169-S173 PolarHBondContact O-N 3.15Å; R170-S173 WeakPolarHBondContact CA-OG 3.49Å; R170-S173 PolarHBondContact O-N 2.94Å; R170-S173 VanDerWaalsContact O-N 3.15Å; R170-S173 PolarHBondContact O-OG 3.07Å; A171-S173 VanDerWaalsContact C-N 3.32Å; A171-S173 PolarHBondContact O-N 3.28Å; S173-G175 VanDerWaalsContact C-N 3.3Å
174	L	94.9	Very high	95.3	Very high	35 Å²	35	44.5 Å²	44.5	18%	0.183	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	1.7	173.1	-64	169.6	0	0	0	112.7	N131 I134 Y135 N138 R170 A171 R172	N131-L174 HydrophobicContact CB-CD1 4.13Å; I134-L174 HydrophobicContact CB-CD1 4.41Å; I134-L174 HydrophobicContact CG2-CB 3.73Å; I134-L174 HydrophobicContact CG2-CD1 4.26Å; Y135-L174 HydrophobicContact CD2-CD2 3.98Å; N138-L174 PolarHBondContact ND2-O 2.74Å; R170-L174 WeakPolarHBondContact O-CG 3.42Å; R170-L174 PolarHBondContact O-N 2.97Å; R170-L174 VanDerWaalsContact O-N 3.14Å; A171-L174 WeakPolarHBondContact O-CA 3.38Å; A171-L174 WeakPolarHBondContact O-CB 3.3Å; A171-L174 PolarHBondContact O-N 2.83Å; R172-L174 PolarHBondContact O-N 3.37Å
175	G	93.4	Very high	94.6	Very high	57 Å²	57	51.4 Å²	51.4	59%	0.588	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	9.8	-180	0	0	0	0	0	114.7	A171 R172 S173	A171-G175 PolarHBondContact O-N 3.12Å; R172-G175 PolarHBondContact O-N 3.2Å; S173-G175 VanDerWaalsContact C-N 3.3Å
176	A	95.1	Very high	94.1	Very high	4 Å²	4	50.6 Å²	50.6	3%	0.033	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	144.1	177.8	0	0	0	0	0	112.6	I134 S146 I148 A171 R172	I134-A176 HydrophobicContact CD1-CB 3.83Å; S146-A176 CarbonylContact O-C 3.54Å; S146-A176 VanDerWaalsContact O-CA 3.23Å; S146-A176 WeakPolarHBondContact O-CA 3.25Å; I148-A176 HydrophobicContact CG1-CB 4.45Å; A171-A176 HydrophobicContact CB-CB 4.28Å; A171-A176 WeakPolarHBondContact O-CB 3.04Å; A171-A176 PolarHBondContact O-N 3.04Å; A171-A176 VanDerWaalsContact O-N 3.11Å; R172-A176 WeakPolarHBondContact CA-O 3.28Å
177	I	94.9	Very high	93.5	Very high	67 Å²	67	46.1 Å²	46.1	34%	0.344	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.4	169.9	-55.8	172.7	0	0	0	108.6	S146 V147 I148 Y179	S146-I177 PolarHBondContact O-N 2.66Å; V147-I177 WeakPolarHBondContact CA-O 3.39Å; I148-I177 PolarHBondContact N-O 3.4Å; I177-Y179 HydrophobicContact CB-CE2 4.23Å; I177-Y179 HydrophobicContact CG2-CD2 4.11Å; I177-Y179 HydrophobicContact CG2-CE2 3.44Å; I177-Y179 VanDerWaalsContact CG2-CE2 3.44Å
178	V	96.8	Very high	93	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.4	-178.8	-171.3	0	0	0	0	111.4	I148 A171 R172 A195 D196	I148-V178 HydrophobicContact CB-CG1 4.45Å; I148-V178 HydrophobicContact CB-CG2 4.45Å; I148-V178 HydrophobicContact CD1-CG2 4.45Å; I148-V178 HydrophobicContact CG2-CG1 4.43Å; A171-V178 HydrophobicContact CB-CG2 4.01Å; R172-V178 HydrophobicContact CG-CG2 4.33Å; V178-A195 VanDerWaalsContact O-CA 3.31Å; V178-A195 WeakPolarHBondContact O-CA 3.29Å; V178-D196 WeakPolarHBondContact CB-OD1 3.4Å; V178-D196 PolarHBondContact N-OD1 3.16Å; V178-D196 VanDerWaalsContact N-OD1 3.13Å; V178-D196 PolarHBondContact O-N 3.18Å
179	Y	95.1	Very high	92.4	Very high	15 Å²	15	53.4 Å²	53.4	6%	0.059	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	146.3	169.2	-68.8	-85.2	0	0	0	111.2	V147 I148 A150 I177 H200 F202 L211 I214	V147-Y179 HydrophobicContact CG1-CD2 3.44Å; V147-Y179 VanDerWaalsContact CG1-CD2 3.44Å; V147-Y179 HydrophobicContact CG1-CE2 3.6Å; I148-Y179 PolarHBondContact O-N 2.65Å; A150-Y179 PolarHBondContact N-O 3.33Å; I177-Y179 HydrophobicContact CB-CE2 4.23Å; I177-Y179 HydrophobicContact CG2-CD2 4.11Å; I177-Y179 HydrophobicContact CG2-CE2 3.44Å; I177-Y179 VanDerWaalsContact CG2-CE2 3.44Å; Y179-H200 WeakPolarHBondContact CA-O 3.12Å; Y179-H200 HydrophobicContact CD1-CB 3.74Å; Y179-H200 AromaticContact CD1-CD2 3.65Å; Y179-H200 HydrophobicContact CE1-CB 3.96Å; Y179-H200 AromaticContact CE1-CD2 3.08Å; Y179-H200 WeakPolarHBondContact CE1-CD2 3.29Å; Y179-H200 AromaticContact CE1-CG 3.73Å; Y179-H200 AromaticContact CE1-NE2 3.96Å; Y179-H200 AromaticContact CE2-CD2 3.94Å; Y179-H200 HydrophobicContact CG-CB 4.49Å; Y179-H200 AromaticContact CZ-CD2 3.24Å; Y179-H200 AromaticContact CZ-NE2 3.82Å; Y179-H200 PolarHBondContact OH-CD2 3.27Å; Y179-H200 PolarHBondContact OH-NE2 2.88Å; Y179-F202 HydrophobicContact CD1-CD2 4.41Å; Y179-F202 AromaticContact CD1-CE2 3.64Å; Y179-F202 HydrophobicContact CD1-CE2 3.64Å; Y179-F202 AromaticContact CE1-CE2 3.96Å; Y179-F202 HydrophobicContact CE1-CE2 3.96Å; Y179-F202 HydrophobicContact CE1-CZ 4.49Å; Y179-L211 HydrophobicContact CD1-CD2 4Å; Y179-L211 HydrophobicContact CE1-CD2 4.41Å; Y179-L211 HydrophobicContact CG-CD2 4.15Å; Y179-I214 HydrophobicContact CD1-CD1 4.23Å; Y179-I214 HydrophobicContact CE1-CD1 3.26Å; Y179-I214 HydrophobicContact CE1-CG2 4.46Å; Y179-I214 HydrophobicContact CE2-CG2 4.38Å; Y179-I214 WeakPolarHBondContact OH-CG2 3.48Å
180	C	94.6	Very high	92	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	128.7	170.6	-73.9	0	0	0	0	110.1	A150 L191 A195 H200 V201 F202	A150-C180 CarbonylContact O-C 3.51Å; A150-C180 WeakPolarHBondContact O-CA 3.43Å; C180-L191 HydrophobicContact CB-CB 3.97Å; C180-L191 HydrophobicContact CB-CD1 4.25Å; C180-L191 HydrophobicContact CB-CG 4.48Å; C180-A195 HydrophobicContact CB-CB 4.1Å; C180-H200 PolarHBondContact N-O 2.86Å; C180-V201 HydrophobicContact CB-CG2 4.42Å; C180-V201 VanDerWaalsContact O-CA 3.3Å; C180-V201 WeakPolarHBondContact O-CA 3.39Å; C180-F202 PolarHBondContact O-N 3.08Å
181	V	93.9	Very high	91.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.7	173.2	-176.6	0	0	0	0	108	F68 I149 A150 L151 T152 F202 V204 L211	F68-V181 HydrophobicContact CE1-CG2 4.1Å; F68-V181 HydrophobicContact CE2-CG1 4.01Å; F68-V181 HydrophobicContact CE2-CG2 4.47Å; F68-V181 HydrophobicContact CZ-CB 4.39Å; F68-V181 HydrophobicContact CZ-CG1 4.03Å; F68-V181 HydrophobicContact CZ-CG2 3.71Å; I149-V181 HydrophobicContact CG2-CG2 3.88Å; A150-V181 PolarHBondContact O-N 3.15Å; L151-V181 WeakPolarHBondContact CA-O 3.46Å; L151-V181 HydrophobicContact CD2-CB 4.2Å; L151-V181 HydrophobicContact CD2-CG1 4.21Å; L151-V181 HydrophobicContact CG-CB 4.02Å; T152-V181 PolarHBondContact N-O 3.12Å; V181-F202 CarbonylContact C-O 3.54Å; V181-F202 WeakPolarHBondContact CA-O 3.42Å; V181-V204 HydrophobicContact CG1-CB 3.97Å; V181-V204 HydrophobicContact CG1-CG2 4.27Å; V181-L211 HydrophobicContact CG2-CD1 4.36Å
182	G	93.1	Very high	91.3	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	129	-177.6	0	0	0	0	0	112.5	T152 F186 F202 P203 V204	T152-G182 CarbonylContact O-C 3.46Å; T152-G182 WeakPolarHBondContact O-CA 3.31Å; G182-F186 VanDerWaalsContact C-CD1 3.49Å; G182-F186 VanDerWaalsContact CA-CD1 3.43Å; G182-F186 VanDerWaalsContact CA-CG 3.42Å; G182-F202 PolarHBondContact N-O 3.01Å; G182-P203 CarbonylContact O-C 3.59Å; G182-V204 WeakPolarHBondContact O-CB 3.4Å; G182-V204 PolarHBondContact O-N 3.33Å
183	V	90.1	Very high	90.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.254	C	S	.	.			trans	-103.3	149.1	176.2	-175.7	0	0	0	0	108.8	H61 I65 T152 D153 V204	H61-V183 HydrophobicContact CB-CG1 3.55Å; I65-V183 HydrophobicContact CD1-CG2 4.11Å; I65-V183 HydrophobicContact CG1-CG1 4.49Å; I65-V183 HydrophobicContact CG1-CG2 3.7Å; T152-V183 PolarHBondContact O-N 3.33Å; D153-V183 WeakPolarHBondContact CA-O 3.46Å; D153-V183 WeakPolarHBondContact CB-O 3.36Å; V183-V204 HydrophobicContact CG2-CB 4.35Å
184	K	85.5	Confident	90.8	Very high	88 Å²	88	39.7 Å²	39.7	38%	0.383	22%	0.222	S	C	.	.	S	Bend	trans	57.1	-141.4	179.8	-170.4	-146.4	170.5	-177.8	0	111	D153 E155 F186	D153-K184 HydrophobicContact CB-CB 4.47Å; E155-K184 IonicContact OE1-NZ 3.74Å; E155-K184 PolarHBondContact OE1-NZ 2.64Å; K184-F186 VanDerWaalsContact C-N 3.31Å; K184-F186 PolarHBondContact O-N 3.46Å
185	D	81.7	Confident	90.7	Very high	145 Å²	145	38.2 Å²	38.2	78%	0.775	22%	0.215	S	C	*	.	S	Bend	trans	-92	60.7	-179.2	-60.7	-43.5	0	0	0	109.9
186	F	85.8	Confident	90.6	Very high	41 Å²	41	38 Å²	38	18%	0.18	20%	0.2	C	C	.	.			trans	-67.5	150.6	-173.1	67.9	-83.9	0	0	0	113.2	D153 G182 K184 Q188 L191 V201 P203	D153-F186 WeakPolarHBondContact O-CA 3.39Å; D153-F186 VanDerWaalsContact O-CB 3.25Å; D153-F186 WeakPolarHBondContact O-CB 3.4Å; G182-F186 VanDerWaalsContact C-CD1 3.49Å; G182-F186 VanDerWaalsContact CA-CD1 3.43Å; G182-F186 VanDerWaalsContact CA-CG 3.42Å; K184-F186 VanDerWaalsContact C-N 3.31Å; K184-F186 PolarHBondContact O-N 3.46Å; F186-Q188 HydrophobicContact CD2-CB 4.22Å; F186-Q188 HydrophobicContact CE2-CB 3.73Å; F186-Q188 HydrophobicContact CE2-CG 4.08Å; F186-Q188 PolarHBondContact O-N 3.32Å; F186-Q188 VanDerWaalsContact O-N 3.16Å; F186-L191 HydrophobicContact CB-CD1 4.08Å; F186-L191 HydrophobicContact CD2-CD1 3.48Å; F186-L191 VanDerWaalsContact CD2-CD1 3.48Å; F186-L191 HydrophobicContact CD2-CG 4.27Å; F186-L191 HydrophobicContact CE2-CD1 4.21Å; F186-L191 HydrophobicContact CG-CD1 4.03Å; F186-V201 HydrophobicContact CE2-CG1 3.8Å; F186-P203 HydrophobicContact CE1-CB 3.91Å; F186-P203 HydrophobicContact CZ-CB 4.28Å
187	N	85	Confident	90.3	Very high	71 Å²	71	40.7 Å²	40.7	38%	0.38	22%	0.216	S	C	.	.			trans	-81.9	96	172.7	-170.3	-43.5	0	0	0	110.4	T189 Q190 L191	N187-T189 VanDerWaalsContact C-N 3.26Å; N187-T189 PolarHBondContact O-N 2.78Å; N187-T189 PolarHBondContact OD1-N 2.86Å; N187-T189 VanDerWaalsContact OD1-N 3.16Å; N187-Q190 HydrophobicContact CB-CB 4.07Å; N187-Q190 HydrophobicContact CB-CG 4.18Å; N187-Q190 PolarHBondContact O-N 3.13Å; N187-Q190 VanDerWaalsContact O-N 3.17Å; N187-Q190 PolarHBondContact OD1-N 2.8Å; N187-L191 PolarHBondContact O-N 2.79Å
188	Q	86.1	Confident	89.8	Confident	91 Å²	91	42.9 Å²	42.9	43%	0.425	23%	0.226	S	C	.	.	H	α-helix	trans	-56.4	-38.4	-179.1	-172.1	176.8	9.7	0	0	112.9	F186 L191 A192 V201	F186-Q188 HydrophobicContact CD2-CB 4.22Å; F186-Q188 HydrophobicContact CE2-CB 3.73Å; F186-Q188 HydrophobicContact CE2-CG 4.08Å; F186-Q188 PolarHBondContact O-N 3.32Å; F186-Q188 VanDerWaalsContact O-N 3.16Å; Q188-L191 PolarHBondContact O-N 2.86Å; Q188-A192 VanDerWaalsContact O-CB 3.25Å; Q188-A192 WeakPolarHBondContact O-CB 3.42Å; Q188-A192 PolarHBondContact O-N 2.86Å; Q188-V201 HydrophobicContact CG-CB 4.46Å; Q188-V201 HydrophobicContact CG-CG1 4Å
189	T	87.2	Confident	89.4	Confident	97 Å²	97	50.5 Å²	50.5	60%	0.595	26%	0.262	S	S	*	.	H	α-helix	trans	-65.5	-42	179.4	-53.5	0	0	0	0	111.6	N187 A192 T193	N187-T189 VanDerWaalsContact C-N 3.26Å; N187-T189 PolarHBondContact O-N 2.78Å; N187-T189 PolarHBondContact OD1-N 2.86Å; N187-T189 VanDerWaalsContact OD1-N 3.16Å; T189-A192 PolarHBondContact O-N 3.38Å; T189-T193 WeakPolarHBondContact O-CG2 3.41Å
190	Q	88.3	Confident	89.2	Confident	54 Å²	54	51.5 Å²	51.5	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-48.4	175.2	-74.7	-168.9	41.6	0	0	111.3	G154 Y161 N187 A192 T193	G154-Q190 PolarHBondContact O-OE1 2.78Å; Y161-Q190 HydrophobicContact CD2-CB 4.39Å; Y161-Q190 HydrophobicContact CD2-CG 4.44Å; Y161-Q190 HydrophobicContact CE2-CB 3.69Å; Y161-Q190 HydrophobicContact CE2-CG 3.85Å; N187-Q190 HydrophobicContact CB-CB 4.07Å; N187-Q190 HydrophobicContact CB-CG 4.18Å; N187-Q190 PolarHBondContact O-N 3.13Å; N187-Q190 VanDerWaalsContact O-N 3.17Å; N187-Q190 PolarHBondContact OD1-N 2.8Å; Q190-A192 VanDerWaalsContact C-N 3.25Å; Q190-A192 PolarHBondContact O-N 2.99Å; Q190-T193 PolarHBondContact O-N 3.16Å; Q190-T193 PolarHBondContact O-OG1 3Å
191	L	90.8	Very high	89	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-34.6	178.3	-66.8	-168.6	0	0	0	112.5	T152 C180 F186 N187 Q188 T193 I194 A195 V201	T152-L191 HydrophobicContact CG2-CD1 4.41Å; T152-L191 HydrophobicContact CG2-CD2 3.49Å; T152-L191 VanDerWaalsContact CG2-CD2 3.49Å; C180-L191 HydrophobicContact CB-CB 3.97Å; C180-L191 HydrophobicContact CB-CD1 4.25Å; C180-L191 HydrophobicContact CB-CG 4.48Å; F186-L191 HydrophobicContact CB-CD1 4.08Å; F186-L191 HydrophobicContact CD2-CD1 3.48Å; F186-L191 VanDerWaalsContact CD2-CD1 3.48Å; F186-L191 HydrophobicContact CD2-CG 4.27Å; F186-L191 HydrophobicContact CE2-CD1 4.21Å; F186-L191 HydrophobicContact CG-CD1 4.03Å; N187-L191 PolarHBondContact O-N 2.79Å; Q188-L191 PolarHBondContact O-N 2.86Å; L191-T193 PolarHBondContact O-N 2.86Å; L191-I194 PolarHBondContact O-N 3.24Å; L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.38Å; L191-V201 HydrophobicContact CB-CG1 3.92Å; L191-V201 HydrophobicContact CB-CG2 4.3Å; L191-V201 HydrophobicContact CD1-CG1 4.31Å
192	A	90.9	Very high	88.8	Confident	19 Å²	19	53.4 Å²	53.4	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-17.9	177.3	0	0	0	0	0	113.8	Q188 T189 Q190 M198 V201	Q188-A192 VanDerWaalsContact O-CB 3.25Å; Q188-A192 WeakPolarHBondContact O-CB 3.42Å; Q188-A192 PolarHBondContact O-N 2.86Å; T189-A192 PolarHBondContact O-N 3.38Å; Q190-A192 VanDerWaalsContact C-N 3.25Å; Q190-A192 PolarHBondContact O-N 2.99Å; A192-M198 HydrophobicContact CB-CB 4.42Å; A192-V201 HydrophobicContact CB-CG2 3.98Å
193	T	89.8	Confident	88.5	Confident	48 Å²	48	55.9 Å²	55.9	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-86.2	-20.7	172.7	73.7	0	0	0	0	113.5	Y161 Q165 T189 Q190 L191	Y161-T193 VanDerWaalsContact CE2-OG1 3.28Å; Y161-T193 WeakPolarHBondContact CE2-OG1 3.33Å; Y161-T193 WeakPolarHBondContact OH-CB 3.4Å; Y161-T193 WeakPolarHBondContact OH-CG2 3.26Å; Y161-T193 PolarHBondContact OH-OG1 3.12Å; Q165-T193 PolarHBondContact NE2-OG1 3.3Å; T189-T193 WeakPolarHBondContact O-CG2 3.41Å; Q190-T193 PolarHBondContact O-N 3.16Å; Q190-T193 PolarHBondContact O-OG1 3Å; L191-T193 PolarHBondContact O-N 2.86Å
194	I	94.3	Very high	88.3	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-84.3	-48.6	174.1	-56.1	-57.2	0	0	0	108.9	M123 L127 A164 Q165 A168 R172 L191	M123-I194 HydrophobicContact SD-CG1 4.34Å; M123-I194 HydrophobicContact SD-CG2 3.85Å; L127-I194 HydrophobicContact CD1-CG2 4.38Å; A164-I194 HydrophobicContact CB-CD1 3.76Å; Q165-I194 HydrophobicContact CB-CD1 4.31Å; Q165-I194 HydrophobicContact CG-CD1 3.62Å; A168-I194 HydrophobicContact CB-CG2 4.01Å; A168-I194 WeakPolarHBondContact CB-O 3.46Å; R172-I194 PolarHBondContact NH1-O 3.28Å; L191-I194 PolarHBondContact O-N 3.24Å
195	A	93.4	Very high	87.8	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	31%	0.313	C	S	.	.	S	Bend	trans	-62.9	166.6	171.8	0	0	0	0	0	111.9	V178 C180 L191 H200 V201	V178-A195 VanDerWaalsContact O-CA 3.31Å; V178-A195 WeakPolarHBondContact O-CA 3.29Å; C180-A195 HydrophobicContact CB-CB 4.1Å; L191-A195 WeakPolarHBondContact O-CB 3.48Å; L191-A195 PolarHBondContact O-N 3.38Å; A195-H200 HydrophobicContact CB-CB 3.98Å; A195-V201 HydrophobicContact CB-CG2 3.77Å
196	D	90.1	Very high	87.1	Confident	52 Å²	52	53.2 Å²	53.2	28%	0.278	30%	0.297	S	S	.	.	S	Bend	trans	-71.7	-43.2	-178	-79.6	19.2	0	0	0	112.5	R172 V178	R172-D196 WeakPolarHBondContact CD-OD1 3.35Å; R172-D196 WeakPolarHBondContact CG-OD1 3.46Å; R172-D196 IonicContact CZ-OD1 2.99Å; R172-D196 IonicContact NE-OD1 2.7Å; R172-D196 IonicContact NH1-OD1 3.22Å; R172-D196 PolarHBondContact NH1-OD1 3.14Å; V178-D196 WeakPolarHBondContact CB-OD1 3.4Å; V178-D196 PolarHBondContact N-OD1 3.16Å; V178-D196 VanDerWaalsContact N-OD1 3.13Å; V178-D196 PolarHBondContact O-N 3.18Å
197	T	88.1	Confident	85.8	Confident	61 Å²	61	51.2 Å²	51.2	37%	0.374	29%	0.288	S	S	.	.	S	Bend	trans	-142	171.3	173	80.5	0	0	0	0	110.6	E199 H200	T197-E199 PolarHBondContact O-N 3.44Å; T197-E199 PolarHBondContact OG1-N 3.31Å; T197-H200 PolarHBondContact N-ND1 3.12Å; T197-H200 WeakPolarHBondContact O-CB 3.05Å; T197-H200 PolarHBondContact O-N 2.87Å; T197-H200 PolarHBondContact OG1-ND1 3.3Å
198	M	86.3	Confident	84.7	Confident	113 Å²	113	50.5 Å²	50.5	56%	0.557	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-60.3	-27	174.2	-175.9	169.3	-86.5	0	0	112.9	A192 H200 V201	A192-M198 HydrophobicContact CB-CB 4.42Å; M198-H200 PolarHBondContact O-N 3.41Å; M198-V201 PolarHBondContact O-N 3.44Å
199	E	87.1	Confident	83.7	Confident	160 Å²	160	53.5 Å²	53.5	75%	0.748	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-73.7	-16.3	175.8	-61.5	177.4	175.9	0	0	112.6	T197 V201 F202	T197-E199 PolarHBondContact O-N 3.44Å; T197-E199 PolarHBondContact OG1-N 3.31Å; E199-V201 PolarHBondContact O-N 2.82Å; E199-F202 WeakPolarHBondContact O-CE1 3.34Å; E199-F202 WeakPolarHBondContact O-CZ 3.2Å
200	H	90.4	Very high	82.5	Confident	36 Å²	36	50.5 Å²	50.5	17%	0.167	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-88.1	11	175.7	-64.3	75.9	0	0	0	112.5	Y179 C180 A195 T197 M198	Y179-H200 WeakPolarHBondContact CA-O 3.12Å; Y179-H200 HydrophobicContact CD1-CB 3.74Å; Y179-H200 AromaticContact CD1-CD2 3.65Å; Y179-H200 HydrophobicContact CE1-CB 3.96Å; Y179-H200 AromaticContact CE1-CD2 3.08Å; Y179-H200 WeakPolarHBondContact CE1-CD2 3.29Å; Y179-H200 AromaticContact CE1-CG 3.73Å; Y179-H200 AromaticContact CE1-NE2 3.96Å; Y179-H200 AromaticContact CE2-CD2 3.94Å; Y179-H200 HydrophobicContact CG-CB 4.49Å; Y179-H200 AromaticContact CZ-CD2 3.24Å; Y179-H200 AromaticContact CZ-NE2 3.82Å; Y179-H200 PolarHBondContact OH-CD2 3.27Å; Y179-H200 PolarHBondContact OH-NE2 2.88Å; C180-H200 PolarHBondContact N-O 2.86Å; A195-H200 HydrophobicContact CB-CB 3.98Å; T197-H200 PolarHBondContact N-ND1 3.12Å; T197-H200 WeakPolarHBondContact O-CB 3.05Å; T197-H200 PolarHBondContact O-N 2.87Å; T197-H200 PolarHBondContact OG1-ND1 3.3Å; M198-H200 PolarHBondContact O-N 3.41Å
201	V	90.8	Very high	81.4	Confident	9 Å²	9	48 Å²	48	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.2	177.8	-172.7	0	0	0	0	110.3	C180 F186 Q188 L191 A192 A195 M198 E199	C180-V201 HydrophobicContact CB-CG2 4.42Å; C180-V201 VanDerWaalsContact O-CA 3.3Å; C180-V201 WeakPolarHBondContact O-CA 3.39Å; F186-V201 HydrophobicContact CE2-CG1 3.8Å; Q188-V201 HydrophobicContact CG-CB 4.46Å; Q188-V201 HydrophobicContact CG-CG1 4Å; L191-V201 HydrophobicContact CB-CG1 3.92Å; L191-V201 HydrophobicContact CB-CG2 4.3Å; L191-V201 HydrophobicContact CD1-CG1 4.31Å; A192-V201 HydrophobicContact CB-CG2 3.98Å; A195-V201 HydrophobicContact CB-CG2 3.77Å; M198-V201 PolarHBondContact O-N 3.44Å; E199-V201 PolarHBondContact O-N 2.82Å
202	F	89.6	Confident	80.1	Confident	32 Å²	32	52.6 Å²	52.6	14%	0.14	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.3	-178.2	-53.5	-66.1	0	0	0	111.9	Y179 C180 V181 G182 E199 A210 L211 I214	Y179-F202 HydrophobicContact CD1-CD2 4.41Å; Y179-F202 AromaticContact CD1-CE2 3.64Å; Y179-F202 HydrophobicContact CD1-CE2 3.64Å; Y179-F202 AromaticContact CE1-CE2 3.96Å; Y179-F202 HydrophobicContact CE1-CE2 3.96Å; Y179-F202 HydrophobicContact CE1-CZ 4.49Å; C180-F202 PolarHBondContact O-N 3.08Å; V181-F202 CarbonylContact C-O 3.54Å; V181-F202 WeakPolarHBondContact CA-O 3.42Å; G182-F202 PolarHBondContact N-O 3.01Å; E199-F202 WeakPolarHBondContact O-CE1 3.34Å; E199-F202 WeakPolarHBondContact O-CZ 3.2Å; F202-A210 HydrophobicContact CD1-CB 3.35Å; F202-A210 HydrophobicContact CD2-CB 4.17Å; F202-A210 HydrophobicContact CE1-CB 3.45Å; F202-A210 VanDerWaalsContact CE1-CB 3.45Å; F202-A210 HydrophobicContact CE2-CB 4.22Å; F202-A210 HydrophobicContact CG-CB 3.74Å; F202-A210 HydrophobicContact CZ-CB 3.89Å; F202-L211 HydrophobicContact CD2-CD2 4.06Å; F202-L211 HydrophobicContact CD2-CG 4.44Å; F202-L211 HydrophobicContact CE2-CD2 3.87Å; F202-I214 HydrophobicContact CE2-CD1 3.94Å; F202-I214 HydrophobicContact CZ-CD1 3.79Å
203	P	88.3	Confident	78.7	Confident	53 Å²	53	54 Å²	54	34%	0.344	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	146.8	166.5	29.8	-34.2	0	0	0	110.4	G182 F186 T205 G207	G182-P203 CarbonylContact O-C 3.59Å; F186-P203 HydrophobicContact CE1-CB 3.91Å; F186-P203 HydrophobicContact CZ-CB 4.28Å; P203-T205 PolarHBondContact O-N 3.07Å; P203-G207 WeakPolarHBondContact O-CA 3.37Å; P203-G207 PolarHBondContact O-N 3.45Å
204	V	84.3	Confident	77.4	Confident	19 Å²	19	53.8 Å²	53.8	12%	0.115	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-36.2	174.2	72	0	0	0	0	111	E64 F68 V181 G182 V183 G206	E64-V204 HydrophobicContact CB-CG2 4.45Å; E64-V204 WeakPolarHBondContact OE2-CG1 3.46Å; F68-V204 HydrophobicContact CB-CG2 4.35Å; F68-V204 HydrophobicContact CD2-CG2 4.12Å; V181-V204 HydrophobicContact CG1-CB 3.97Å; V181-V204 HydrophobicContact CG1-CG2 4.27Å; G182-V204 WeakPolarHBondContact O-CB 3.4Å; G182-V204 PolarHBondContact O-N 3.33Å; V183-V204 HydrophobicContact CG2-CB 4.35Å; V204-G206 PolarHBondContact O-N 3.23Å
205	T	76	Confident	75.8	Confident	115 Å²	115	55.5 Å²	55.5	71%	0.706	31%	0.308	S	S	*	.	H	α-helix	trans	-75.6	84.6	168.6	56.2	0	0	0	0	109.9	P203	P203-T205 PolarHBondContact O-N 3.07Å
206	G	65.8	Low	74	Confident	42 Å²	42	60.5 Å²	60.5	43%	0.433	33%	0.334	S	S	.	.	H	α-helix	trans	121	-19.9	178.6	0	0	0	0	0	114.3	V204 F208 Q209 A210	V204-G206 PolarHBondContact O-N 3.23Å; G206-F208 PolarHBondContact O-N 3.21Å; G206-F208 VanDerWaalsContact O-N 3.1Å; G206-Q209 PolarHBondContact O-N 3.08Å; G206-A210 PolarHBondContact O-N 3.24Å
207	G	59.7	Low	71.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-60.1	-25	-178.9	0	0	0	0	0	113.9	P203 Q209 A210 L211	P203-G207 WeakPolarHBondContact O-CA 3.37Å; P203-G207 PolarHBondContact O-N 3.45Å; G207-Q209 VanDerWaalsContact C-N 3.32Å; G207-Q209 PolarHBondContact O-N 3.4Å; G207-A210 PolarHBondContact O-N 2.92Å; G207-L211 PolarHBondContact O-N 3.4Å
208	F	61.2	Low	69.6	Low	55 Å²	55	64.5 Å²	64.5	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-62.6	-36.9	173.1	-178.2	-105.8	0	0	0	112.7	F68 H71 L72 K75 G206 R212	F68-F208 HydrophobicContact CE2-CB 4.37Å; H71-F208 HydrophobicContact CB-CD2 4.26Å; H71-F208 HydrophobicContact CB-CE2 3.85Å; H71-F208 HydrophobicContact CB-CZ 4.39Å; L72-F208 HydrophobicContact CD2-CD2 3.57Å; L72-F208 HydrophobicContact CD2-CE2 3.67Å; L72-F208 HydrophobicContact CG-CD2 4.07Å; L72-F208 HydrophobicContact CG-CE2 4.22Å; K75-F208 HydrophobicContact CD-CE2 4.49Å; K75-F208 HydrophobicContact CD-CZ 3.98Å; G206-F208 PolarHBondContact O-N 3.21Å; G206-F208 VanDerWaalsContact O-N 3.1Å; F208-R212 WeakPolarHBondContact O-CD 3.27Å; F208-R212 WeakPolarHBondContact O-CG 2.96Å; F208-R212 PolarHBondContact O-N 3.35Å
209	Q	65.3	Low	68.7	Low	155 Å²	155	62.1 Å²	62.1	72%	0.724	36%	0.355	S	S	*	.	H	α-helix	trans	-72	-38.7	176	-70.5	-178.8	-9	0	0	111.3	G206 G207 R212 G213	G206-Q209 PolarHBondContact O-N 3.08Å; G207-Q209 VanDerWaalsContact C-N 3.32Å; G207-Q209 PolarHBondContact O-N 3.4Å; Q209-R212 PolarHBondContact O-N 2.94Å; Q209-G213 PolarHBondContact O-N 2.76Å
210	A	62.1	Low	67.8	Low	34 Å²	34	56.9 Å²	56.9	28%	0.281	33%	0.334	S	S	.	.	H	α-helix	trans	-65.6	-46.3	178.9	0	0	0	0	0	112.4	F202 G206 G207 R212 G213 I214	F202-A210 HydrophobicContact CD1-CB 3.35Å; F202-A210 HydrophobicContact CD2-CB 4.17Å; F202-A210 HydrophobicContact CE1-CB 3.45Å; F202-A210 VanDerWaalsContact CE1-CB 3.45Å; F202-A210 HydrophobicContact CE2-CB 4.22Å; F202-A210 HydrophobicContact CG-CB 3.74Å; F202-A210 HydrophobicContact CZ-CB 3.89Å; G206-A210 PolarHBondContact O-N 3.24Å; G207-A210 PolarHBondContact O-N 2.92Å; A210-R212 VanDerWaalsContact C-N 3.28Å; A210-R212 PolarHBondContact O-N 3.36Å; A210-G213 PolarHBondContact O-N 3.28Å; A210-I214 PolarHBondContact O-N 3.06Å
211	L	64.6	Low	66.5	Low	2 Å²	2	58.1 Å²	58.1	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-68.8	-25.4	178	-69.9	-173.9	0	0	0	113.5	F68 L72 I149 Y179 V181 F202 G207 I214 I215	F68-L211 HydrophobicContact CE1-CD1 3.86Å; F68-L211 HydrophobicContact CZ-CD1 3.43Å; F68-L211 VanDerWaalsContact CZ-CD1 3.43Å; F68-L211 HydrophobicContact CZ-CG 4.41Å; L72-L211 HydrophobicContact CD1-CD1 3.96Å; I149-L211 HydrophobicContact CD1-CD1 3.92Å; I149-L211 HydrophobicContact CG1-CD1 4.45Å; I149-L211 HydrophobicContact CG2-CD1 4.13Å; Y179-L211 HydrophobicContact CD1-CD2 4Å; Y179-L211 HydrophobicContact CE1-CD2 4.41Å; Y179-L211 HydrophobicContact CG-CD2 4.15Å; V181-L211 HydrophobicContact CG2-CD1 4.36Å; F202-L211 HydrophobicContact CD2-CD2 4.06Å; F202-L211 HydrophobicContact CD2-CG 4.44Å; F202-L211 HydrophobicContact CE2-CD2 3.87Å; G207-L211 PolarHBondContact O-N 3.4Å; L211-I214 HydrophobicContact CD2-CD1 4.4Å; L211-I214 PolarHBondContact O-N 2.91Å; L211-I215 WeakPolarHBondContact O-CG1 3.19Å; L211-I215 PolarHBondContact O-N 3.4Å; L211-I215 VanDerWaalsContact O-N 3.07Å
212	R	65.1	Low	65.1	Low	97 Å²	97	61 Å²	61	37%	0.366	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-45.3	172.1	-78.5	167.1	62.7	150.1	155.1	111	K75 F208 Q209 A210 I214 I215 D216	K75-R212 HydrophobicContact CD-CG 4.14Å; K75-R212 VanDerWaalsContact CE-CZ 3.41Å; K75-R212 VanDerWaalsContact CE-NH2 3.31Å; K75-R212 VanDerWaalsContact NZ-CG 3.33Å; F208-R212 WeakPolarHBondContact O-CD 3.27Å; F208-R212 WeakPolarHBondContact O-CG 2.96Å; F208-R212 PolarHBondContact O-N 3.35Å; Q209-R212 PolarHBondContact O-N 2.94Å; A210-R212 VanDerWaalsContact C-N 3.28Å; A210-R212 PolarHBondContact O-N 3.36Å; R212-I214 PolarHBondContact O-N 3.44Å; R212-I215 PolarHBondContact O-N 3.38Å; R212-D216 WeakPolarHBondContact O-CB 3.14Å; R212-D216 PolarHBondContact O-N 3.17Å
213	G	61.3	Low	63.5	Low	48 Å²	48	62.8 Å²	62.8	50%	0.495	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-32.9	177.5	0	0	0	0	0	113.2	Q209 A210 S217	Q209-G213 PolarHBondContact O-N 2.76Å; A210-G213 PolarHBondContact O-N 3.28Å; G213-S217 WeakPolarHBondContact O-CB 3.45Å; G213-S217 PolarHBondContact O-OG 2.73Å; G213-S217 VanDerWaalsContact O-OG 3.11Å
214	I	62.1	Low	61.9	Low	43 Å²	43	63.5 Å²	63.5	22%	0.221	38%	0.376	C	S	.	.	H	α-helix	trans	-77.6	-50.7	-177.9	-64.5	178.5	0	0	0	111	Y179 F202 A210 L211 R212 D216 S217 V218	Y179-I214 HydrophobicContact CD1-CD1 4.23Å; Y179-I214 HydrophobicContact CE1-CD1 3.26Å; Y179-I214 HydrophobicContact CE1-CG2 4.46Å; Y179-I214 HydrophobicContact CE2-CG2 4.38Å; Y179-I214 WeakPolarHBondContact OH-CG2 3.48Å; F202-I214 HydrophobicContact CE2-CD1 3.94Å; F202-I214 HydrophobicContact CZ-CD1 3.79Å; A210-I214 PolarHBondContact O-N 3.06Å; L211-I214 HydrophobicContact CD2-CD1 4.4Å; L211-I214 PolarHBondContact O-N 2.91Å; R212-I214 PolarHBondContact O-N 3.44Å; I214-D216 VanDerWaalsContact C-N 3.32Å; I214-D216 PolarHBondContact O-N 2.8Å; I214-S217 PolarHBondContact O-N 2.92Å; I214-S217 PolarHBondContact O-OG 2.87Å; I214-V218 WeakPolarHBondContact O-CG2 3.42Å
215	I	59.9	Low	60.3	Low	37 Å²	37	66.6 Å²	66.6	19%	0.19	40%	0.395	C	S	.	.	H	α-helix	trans	-72.1	-29.1	-176.6	-62.4	166.8	0	0	0	111.5	L48 F76 L211 R212 S217	L48-I215 HydrophobicContact CD1-CD1 4.35Å; F76-I215 HydrophobicContact CD1-CG2 4.1Å; F76-I215 HydrophobicContact CD2-CD1 4.47Å; F76-I215 HydrophobicContact CE1-CB 4Å; F76-I215 HydrophobicContact CE1-CD1 4.25Å; F76-I215 HydrophobicContact CE1-CG2 3.46Å; F76-I215 VanDerWaalsContact CE1-CG2 3.46Å; F76-I215 HydrophobicContact CE2-CD1 3.53Å; F76-I215 HydrophobicContact CZ-CB 3.88Å; F76-I215 HydrophobicContact CZ-CD1 3.41Å; F76-I215 VanDerWaalsContact CZ-CD1 3.41Å; F76-I215 HydrophobicContact CZ-CG1 4.23Å; F76-I215 HydrophobicContact CZ-CG2 3.77Å; L211-I215 WeakPolarHBondContact O-CG1 3.19Å; L211-I215 PolarHBondContact O-N 3.4Å; L211-I215 VanDerWaalsContact O-N 3.07Å; R212-I215 PolarHBondContact O-N 3.38Å; I215-S217 VanDerWaalsContact C-N 3.26Å; I215-S217 PolarHBondContact O-N 3.29Å
216	D	56	Low	59.1	Low	108 Å²	108	62.9 Å²	62.9	58%	0.578	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-7	176.1	-61.4	-21.7	0	0	0	112.4	K75 R212 I214	K75-D216 IonicContact NZ-OD2 2.83Å; R212-D216 WeakPolarHBondContact O-CB 3.14Å; R212-D216 PolarHBondContact O-N 3.17Å; I214-D216 VanDerWaalsContact C-N 3.32Å; I214-D216 PolarHBondContact O-N 2.8Å
217	S	44.3	Very low	58.5	Low	93 Å²	93	64.7 Å²	64.7	65%	0.65	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-0	-175.2	69.6	0	0	0	0	116	G213 I214 I215	G213-S217 WeakPolarHBondContact O-CB 3.45Å; G213-S217 PolarHBondContact O-OG 2.73Å; G213-S217 VanDerWaalsContact O-OG 3.11Å; I214-S217 PolarHBondContact O-N 2.92Å; I214-S217 PolarHBondContact O-OG 2.87Å; I215-S217 VanDerWaalsContact C-N 3.26Å; I215-S217 PolarHBondContact O-N 3.29Å
218	V	41	Very low	58.4	Low	104 Å²	104	70.5 Å²	70.5	63%	0.63	40%	0.399	S	S	*	.			trans	-111.5	0	179.3	-156.5	0	0	0	0	110.1	C42 F46 I214	C42-V218 PolarHBondContact SG-O 2.73Å; C42-V218 VanDerWaalsContact SG-O 3.38Å; F46-V218 HydrophobicContact CE1-CB 3.9Å; F46-V218 HydrophobicContact CE1-CG1 3.81Å; F46-V218 HydrophobicContact CE1-CG2 4.39Å; F46-V218 HydrophobicContact CZ-CB 3.61Å; F46-V218 HydrophobicContact CZ-CG1 3.52Å; I214-V218 WeakPolarHBondContact O-CG2 3.42Å

Retrieved 218 of 218 residues in 1814.7 ms (Link to these results)

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