A0A087XQX9_POEFO Loading...

ethanolamine-phosphate cytidylyltransferase

AlphaFold DB , UniProt , Accession A0A087XQX9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 407 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	29.2	Very low	226 Å²	226	162.3 Å²	162.3	100%	1.113	80%	0.799	S	S	*	*				0	116.7	0	-72.8	166.2	172.3	0	0	106.4
2	I	28.2	Very low	29.2	Very low	151 Å²	151	162.4 Å²	162.4	77%	0.774	80%	0.796	S	S	*	*				69.5	128.5	90.7	-67.1	168.6	0	0	0	110.8
3	K	29.8	Very low	29.3	Very low	180 Å²	180	158.8 Å²	158.8	78%	0.783	78%	0.783	S	S	*	*			cis	-163.8	166.2	-10	-101	-177.1	-179.9	-179.4	0	105.3
4	N	29.6	Very low	29.3	Very low	140 Å²	140	157.2 Å²	157.2	75%	0.749	78%	0.777	S	S	*	*			cis	-150.9	178.5	4.4	-102.5	-3.5	0	0	0	106.6
5	G	28.8	Very low	29.3	Very low	58 Å²	58	155.8 Å²	155.8	60%	0.598	77%	0.768	S	S	*	*			cis	122.5	103	-7.7	0	0	0	0	0	116
6	H	28.7	Very low	29.3	Very low	182 Å²	182	156.4 Å²	156.4	84%	0.843	77%	0.768	S	S	*	*			trans	-167.3	154.4	157.1	-101.7	48.8	0	0	0	107.8
7	H	28.6	Very low	29.3	Very low	168 Å²	168	154.6 Å²	154.6	78%	0.778	77%	0.768	S	S	*	*			cis	115.2	93.4	-6.8	-77	30.9	0	0	0	119.2
8	Q	29.1	Very low	29.3	Very low	181 Å²	181	152.1 Å²	152.1	85%	0.846	77%	0.768	S	S	*	*			trans	-162.6	118.9	139	-99.6	165	17.4	0	0	107.1
9	H	28.2	Very low	29.4	Very low	150 Å²	150	149.3 Å²	149.3	69%	0.694	77%	0.77	S	S	*	*				65.6	134.9	81.3	-64.6	-59.9	0	0	0	113.7
10	H	27.1	Very low	29.4	Very low	182 Å²	182	147.2 Å²	147.2	84%	0.843	78%	0.776	S	S	*	*			cis	-140.9	169.1	32	-101.9	-83.6	0	0	0	116.5
11	H	28.3	Very low	29.5	Very low	167 Å²	167	145.4 Å²	145.4	77%	0.773	78%	0.782	S	S	*	*			trans	-95.9	155.3	169.4	-86.8	-102.6	0	0	0	113.3
12	H	29.7	Very low	29.2	Very low	164 Å²	164	138.1 Å²	138.1	76%	0.759	77%	0.765	S	S	*	*				-162.7	129.6	119.3	-102.2	61.3	0	0	0	108.5
13	N	31	Very low	29.3	Very low	116 Å²	116	141 Å²	141	62%	0.62	77%	0.772	S	S	*	*				79.1	129.7	61.8	-150.5	24.4	0	0	0	110.6
14	L	28.2	Very low	29.5	Very low	136 Å²	136	140.2 Å²	140.2	71%	0.712	78%	0.776	S	S	*	*			cis	-147.2	175.9	49	-100.6	88	0	0	0	116.5
15	H	30.4	Very low	29.6	Very low	136 Å²	136	138.3 Å²	138.3	63%	0.63	78%	0.78	S	S	*	*			trans	-20.6	152	168.2	-65.9	-62.2	0	0	0	121.1
16	Q	29.3	Very low	30.1	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	79%	0.792	S	S	*	*				65	137.9	59.9	-126.3	175.3	-1.1	0	0	111.2
17	V	28.8	Very low	30.2	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	79%	0.791	S	S	*	*			cis	-149.3	-177.9	49.7	172.4	0	0	0	0	111.8
18	S	28.9	Very low	30.7	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	79%	0.79	S	S	*	*			trans	-67.6	167.2	-169	56.5	0	0	0	0	119
19	A	32.4	Very low	31.1	Very low	99 Å²	99	132.5 Å²	132.5	82%	0.818	79%	0.789	S	S	*	*			trans	-74.1	165.7	174.7	0	0	0	0	0	115.5
20	A	29.1	Very low	31.5	Very low	107 Å²	107	129.7 Å²	129.7	88%	0.884	79%	0.791	S	S	*	*			trans	-137.8	152.8	157.5	0	0	0	0	0	108.9
21	A	31.6	Very low	32.1	Very low	110 Å²	110	125.4 Å²	125.4	91%	0.909	79%	0.788	S	S	*	*			trans	-101.5	157.3	-166.8	0	0	0	0	0	114.4
22	G	27.4	Very low	32.7	Very low	72 Å²	72	122.2 Å²	122.2	74%	0.742	79%	0.79	S	S	*	*			trans	-173.4	72.4	-179.2	0	0	0	0	0	119.2
23	K	31	Very low	33.2	Very low	212 Å²	212	120.8 Å²	120.8	92%	0.922	79%	0.793	S	S	*	*			trans	72.4	149.2	153.1	-60.1	-177.7	176.9	-179	0	120.8
24	D	33.4	Very low	33.6	Very low	164 Å²	164	121.2 Å²	121.2	88%	0.877	80%	0.804	S	S	*	*			trans	-79.6	149	177.6	-50.2	-92.1	0	0	0	114.6
25	A	31.1	Very low	34.8	Very low	100 Å²	100	119.2 Å²	119.2	83%	0.826	80%	0.801	S	S	*	*			trans	-153.6	125	137.1	0	0	0	0	0	108.2
26	G	39.7	Very low	35.8	Very low	82 Å²	82	118.5 Å²	118.5	85%	0.845	81%	0.808	S	S	*	*			trans	-83.4	132.4	-172.8	0	0	0	0	0	113.8
27	T	31.4	Very low	37	Very low	134 Å²	134	119.2 Å²	119.2	82%	0.822	81%	0.812	S	S	*	*			trans	-141	124.5	158.3	-57.3	0	0	0	0	108.3
28	T	38.6	Very low	38.4	Very low	125 Å²	125	123.2 Å²	123.2	77%	0.767	82%	0.819	S	S	*	*			trans	-64.7	126.9	174.4	45.9	0	0	0	0	110.3	A30	T28-A30 PolarHBondContact O-N 3.09Å; T28-A30 VanDerWaalsContact O-N 3.09Å
29	P	37.9	Very low	40.2	Very low	126 Å²	126	129.3 Å²	129.3	82%	0.818	83%	0.825	S	S	*	*			trans	-64.6	114.5	168.6	27.2	-31.8	0	0	0	108.1
30	A	36.8	Very low	42.7	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	82%	0.817	S	S	*	*			trans	-58	146.1	177.8	0	0	0	0	0	110.3	T28 A32	T28-A30 PolarHBondContact O-N 3.09Å; T28-A30 VanDerWaalsContact O-N 3.09Å; A30-A32 PolarHBondContact O-N 3.09Å; A30-A32 VanDerWaalsContact O-N 3.09Å
31	A	38.9	Very low	45.7	Very low	93 Å²	93	135.5 Å²	135.5	77%	0.769	80%	0.804	S	S	*	*			trans	-54.1	120	-179.5	0	0	0	0	0	110.4	T33	A31-T33 PolarHBondContact O-N 2.87Å
32	A	41.1	Very low	48.7	Very low	100 Å²	100	137.2 Å²	137.2	83%	0.826	79%	0.791	S	S	*	*			trans	-63.9	98.6	175.9	0	0	0	0	0	108.7	A30 C34	A30-A32 PolarHBondContact O-N 3.09Å; A30-A32 VanDerWaalsContact O-N 3.09Å; A32-C34 PolarHBondContact O-N 3.04Å
33	T	39.8	Very low	52	Low	134 Å²	134	136 Å²	136	82%	0.822	77%	0.767	S	S	*	*			trans	-62	102.9	-179.5	48.1	0	0	0	0	109.1	A31 S35	A31-T33 PolarHBondContact O-N 2.87Å; T33-S35 PolarHBondContact O-N 2.92Å
34	C	39.7	Very low	55.3	Low	125 Å²	125	128.7 Å²	128.7	85%	0.845	73%	0.734	S	S	*	*			trans	-59.5	113.8	-179.8	-163.9	0	0	0	0	109	A32	A32-C34 PolarHBondContact O-N 3.04Å
35	S	53	Low	58.4	Low	94 Å²	94	120.9 Å²	120.9	66%	0.657	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-60.7	134.1	-177.1	54.5	0	0	0	0	109.8	T33 E37	T33-S35 PolarHBondContact O-N 2.92Å; S35-E37 PolarHBondContact O-N 3.29Å; S35-E37 VanDerWaalsContact O-N 3.16Å
36	P	51	Low	61.6	Low	120 Å²	120	116.2 Å²	116.2	78%	0.779	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-59.8	124.3	-179.7	25.2	-33.8	0	0	0	109.8	K38	P36-K38 PolarHBondContact O-N 3.16Å
37	E	54.5	Low	64.4	Low	182 Å²	182	112.3 Å²	112.3	85%	0.85	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-53.3	131.3	175	-65.8	-173.3	127.7	0	0	109.6	S35 R39	S35-E37 PolarHBondContact O-N 3.29Å; S35-E37 VanDerWaalsContact O-N 3.16Å; E37-R39 PolarHBondContact O-N 3.24Å
38	K	58	Low	67.6	Low	208 Å²	208	106.2 Å²	106.2	90%	0.904	58%	0.576	S	S	*	*			trans	-67.3	86.1	175.5	-71.1	-178.9	178.5	176.7	0	108.9	P36 R40	P36-K38 PolarHBondContact O-N 3.16Å; K38-R40 PolarHBondContact O-N 3.07Å
39	R	68.4	Low	70.3	Confident	238 Å²	238	101 Å²	101	90%	0.898	55%	0.546	S	S	*	.			trans	-46.3	112.4	-179.1	-66.7	-178	107.2	-168	8	109.4	E37 R41	E37-R39 PolarHBondContact O-N 3.24Å; R39-R41 PolarHBondContact O-N 2.75Å
40	R	83.3	Confident	73.1	Confident	173 Å²	173	95.7 Å²	95.7	65%	0.653	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-52.4	127	179.3	-174.3	178.4	65.2	111.5	9.2	108.9	K38 K42 D70	K38-R40 PolarHBondContact O-N 3.07Å; R40-K42 PolarHBondContact O-N 2.99Å; R40-D70 IonicContact CZ-OD1 3.41Å; R40-D70 IonicContact CZ-OD2 3.22Å; R40-D70 IonicContact NH1-OD1 2.64Å; R40-D70 IonicContact NH1-OD2 3.65Å; R40-D70 IonicContact NH2-OD1 3.85Å; R40-D70 PolarHBondContact NH2-OD1 3.22Å; R40-D70 IonicContact NH2-OD2 3.84Å; R40-D70 PolarHBondContact NH2-OD2 3.25Å
41	R	92.1	Very high	75.9	Confident	163 Å²	163	91.6 Å²	91.6	62%	0.615	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-57.2	125.4	176.8	-175.7	-179.9	66.5	80.8	-12	108.5	R39 I43 D128	R39-R41 PolarHBondContact O-N 2.75Å; R41-I43 PolarHBondContact O-N 2.66Å; R41-D128 IonicContact CZ-OD1 3.69Å; R41-D128 VanDerWaalsContact NH1-CG 3.29Å; R41-D128 IonicContact NH1-OD1 2.78Å; R41-D128 PolarHBondContact NH1-OD1 2.77Å; R41-D128 IonicContact NH1-OD2 3.18Å; R41-D128 PolarHBondContact NH1-OD2 2.82Å; R41-D128 IonicContact NH2-OD1 3.47Å; R41-D128 PolarHBondContact NH2-OD1 3.48Å
42	K	95	Very high	78.5	Confident	146 Å²	146	88.4 Å²	88.4	64%	0.635	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-62.6	132.1	174.3	-70.6	-171	176.4	-171.4	0	109.8	R40 D70	R40-K42 PolarHBondContact O-N 2.99Å; K42-D70 WeakPolarHBondContact CA-OD2 3.4Å; K42-D70 HydrophobicContact CB-CB 4.21Å; K42-D70 HydrophobicContact CG-CB 4.36Å
43	I	98	Very high	81	Confident	46 Å²	46	84 Å²	84	24%	0.236	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-83.9	121	171.9	-61.3	172.1	0	0	0	108	R41 V45 D70 Y71 D128 F129	R41-I43 PolarHBondContact O-N 2.66Å; I43-V45 HydrophobicContact CG2-CG2 4.35Å; I43-D70 PolarHBondContact N-OD2 3.28Å; I43-D70 PolarHBondContact O-N 2.97Å; I43-Y71 PolarHBondContact O-N 2.96Å; I43-Y71 VanDerWaalsContact O-N 3.16Å; I43-D128 WeakPolarHBondContact CA-OD2 3.35Å; I43-D128 HydrophobicContact CG2-CB 4.25Å; I43-F129 HydrophobicContact CG2-CE1 3.73Å; I43-F129 HydrophobicContact CG2-CZ 4.09Å
44	R	98.6	Very high	83.7	Confident	60 Å²	60	78.3 Å²	78.3	23%	0.226	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.6	177.8	-78.5	173.2	70.1	85.8	-13.8	109.3	Y71 E108 Y125 S126 C127 D128	R44-Y71 HydrophobicContact CG-CD1 4.45Å; R44-E108 IonicContact CZ-OE2 3.42Å; R44-E108 IonicContact NH1-OE2 3.3Å; R44-E108 IonicContact NH2-OE2 2.71Å; R44-E108 PolarHBondContact NH2-OE2 2.71Å; R44-Y125 PolarHBondContact NE-O 2.78Å; R44-Y125 PolarHBondContact NH2-O 2.97Å; R44-S126 VanDerWaalsContact CB-O 3.31Å; R44-S126 WeakPolarHBondContact CB-O 3.36Å; R44-S126 WeakPolarHBondContact CD-O 3.31Å; R44-C127 CarbonylContact O-C 3.58Å; R44-C127 WeakPolarHBondContact O-CA 3.45Å; R44-D128 PolarHBondContact N-OD2 3.12Å; R44-D128 PolarHBondContact O-N 2.99Å
45	V	98.8	Very high	86.3	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.6	-175.3	-174.2	0	0	0	0	109.2	I43 A65 Y71 L72 I73 F129 V131	I43-V45 HydrophobicContact CG2-CG2 4.35Å; V45-A65 HydrophobicContact CG1-CB 4.17Å; V45-Y71 PolarHBondContact N-O 2.72Å; V45-L72 HydrophobicContact CB-CD1 4.06Å; V45-L72 HydrophobicContact CG1-CD1 3.95Å; V45-I73 PolarHBondContact O-N 3.08Å; V45-F129 HydrophobicContact CB-CE2 4.41Å; V45-F129 HydrophobicContact CG1-CD2 4.26Å; V45-F129 HydrophobicContact CG1-CE2 3.83Å; V45-F129 HydrophobicContact CG2-CE2 3.88Å; V45-F129 HydrophobicContact CG2-CZ 3.84Å; V45-V131 HydrophobicContact CG1-CB 4.36Å; V45-V131 HydrophobicContact CG1-CG2 3.48Å; V45-V131 VanDerWaalsContact CG1-CG2 3.48Å
46	W	98.8	Very high	88.4	Confident	1 Å²	1	68.7 Å²	68.7	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136	173.4	-178.6	-95	0	0	0	111.2	D48 I73 V110 A113 T121 L122 Y125 C127 F129 C130 V131	W46-D48 HydrophobicContact CZ2-CB 4.07Å; W46-D48 PolarHBondContact NE1-OD2 2.98Å; W46-I73 HydrophobicContact CE3-CB 3.99Å; W46-I73 HydrophobicContact CE3-CG2 3.9Å; W46-I73 HydrophobicContact CZ3-CB 4.31Å; W46-I73 HydrophobicContact CZ3-CG2 3.69Å; W46-V110 HydrophobicContact CH2-CB 3.98Å; W46-V110 HydrophobicContact CH2-CG1 4.03Å; W46-V110 HydrophobicContact CH2-CG2 4.29Å; W46-V110 HydrophobicContact CZ3-CB 4.19Å; W46-V110 HydrophobicContact CZ3-CG2 4.02Å; W46-A113 HydrophobicContact CH2-CB 4.45Å; W46-A113 HydrophobicContact CZ2-CB 4.24Å; W46-T121 HydrophobicContact CH2-CG2 3.95Å; W46-T121 HydrophobicContact CZ2-CG2 3.64Å; W46-L122 HydrophobicContact CB-CD2 3.51Å; W46-L122 HydrophobicContact CD2-CD2 4.47Å; W46-L122 HydrophobicContact CG-CD2 3.66Å; W46-Y125 HydrophobicContact CE3-CD2 4.24Å; W46-Y125 AromaticContact CH2-CD2 3.88Å; W46-Y125 HydrophobicContact CH2-CD2 3.88Å; W46-Y125 AromaticContact CH2-CE2 4Å; W46-Y125 HydrophobicContact CH2-CE2 4Å; W46-Y125 AromaticContact CZ3-CD2 3.47Å; W46-Y125 HydrophobicContact CZ3-CD2 3.47Å; W46-Y125 VanDerWaalsContact CZ3-CD2 3.47Å; W46-Y125 HydrophobicContact CZ3-CE2 4.01Å; W46-Y125 AromaticContact CZ3-CG 3.88Å; W46-Y125 HydrophobicContact CZ3-CG 3.88Å; W46-C127 HydrophobicContact CB-CB 3.96Å; W46-F129 PolarHBondContact N-O 2.78Å; W46-C130 HydrophobicContact CB-CB 4.25Å; W46-C130 HydrophobicContact CG-CB 4.48Å; W46-C130 CarbonylContact O-C 3.58Å; W46-C130 WeakPolarHBondContact O-CA 3.34Å; W46-V131 PolarHBondContact O-N 3.41Å
47	C	98.6	Very high	90.5	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	154.3	153.9	-71.4	0	0	0	0	108.2	L62 A65 L72 I73 V74 G75 V131	C47-L62 HydrophobicContact CB-CD2 3.94Å; C47-A65 WeakPolarHBondContact SG-CB 3.5Å; C47-L72 HydrophobicContact CB-CD1 4.43Å; C47-I73 PolarHBondContact N-O 3.33Å; C47-V74 HydrophobicContact CB-CG1 4.47Å; C47-V74 HydrophobicContact CB-CG2 4.44Å; C47-V74 CarbonylContact O-C 3.41Å; C47-V74 WeakPolarHBondContact O-CA 3.47Å; C47-G75 PolarHBondContact O-N 2.91Å; C47-V131 PolarHBondContact SG-O 3.25Å
48	D	98.1	Very high	92.5	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	164.5	160.5	59.7	64.2	0	0	0	111.5	W46 G75 H77 T117 H132	W46-D48 HydrophobicContact CZ2-CB 4.07Å; W46-D48 PolarHBondContact NE1-OD2 2.98Å; D48-G75 WeakPolarHBondContact CA-O 3.39Å; D48-H77 IonicContact OD1-CE1 2.77Å; D48-T117 WeakPolarHBondContact OD2-CB 3.49Å; D48-T117 PolarHBondContact OD2-OG1 2.79Å; D48-H132 IonicContact OD1-CE1 2.7Å; D48-H132 PolarHBondContact OD1-CE1 3.34Å; D48-H132 IonicContact OD1-NE2 3.59Å; D48-H132 IonicContact OD2-NE2 3.75Å
49	G	96.1	Very high	94.4	Very high	14 Å²	14	46.6 Å²	46.6	14%	0.144	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.8	176.7	178.8	0	0	0	0	0	113.9	Y51 G75 H77	G49-Y51 WeakPolarHBondContact O-CD2 3.38Å; G49-G75 PolarHBondContact N-O 3.35Å; G49-G75 VanDerWaalsContact N-O 3.16Å; G49-H77 VanDerWaalsContact CA-NE2 3.26Å; G49-H77 WeakPolarHBondContact CA-NE2 3.16Å; G49-H77 PolarHBondContact O-CD2 3.45Å; G49-H77 PolarHBondContact O-NE2 2.68Å
50	C	95.6	Very high	95.8	Very high	15 Å²	15	36.1 Å²	36.1	10%	0.101	16%	0.161	C	C	.	.			trans	-71.7	-40	176.9	-59.9	0	0	0	0	112	D52 H77 I82 K86 R96	C50-D52 PolarHBondContact O-N 2.69Å; C50-D52 VanDerWaalsContact O-N 3.12Å; C50-H77 PolarHBondContact N-NE2 3.45Å; C50-I82 HydrophobicContact CB-CD1 3.81Å; C50-I82 HydrophobicContact CB-CG1 4.41Å; C50-K86 WeakPolarHBondContact SG-CE 3.26Å; C50-K86 PolarHBondContact SG-NZ 3.31Å; C50-R96 WeakPolarHBondContact O-CD 3.33Å; C50-R96 PolarHBondContact O-NH1 3.46Å
51	Y	96.9	Very high	96.5	Very high	5 Å²	5	29.4 Å²	29.4	2%	0.02	14%	0.137	C	C	.	.			trans	46.4	37.7	-171.7	-58.7	-76.3	0	0	0	113.5	G49 V54 H58 L62 V74 V76 V100	G49-Y51 WeakPolarHBondContact O-CD2 3.38Å; Y51-V54 VanDerWaalsContact O-CG2 3.23Å; Y51-V54 WeakPolarHBondContact O-CG2 3.19Å; Y51-H58 HydrophobicContact CD1-CB 4.32Å; Y51-H58 AromaticContact CD1-CD2 3.78Å; Y51-H58 HydrophobicContact CE1-CB 4.46Å; Y51-H58 AromaticContact CE1-CD2 3.99Å; Y51-L62 HydrophobicContact CE1-CD1 4.08Å; Y51-L62 HydrophobicContact CE1-CD2 4.36Å; Y51-L62 HydrophobicContact CE1-CG 4.35Å; Y51-V74 HydrophobicContact CD2-CG1 4.02Å; Y51-V74 HydrophobicContact CE2-CG1 3.28Å; Y51-V76 HydrophobicContact CD2-CG2 3.97Å; Y51-V100 VanDerWaalsContact CB-CG2 3.41Å; Y51-V100 HydrophobicContact CD1-CG2 4.09Å; Y51-V100 HydrophobicContact CD2-CG2 3.9Å; Y51-V100 HydrophobicContact CG-CG2 3.51Å
52	D	93.8	Very high	96.8	Very high	25 Å²	25	21.7 Å²	21.7	13%	0.134	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	135	170.8	-173.4	35.6	0	0	0	109	C50 P89 V90 F91	C50-D52 PolarHBondContact O-N 2.69Å; C50-D52 VanDerWaalsContact O-N 3.12Å; D52-P89 HydrophobicContact CB-CB 4.12Å; D52-P89 VanDerWaalsContact OD2-CA 3.27Å; D52-P89 WeakPolarHBondContact OD2-CA 3.36Å; D52-P89 WeakPolarHBondContact OD2-CB 3.28Å; D52-V90 VanDerWaalsContact CG-N 3.33Å; D52-V90 PolarHBondContact OD1-N 3.14Å; D52-V90 VanDerWaalsContact OD1-N 3.15Å; D52-V90 PolarHBondContact OD2-N 3.35Å; D52-F91 PolarHBondContact OD1-N 3.41Å
53	M	91.9	Very high	97	Very high	8 Å²	8	16.6 Å²	16.6	4%	0.039	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	57.3	-168.9	-65.3	-65.2	-50.5	0	0	113.1	H55 V90 F91 T166 M173 I362 I366	M53-H55 PolarHBondContact O-CD2 3.41Å; M53-H55 VanDerWaalsContact O-CD2 3.25Å; M53-H55 PolarHBondContact O-N 2.93Å; M53-V90 HydrophobicContact CG-CB 4.25Å; M53-V90 HydrophobicContact CG-CG2 4.31Å; M53-V90 HydrophobicContact SD-CB 4.34Å; M53-V90 HydrophobicContact SD-CG1 3.98Å; M53-F91 HydrophobicContact CG-CE2 4.29Å; M53-F91 HydrophobicContact SD-CD2 4.11Å; M53-F91 HydrophobicContact SD-CE2 3.38Å; M53-F91 WeakPolarHBondContact SD-CE2 3.2Å; M53-F91 HydrophobicContact SD-CZ 4.06Å; M53-T166 HydrophobicContact CB-CG2 3.83Å; M53-T166 HydrophobicContact CG-CG2 4.25Å; M53-M173 HydrophobicContact CE-CE 3.73Å; M53-I362 HydrophobicContact CE-CG2 3.76Å; M53-I362 HydrophobicContact SD-CG2 3.7Å; M53-I366 HydrophobicContact CE-CD1 3.99Å; M53-I366 HydrophobicContact SD-CD1 3.9Å
54	V	96.7	Very high	97	Very high	15 Å²	15	16 Å²	16	9%	0.091	8%	0.081	C	C	.	.			trans	-51.5	137.9	174.8	179.1	0	0	0	0	111.1	Y51 H58 M99 I103	Y51-V54 VanDerWaalsContact O-CG2 3.23Å; Y51-V54 WeakPolarHBondContact O-CG2 3.19Å; V54-H58 HydrophobicContact CG1-CB 4.39Å; V54-M99 HydrophobicContact CB-CE 4.06Å; V54-M99 HydrophobicContact CB-CG 3.64Å; V54-M99 HydrophobicContact CG1-CE 4.04Å; V54-M99 HydrophobicContact CG1-CG 4.06Å; V54-M99 HydrophobicContact CG2-CB 4.15Å; V54-M99 HydrophobicContact CG2-CG 3.53Å; V54-I103 HydrophobicContact CG1-CD1 4.02Å
55	H	95.9	Very high	97	Very high	16 Å²	16	13.2 Å²	13.2	7%	0.074	7%	0.07	C	C	.	.			trans	-151.5	166.1	-178.4	55.5	63.5	0	0	0	109.8	M53 G57 H58 S59 V164 T166 L169 M283	M53-H55 PolarHBondContact O-CD2 3.41Å; M53-H55 VanDerWaalsContact O-CD2 3.25Å; M53-H55 PolarHBondContact O-N 2.93Å; H55-G57 PolarHBondContact ND1-N 3.43Å; H55-G57 PolarHBondContact O-N 3.33Å; H55-H58 AromaticContact CD2-CE1 3.76Å; H55-H58 AromaticContact CD2-ND1 3.52Å; H55-H58 AromaticContact CE1-CE1 3.69Å; H55-H58 AromaticContact CE1-ND1 3.3Å; H55-H58 PolarHBondContact CE1-ND1 3.16Å; H55-H58 VanDerWaalsContact CE1-ND1 3.3Å; H55-H58 AromaticContact CG-ND1 3.61Å; H55-H58 AromaticContact ND1-ND1 3.46Å; H55-H58 PolarHBondContact ND1-ND1 3.03Å; H55-H58 AromaticContact NE2-CE1 3.35Å; H55-H58 PolarHBondContact NE2-CE1 3.22Å; H55-H58 AromaticContact NE2-ND1 3.34Å; H55-H58 PolarHBondContact NE2-ND1 3.18Å; H55-H58 WeakPolarHBondContact O-CB 3.33Å; H55-H58 PolarHBondContact O-N 2.86Å; H55-S59 PolarHBondContact O-N 2.89Å; H55-V164 HydrophobicContact CB-CG2 4.1Å; H55-T166 PolarHBondContact NE2-N 2.82Å; H55-L169 HydrophobicContact CB-CD1 3.78Å; H55-M283 HydrophobicContact CB-CE 3.81Å
56	Y	95.7	Very high	97	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-51.1	-29.3	-175.7	68.7	-91.6	0	0	0	114.9	S59 N60 T161 G163 V164 F210 E287 L290	Y56-S59 WeakPolarHBondContact O-CB 3.34Å; Y56-S59 PolarHBondContact O-N 3.48Å; Y56-N60 WeakPolarHBondContact O-CB 3.38Å; Y56-N60 PolarHBondContact O-N 2.8Å; Y56-T161 HydrophobicContact CD2-CG2 4.05Å; Y56-T161 HydrophobicContact CE2-CG2 3.95Å; Y56-G163 PolarHBondContact OH-O 3.04Å; Y56-V164 HydrophobicContact CD1-CB 4.44Å; Y56-V164 HydrophobicContact CD1-CG1 4.1Å; Y56-V164 HydrophobicContact CD2-CG1 3.98Å; Y56-V164 HydrophobicContact CE1-CB 3.64Å; Y56-V164 HydrophobicContact CE1-CG1 3.65Å; Y56-V164 HydrophobicContact CE1-CG2 4.08Å; Y56-V164 HydrophobicContact CE2-CB 4.21Å; Y56-V164 HydrophobicContact CE2-CG1 3.52Å; Y56-V164 HydrophobicContact CG-CG1 4.26Å; Y56-V164 WeakPolarHBondContact OH-CB 3.35Å; Y56-F210 HydrophobicContact CD2-CE2 4.39Å; Y56-F210 AromaticContact CE2-CD2 3.66Å; Y56-F210 HydrophobicContact CE2-CD2 3.66Å; Y56-F210 AromaticContact CE2-CE2 3.55Å; Y56-F210 HydrophobicContact CE2-CE2 3.55Å; Y56-F210 HydrophobicContact CE2-CZ 4.41Å; Y56-F210 AromaticContact CZ-CD2 3.65Å; Y56-F210 AromaticContact CZ-CE2 3.97Å; Y56-F210 WeakPolarHBondContact OH-CD2 3.3Å; Y56-F210 WeakPolarHBondContact OH-CG 3.46Å; Y56-E287 HydrophobicContact CD1-CB 4.17Å; Y56-E287 HydrophobicContact CE1-CB 3.67Å; Y56-E287 HydrophobicContact CE1-CG 3.6Å; Y56-E287 PolarHBondContact OH-OE1 3.44Å; Y56-L290 HydrophobicContact CD2-CB 4.47Å; Y56-L290 HydrophobicContact CD2-CD1 4.04Å; Y56-L290 HydrophobicContact CG-CB 4.17Å
57	G	95.4	Very high	97	Very high	8 Å²	8	19.1 Å²	19.1	8%	0.082	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-44.5	170.1	0	0	0	0	0	115.4	H55 N60 Q61 T161	H55-G57 PolarHBondContact ND1-N 3.43Å; H55-G57 PolarHBondContact O-N 3.33Å; G57-N60 PolarHBondContact O-N 2.99Å; G57-Q61 PolarHBondContact O-N 2.82Å; G57-T161 PolarHBondContact O-OG1 3.06Å
58	H	97.5	Very high	96.9	Very high	34 Å²	34	22.2 Å²	22.2	16%	0.157	13%	0.126	C	C	.	.	H	α-helix	trans	-65	-42.1	172	-68.5	103.5	0	0	0	110.6	Y51 V54 H55 N60 Q61 L62	Y51-H58 HydrophobicContact CD1-CB 4.32Å; Y51-H58 AromaticContact CD1-CD2 3.78Å; Y51-H58 HydrophobicContact CE1-CB 4.46Å; Y51-H58 AromaticContact CE1-CD2 3.99Å; V54-H58 HydrophobicContact CG1-CB 4.39Å; H55-H58 AromaticContact CD2-CE1 3.76Å; H55-H58 AromaticContact CD2-ND1 3.52Å; H55-H58 AromaticContact CE1-CE1 3.69Å; H55-H58 AromaticContact CE1-ND1 3.3Å; H55-H58 PolarHBondContact CE1-ND1 3.16Å; H55-H58 VanDerWaalsContact CE1-ND1 3.3Å; H55-H58 AromaticContact CG-ND1 3.61Å; H55-H58 AromaticContact ND1-ND1 3.46Å; H55-H58 PolarHBondContact ND1-ND1 3.03Å; H55-H58 AromaticContact NE2-CE1 3.35Å; H55-H58 PolarHBondContact NE2-CE1 3.22Å; H55-H58 AromaticContact NE2-ND1 3.34Å; H55-H58 PolarHBondContact NE2-ND1 3.18Å; H55-H58 WeakPolarHBondContact O-CB 3.33Å; H55-H58 PolarHBondContact O-N 2.86Å; H58-N60 VanDerWaalsContact C-N 3.3Å; H58-N60 PolarHBondContact O-N 3.46Å; H58-Q61 WeakPolarHBondContact O-CB 3.14Å; H58-Q61 PolarHBondContact O-N 2.9Å; H58-L62 WeakPolarHBondContact O-CG 3.48Å; H58-L62 PolarHBondContact O-N 3.16Å
59	S	98.1	Very high	96.9	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-37.7	177.1	-45.8	0	0	0	0	112.4	H55 Y56 L62 R63	H55-S59 PolarHBondContact O-N 2.89Å; Y56-S59 WeakPolarHBondContact O-CB 3.34Å; Y56-S59 PolarHBondContact O-N 3.48Å; S59-L62 PolarHBondContact O-N 2.64Å; S59-R63 WeakPolarHBondContact O-CB 3.4Å; S59-R63 PolarHBondContact O-N 2.74Å
60	N	97.8	Very high	97	Very high	19 Å²	19	24.4 Å²	24.4	10%	0.102	14%	0.139	C	C	.	.	H	α-helix	trans	-74.3	-29.9	175.7	-176.3	55	0	0	0	113.3	Y56 G57 H58 R63 Q64 T161 F220	Y56-N60 WeakPolarHBondContact O-CB 3.38Å; Y56-N60 PolarHBondContact O-N 2.8Å; G57-N60 PolarHBondContact O-N 2.99Å; H58-N60 VanDerWaalsContact C-N 3.3Å; H58-N60 PolarHBondContact O-N 3.46Å; N60-R63 VanDerWaalsContact OD1-CZ 3.31Å; N60-R63 PolarHBondContact OD1-NE 2.79Å; N60-R63 PolarHBondContact OD1-NH2 2.92Å; N60-Q64 PolarHBondContact ND2-NE2 3.03Å; N60-Q64 WeakPolarHBondContact O-CB 3.46Å; N60-Q64 VanDerWaalsContact O-CG 3.29Å; N60-Q64 WeakPolarHBondContact O-CG 3.45Å; N60-Q64 PolarHBondContact O-N 2.98Å; N60-Q64 PolarHBondContact O-NE2 3.34Å; N60-T161 HydrophobicContact CB-CG2 4.29Å; N60-T161 WeakPolarHBondContact CB-OG1 3.13Å; N60-T161 PolarHBondContact ND2-OG1 3.45Å; N60-F220 HydrophobicContact CB-CE2 3.95Å; N60-F220 HydrophobicContact CB-CZ 3.82Å
61	Q	97.8	Very high	97.1	Very high	32 Å²	32	26.7 Å²	26.7	15%	0.15	15%	0.146	C	C	.	.	H	α-helix	trans	-60	-51.9	168.4	-174.7	-157	-0.5	0	0	109.6	G57 H58 R63 Q64 A65 C158	G57-Q61 PolarHBondContact O-N 2.82Å; H58-Q61 WeakPolarHBondContact O-CB 3.14Å; H58-Q61 PolarHBondContact O-N 2.9Å; Q61-R63 PolarHBondContact O-N 2.79Å; Q61-Q64 WeakPolarHBondContact O-CB 3.38Å; Q61-Q64 PolarHBondContact O-N 3.2Å; Q61-Q64 VanDerWaalsContact O-N 3.14Å; Q61-A65 PolarHBondContact O-N 3.33Å; Q61-C158 VanDerWaalsContact CG-SG 3.55Å
62	L	98.6	Very high	97.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-37.6	-179.6	-64.7	171.5	0	0	0	112.3	C47 Y51 H58 S59 A65 K66 L72 V74 I103 V106	C47-L62 HydrophobicContact CB-CD2 3.94Å; Y51-L62 HydrophobicContact CE1-CD1 4.08Å; Y51-L62 HydrophobicContact CE1-CD2 4.36Å; Y51-L62 HydrophobicContact CE1-CG 4.35Å; H58-L62 WeakPolarHBondContact O-CG 3.48Å; H58-L62 PolarHBondContact O-N 3.16Å; S59-L62 PolarHBondContact O-N 2.64Å; L62-A65 PolarHBondContact O-N 2.9Å; L62-K66 WeakPolarHBondContact O-CB 3.37Å; L62-K66 PolarHBondContact O-N 3.29Å; L62-L72 HydrophobicContact CB-CD2 4.08Å; L62-L72 HydrophobicContact CD2-CD2 4.05Å; L62-L72 VanDerWaalsContact O-CD2 3.28Å; L62-L72 WeakPolarHBondContact O-CD2 3.39Å; L62-V74 HydrophobicContact CD2-CG1 4.3Å; L62-V74 HydrophobicContact CD2-CG2 3.5Å; L62-I103 HydrophobicContact CD1-CD1 3.59Å; L62-I103 HydrophobicContact CD1-CG2 4.31Å; L62-V106 HydrophobicContact CD1-CG2 3.92Å
63	R	98.4	Very high	97.4	Very high	40 Å²	40	25.2 Å²	25.2	15%	0.151	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-47.1	169.8	-174.3	-167.8	67	78.3	2.1	112.1	S59 N60 Q61 A65 A67 W105 Q219	S59-R63 WeakPolarHBondContact O-CB 3.4Å; S59-R63 PolarHBondContact O-N 2.74Å; N60-R63 VanDerWaalsContact OD1-CZ 3.31Å; N60-R63 PolarHBondContact OD1-NE 2.79Å; N60-R63 PolarHBondContact OD1-NH2 2.92Å; Q61-R63 PolarHBondContact O-N 2.79Å; R63-A65 VanDerWaalsContact C-N 3.35Å; R63-A67 WeakPolarHBondContact O-CB 3.31Å; R63-A67 PolarHBondContact O-N 3.1Å; R63-W105 HydrophobicContact CB-CD2 3.65Å; R63-W105 HydrophobicContact CB-CE3 3.73Å; R63-W105 HydrophobicContact CB-CG 4.15Å; R63-W105 HydrophobicContact CB-CH2 4.25Å; R63-W105 HydrophobicContact CB-CZ2 4.17Å; R63-W105 HydrophobicContact CB-CZ3 4.03Å; R63-W105 HydrophobicContact CG-CD2 3.89Å; R63-W105 HydrophobicContact CG-CE3 4.36Å; R63-W105 HydrophobicContact CG-CG 4.34Å; R63-W105 HydrophobicContact CG-CH2 4.27Å; R63-W105 HydrophobicContact CG-CZ2 3.79Å; R63-Q219 WeakPolarHBondContact CD-O 3.24Å
64	Q	98.4	Very high	97.8	Very high	34 Å²	34	24.9 Å²	24.9	16%	0.159	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-42.5	177.5	-75.9	176.4	97.9	0	0	111	N60 Q61 A67 M68 C158 K159	N60-Q64 PolarHBondContact ND2-NE2 3.03Å; N60-Q64 WeakPolarHBondContact O-CB 3.46Å; N60-Q64 VanDerWaalsContact O-CG 3.29Å; N60-Q64 WeakPolarHBondContact O-CG 3.45Å; N60-Q64 PolarHBondContact O-N 2.98Å; N60-Q64 PolarHBondContact O-NE2 3.34Å; Q61-Q64 WeakPolarHBondContact O-CB 3.38Å; Q61-Q64 PolarHBondContact O-N 3.2Å; Q61-Q64 VanDerWaalsContact O-N 3.14Å; Q64-A67 PolarHBondContact O-N 3.17Å; Q64-M68 WeakPolarHBondContact O-CG 3.43Å; Q64-M68 PolarHBondContact O-N 2.74Å; Q64-C158 HydrophobicContact CB-CB 3.75Å; Q64-C158 HydrophobicContact CG-CB 4.41Å; Q64-K159 PolarHBondContact NE2-O 3.05Å
65	A	98.4	Very high	97.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-48.6	177.5	0	0	0	0	0	112.8	V45 C47 Q61 L62 R63 A67 M68 L72 V131	V45-A65 HydrophobicContact CG1-CB 4.17Å; C47-A65 WeakPolarHBondContact SG-CB 3.5Å; Q61-A65 PolarHBondContact O-N 3.33Å; L62-A65 PolarHBondContact O-N 2.9Å; R63-A65 VanDerWaalsContact C-N 3.35Å; A65-A67 PolarHBondContact O-N 3.03Å; A65-M68 WeakPolarHBondContact O-CB 3.42Å; A65-M68 PolarHBondContact O-N 3.43Å; A65-L72 HydrophobicContact CB-CD1 3.95Å; A65-L72 HydrophobicContact CB-CD2 4.25Å; A65-V131 HydrophobicContact CB-CB 3.69Å; A65-V131 HydrophobicContact CB-CG1 3.82Å; A65-V131 HydrophobicContact CB-CG2 3.94Å
66	K	98.3	Very high	98	Very high	45 Å²	45	23.4 Å²	23.4	20%	0.196	13%	0.129	C	C	.	.	H	α-helix	trans	-57.5	-36.4	175.1	178.3	62.6	165.6	-175.2	0	111.8	L62 M68 G69 D70 L72 W105 D107	L62-K66 WeakPolarHBondContact O-CB 3.37Å; L62-K66 PolarHBondContact O-N 3.29Å; K66-M68 PolarHBondContact O-N 2.86Å; K66-G69 PolarHBondContact O-N 2.7Å; K66-D70 PolarHBondContact NZ-O 3.36Å; K66-L72 HydrophobicContact CB-CB 4.21Å; K66-L72 HydrophobicContact CB-CD2 3.96Å; K66-L72 HydrophobicContact CD-CB 3.99Å; K66-W105 HydrophobicContact CB-CB 3.9Å; K66-W105 WeakPolarHBondContact CD-O 3.34Å; K66-W105 HydrophobicContact CG-CB 4.08Å; K66-D107 IonicContact NZ-OD1 3.9Å; K66-D107 PolarHBondContact NZ-OD1 3.1Å; K66-D107 IonicContact NZ-OD2 3.79Å; K66-D107 PolarHBondContact NZ-OD2 3.23Å
67	A	98	Very high	98.1	Very high	80 Å²	80	23.6 Å²	23.6	66%	0.661	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-8.6	177.2	0	0	0	0	0	114.8	R63 Q64 A65	R63-A67 WeakPolarHBondContact O-CB 3.31Å; R63-A67 PolarHBondContact O-N 3.1Å; Q64-A67 PolarHBondContact O-N 3.17Å; A65-A67 PolarHBondContact O-N 3.03Å
68	M	98.2	Very high	98.2	Very high	65 Å²	65	24.7 Å²	24.7	32%	0.32	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-5	174.1	-59.5	179.5	-165.9	0	0	113.3	Q64 A65 K66 F129 V131 R156 C158	Q64-M68 WeakPolarHBondContact O-CG 3.43Å; Q64-M68 PolarHBondContact O-N 2.74Å; A65-M68 WeakPolarHBondContact O-CB 3.42Å; A65-M68 PolarHBondContact O-N 3.43Å; K66-M68 PolarHBondContact O-N 2.86Å; M68-F129 HydrophobicContact CB-CE2 3.87Å; M68-F129 HydrophobicContact CB-CZ 3.78Å; M68-F129 HydrophobicContact SD-CE2 4.35Å; M68-V131 HydrophobicContact CE-CG1 3.94Å; M68-V131 HydrophobicContact SD-CG1 4.07Å; M68-V131 HydrophobicContact SD-CG2 3.58Å; M68-V131 VanDerWaalsContact SD-CG2 3.58Å; M68-R156 HydrophobicContact SD-CB 4.03Å; M68-R156 HydrophobicContact SD-CG 4.47Å; M68-C158 HydrophobicContact CE-CB 4.07Å
69	G	97.3	Very high	98.2	Very high	19 Å²	19	25.1 Å²	25.1	20%	0.196	14%	0.138	C	C	.	.	S	Bend	trans	-156.7	-158.1	-178.2	0	0	0	0	0	113.3	K66	K66-G69 PolarHBondContact O-N 2.7Å
70	D	97.9	Very high	98.1	Very high	48 Å²	48	28.6 Å²	28.6	26%	0.257	16%	0.163	S	C	.	.	S	Bend	trans	-107.5	-23.9	-176.9	-57.1	-62.8	0	0	0	112.5	R40 K42 I43 K66	R40-D70 IonicContact CZ-OD1 3.41Å; R40-D70 IonicContact CZ-OD2 3.22Å; R40-D70 IonicContact NH1-OD1 2.64Å; R40-D70 IonicContact NH1-OD2 3.65Å; R40-D70 IonicContact NH2-OD1 3.85Å; R40-D70 PolarHBondContact NH2-OD1 3.22Å; R40-D70 IonicContact NH2-OD2 3.84Å; R40-D70 PolarHBondContact NH2-OD2 3.25Å; K42-D70 WeakPolarHBondContact CA-OD2 3.4Å; K42-D70 HydrophobicContact CB-CB 4.21Å; K42-D70 HydrophobicContact CG-CB 4.36Å; I43-D70 PolarHBondContact N-OD2 3.28Å; I43-D70 PolarHBondContact O-N 2.97Å; K66-D70 PolarHBondContact NZ-O 3.36Å
71	Y	98.4	Very high	97.9	Very high	63 Å²	63	29.6 Å²	29.6	25%	0.247	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	132.3	-174.1	-160.9	-93.1	0	0	0	110.3	I43 R44 V45 I73 D107 E108	I43-Y71 PolarHBondContact O-N 2.96Å; I43-Y71 VanDerWaalsContact O-N 3.16Å; R44-Y71 HydrophobicContact CG-CD1 4.45Å; V45-Y71 PolarHBondContact N-O 2.72Å; Y71-I73 HydrophobicContact CD1-CG1 4.07Å; Y71-I73 HydrophobicContact CE1-CG1 4.13Å; Y71-D107 WeakPolarHBondContact CA-OD2 3.37Å; Y71-D107 HydrophobicContact CD1-CB 4.1Å; Y71-D107 HydrophobicContact CD2-CB 3.66Å; Y71-D107 HydrophobicContact CE1-CB 3.76Å; Y71-D107 HydrophobicContact CE2-CB 3.28Å; Y71-D107 HydrophobicContact CG-CB 4.07Å; Y71-E108 HydrophobicContact CE1-CB 3.84Å; Y71-E108 WeakPolarHBondContact CE1-OE2 3.35Å
72	L	98.8	Very high	97.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	120.5	-178.1	176.1	61.9	0	0	0	110.5	V45 C47 L62 A65 K66 V74 V106 D107 E108	V45-L72 HydrophobicContact CB-CD1 4.06Å; V45-L72 HydrophobicContact CG1-CD1 3.95Å; C47-L72 HydrophobicContact CB-CD1 4.43Å; L62-L72 HydrophobicContact CB-CD2 4.08Å; L62-L72 HydrophobicContact CD2-CD2 4.05Å; L62-L72 VanDerWaalsContact O-CD2 3.28Å; L62-L72 WeakPolarHBondContact O-CD2 3.39Å; A65-L72 HydrophobicContact CB-CD1 3.95Å; A65-L72 HydrophobicContact CB-CD2 4.25Å; K66-L72 HydrophobicContact CB-CB 4.21Å; K66-L72 HydrophobicContact CB-CD2 3.96Å; K66-L72 HydrophobicContact CD-CB 3.99Å; L72-V74 HydrophobicContact CD2-CG2 4.4Å; L72-V74 HydrophobicContact CG-CG2 4.15Å; L72-V106 HydrophobicContact CD2-CG2 4.46Å; L72-D107 PolarHBondContact N-OD2 3.07Å; L72-D107 PolarHBondContact O-N 3.36Å; L72-E108 PolarHBondContact O-N 3.28Å
73	I	98.8	Very high	97.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.4	170.6	-44	177.6	0	0	0	108.3	V45 W46 C47 Y71 E108 V110 C127	V45-I73 PolarHBondContact O-N 3.08Å; W46-I73 HydrophobicContact CE3-CB 3.99Å; W46-I73 HydrophobicContact CE3-CG2 3.9Å; W46-I73 HydrophobicContact CZ3-CB 4.31Å; W46-I73 HydrophobicContact CZ3-CG2 3.69Å; C47-I73 PolarHBondContact N-O 3.33Å; Y71-I73 HydrophobicContact CD1-CG1 4.07Å; Y71-I73 HydrophobicContact CE1-CG1 4.13Å; I73-E108 WeakPolarHBondContact CA-O 3.36Å; I73-E108 HydrophobicContact CB-CB 4.39Å; I73-E108 HydrophobicContact CG1-CB 4.22Å; I73-E108 HydrophobicContact CG2-CB 4.05Å; I73-E108 HydrophobicContact CG2-CG 4.06Å; I73-V110 HydrophobicContact CG2-CB 4.5Å; I73-V110 HydrophobicContact CG2-CG2 3.64Å; I73-C127 WeakPolarHBondContact CD1-SG 3.38Å
74	V	98.9	Very high	96.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	113.5	175.2	-171.9	0	0	0	0	110.8	C47 Y51 L62 L72 V76 V100 V106 E108 V109 V110	C47-V74 HydrophobicContact CB-CG1 4.47Å; C47-V74 HydrophobicContact CB-CG2 4.44Å; C47-V74 CarbonylContact O-C 3.41Å; C47-V74 WeakPolarHBondContact O-CA 3.47Å; Y51-V74 HydrophobicContact CD2-CG1 4.02Å; Y51-V74 HydrophobicContact CE2-CG1 3.28Å; L62-V74 HydrophobicContact CD2-CG1 4.3Å; L62-V74 HydrophobicContact CD2-CG2 3.5Å; L72-V74 HydrophobicContact CD2-CG2 4.4Å; L72-V74 HydrophobicContact CG-CG2 4.15Å; V74-V76 HydrophobicContact CG1-CG2 4.19Å; V74-V100 HydrophobicContact CB-CG1 3.77Å; V74-V100 HydrophobicContact CG1-CG1 3.69Å; V74-V100 HydrophobicContact CG2-CG1 4.13Å; V74-V106 HydrophobicContact CB-CG1 4.31Å; V74-V106 HydrophobicContact CG2-CB 4.34Å; V74-V106 HydrophobicContact CG2-CG1 3.78Å; V74-V106 HydrophobicContact CG2-CG2 3.67Å; V74-E108 PolarHBondContact N-O 3.32Å; V74-V109 WeakPolarHBondContact O-CA 3.3Å; V74-V110 PolarHBondContact O-N 3.26Å
75	G	98.8	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	133.5	166.9	0	0	0	0	0	111.4	C47 D48 G49 V110 A113	C47-G75 PolarHBondContact O-N 2.91Å; D48-G75 WeakPolarHBondContact CA-O 3.39Å; G49-G75 PolarHBondContact N-O 3.35Å; G49-G75 VanDerWaalsContact N-O 3.16Å; G75-V110 WeakPolarHBondContact CA-O 3.42Å; G75-A113 VanDerWaalsContact CA-CB 3.47Å
76	V	98.7	Very high	95.3	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.6	177.6	-173.5	0	0	0	0	109	Y51 V74 R96 Y97 V100 V109 V110 G112 A113	Y51-V76 HydrophobicContact CD2-CG2 3.97Å; V74-V76 HydrophobicContact CG1-CG2 4.19Å; V76-R96 HydrophobicContact CG1-CB 4.27Å; V76-R96 VanDerWaalsContact CG1-NH1 3.34Å; V76-Y97 HydrophobicContact CB-CD1 3.62Å; V76-Y97 HydrophobicContact CB-CE1 3.7Å; V76-Y97 HydrophobicContact CG1-CD1 3.61Å; V76-Y97 HydrophobicContact CG1-CE1 3.7Å; V76-Y97 HydrophobicContact CG2-CD1 4.35Å; V76-V100 HydrophobicContact CG2-CB 4.34Å; V76-V100 HydrophobicContact CG2-CG1 4.38Å; V76-V100 HydrophobicContact CG2-CG2 4.03Å; V76-V109 HydrophobicContact CG2-CG1 4Å; V76-V110 PolarHBondContact N-O 3Å; V76-G112 PolarHBondContact O-N 3.26Å; V76-A113 PolarHBondContact O-N 2.92Å; V76-A113 VanDerWaalsContact O-N 3.08Å
77	H	98.1	Very high	94.3	Very high	5 Å²	5	43.8 Å²	43.8	2%	0.023	25%	0.248	C	C	.	.			trans	-75.6	154.5	-175.6	-21.5	-72.1	0	0	0	112.4	D48 G49 C50 E81 I82 R96 A113 P114 Y115	D48-H77 IonicContact OD1-CE1 2.77Å; G49-H77 VanDerWaalsContact CA-NE2 3.26Å; G49-H77 WeakPolarHBondContact CA-NE2 3.16Å; G49-H77 PolarHBondContact O-CD2 3.45Å; G49-H77 PolarHBondContact O-NE2 2.68Å; C50-H77 PolarHBondContact N-NE2 3.45Å; H77-E81 HydrophobicContact CB-CB 4.19Å; H77-E81 HydrophobicContact CB-CG 4.3Å; H77-I82 HydrophobicContact CB-CG1 4.17Å; H77-R96 PolarHBondContact O-NH1 3.17Å; H77-R96 PolarHBondContact O-NH2 2.66Å; H77-A113 WeakPolarHBondContact CA-O 3.11Å; H77-A113 WeakPolarHBondContact CB-O 3.24Å; H77-A113 PolarHBondContact ND1-O 3Å; H77-P114 PolarHBondContact CE1-O 2.76Å; H77-P114 PolarHBondContact ND1-O 2.83Å; H77-Y115 AromaticContact CD2-CD2 3.85Å
78	T	98.1	Very high	93.8	Very high	30 Å²	30	42.9 Å²	42.9	18%	0.184	24%	0.236	C	C	.	.			trans	-67.1	162.2	174.7	66.9	0	0	0	0	112.4	S80 E81 I82	T78-S80 PolarHBondContact O-N 2.86Å; T78-S80 PolarHBondContact OG1-OG 3.33Å; T78-E81 PolarHBondContact O-N 3.28Å; T78-E81 VanDerWaalsContact OG1-CB 3.28Å; T78-E81 WeakPolarHBondContact OG1-CB 3.49Å; T78-E81 PolarHBondContact OG1-N 2.73Å; T78-I82 WeakPolarHBondContact O-CG1 3.39Å; T78-I82 PolarHBondContact O-N 2.67Å; T78-I82 VanDerWaalsContact O-N 3.13Å
79	D	96.1	Very high	93.4	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-33.3	174.5	-64	-31.3	0	0	0	112.1	S83 P89 T92 Q93 R96	D79-S83 VanDerWaalsContact O-CB 3.32Å; D79-S83 WeakPolarHBondContact O-CB 3.34Å; D79-S83 PolarHBondContact O-N 2.91Å; D79-S83 VanDerWaalsContact O-N 3.14Å; D79-S83 PolarHBondContact O-OG 2.89Å; D79-P89 HydrophobicContact CB-CG 4.25Å; D79-P89 VanDerWaalsContact OD1-CG 3.23Å; D79-P89 WeakPolarHBondContact OD1-CG 3.2Å; D79-T92 WeakPolarHBondContact OD2-CA 3.33Å; D79-Q93 VanDerWaalsContact CG-N 3.27Å; D79-Q93 PolarHBondContact OD1-N 3.39Å; D79-Q93 PolarHBondContact OD2-N 3.41Å; D79-R96 IonicContact OD1-CZ 3.45Å; D79-R96 IonicContact OD1-NE 2.83Å; D79-R96 PolarHBondContact OD1-NE 3.42Å; D79-R96 IonicContact OD1-NH2 2.67Å; D79-R96 PolarHBondContact OD1-NH2 2.71Å
80	S	95.6	Very high	93.2	Very high	77 Å²	77	40.9 Å²	40.9	54%	0.538	22%	0.224	S	C	.	.	H	α-helix	trans	-69.7	-37.9	176.1	56	0	0	0	0	112.7	T78 S83 K84	T78-S80 PolarHBondContact O-N 2.86Å; T78-S80 PolarHBondContact OG1-OG 3.33Å; S80-S83 PolarHBondContact O-N 2.83Å; S80-K84 WeakPolarHBondContact O-CG 3.48Å; S80-K84 PolarHBondContact O-N 2.89Å
81	E	94.2	Very high	93	Very high	40 Å²	40	39.5 Å²	39.5	19%	0.187	22%	0.215	C	C	.	.	H	α-helix	trans	-71.6	-40.2	-179.9	-168	64.2	-165.7	0	0	111.8	H77 T78 S83 K84 H85 Y115	H77-E81 HydrophobicContact CB-CB 4.19Å; H77-E81 HydrophobicContact CB-CG 4.3Å; T78-E81 PolarHBondContact O-N 3.28Å; T78-E81 VanDerWaalsContact OG1-CB 3.28Å; T78-E81 WeakPolarHBondContact OG1-CB 3.49Å; T78-E81 PolarHBondContact OG1-N 2.73Å; E81-S83 VanDerWaalsContact C-N 3.32Å; E81-S83 PolarHBondContact O-N 3.03Å; E81-K84 PolarHBondContact O-N 2.9Å; E81-K84 WeakPolarHBondContact OE2-CE 3.37Å; E81-K84 IonicContact OE2-NZ 3.55Å; E81-K84 PolarHBondContact OE2-NZ 2.63Å; E81-H85 PolarHBondContact O-ND1 2.95Å; E81-H85 IonicContact OE1-CE1 3.61Å; E81-H85 PolarHBondContact OE1-CE1 2.84Å; E81-Y115 HydrophobicContact CG-CD2 4.44Å
82	I	92.6	Very high	92.9	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-44.1	172.2	-67.3	173.8	0	0	0	110.7	C50 H77 T78 K84 H85 K86 P89	C50-I82 HydrophobicContact CB-CD1 3.81Å; C50-I82 HydrophobicContact CB-CG1 4.41Å; H77-I82 HydrophobicContact CB-CG1 4.17Å; T78-I82 WeakPolarHBondContact O-CG1 3.39Å; T78-I82 PolarHBondContact O-N 2.67Å; T78-I82 VanDerWaalsContact O-N 3.13Å; I82-K84 PolarHBondContact O-N 2.91Å; I82-H85 PolarHBondContact O-N 3.16Å; I82-H85 VanDerWaalsContact O-N 3.1Å; I82-K86 HydrophobicContact CG2-CD 4.41Å; I82-K86 HydrophobicContact CG2-CG 3.92Å; I82-K86 PolarHBondContact O-N 2.8Å; I82-P89 HydrophobicContact CD1-CB 4.43Å; I82-P89 HydrophobicContact CD1-CG 4.33Å; I82-P89 HydrophobicContact CG2-CG 4.47Å
83	S	89.8	Confident	92.9	Very high	58 Å²	58	41.9 Å²	41.9	41%	0.406	23%	0.233	S	C	.	.	H	α-helix	trans	-70.1	-12.2	-175.9	-59.3	0	0	0	0	114.7	D79 S80 E81	D79-S83 VanDerWaalsContact O-CB 3.32Å; D79-S83 WeakPolarHBondContact O-CB 3.34Å; D79-S83 PolarHBondContact O-N 2.91Å; D79-S83 VanDerWaalsContact O-N 3.14Å; D79-S83 PolarHBondContact O-OG 2.89Å; S80-S83 PolarHBondContact O-N 2.83Å; E81-S83 VanDerWaalsContact C-N 3.32Å; E81-S83 PolarHBondContact O-N 3.03Å
84	K	88.7	Confident	92.9	Very high	148 Å²	148	46.6 Å²	46.6	64%	0.643	26%	0.255	S	S	*	.	H	α-helix	trans	-75.9	-37.6	169.3	-67.1	168.8	-172.4	173.9	0	112	S80 E81 I82	S80-K84 WeakPolarHBondContact O-CG 3.48Å; S80-K84 PolarHBondContact O-N 2.89Å; E81-K84 PolarHBondContact O-N 2.9Å; E81-K84 WeakPolarHBondContact OE2-CE 3.37Å; E81-K84 IonicContact OE2-NZ 3.55Å; E81-K84 PolarHBondContact OE2-NZ 2.63Å; I82-K84 PolarHBondContact O-N 2.91Å
85	H	83.3	Confident	92.8	Very high	98 Å²	98	48 Å²	48	45%	0.454	26%	0.262	S	S	.	.	H	α-helix	trans	-98.9	-26.8	-168.3	-62.6	95.8	0	0	0	113.1	E81 I82 Y115	E81-H85 PolarHBondContact O-ND1 2.95Å; E81-H85 IonicContact OE1-CE1 3.61Å; E81-H85 PolarHBondContact OE1-CE1 2.84Å; I82-H85 PolarHBondContact O-N 3.16Å; I82-H85 VanDerWaalsContact O-N 3.1Å; H85-Y115 HydrophobicContact CB-CD1 4.09Å; H85-Y115 HydrophobicContact CB-CD2 4.28Å; H85-Y115 HydrophobicContact CB-CE1 3.64Å; H85-Y115 HydrophobicContact CB-CE2 3.84Å; H85-Y115 HydrophobicContact CB-CG 4.39Å; H85-Y115 VanDerWaalsContact CB-CZ 3.5Å; H85-Y115 AromaticContact CD2-CD1 3.6Å; H85-Y115 AromaticContact CD2-CE1 3.88Å; H85-Y115 VanDerWaalsContact CE1-CB 3.47Å; H85-Y115 WeakPolarHBondContact CE1-CB 3.41Å; H85-Y115 AromaticContact CE1-CD1 3.81Å; H85-Y115 AromaticContact CE1-CG 3.52Å; H85-Y115 AromaticContact CG-CD1 3.52Å; H85-Y115 AromaticContact CG-CD2 3.96Å; H85-Y115 AromaticContact CG-CE1 3.61Å; H85-Y115 AromaticContact CG-CG 3.71Å; H85-Y115 AromaticContact CG-CZ 3.87Å; H85-Y115 AromaticContact ND1-CD1 3.66Å; H85-Y115 AromaticContact ND1-CD2 3.53Å; H85-Y115 AromaticContact ND1-CG 3.34Å; H85-Y115 VanDerWaalsContact ND1-CG 3.34Å; H85-Y115 AromaticContact NE2-CD1 3.8Å; H85-Y115 AromaticContact NE2-CG 3.99Å
86	K	82.3	Confident	92.8	Very high	105 Å²	105	48.1 Å²	48.1	46%	0.457	26%	0.262	S	S	.	.	S	Bend	trans	-153	-169.9	178.6	60.4	176.6	179.6	-176.3	0	111.5	C50 I82	C50-K86 WeakPolarHBondContact SG-CE 3.26Å; C50-K86 PolarHBondContact SG-NZ 3.31Å; I82-K86 HydrophobicContact CG2-CD 4.41Å; I82-K86 HydrophobicContact CG2-CG 3.92Å; I82-K86 PolarHBondContact O-N 2.8Å
87	G	78.9	Confident	92.8	Very high	39 Å²	39	48.2 Å²	48.2	40%	0.402	26%	0.263	S	S	.	.	S	Bend	trans	-59.8	153.6	172.3	0	0	0	0	0	112.6
88	P	85.6	Confident	92.8	Very high	62 Å²	62	51.3 Å²	51.3	40%	0.403	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-61.8	147.9	178	28.5	-35.9	0	0	0	111
89	P	91.6	Very high	92.8	Very high	18 Å²	18	50.7 Å²	50.7	12%	0.117	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-68.9	163.3	-178.1	28.8	-33.9	0	0	0	113	D52 D79 I82 F91 N369	D52-P89 HydrophobicContact CB-CB 4.12Å; D52-P89 VanDerWaalsContact OD2-CA 3.27Å; D52-P89 WeakPolarHBondContact OD2-CA 3.36Å; D52-P89 WeakPolarHBondContact OD2-CB 3.28Å; D79-P89 HydrophobicContact CB-CG 4.25Å; D79-P89 VanDerWaalsContact OD1-CG 3.23Å; D79-P89 WeakPolarHBondContact OD1-CG 3.2Å; I82-P89 HydrophobicContact CD1-CB 4.43Å; I82-P89 HydrophobicContact CD1-CG 4.33Å; I82-P89 HydrophobicContact CG2-CG 4.47Å; P89-F91 WeakPolarHBondContact CB-O 3.44Å; P89-N369 PolarHBondContact O-ND2 2.8Å
90	V	91.4	Very high	93	Very high	24 Å²	24	48.6 Å²	48.6	15%	0.145	26%	0.26	C	S	.	.	S	Bend	trans	-81.4	-34.8	176	179.6	0	0	0	0	111.5	D52 M53 R365 I366	D52-V90 VanDerWaalsContact CG-N 3.33Å; D52-V90 PolarHBondContact OD1-N 3.14Å; D52-V90 VanDerWaalsContact OD1-N 3.15Å; D52-V90 PolarHBondContact OD2-N 3.35Å; M53-V90 HydrophobicContact CG-CB 4.25Å; M53-V90 HydrophobicContact CG-CG2 4.31Å; M53-V90 HydrophobicContact SD-CB 4.34Å; M53-V90 HydrophobicContact SD-CG1 3.98Å; V90-R365 HydrophobicContact CG1-CB 3.94Å; V90-R365 PolarHBondContact O-NH1 2.93Å; V90-I366 HydrophobicContact CG1-CG1 3.79Å; V90-I366 HydrophobicContact CG2-CG1 4.04Å
91	F	94.6	Very high	93.1	Very high	19 Å²	19	49.4 Å²	49.4	8%	0.083	25%	0.252	C	S	.	.	S	Bend	trans	-105	144.3	173.4	-68.6	-66.7	0	0	0	111.7	D52 M53 P89 E95 R96 L357 I362	D52-F91 PolarHBondContact OD1-N 3.41Å; M53-F91 HydrophobicContact CG-CE2 4.29Å; M53-F91 HydrophobicContact SD-CD2 4.11Å; M53-F91 HydrophobicContact SD-CE2 3.38Å; M53-F91 WeakPolarHBondContact SD-CE2 3.2Å; M53-F91 HydrophobicContact SD-CZ 4.06Å; P89-F91 WeakPolarHBondContact CB-O 3.44Å; F91-E95 WeakPolarHBondContact CA-OE2 3.26Å; F91-E95 HydrophobicContact CB-CB 3.94Å; F91-E95 HydrophobicContact CD1-CB 4.16Å; F91-E95 WeakPolarHBondContact CD1-OE2 3.5Å; F91-E95 HydrophobicContact CG-CB 4.4Å; F91-R96 HydrophobicContact CB-CG 3.67Å; F91-R96 PolarHBondContact O-NE 2.69Å; F91-L357 HydrophobicContact CE1-CD1 4.45Å; F91-L357 HydrophobicContact CE1-CD2 3.7Å; F91-L357 HydrophobicContact CZ-CD2 4.34Å; F91-I362 HydrophobicContact CE1-CD1 4.46Å; F91-I362 HydrophobicContact CE1-CG1 4.18Å; F91-I362 HydrophobicContact CZ-CD1 3.87Å; F91-I362 HydrophobicContact CZ-CG1 3.86Å; F91-I362 HydrophobicContact CZ-CG2 4.24Å
92	T	96.8	Very high	93.3	Very high	65 Å²	65	47.7 Å²	47.7	40%	0.399	24%	0.244	S	C	.	.			trans	-64.5	160.1	172	70.5	0	0	0	0	110.6	D79 E94 E95 R96	D79-T92 WeakPolarHBondContact OD2-CA 3.33Å; T92-E94 PolarHBondContact O-N 3.3Å; T92-E95 PolarHBondContact N-OE2 3.38Å; T92-E95 PolarHBondContact O-N 3.1Å; T92-E95 VanDerWaalsContact O-N 3.16Å; T92-E95 WeakPolarHBondContact OG1-CG 3.47Å; T92-E95 PolarHBondContact OG1-N 3.19Å; T92-E95 PolarHBondContact OG1-OE2 2.91Å; T92-R96 WeakPolarHBondContact O-CG 3.49Å; T92-R96 PolarHBondContact O-N 2.77Å
93	Q	98	Very high	93.6	Very high	48 Å²	48	47.9 Å²	47.9	22%	0.224	25%	0.245	C	C	.	.	H	α-helix	trans	-54.9	-39	177	58.5	169.7	59.1	0	0	112.7	D79 R96 Y97	D79-Q93 VanDerWaalsContact CG-N 3.27Å; D79-Q93 PolarHBondContact OD1-N 3.39Å; D79-Q93 PolarHBondContact OD2-N 3.41Å; Q93-R96 VanDerWaalsContact CA-NH2 3.34Å; Q93-R96 CarbonylContact O-C 3.51Å; Q93-R96 PolarHBondContact O-N 3.4Å; Q93-Y97 HydrophobicContact CB-CE1 4.13Å; Q93-Y97 HydrophobicContact CB-CE2 3.92Å; Q93-Y97 HydrophobicContact CG-CE2 4.07Å; Q93-Y97 PolarHBondContact NE2-OH 3.43Å; Q93-Y97 WeakPolarHBondContact O-CB 3.43Å; Q93-Y97 VanDerWaalsContact O-CD1 3.24Å; Q93-Y97 WeakPolarHBondContact O-CD1 3.27Å; Q93-Y97 VanDerWaalsContact O-CD2 3.27Å; Q93-Y97 WeakPolarHBondContact O-CD2 3.4Å; Q93-Y97 PolarHBondContact O-N 2.88Å
94	E	98.2	Very high	94	Very high	98 Å²	98	47.7 Å²	47.7	46%	0.458	24%	0.237	S	C	.	.	H	α-helix	trans	-66.8	-40.9	178.7	-52	-49	133.5	0	0	112.5	T92 R96 Y97 K98	T92-E94 PolarHBondContact O-N 3.3Å; E94-R96 VanDerWaalsContact C-N 3.32Å; E94-R96 PolarHBondContact O-N 2.58Å; E94-Y97 PolarHBondContact O-N 3.03Å; E94-Y97 WeakPolarHBondContact OE1-CE2 3.47Å; E94-Y97 WeakPolarHBondContact OE2-CD2 3.24Å; E94-K98 WeakPolarHBondContact O-CB 3.28Å; E94-K98 PolarHBondContact O-N 3.39Å
95	E	98.1	Very high	94.5	Very high	31 Å²	31	42.3 Å²	42.3	15%	0.145	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-41.9	172.2	-70.4	175.2	129	0	0	110.6	F91 T92 M99 I244 R365	F91-E95 WeakPolarHBondContact CA-OE2 3.26Å; F91-E95 HydrophobicContact CB-CB 3.94Å; F91-E95 HydrophobicContact CD1-CB 4.16Å; F91-E95 WeakPolarHBondContact CD1-OE2 3.5Å; F91-E95 HydrophobicContact CG-CB 4.4Å; T92-E95 PolarHBondContact N-OE2 3.38Å; T92-E95 PolarHBondContact O-N 3.1Å; T92-E95 VanDerWaalsContact O-N 3.16Å; T92-E95 WeakPolarHBondContact OG1-CG 3.47Å; T92-E95 PolarHBondContact OG1-N 3.19Å; T92-E95 PolarHBondContact OG1-OE2 2.91Å; E95-M99 VanDerWaalsContact O-CB 3.3Å; E95-M99 WeakPolarHBondContact O-CB 3.45Å; E95-M99 PolarHBondContact O-N 3.19Å; E95-I244 HydrophobicContact CB-CG1 4.24Å; E95-I244 HydrophobicContact CG-CD1 4.21Å; E95-I244 HydrophobicContact CG-CG1 4.18Å; E95-I244 WeakPolarHBondContact O-CG2 3.42Å; E95-R365 VanDerWaalsContact CD-NH1 3.32Å; E95-R365 IonicContact OE1-CZ 2.79Å; E95-R365 IonicContact OE1-NH1 3.2Å; E95-R365 PolarHBondContact OE1-NH1 2.88Å; E95-R365 VanDerWaalsContact OE1-NH1 3.07Å; E95-R365 IonicContact OE1-NH2 2.63Å; E95-R365 PolarHBondContact OE1-NH2 3.26Å; E95-R365 IonicContact OE2-CZ 2.72Å; E95-R365 IonicContact OE2-NH1 4Å; E95-R365 PolarHBondContact OE2-NH1 3.25Å; E95-R365 IonicContact OE2-NH2 2.8Å
96	R	98.4	Very high	95.2	Very high	1 Å²	1	37.8 Å²	37.8	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-68.8	-43.3	178.4	-64	-179.3	-62.9	98.4	-2.3	111.9	C50 V76 H77 D79 F91 T92 Q93 E94 K98 M99 V100	C50-R96 WeakPolarHBondContact O-CD 3.33Å; C50-R96 PolarHBondContact O-NH1 3.46Å; V76-R96 HydrophobicContact CG1-CB 4.27Å; V76-R96 VanDerWaalsContact CG1-NH1 3.34Å; H77-R96 PolarHBondContact O-NH1 3.17Å; H77-R96 PolarHBondContact O-NH2 2.66Å; D79-R96 IonicContact OD1-CZ 3.45Å; D79-R96 IonicContact OD1-NE 2.83Å; D79-R96 PolarHBondContact OD1-NE 3.42Å; D79-R96 IonicContact OD1-NH2 2.67Å; D79-R96 PolarHBondContact OD1-NH2 2.71Å; F91-R96 HydrophobicContact CB-CG 3.67Å; F91-R96 PolarHBondContact O-NE 2.69Å; T92-R96 WeakPolarHBondContact O-CG 3.49Å; T92-R96 PolarHBondContact O-N 2.77Å; Q93-R96 VanDerWaalsContact CA-NH2 3.34Å; Q93-R96 CarbonylContact O-C 3.51Å; Q93-R96 PolarHBondContact O-N 3.4Å; E94-R96 VanDerWaalsContact C-N 3.32Å; E94-R96 PolarHBondContact O-N 2.58Å; R96-K98 PolarHBondContact O-N 3.32Å; R96-M99 PolarHBondContact O-N 3.41Å; R96-V100 WeakPolarHBondContact O-CG2 3.39Å; R96-V100 PolarHBondContact O-N 3.36Å
97	Y	98.6	Very high	96	Very high	2 Å²	2	36 Å²	36	1%	0.008	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-47.7	175.4	-57.5	-26.2	0	0	0	111.2	V76 Q93 E94 V100 R101 E111 G112	V76-Y97 HydrophobicContact CB-CD1 3.62Å; V76-Y97 HydrophobicContact CB-CE1 3.7Å; V76-Y97 HydrophobicContact CG1-CD1 3.61Å; V76-Y97 HydrophobicContact CG1-CE1 3.7Å; V76-Y97 HydrophobicContact CG2-CD1 4.35Å; Q93-Y97 HydrophobicContact CB-CE1 4.13Å; Q93-Y97 HydrophobicContact CB-CE2 3.92Å; Q93-Y97 HydrophobicContact CG-CE2 4.07Å; Q93-Y97 PolarHBondContact NE2-OH 3.43Å; Q93-Y97 WeakPolarHBondContact O-CB 3.43Å; Q93-Y97 VanDerWaalsContact O-CD1 3.24Å; Q93-Y97 WeakPolarHBondContact O-CD1 3.27Å; Q93-Y97 VanDerWaalsContact O-CD2 3.27Å; Q93-Y97 WeakPolarHBondContact O-CD2 3.4Å; Q93-Y97 PolarHBondContact O-N 2.88Å; E94-Y97 PolarHBondContact O-N 3.03Å; E94-Y97 WeakPolarHBondContact OE1-CE2 3.47Å; E94-Y97 WeakPolarHBondContact OE2-CD2 3.24Å; Y97-V100 PolarHBondContact O-N 3.42Å; Y97-R101 VanDerWaalsContact O-CG 3.3Å; Y97-R101 WeakPolarHBondContact O-CG 3.28Å; Y97-R101 PolarHBondContact O-N 3.13Å; Y97-E111 HydrophobicContact CD1-CB 4.47Å; Y97-E111 HydrophobicContact CD1-CG 4.04Å; Y97-E111 HydrophobicContact CD2-CB 4.14Å; Y97-E111 HydrophobicContact CD2-CG 3.5Å; Y97-E111 VanDerWaalsContact CD2-CG 3.5Å; Y97-E111 WeakPolarHBondContact CD2-OE1 3.48Å; Y97-E111 HydrophobicContact CE1-CB 4.05Å; Y97-E111 HydrophobicContact CE1-CG 4.11Å; Y97-E111 HydrophobicContact CE2-CB 3.67Å; Y97-E111 HydrophobicContact CE2-CG 3.59Å; Y97-E111 HydrophobicContact CG-CG 3.74Å; Y97-G112 PolarHBondContact OH-N 2.9Å; Y97-G112 VanDerWaalsContact OH-N 3.17Å
98	K	98.6	Very high	96.9	Very high	70 Å²	70	37 Å²	37	30%	0.304	18%	0.181	S	C	.	.	H	α-helix	trans	-65.6	-39.3	178.1	-162.4	175.4	-171	-167.5	0	112.1	E94 R96 R101 A102 D248 E251	E94-K98 WeakPolarHBondContact O-CB 3.28Å; E94-K98 PolarHBondContact O-N 3.39Å; R96-K98 PolarHBondContact O-N 3.32Å; K98-R101 PolarHBondContact O-N 2.86Å; K98-A102 PolarHBondContact O-N 3.48Å; K98-D248 WeakPolarHBondContact CD-OD1 3.5Å; K98-D248 VanDerWaalsContact CE-OD1 3.24Å; K98-D248 WeakPolarHBondContact CE-OD1 3.37Å; K98-D248 VanDerWaalsContact NZ-CG 3.34Å; K98-D248 IonicContact NZ-OD1 2.68Å; K98-D248 PolarHBondContact NZ-OD1 2.98Å; K98-D248 IonicContact NZ-OD2 3.45Å; K98-E251 WeakPolarHBondContact CE-OE2 3.44Å; K98-E251 IonicContact NZ-OE2 3.57Å; K98-E251 PolarHBondContact NZ-OE2 3.07Å
99	M	98.4	Very high	97.6	Very high	17 Å²	17	35 Å²	35	8%	0.084	17%	0.168	C	C	.	.	H	α-helix	trans	-62.9	-42.4	177.4	-164.9	64	-173	0	0	112.6	V54 E95 R96 A102 F242 I244 V247	V54-M99 HydrophobicContact CB-CE 4.06Å; V54-M99 HydrophobicContact CB-CG 3.64Å; V54-M99 HydrophobicContact CG1-CE 4.04Å; V54-M99 HydrophobicContact CG1-CG 4.06Å; V54-M99 HydrophobicContact CG2-CB 4.15Å; V54-M99 HydrophobicContact CG2-CG 3.53Å; E95-M99 VanDerWaalsContact O-CB 3.3Å; E95-M99 WeakPolarHBondContact O-CB 3.45Å; E95-M99 PolarHBondContact O-N 3.19Å; R96-M99 PolarHBondContact O-N 3.41Å; M99-A102 WeakPolarHBondContact O-CB 3.42Å; M99-A102 PolarHBondContact O-N 3.4Å; M99-F242 HydrophobicContact CE-CD1 3.75Å; M99-F242 HydrophobicContact CE-CE1 4.15Å; M99-F242 WeakPolarHBondContact CE-O 3.39Å; M99-I244 HydrophobicContact CB-CG2 3.68Å; M99-I244 HydrophobicContact CG-CG2 4.23Å; M99-I244 HydrophobicContact SD-CG2 3.75Å; M99-V247 HydrophobicContact SD-CG2 3.83Å
100	V	98.7	Very high	97.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.1	-40.8	176.7	177.4	0	0	0	0	111	Y51 V74 V76 R96 Y97 A102 I103 V106 V109	Y51-V100 VanDerWaalsContact CB-CG2 3.41Å; Y51-V100 HydrophobicContact CD1-CG2 4.09Å; Y51-V100 HydrophobicContact CD2-CG2 3.9Å; Y51-V100 HydrophobicContact CG-CG2 3.51Å; V74-V100 HydrophobicContact CB-CG1 3.77Å; V74-V100 HydrophobicContact CG1-CG1 3.69Å; V74-V100 HydrophobicContact CG2-CG1 4.13Å; V76-V100 HydrophobicContact CG2-CB 4.34Å; V76-V100 HydrophobicContact CG2-CG1 4.38Å; V76-V100 HydrophobicContact CG2-CG2 4.03Å; R96-V100 WeakPolarHBondContact O-CG2 3.39Å; R96-V100 PolarHBondContact O-N 3.36Å; Y97-V100 PolarHBondContact O-N 3.42Å; V100-A102 PolarHBondContact O-N 2.89Å; V100-I103 WeakPolarHBondContact O-CB 3.45Å; V100-I103 PolarHBondContact O-N 3.26Å; V100-I103 VanDerWaalsContact O-N 3.09Å; V100-V106 HydrophobicContact CG1-CG1 4.37Å; V100-V106 HydrophobicContact CG1-CG2 4.19Å; V100-V109 HydrophobicContact CB-CG2 4.19Å; V100-V109 HydrophobicContact CG1-CG2 3.66Å
101	R	98.6	Very high	98.2	Very high	94 Å²	94	37.6 Å²	37.6	36%	0.355	18%	0.177	S	C	.	.	H	α-helix	trans	-57.8	-31.8	173.4	-73.6	174	178.9	126.9	9.4	112.6	Y97 K98 I103 V109 E111 R296	Y97-R101 VanDerWaalsContact O-CG 3.3Å; Y97-R101 WeakPolarHBondContact O-CG 3.28Å; Y97-R101 PolarHBondContact O-N 3.13Å; K98-R101 PolarHBondContact O-N 2.86Å; R101-I103 PolarHBondContact O-N 2.93Å; R101-V109 HydrophobicContact CB-CG2 4.45Å; R101-V109 HydrophobicContact CG-CB 3.8Å; R101-V109 HydrophobicContact CG-CG1 4.4Å; R101-V109 HydrophobicContact CG-CG2 3.55Å; R101-E111 IonicContact CZ-OE1 3.45Å; R101-E111 IonicContact NH1-OE1 3.16Å; R101-E111 PolarHBondContact NH1-OE1 2.88Å; R101-E111 IonicContact NH2-OE1 2.82Å; R101-E111 PolarHBondContact NH2-OE1 3.34Å; R101-R296 VanDerWaalsContact O-CZ 3.23Å; R101-R296 PolarHBondContact O-NE 2.93Å; R101-R296 PolarHBondContact O-NH2 3.48Å
102	A	98.6	Very high	98.3	Very high	3 Å²	3	38.7 Å²	38.7	3%	0.025	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.6	178.5	0	0	0	0	0	114.3	K98 M99 V100 V247 C295 R296	K98-A102 PolarHBondContact O-N 3.48Å; M99-A102 WeakPolarHBondContact O-CB 3.42Å; M99-A102 PolarHBondContact O-N 3.4Å; V100-A102 PolarHBondContact O-N 2.89Å; A102-V247 HydrophobicContact CB-CB 4.25Å; A102-V247 HydrophobicContact CB-CG1 3.5Å; A102-V247 HydrophobicContact CB-CG2 3.65Å; A102-C295 CarbonylContact O-C 3.57Å; A102-C295 WeakPolarHBondContact O-CA 3.35Å; A102-R296 PolarHBondContact O-N 3.41Å
103	I	98.8	Very high	98.4	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.031	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-78.1	125.3	-177.2	-59.7	173.2	0	0	0	110	V54 L62 V100 R101 W105 V106 A294 R296	V54-I103 HydrophobicContact CG1-CD1 4.02Å; L62-I103 HydrophobicContact CD1-CD1 3.59Å; L62-I103 HydrophobicContact CD1-CG2 4.31Å; V100-I103 WeakPolarHBondContact O-CB 3.45Å; V100-I103 PolarHBondContact O-N 3.26Å; V100-I103 VanDerWaalsContact O-N 3.09Å; R101-I103 PolarHBondContact O-N 2.93Å; I103-W105 HydrophobicContact CG2-CE3 3.8Å; I103-W105 HydrophobicContact CG2-CZ3 4.45Å; I103-W105 PolarHBondContact O-N 3Å; I103-W105 VanDerWaalsContact O-N 3.15Å; I103-V106 HydrophobicContact CB-CG2 4.09Å; I103-V106 HydrophobicContact CG2-CG2 4.28Å; I103-V106 PolarHBondContact O-N 3.4Å; I103-V106 VanDerWaalsContact O-N 3.1Å; I103-A294 WeakPolarHBondContact CA-O 3.39Å; I103-R296 PolarHBondContact O-NH2 3.27Å
104	K	98.3	Very high	98.2	Very high	53 Å²	53	36.1 Å²	36.1	23%	0.23	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.9	-168.4	75.4	-169.3	-175.6	-171.5	0	116.5	F220 L293 A294 R296	K104-F220 WeakPolarHBondContact CE-O 3.45Å; K104-F220 PolarHBondContact NZ-O 3.36Å; K104-L293 VanDerWaalsContact CE-O 3.24Å; K104-L293 WeakPolarHBondContact CE-O 3.37Å; K104-L293 PolarHBondContact NZ-O 2.88Å; K104-A294 PolarHBondContact N-O 3.15Å; K104-R296 HydrophobicContact CB-CB 3.8Å
105	W	98.6	Very high	98	Very high	36 Å²	36	34.3 Å²	34.3	14%	0.136	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.9	175.8	-60.6	-66.4	0	0	0	113.9	R63 K66 I103 F220 A294	R63-W105 HydrophobicContact CB-CD2 3.65Å; R63-W105 HydrophobicContact CB-CE3 3.73Å; R63-W105 HydrophobicContact CB-CG 4.15Å; R63-W105 HydrophobicContact CB-CH2 4.25Å; R63-W105 HydrophobicContact CB-CZ2 4.17Å; R63-W105 HydrophobicContact CB-CZ3 4.03Å; R63-W105 HydrophobicContact CG-CD2 3.89Å; R63-W105 HydrophobicContact CG-CE3 4.36Å; R63-W105 HydrophobicContact CG-CG 4.34Å; R63-W105 HydrophobicContact CG-CH2 4.27Å; R63-W105 HydrophobicContact CG-CZ2 3.79Å; K66-W105 HydrophobicContact CB-CB 3.9Å; K66-W105 WeakPolarHBondContact CD-O 3.34Å; K66-W105 HydrophobicContact CG-CB 4.08Å; I103-W105 HydrophobicContact CG2-CE3 3.8Å; I103-W105 HydrophobicContact CG2-CZ3 4.45Å; I103-W105 PolarHBondContact O-N 3Å; I103-W105 VanDerWaalsContact O-N 3.15Å; W105-F220 HydrophobicContact CH2-CB 4.47Å; W105-F220 AromaticContact CH2-CD1 3.71Å; W105-F220 HydrophobicContact CH2-CD1 3.71Å; W105-F220 HydrophobicContact CH2-CD2 4.36Å; W105-F220 AromaticContact CH2-CE1 3.97Å; W105-F220 HydrophobicContact CH2-CE1 3.97Å; W105-F220 AromaticContact CH2-CG 3.93Å; W105-F220 HydrophobicContact CH2-CG 3.93Å; W105-F220 HydrophobicContact CH2-CZ 4.41Å; W105-F220 HydrophobicContact CZ3-CD1 4.28Å; W105-F220 HydrophobicContact CZ3-CE1 4.13Å; W105-A294 HydrophobicContact CH2-CB 4.45Å; W105-A294 HydrophobicContact CZ3-CB 3.92Å
106	V	98.7	Very high	97.8	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	18%	0.179	C	C	.	.			trans	-90.5	126.2	178.7	-179.2	0	0	0	0	109.4	L62 L72 V74 V100 I103 E108 V109 R296	L62-V106 HydrophobicContact CD1-CG2 3.92Å; L72-V106 HydrophobicContact CD2-CG2 4.46Å; V74-V106 HydrophobicContact CB-CG1 4.31Å; V74-V106 HydrophobicContact CG2-CB 4.34Å; V74-V106 HydrophobicContact CG2-CG1 3.78Å; V74-V106 HydrophobicContact CG2-CG2 3.67Å; V100-V106 HydrophobicContact CG1-CG1 4.37Å; V100-V106 HydrophobicContact CG1-CG2 4.19Å; I103-V106 HydrophobicContact CB-CG2 4.09Å; I103-V106 HydrophobicContact CG2-CG2 4.28Å; I103-V106 PolarHBondContact O-N 3.4Å; I103-V106 VanDerWaalsContact O-N 3.1Å; V106-E108 WeakPolarHBondContact CG1-O 3.42Å; V106-V109 HydrophobicContact CG1-CG2 3.63Å; V106-R296 PolarHBondContact O-NH2 2.96Å
107	D	98.7	Very high	97.7	Very high	68 Å²	68	35.2 Å²	35.2	36%	0.364	18%	0.18	S	C	.	.	S	Bend	trans	-94.5	-35.3	175.2	-49	-95.5	0	0	0	111.8	K66 Y71 L72	K66-D107 IonicContact NZ-OD1 3.9Å; K66-D107 PolarHBondContact NZ-OD1 3.1Å; K66-D107 IonicContact NZ-OD2 3.79Å; K66-D107 PolarHBondContact NZ-OD2 3.23Å; Y71-D107 WeakPolarHBondContact CA-OD2 3.37Å; Y71-D107 HydrophobicContact CD1-CB 4.1Å; Y71-D107 HydrophobicContact CD2-CB 3.66Å; Y71-D107 HydrophobicContact CE1-CB 3.76Å; Y71-D107 HydrophobicContact CE2-CB 3.28Å; Y71-D107 HydrophobicContact CG-CB 4.07Å; L72-D107 PolarHBondContact N-OD2 3.07Å; L72-D107 PolarHBondContact O-N 3.36Å
108	E	98.3	Very high	97.6	Very high	60 Å²	60	37.8 Å²	37.8	28%	0.28	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.8	-173	-170.6	-177.2	162	0	0	110.4	R44 Y71 L72 I73 V74 V106	R44-E108 IonicContact CZ-OE2 3.42Å; R44-E108 IonicContact NH1-OE2 3.3Å; R44-E108 IonicContact NH2-OE2 2.71Å; R44-E108 PolarHBondContact NH2-OE2 2.71Å; Y71-E108 HydrophobicContact CE1-CB 3.84Å; Y71-E108 WeakPolarHBondContact CE1-OE2 3.35Å; L72-E108 PolarHBondContact O-N 3.28Å; I73-E108 WeakPolarHBondContact CA-O 3.36Å; I73-E108 HydrophobicContact CB-CB 4.39Å; I73-E108 HydrophobicContact CG1-CB 4.22Å; I73-E108 HydrophobicContact CG2-CB 4.05Å; I73-E108 HydrophobicContact CG2-CG 4.06Å; V74-E108 PolarHBondContact N-O 3.32Å; V106-E108 WeakPolarHBondContact CG1-O 3.42Å
109	V	98.8	Very high	97.5	Very high	19 Å²	19	36.2 Å²	36.2	12%	0.115	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.1	174.6	171.3	0	0	0	0	109.9	V74 V76 V100 R101 V106	V74-V109 WeakPolarHBondContact O-CA 3.3Å; V76-V109 HydrophobicContact CG2-CG1 4Å; V100-V109 HydrophobicContact CB-CG2 4.19Å; V100-V109 HydrophobicContact CG1-CG2 3.66Å; R101-V109 HydrophobicContact CB-CG2 4.45Å; R101-V109 HydrophobicContact CG-CB 3.8Å; R101-V109 HydrophobicContact CG-CG1 4.4Å; R101-V109 HydrophobicContact CG-CG2 3.55Å; V106-V109 HydrophobicContact CG1-CG2 3.63Å
110	V	98.7	Very high	97.5	Very high	11 Å²	11	37.8 Å²	37.8	7%	0.067	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	112.9	177.4	169.5	0	0	0	0	109.2	W46 I73 V74 G75 V76 Y125	W46-V110 HydrophobicContact CH2-CB 3.98Å; W46-V110 HydrophobicContact CH2-CG1 4.03Å; W46-V110 HydrophobicContact CH2-CG2 4.29Å; W46-V110 HydrophobicContact CZ3-CB 4.19Å; W46-V110 HydrophobicContact CZ3-CG2 4.02Å; I73-V110 HydrophobicContact CG2-CB 4.5Å; I73-V110 HydrophobicContact CG2-CG2 3.64Å; V74-V110 PolarHBondContact O-N 3.26Å; G75-V110 WeakPolarHBondContact CA-O 3.42Å; V76-V110 PolarHBondContact N-O 3Å; V110-Y125 HydrophobicContact CB-CE1 4.5Å; V110-Y125 HydrophobicContact CG1-CE1 4.12Å; V110-Y125 HydrophobicContact CG1-CE2 3.98Å; V110-Y125 VanDerWaalsContact CG1-OH 3.3Å; V110-Y125 WeakPolarHBondContact CG1-OH 3.39Å; V110-Y125 HydrophobicContact CG2-CD1 3.86Å; V110-Y125 HydrophobicContact CG2-CE1 3.51Å; V110-Y125 HydrophobicContact CG2-CE2 4.34Å; V110-Y125 HydrophobicContact CG2-CG 4.41Å
111	E	98.4	Very high	97.5	Very high	86 Å²	86	38.5 Å²	38.5	40%	0.402	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	149	176.9	-58.9	-177.2	170.1	0	0	111.2	Y97 R101 A113	Y97-E111 HydrophobicContact CD1-CB 4.47Å; Y97-E111 HydrophobicContact CD1-CG 4.04Å; Y97-E111 HydrophobicContact CD2-CB 4.14Å; Y97-E111 HydrophobicContact CD2-CG 3.5Å; Y97-E111 VanDerWaalsContact CD2-CG 3.5Å; Y97-E111 WeakPolarHBondContact CD2-OE1 3.48Å; Y97-E111 HydrophobicContact CE1-CB 4.05Å; Y97-E111 HydrophobicContact CE1-CG 4.11Å; Y97-E111 HydrophobicContact CE2-CB 3.67Å; Y97-E111 HydrophobicContact CE2-CG 3.59Å; Y97-E111 HydrophobicContact CG-CG 3.74Å; R101-E111 IonicContact CZ-OE1 3.45Å; R101-E111 IonicContact NH1-OE1 3.16Å; R101-E111 PolarHBondContact NH1-OE1 2.88Å; R101-E111 IonicContact NH2-OE1 2.82Å; R101-E111 PolarHBondContact NH2-OE1 3.34Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.48Å
112	G	96.9	Very high	97.5	Very high	42 Å²	42	34 Å²	34	43%	0.433	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	30.8	178.5	0	0	0	0	0	114.9	V76 Y97	V76-G112 PolarHBondContact O-N 3.26Å; Y97-G112 PolarHBondContact OH-N 2.9Å; Y97-G112 VanDerWaalsContact OH-N 3.17Å
113	A	97.3	Very high	97.4	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.033	22%	0.219	C	C	.	.			trans	-62.7	143.6	177.2	0	0	0	0	0	111.7	W46 G75 V76 H77 E111	W46-A113 HydrophobicContact CH2-CB 4.45Å; W46-A113 HydrophobicContact CZ2-CB 4.24Å; G75-A113 VanDerWaalsContact CA-CB 3.47Å; V76-A113 PolarHBondContact O-N 2.92Å; V76-A113 VanDerWaalsContact O-N 3.08Å; H77-A113 WeakPolarHBondContact CA-O 3.11Å; H77-A113 WeakPolarHBondContact CB-O 3.24Å; H77-A113 PolarHBondContact ND1-O 3Å; E111-A113 VanDerWaalsContact C-N 3.3Å; E111-A113 PolarHBondContact O-N 3.48Å
114	P	95.4	Very high	97.4	Very high	55 Å²	55	44.8 Å²	44.8	36%	0.357	25%	0.249	S	C	.	.			trans	-60.4	158	176.9	27.4	-35.4	0	0	0	111.5	H77 V116 T121	H77-P114 PolarHBondContact CE1-O 2.76Å; H77-P114 PolarHBondContact ND1-O 2.83Å; P114-V116 VanDerWaalsContact C-N 3.26Å; P114-V116 PolarHBondContact O-N 3.25Å; P114-T121 HydrophobicContact CG-CG2 4.43Å
115	Y	92.9	Very high	97.4	Very high	60 Å²	60	44.4 Å²	44.4	24%	0.235	25%	0.247	C	C	.	.	S	Bend	trans	-70.8	-18.6	-176.9	-160.5	-99	0	0	0	114.5	H77 E81 H85	H77-Y115 AromaticContact CD2-CD2 3.85Å; E81-Y115 HydrophobicContact CG-CD2 4.44Å; H85-Y115 HydrophobicContact CB-CD1 4.09Å; H85-Y115 HydrophobicContact CB-CD2 4.28Å; H85-Y115 HydrophobicContact CB-CE1 3.64Å; H85-Y115 HydrophobicContact CB-CE2 3.84Å; H85-Y115 HydrophobicContact CB-CG 4.39Å; H85-Y115 VanDerWaalsContact CB-CZ 3.5Å; H85-Y115 AromaticContact CD2-CD1 3.6Å; H85-Y115 AromaticContact CD2-CE1 3.88Å; H85-Y115 VanDerWaalsContact CE1-CB 3.47Å; H85-Y115 WeakPolarHBondContact CE1-CB 3.41Å; H85-Y115 AromaticContact CE1-CD1 3.81Å; H85-Y115 AromaticContact CE1-CG 3.52Å; H85-Y115 AromaticContact CG-CD1 3.52Å; H85-Y115 AromaticContact CG-CD2 3.96Å; H85-Y115 AromaticContact CG-CE1 3.61Å; H85-Y115 AromaticContact CG-CG 3.71Å; H85-Y115 AromaticContact CG-CZ 3.87Å; H85-Y115 AromaticContact ND1-CD1 3.66Å; H85-Y115 AromaticContact ND1-CD2 3.53Å; H85-Y115 AromaticContact ND1-CG 3.34Å; H85-Y115 VanDerWaalsContact ND1-CG 3.34Å; H85-Y115 AromaticContact NE2-CD1 3.8Å; H85-Y115 AromaticContact NE2-CG 3.99Å
116	V	94.1	Very high	97.3	Very high	48 Å²	48	46.7 Å²	46.7	29%	0.291	27%	0.268	S	S	.	.	S	Bend	trans	-129.4	130.7	179.5	177.9	0	0	0	0	109.3	P114 T118 T145 Y146	P114-V116 VanDerWaalsContact C-N 3.26Å; P114-V116 PolarHBondContact O-N 3.25Å; V116-T118 PolarHBondContact O-N 3.1Å; V116-T145 HydrophobicContact CB-CG2 4.45Å; V116-T145 HydrophobicContact CG1-CG2 3.8Å; V116-T145 HydrophobicContact CG2-CG2 3.77Å; V116-Y146 HydrophobicContact CG1-CD1 4.31Å; V116-Y146 HydrophobicContact CG1-CE1 4.2Å
117	T	96.1	Very high	97.3	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	27%	0.269	C	S	.	.			trans	-63.1	127.4	173.1	-35.7	0	0	0	0	111	D48 L122 C130 H132 V149	D48-T117 WeakPolarHBondContact OD2-CB 3.49Å; D48-T117 PolarHBondContact OD2-OG1 2.79Å; T117-L122 HydrophobicContact CG2-CD2 3.91Å; T117-L122 HydrophobicContact CG2-CG 4.22Å; T117-C130 HydrophobicContact CG2-CB 3.9Å; T117-H132 PolarHBondContact OG1-NE2 3.49Å; T117-V149 WeakPolarHBondContact O-CG2 3.4Å
118	T	96.9	Very high	97.3	Very high	56 Å²	56	45.2 Å²	45.2	34%	0.344	26%	0.26	S	S	.	.			trans	-124.4	158	176.1	50.5	0	0	0	0	110.8	V116 G120 T121 L122 E148	V116-T118 PolarHBondContact O-N 3.1Å; T118-G120 VanDerWaalsContact C-N 3.29Å; T118-G120 PolarHBondContact O-N 3.24Å; T118-T121 WeakPolarHBondContact O-CB 3.39Å; T118-T121 PolarHBondContact O-N 3.05Å; T118-T121 PolarHBondContact OG1-OG1 3.1Å; T118-L122 PolarHBondContact O-N 3.23Å; T118-L122 VanDerWaalsContact O-N 3.16Å; T118-E148 WeakPolarHBondContact CA-OE2 3.33Å
119	L	97.4	Very high	97.3	Very high	37 Å²	37	43.4 Å²	43.4	19%	0.194	25%	0.251	C	S	.	.	H	α-helix	trans	-56	-44	176.7	-68	179.9	0	0	0	112.2	T121 L122 D123 E148 V149 S152	L119-T121 PolarHBondContact O-N 3.21Å; L119-L122 PolarHBondContact O-N 3.29Å; L119-D123 PolarHBondContact O-N 3.07Å; L119-E148 HydrophobicContact CD1-CG 3.66Å; L119-E148 HydrophobicContact CG-CG 3.78Å; L119-E148 PolarHBondContact N-OE2 3.15Å; L119-V149 HydrophobicContact CD2-CG1 4.47Å; L119-V149 HydrophobicContact CD2-CG2 4.34Å; L119-S152 WeakPolarHBondContact CD2-OG 3.45Å
120	G	97.6	Very high	97.3	Very high	51 Å²	51	42.5 Å²	42.5	53%	0.526	25%	0.246	S	C	.	.	H	α-helix	trans	-60.4	-26.7	175.8	0	0	0	0	0	114.2	T118 K124	T118-G120 VanDerWaalsContact C-N 3.29Å; T118-G120 PolarHBondContact O-N 3.24Å; G120-K124 WeakPolarHBondContact O-CB 3.41Å; G120-K124 PolarHBondContact O-N 3.09Å
121	T	97.9	Very high	97.3	Very high	14 Å²	14	42 Å²	42	9%	0.086	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-45.6	171.9	-55.2	0	0	0	0	110.8	W46 P114 T118 L119 D123 K124 Y125	W46-T121 HydrophobicContact CH2-CG2 3.95Å; W46-T121 HydrophobicContact CZ2-CG2 3.64Å; P114-T121 HydrophobicContact CG-CG2 4.43Å; T118-T121 WeakPolarHBondContact O-CB 3.39Å; T118-T121 PolarHBondContact O-N 3.05Å; T118-T121 PolarHBondContact OG1-OG1 3.1Å; L119-T121 PolarHBondContact O-N 3.21Å; T121-D123 VanDerWaalsContact C-N 3.34Å; T121-D123 PolarHBondContact O-N 3.31Å; T121-K124 PolarHBondContact O-N 2.66Å; T121-Y125 HydrophobicContact CG2-CD2 4.24Å; T121-Y125 HydrophobicContact CG2-CE2 4.3Å; T121-Y125 VanDerWaalsContact O-CD2 3.28Å; T121-Y125 WeakPolarHBondContact O-CD2 3.42Å; T121-Y125 PolarHBondContact O-N 2.72Å
122	L	98.3	Very high	97.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-43.3	177.1	-60.9	-177.4	0	0	0	111.5	W46 T117 T118 L119 Y125 S126 C127 C130 V149 R154	W46-L122 HydrophobicContact CB-CD2 3.51Å; W46-L122 HydrophobicContact CD2-CD2 4.47Å; W46-L122 HydrophobicContact CG-CD2 3.66Å; T117-L122 HydrophobicContact CG2-CD2 3.91Å; T117-L122 HydrophobicContact CG2-CG 4.22Å; T118-L122 PolarHBondContact O-N 3.23Å; T118-L122 VanDerWaalsContact O-N 3.16Å; L119-L122 PolarHBondContact O-N 3.29Å; L122-Y125 PolarHBondContact O-N 2.68Å; L122-S126 PolarHBondContact O-N 2.99Å; L122-C127 HydrophobicContact CB-CB 4.46Å; L122-C127 HydrophobicContact CD2-CB 4.14Å; L122-C127 PolarHBondContact O-N 3.5Å; L122-C130 HydrophobicContact CD2-CB 4.13Å; L122-V149 HydrophobicContact CD1-CG1 3.81Å; L122-R154 HydrophobicContact CD1-CB 4.08Å
123	D	98.1	Very high	96.6	Very high	85 Å²	85	37.4 Å²	37.4	46%	0.455	22%	0.215	S	C	.	.	H	α-helix	trans	-68.5	-40.9	179.9	-64.9	-31.5	0	0	0	112.1	L119 T121 Y125 S126 R154	L119-D123 PolarHBondContact O-N 3.07Å; T121-D123 VanDerWaalsContact C-N 3.34Å; T121-D123 PolarHBondContact O-N 3.31Å; D123-Y125 VanDerWaalsContact C-N 3.25Å; D123-Y125 PolarHBondContact O-N 3.35Å; D123-S126 PolarHBondContact O-N 3.04Å; D123-R154 IonicContact OD1-CZ 2.66Å; D123-R154 IonicContact OD1-NH1 2.97Å; D123-R154 PolarHBondContact OD1-NH1 2.88Å; D123-R154 IonicContact OD1-NH2 2.82Å; D123-R154 PolarHBondContact OD1-NH2 3.14Å; D123-R154 IonicContact OD2-NH1 3.18Å; D123-R154 PolarHBondContact OD2-NH1 3.46Å
124	K	98.3	Very high	95.8	Very high	150 Å²	150	41 Å²	41	65%	0.652	23%	0.234	S	C	*	.	H	α-helix	trans	-55.9	-37.1	175.6	179.5	-174.9	177.7	-161.9	0	113.2	G120 T121	G120-K124 WeakPolarHBondContact O-CB 3.41Å; G120-K124 PolarHBondContact O-N 3.09Å; T121-K124 PolarHBondContact O-N 2.66Å
125	Y	97.8	Very high	95	Very high	46 Å²	46	42.3 Å²	42.3	18%	0.18	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	6.3	179.6	-62.8	-72.1	0	0	0	113.5	R44 W46 V110 T121 L122 D123 C127	R44-Y125 PolarHBondContact NE-O 2.78Å; R44-Y125 PolarHBondContact NH2-O 2.97Å; W46-Y125 HydrophobicContact CE3-CD2 4.24Å; W46-Y125 AromaticContact CH2-CD2 3.88Å; W46-Y125 HydrophobicContact CH2-CD2 3.88Å; W46-Y125 AromaticContact CH2-CE2 4Å; W46-Y125 HydrophobicContact CH2-CE2 4Å; W46-Y125 AromaticContact CZ3-CD2 3.47Å; W46-Y125 HydrophobicContact CZ3-CD2 3.47Å; W46-Y125 VanDerWaalsContact CZ3-CD2 3.47Å; W46-Y125 HydrophobicContact CZ3-CE2 4.01Å; W46-Y125 AromaticContact CZ3-CG 3.88Å; W46-Y125 HydrophobicContact CZ3-CG 3.88Å; V110-Y125 HydrophobicContact CB-CE1 4.5Å; V110-Y125 HydrophobicContact CG1-CE1 4.12Å; V110-Y125 HydrophobicContact CG1-CE2 3.98Å; V110-Y125 VanDerWaalsContact CG1-OH 3.3Å; V110-Y125 WeakPolarHBondContact CG1-OH 3.39Å; V110-Y125 HydrophobicContact CG2-CD1 3.86Å; V110-Y125 HydrophobicContact CG2-CE1 3.51Å; V110-Y125 HydrophobicContact CG2-CE2 4.34Å; V110-Y125 HydrophobicContact CG2-CG 4.41Å; T121-Y125 HydrophobicContact CG2-CD2 4.24Å; T121-Y125 HydrophobicContact CG2-CE2 4.3Å; T121-Y125 VanDerWaalsContact O-CD2 3.28Å; T121-Y125 WeakPolarHBondContact O-CD2 3.42Å; T121-Y125 PolarHBondContact O-N 2.72Å; L122-Y125 PolarHBondContact O-N 2.68Å; D123-Y125 VanDerWaalsContact C-N 3.25Å; D123-Y125 PolarHBondContact O-N 3.35Å; Y125-C127 VanDerWaalsContact C-N 3.3Å; Y125-C127 PolarHBondContact O-N 3.3Å
126	S	97.7	Very high	94.1	Very high	84 Å²	84	46.9 Å²	46.9	59%	0.587	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	40.9	-176.9	-60.5	0	0	0	0	113.6	R44 L122 D123	R44-S126 VanDerWaalsContact CB-O 3.31Å; R44-S126 WeakPolarHBondContact CB-O 3.36Å; R44-S126 WeakPolarHBondContact CD-O 3.31Å; L122-S126 PolarHBondContact O-N 2.99Å; D123-S126 PolarHBondContact O-N 3.04Å
127	C	98.3	Very high	93.3	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.02	26%	0.262	C	S	.	.			trans	-88	135.6	175.6	-72.4	0	0	0	0	111.9	R44 W46 I73 L122 Y125 R154	R44-C127 CarbonylContact O-C 3.58Å; R44-C127 WeakPolarHBondContact O-CA 3.45Å; W46-C127 HydrophobicContact CB-CB 3.96Å; I73-C127 WeakPolarHBondContact CD1-SG 3.38Å; L122-C127 HydrophobicContact CB-CB 4.46Å; L122-C127 HydrophobicContact CD2-CB 4.14Å; L122-C127 PolarHBondContact O-N 3.5Å; Y125-C127 VanDerWaalsContact C-N 3.3Å; Y125-C127 PolarHBondContact O-N 3.3Å; C127-R154 PolarHBondContact O-NH2 3.44Å
128	D	98.3	Very high	92.4	Very high	36 Å²	36	50.9 Å²	50.9	19%	0.193	29%	0.285	C	S	.	.	S	Bend	trans	-64.4	-48.9	176.2	-72.5	-88.8	0	0	0	111.5	R41 I43 R44 R154	R41-D128 IonicContact CZ-OD1 3.69Å; R41-D128 VanDerWaalsContact NH1-CG 3.29Å; R41-D128 IonicContact NH1-OD1 2.78Å; R41-D128 PolarHBondContact NH1-OD1 2.77Å; R41-D128 IonicContact NH1-OD2 3.18Å; R41-D128 PolarHBondContact NH1-OD2 2.82Å; R41-D128 IonicContact NH2-OD1 3.47Å; R41-D128 PolarHBondContact NH2-OD1 3.48Å; I43-D128 WeakPolarHBondContact CA-OD2 3.35Å; I43-D128 HydrophobicContact CG2-CB 4.25Å; R44-D128 PolarHBondContact N-OD2 3.12Å; R44-D128 PolarHBondContact O-N 2.99Å; D128-R154 WeakPolarHBondContact O-CB 3.41Å; D128-R154 WeakPolarHBondContact O-CG 3.26Å; D128-R154 PolarHBondContact O-NE 2.81Å
129	F	98.4	Very high	91.3	Very high	21 Å²	21	50.8 Å²	50.8	9%	0.092	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	162	-177.1	53.9	-96	0	0	0	112	I43 V45 W46 M68 V131 R154 R156	I43-F129 HydrophobicContact CG2-CE1 3.73Å; I43-F129 HydrophobicContact CG2-CZ 4.09Å; V45-F129 HydrophobicContact CB-CE2 4.41Å; V45-F129 HydrophobicContact CG1-CD2 4.26Å; V45-F129 HydrophobicContact CG1-CE2 3.83Å; V45-F129 HydrophobicContact CG2-CE2 3.88Å; V45-F129 HydrophobicContact CG2-CZ 3.84Å; W46-F129 PolarHBondContact N-O 2.78Å; M68-F129 HydrophobicContact CB-CE2 3.87Å; M68-F129 HydrophobicContact CB-CZ 3.78Å; M68-F129 HydrophobicContact SD-CE2 4.35Å; F129-V131 HydrophobicContact CD2-CG2 3.86Å; F129-V131 HydrophobicContact CE2-CG2 3.67Å; F129-R154 CarbonylContact C-O 3.52Å; F129-R154 WeakPolarHBondContact CA-O 3.46Å; F129-R154 HydrophobicContact CB-CB 4.29Å; F129-R154 WeakPolarHBondContact CB-O 3.36Å; F129-R156 HydrophobicContact CB-CG 4.34Å; F129-R156 HydrophobicContact CD2-CB 4.13Å; F129-R156 HydrophobicContact CD2-CG 3.48Å; F129-R156 VanDerWaalsContact CD2-CG 3.48Å; F129-R156 HydrophobicContact CE2-CB 4.47Å; F129-R156 HydrophobicContact CE2-CG 3.87Å; F129-R156 HydrophobicContact CG-CG 3.9Å
130	C	98.2	Very high	90.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	155.5	164.3	63.9	0	0	0	0	112.8	W46 T117 L122 R154 Y155 R156	W46-C130 HydrophobicContact CB-CB 4.25Å; W46-C130 HydrophobicContact CG-CB 4.48Å; W46-C130 CarbonylContact O-C 3.58Å; W46-C130 WeakPolarHBondContact O-CA 3.34Å; T117-C130 HydrophobicContact CG2-CB 3.9Å; L122-C130 HydrophobicContact CD2-CB 4.13Å; C130-R154 PolarHBondContact N-O 3.16Å; C130-Y155 VanDerWaalsContact SG-CD2 3.56Å; C130-R156 PolarHBondContact O-N 3.12Å
131	V	98.3	Very high	89	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118	172.4	-177	0	0	0	0	109.4	V45 W46 C47 A65 M68 F129 R156 C158	V45-V131 HydrophobicContact CG1-CB 4.36Å; V45-V131 HydrophobicContact CG1-CG2 3.48Å; V45-V131 VanDerWaalsContact CG1-CG2 3.48Å; W46-V131 PolarHBondContact O-N 3.41Å; C47-V131 PolarHBondContact SG-O 3.25Å; A65-V131 HydrophobicContact CB-CB 3.69Å; A65-V131 HydrophobicContact CB-CG1 3.82Å; A65-V131 HydrophobicContact CB-CG2 3.94Å; M68-V131 HydrophobicContact CE-CG1 3.94Å; M68-V131 HydrophobicContact SD-CG1 4.07Å; M68-V131 HydrophobicContact SD-CG2 3.58Å; M68-V131 VanDerWaalsContact SD-CG2 3.58Å; F129-V131 HydrophobicContact CD2-CG2 3.86Å; F129-V131 HydrophobicContact CE2-CG2 3.67Å; V131-R156 WeakPolarHBondContact CA-O 3.43Å; V131-R156 HydrophobicContact CG2-CB 4.08Å; V131-C158 HydrophobicContact CG1-CB 3.82Å
132	H	94.6	Very high	88.1	Confident	14 Å²	14	61.9 Å²	61.9	7%	0.065	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	175.6	177.9	-85	-65.4	0	0	0	111.3	D48 T117 Y146 Y155 R156 E157 C158	D48-H132 IonicContact OD1-CE1 2.7Å; D48-H132 PolarHBondContact OD1-CE1 3.34Å; D48-H132 IonicContact OD1-NE2 3.59Å; D48-H132 IonicContact OD2-NE2 3.75Å; T117-H132 PolarHBondContact OG1-NE2 3.49Å; H132-Y146 AromaticContact CD2-CZ 3.76Å; H132-Y146 AromaticContact CE1-CZ 3.96Å; H132-Y146 PolarHBondContact CE1-OH 3.16Å; H132-Y146 VanDerWaalsContact CE1-OH 3.3Å; H132-Y146 AromaticContact NE2-CE1 3.71Å; H132-Y146 AromaticContact NE2-CZ 3.59Å; H132-Y146 PolarHBondContact NE2-OH 3.17Å; H132-Y155 HydrophobicContact CB-CE2 3.94Å; H132-Y155 WeakPolarHBondContact CB-OH 3.39Å; H132-Y155 AromaticContact CD2-CE2 3.75Å; H132-R156 PolarHBondContact N-O 2.99Å; H132-E157 WeakPolarHBondContact O-CA 3.37Å; H132-C158 PolarHBondContact O-N 3.23Å; H132-C158 PolarHBondContact O-SG 3.01Å
133	G	87.4	Confident	87.4	Confident	18 Å²	18	67.3 Å²	67.3	19%	0.186	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	170.7	170.8	0	0	0	0	0	112.7	D135	G133-D135 PolarHBondContact O-N 2.96Å
134	D	80.6	Confident	86.8	Confident	81 Å²	81	65.8 Å²	65.8	43%	0.433	36%	0.364	S	S	.	.	S	Bend	trans	-78.7	23.8	170.5	44.9	7.9	0	0	0	113.1	R160	D134-R160 WeakPolarHBondContact OD1-CB 3.23Å; D134-R160 PolarHBondContact OD1-N 3.34Å; D134-R160 PolarHBondContact OD2-N 3.23Å
135	D	77.6	Confident	86.4	Confident	81 Å²	81	60.9 Å²	60.9	43%	0.433	35%	0.346	S	S	.	.			trans	-81.5	137	-179.3	-81.3	-39.2	0	0	0	112.5	G133 T137 R160	G133-D135 PolarHBondContact O-N 2.96Å; D135-T137 PolarHBondContact O-N 2.69Å; D135-T137 VanDerWaalsContact O-N 3.1Å; D135-T137 PolarHBondContact O-OG1 3.49Å; D135-T137 VanDerWaalsContact O-OG1 3.05Å; D135-R160 IonicContact OD1-CZ 2.75Å; D135-R160 IonicContact OD1-NH1 3.8Å; D135-R160 PolarHBondContact OD1-NH1 3.22Å; D135-R160 IonicContact OD1-NH2 2.69Å; D135-R160 IonicContact OD2-CZ 3.48Å; D135-R160 IonicContact OD2-NH1 2.76Å; D135-R160 PolarHBondContact OD2-NH1 2.86Å; D135-R160 IonicContact OD2-NH2 2.8Å
136	I	74.7	Confident	86.1	Confident	157 Å²	157	59.7 Å²	59.7	81%	0.805	34%	0.342	S	S	*	.			trans	-63.1	113.4	175.7	-58.8	177.5	0	0	0	109.3	L138	I136-L138 HydrophobicContact CG2-CD1 4.1Å; I136-L138 HydrophobicContact CG2-CG 3.93Å
137	T	76	Confident	85.9	Confident	38 Å²	38	58.5 Å²	58.5	23%	0.233	33%	0.327	C	S	.	.			trans	-123.2	73.4	-170.5	31.1	0	0	0	0	109.9	D135 T145 Y146	D135-T137 PolarHBondContact O-N 2.69Å; D135-T137 VanDerWaalsContact O-N 3.1Å; D135-T137 PolarHBondContact O-OG1 3.49Å; D135-T137 VanDerWaalsContact O-OG1 3.05Å; T137-T145 WeakPolarHBondContact O-CB 3.39Å; T137-T145 PolarHBondContact O-N 3.41Å; T137-T145 PolarHBondContact O-OG1 3.13Å; T137-Y146 HydrophobicContact CG2-CE2 4.07Å
138	L	77.6	Confident	85.7	Confident	97 Å²	97	63 Å²	63	51%	0.508	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-106.3	148	178.8	-57.6	-179.7	0	0	0	112.1	I136 K143	I136-L138 HydrophobicContact CG2-CD1 4.1Å; I136-L138 HydrophobicContact CG2-CG 3.93Å; L138-K143 CarbonylContact C-O 3.51Å; L138-K143 WeakPolarHBondContact CA-O 3.32Å
139	T	74.2	Confident	85.5	Confident	54 Å²	54	61.3 Å²	61.3	33%	0.331	34%	0.339	S	S	.	.			trans	-73.9	172.2	165.9	74.1	0	0	0	0	111.1	D141 G142 K143	T139-D141 PolarHBondContact O-N 2.98Å; T139-D141 PolarHBondContact OG1-N 2.68Å; T139-D141 PolarHBondContact OG1-OD2 3.14Å; T139-G142 PolarHBondContact O-N 3.47Å; T139-K143 HydrophobicContact CG2-CB 4.49Å; T139-K143 PolarHBondContact N-O 3.12Å; T139-K143 PolarHBondContact OG1-N 2.97Å
140	V	72.3	Confident	85.4	Confident	150 Å²	150	63.1 Å²	63.1	91%	0.909	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.1	174.9	-62.5	0	0	0	0	113	G142	V140-G142 VanDerWaalsContact C-N 3.28Å
141	D	75.6	Confident	85.3	Confident	136 Å²	136	70.4 Å²	70.4	73%	0.727	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	5.9	177.1	-35.4	-83.3	0	0	0	113	T139 K143	T139-D141 PolarHBondContact O-N 2.98Å; T139-D141 PolarHBondContact OG1-N 2.68Å; T139-D141 PolarHBondContact OG1-OD2 3.14Å; D141-K143 VanDerWaalsContact C-N 3.31Å; D141-K143 PolarHBondContact O-N 3.41Å
142	G	79.1	Confident	85.2	Confident	49 Å²	49	72.9 Å²	72.9	51%	0.505	40%	0.395	S	S	.	.	S	Bend	trans	75.7	11.4	-179.7	0	0	0	0	0	115.1	T139 V140	T139-G142 PolarHBondContact O-N 3.47Å; V140-G142 VanDerWaalsContact C-N 3.28Å
143	K	82.3	Confident	85.3	Confident	113 Å²	113	74.1 Å²	74.1	49%	0.491	41%	0.412	S	S	.	.			trans	-85.4	148	176.4	-96.9	-166.2	167.9	-150	0	112.3	L138 T139 D141 T145 E147	L138-K143 CarbonylContact C-O 3.51Å; L138-K143 WeakPolarHBondContact CA-O 3.32Å; T139-K143 HydrophobicContact CG2-CB 4.49Å; T139-K143 PolarHBondContact N-O 3.12Å; T139-K143 PolarHBondContact OG1-N 2.97Å; D141-K143 VanDerWaalsContact C-N 3.31Å; D141-K143 PolarHBondContact O-N 3.41Å; K143-T145 PolarHBondContact O-N 3.18Å; K143-E147 WeakPolarHBondContact CE-OE2 3.32Å; K143-E147 IonicContact NZ-OE1 2.99Å; K143-E147 IonicContact NZ-OE2 2.7Å; K143-E147 PolarHBondContact NZ-OE2 3.47Å
144	D	86.6	Confident	85.8	Confident	54 Å²	54	75.8 Å²	75.8	29%	0.289	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-66.3	123.1	174.3	-163.1	-55.7	0	0	0	111.4	Y146 E147 K150	D144-Y146 PolarHBondContact O-N 3.47Å; D144-Y146 VanDerWaalsContact O-N 3.1Å; D144-Y146 WeakPolarHBondContact OD1-CA 3.37Å; D144-Y146 PolarHBondContact OD1-N 2.99Å; D144-E147 HydrophobicContact CB-CB 4.3Å; D144-E147 VanDerWaalsContact O-CB 3.31Å; D144-E147 WeakPolarHBondContact O-CB 3.16Å; D144-E147 PolarHBondContact O-N 3.36Å; D144-K150 WeakPolarHBondContact OD1-CD 3.24Å; D144-K150 IonicContact OD1-NZ 3.95Å; D144-K150 PolarHBondContact OD1-NZ 3.38Å; D144-K150 WeakPolarHBondContact OD2-CD 3.06Å; D144-K150 IonicContact OD2-NZ 3.87Å; D144-K150 PolarHBondContact OD2-NZ 3.04Å
145	T	88.9	Confident	86.6	Confident	46 Å²	46	72.9 Å²	72.9	28%	0.282	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.8	179.4	-60.3	0	0	0	0	112.5	V116 T137 K143	V116-T145 HydrophobicContact CB-CG2 4.45Å; V116-T145 HydrophobicContact CG1-CG2 3.8Å; V116-T145 HydrophobicContact CG2-CG2 3.77Å; T137-T145 WeakPolarHBondContact O-CB 3.39Å; T137-T145 PolarHBondContact O-N 3.41Å; T137-T145 PolarHBondContact O-OG1 3.13Å; K143-T145 PolarHBondContact O-N 3.18Å
146	Y	92.1	Very high	87.6	Confident	21 Å²	21	74.1 Å²	74.1	8%	0.082	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	22.4	178.6	-55.2	-67.4	0	0	0	113	V116 H132 T137 D144 E148 V149 K150 Y155	V116-Y146 HydrophobicContact CG1-CD1 4.31Å; V116-Y146 HydrophobicContact CG1-CE1 4.2Å; H132-Y146 AromaticContact CD2-CZ 3.76Å; H132-Y146 AromaticContact CE1-CZ 3.96Å; H132-Y146 PolarHBondContact CE1-OH 3.16Å; H132-Y146 VanDerWaalsContact CE1-OH 3.3Å; H132-Y146 AromaticContact NE2-CE1 3.71Å; H132-Y146 AromaticContact NE2-CZ 3.59Å; H132-Y146 PolarHBondContact NE2-OH 3.17Å; T137-Y146 HydrophobicContact CG2-CE2 4.07Å; D144-Y146 PolarHBondContact O-N 3.47Å; D144-Y146 VanDerWaalsContact O-N 3.1Å; D144-Y146 WeakPolarHBondContact OD1-CA 3.37Å; D144-Y146 PolarHBondContact OD1-N 2.99Å; Y146-E148 VanDerWaalsContact C-N 3.26Å; Y146-E148 PolarHBondContact O-N 2.7Å; Y146-E148 VanDerWaalsContact O-N 3.17Å; Y146-V149 PolarHBondContact O-N 2.99Å; Y146-V149 VanDerWaalsContact O-N 3.1Å; Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 WeakPolarHBondContact O-CG 3.39Å; Y146-K150 PolarHBondContact O-N 3.36Å; Y146-Y155 HydrophobicContact CD1-CE2 4.27Å; Y146-Y155 HydrophobicContact CD2-CD2 4.4Å; Y146-Y155 AromaticContact CD2-CE2 3.44Å; Y146-Y155 HydrophobicContact CD2-CE2 3.44Å; Y146-Y155 VanDerWaalsContact CD2-CE2 3.44Å; Y146-Y155 AromaticContact CD2-CZ 3.96Å; Y146-Y155 HydrophobicContact CE2-CE2 4.04Å; Y146-Y155 HydrophobicContact CG-CD2 4.09Å; Y146-Y155 AromaticContact CG-CE2 3.55Å; Y146-Y155 HydrophobicContact CG-CE2 3.55Å
147	E	92.1	Very high	88.6	Confident	59 Å²	59	72.1 Å²	72.1	28%	0.276	38%	0.382	S	S	.	.	H	α-helix	trans	-48.6	-43.8	-178.3	-176.5	-179.1	-156.1	0	0	113	K143 D144 K151	K143-E147 WeakPolarHBondContact CE-OE2 3.32Å; K143-E147 IonicContact NZ-OE1 2.99Å; K143-E147 IonicContact NZ-OE2 2.7Å; K143-E147 PolarHBondContact NZ-OE2 3.47Å; D144-E147 HydrophobicContact CB-CB 4.3Å; D144-E147 VanDerWaalsContact O-CB 3.31Å; D144-E147 WeakPolarHBondContact O-CB 3.16Å; D144-E147 PolarHBondContact O-N 3.36Å; E147-K151 VanDerWaalsContact CD-NZ 3.26Å; E147-K151 HydrophobicContact CG-CD 4.05Å; E147-K151 VanDerWaalsContact CG-CE 3.46Å; E147-K151 WeakPolarHBondContact O-CB 3.4Å; E147-K151 VanDerWaalsContact O-CG 3.24Å; E147-K151 WeakPolarHBondContact O-CG 3.29Å; E147-K151 PolarHBondContact O-N 3.37Å; E147-K151 WeakPolarHBondContact OE1-CE 3.48Å; E147-K151 IonicContact OE1-NZ 2.72Å; E147-K151 PolarHBondContact OE1-NZ 3.21Å
148	E	94.1	Very high	89.5	Confident	99 Å²	99	70.7 Å²	70.7	46%	0.463	37%	0.373	S	S	.	.	H	α-helix	trans	-59.8	-55.5	177	-173.6	-161.3	-139.1	0	0	111.6	T118 L119 Y146 K150 K151 S152	T118-E148 WeakPolarHBondContact CA-OE2 3.33Å; L119-E148 HydrophobicContact CD1-CG 3.66Å; L119-E148 HydrophobicContact CG-CG 3.78Å; L119-E148 PolarHBondContact N-OE2 3.15Å; Y146-E148 VanDerWaalsContact C-N 3.26Å; Y146-E148 PolarHBondContact O-N 2.7Å; Y146-E148 VanDerWaalsContact O-N 3.17Å; E148-K150 PolarHBondContact O-N 2.92Å; E148-K151 PolarHBondContact O-N 2.88Å; E148-S152 PolarHBondContact O-N 3.16Å; E148-S152 VanDerWaalsContact O-N 3.14Å
149	V	95.8	Very high	90.2	Very high	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-69.7	-36.7	-173.6	-171.8	0	0	0	0	111	T117 L119 L122 Y146 S152 R154	T117-V149 WeakPolarHBondContact O-CG2 3.4Å; L119-V149 HydrophobicContact CD2-CG1 4.47Å; L119-V149 HydrophobicContact CD2-CG2 4.34Å; L122-V149 HydrophobicContact CD1-CG1 3.81Å; Y146-V149 PolarHBondContact O-N 2.99Å; Y146-V149 VanDerWaalsContact O-N 3.1Å; V149-S152 PolarHBondContact O-N 3.38Å; V149-S152 PolarHBondContact O-OG 3.18Å; V149-R154 HydrophobicContact CG1-CB 4.15Å; V149-R154 WeakPolarHBondContact CG1-O 3.37Å; V149-R154 PolarHBondContact O-N 3.3Å
150	K	95.3	Very high	91	Very high	58 Å²	58	78 Å²	78	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-62.7	-47.3	172.9	-76.3	170.3	174.9	164.1	0	111.7	D144 Y146 E148 S152 G153 Y155	D144-K150 WeakPolarHBondContact OD1-CD 3.24Å; D144-K150 IonicContact OD1-NZ 3.95Å; D144-K150 PolarHBondContact OD1-NZ 3.38Å; D144-K150 WeakPolarHBondContact OD2-CD 3.06Å; D144-K150 IonicContact OD2-NZ 3.87Å; D144-K150 PolarHBondContact OD2-NZ 3.04Å; Y146-K150 WeakPolarHBondContact O-CB 3.34Å; Y146-K150 WeakPolarHBondContact O-CG 3.39Å; Y146-K150 PolarHBondContact O-N 3.36Å; E148-K150 PolarHBondContact O-N 2.92Å; K150-S152 VanDerWaalsContact C-N 3.27Å; K150-S152 PolarHBondContact O-N 3.45Å; K150-G153 PolarHBondContact O-N 3Å; K150-Y155 HydrophobicContact CD-CD1 4.24Å; K150-Y155 HydrophobicContact CD-CE1 4.42Å; K150-Y155 HydrophobicContact CD-CG 4.36Å; K150-Y155 VanDerWaalsContact CE-CD1 3.46Å; K150-Y155 VanDerWaalsContact CE-CZ 3.44Å; K150-Y155 HydrophobicContact CG-CD1 3.74Å; K150-Y155 HydrophobicContact CG-CD2 4.05Å; K150-Y155 HydrophobicContact CG-CE1 4.38Å; K150-Y155 HydrophobicContact CG-CG 3.54Å
151	K	95.6	Very high	91.8	Very high	154 Å²	154	72 Å²	72	67%	0.67	36%	0.355	S	S	*	.	H	α-helix	trans	-61.6	-31.8	177.3	-76.6	175.3	-175	175.2	0	113.6	E147 E148 G153	E147-K151 VanDerWaalsContact CD-NZ 3.26Å; E147-K151 HydrophobicContact CG-CD 4.05Å; E147-K151 VanDerWaalsContact CG-CE 3.46Å; E147-K151 WeakPolarHBondContact O-CB 3.4Å; E147-K151 VanDerWaalsContact O-CG 3.24Å; E147-K151 WeakPolarHBondContact O-CG 3.29Å; E147-K151 PolarHBondContact O-N 3.37Å; E147-K151 WeakPolarHBondContact OE1-CE 3.48Å; E147-K151 IonicContact OE1-NZ 2.72Å; E147-K151 PolarHBondContact OE1-NZ 3.21Å; E148-K151 PolarHBondContact O-N 2.88Å; K151-G153 PolarHBondContact O-N 3.46Å
152	S	96.5	Very high	92.3	Very high	51 Å²	51	69.4 Å²	69.4	36%	0.357	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-8.6	175.2	77.9	0	0	0	0	114.7	L119 E148 V149 K150 R154	L119-S152 WeakPolarHBondContact CD2-OG 3.45Å; E148-S152 PolarHBondContact O-N 3.16Å; E148-S152 VanDerWaalsContact O-N 3.14Å; V149-S152 PolarHBondContact O-N 3.38Å; V149-S152 PolarHBondContact O-OG 3.18Å; K150-S152 VanDerWaalsContact C-N 3.27Å; K150-S152 PolarHBondContact O-N 3.45Å; S152-R154 VanDerWaalsContact C-N 3.27Å; S152-R154 PolarHBondContact O-N 3Å; S152-R154 VanDerWaalsContact OG-CB 3.26Å; S152-R154 WeakPolarHBondContact OG-CB 3.48Å; S152-R154 WeakPolarHBondContact OG-CG 3.5Å; S152-R154 PolarHBondContact OG-N 3.3Å
153	G	97.2	Very high	92.5	Very high	41 Å²	41	67.8 Å²	67.8	42%	0.423	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	12.5	-172.1	0	0	0	0	0	114.5	K150 K151 R156	K150-G153 PolarHBondContact O-N 3Å; K151-G153 PolarHBondContact O-N 3.46Å; G153-R156 PolarHBondContact O-NH1 3.46Å; G153-R156 PolarHBondContact O-NH2 3.28Å
154	R	97.9	Very high	92.7	Very high	53 Å²	53	63.1 Å²	63.1	20%	0.2	30%	0.304	C	S	.	.			trans	-104.3	20.9	-176.2	-58.7	172	70.4	-176.4	5.6	113.9	L122 D123 C127 D128 F129 C130 V149 S152	L122-R154 HydrophobicContact CD1-CB 4.08Å; D123-R154 IonicContact OD1-CZ 2.66Å; D123-R154 IonicContact OD1-NH1 2.97Å; D123-R154 PolarHBondContact OD1-NH1 2.88Å; D123-R154 IonicContact OD1-NH2 2.82Å; D123-R154 PolarHBondContact OD1-NH2 3.14Å; D123-R154 IonicContact OD2-NH1 3.18Å; D123-R154 PolarHBondContact OD2-NH1 3.46Å; C127-R154 PolarHBondContact O-NH2 3.44Å; D128-R154 WeakPolarHBondContact O-CB 3.41Å; D128-R154 WeakPolarHBondContact O-CG 3.26Å; D128-R154 PolarHBondContact O-NE 2.81Å; F129-R154 CarbonylContact C-O 3.52Å; F129-R154 WeakPolarHBondContact CA-O 3.46Å; F129-R154 HydrophobicContact CB-CB 4.29Å; F129-R154 WeakPolarHBondContact CB-O 3.36Å; C130-R154 PolarHBondContact N-O 3.16Å; V149-R154 HydrophobicContact CG1-CB 4.15Å; V149-R154 WeakPolarHBondContact CG1-O 3.37Å; V149-R154 PolarHBondContact O-N 3.3Å; S152-R154 VanDerWaalsContact C-N 3.27Å; S152-R154 PolarHBondContact O-N 3Å; S152-R154 VanDerWaalsContact OG-CB 3.26Å; S152-R154 WeakPolarHBondContact OG-CB 3.48Å; S152-R154 WeakPolarHBondContact OG-CG 3.5Å; S152-R154 PolarHBondContact OG-N 3.3Å
155	Y	97.9	Very high	92.7	Very high	20 Å²	20	62.2 Å²	62.2	8%	0.078	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.9	172.5	-171.8	-90.6	0	0	0	110.6	C130 H132 Y146 K150 E157	C130-Y155 VanDerWaalsContact SG-CD2 3.56Å; H132-Y155 HydrophobicContact CB-CE2 3.94Å; H132-Y155 WeakPolarHBondContact CB-OH 3.39Å; H132-Y155 AromaticContact CD2-CE2 3.75Å; Y146-Y155 HydrophobicContact CD1-CE2 4.27Å; Y146-Y155 HydrophobicContact CD2-CD2 4.4Å; Y146-Y155 AromaticContact CD2-CE2 3.44Å; Y146-Y155 HydrophobicContact CD2-CE2 3.44Å; Y146-Y155 VanDerWaalsContact CD2-CE2 3.44Å; Y146-Y155 AromaticContact CD2-CZ 3.96Å; Y146-Y155 HydrophobicContact CE2-CE2 4.04Å; Y146-Y155 HydrophobicContact CG-CD2 4.09Å; Y146-Y155 AromaticContact CG-CE2 3.55Å; Y146-Y155 HydrophobicContact CG-CE2 3.55Å; K150-Y155 HydrophobicContact CD-CD1 4.24Å; K150-Y155 HydrophobicContact CD-CE1 4.42Å; K150-Y155 HydrophobicContact CD-CG 4.36Å; K150-Y155 VanDerWaalsContact CE-CD1 3.46Å; K150-Y155 VanDerWaalsContact CE-CZ 3.44Å; K150-Y155 HydrophobicContact CG-CD1 3.74Å; K150-Y155 HydrophobicContact CG-CD2 4.05Å; K150-Y155 HydrophobicContact CG-CE1 4.38Å; K150-Y155 HydrophobicContact CG-CG 3.54Å; Y155-E157 HydrophobicContact CD1-CG 4.19Å; Y155-E157 HydrophobicContact CE1-CG 3.51Å
156	R	97.8	Very high	92.5	Very high	107 Å²	107	62.2 Å²	62.2	40%	0.404	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	152.4	174.9	-62.5	-66.6	177.9	-85.4	-5.3	110	M68 F129 C130 V131 H132 G153	M68-R156 HydrophobicContact SD-CB 4.03Å; M68-R156 HydrophobicContact SD-CG 4.47Å; F129-R156 HydrophobicContact CB-CG 4.34Å; F129-R156 HydrophobicContact CD2-CB 4.13Å; F129-R156 HydrophobicContact CD2-CG 3.48Å; F129-R156 VanDerWaalsContact CD2-CG 3.48Å; F129-R156 HydrophobicContact CE2-CB 4.47Å; F129-R156 HydrophobicContact CE2-CG 3.87Å; F129-R156 HydrophobicContact CG-CG 3.9Å; C130-R156 PolarHBondContact O-N 3.12Å; V131-R156 WeakPolarHBondContact CA-O 3.43Å; V131-R156 HydrophobicContact CG2-CB 4.08Å; H132-R156 PolarHBondContact N-O 2.99Å; G153-R156 PolarHBondContact O-NH1 3.46Å; G153-R156 PolarHBondContact O-NH2 3.28Å
157	E	96.2	Very high	91.9	Very high	115 Å²	115	66.9 Å²	66.9	54%	0.537	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.5	-179.2	-67.8	173.8	-179.1	0	0	110.5	H132 Y155	H132-E157 WeakPolarHBondContact O-CA 3.37Å; Y155-E157 HydrophobicContact CD1-CG 4.19Å; Y155-E157 HydrophobicContact CE1-CG 3.51Å
158	C	94.4	Very high	91.5	Very high	7 Å²	7	65.5 Å²	65.5	5%	0.047	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	150.6	171.5	68.2	0	0	0	0	110.1	Q61 Q64 M68 V131 H132	Q61-C158 VanDerWaalsContact CG-SG 3.55Å; Q64-C158 HydrophobicContact CB-CB 3.75Å; Q64-C158 HydrophobicContact CG-CB 4.41Å; M68-C158 HydrophobicContact CE-CB 4.07Å; V131-C158 HydrophobicContact CG1-CB 3.82Å; H132-C158 PolarHBondContact O-N 3.23Å; H132-C158 PolarHBondContact O-SG 3.01Å
159	K	93.3	Very high	91.1	Very high	161 Å²	161	60.9 Å²	60.9	70%	0.7	31%	0.305	S	S	*	.			trans	-73.4	135.7	-170.7	-63.3	-175.9	178.2	-175.4	0	110.8	Q64	Q64-K159 PolarHBondContact NE2-O 3.05Å
160	R	89.6	Confident	90.6	Very high	145 Å²	145	62.8 Å²	62.8	55%	0.547	32%	0.317	S	S	.	.			trans	-51.5	139.4	171.8	-159.7	168.4	-164.6	77.1	-9.1	111.7	D134 D135 Q162	D134-R160 WeakPolarHBondContact OD1-CB 3.23Å; D134-R160 PolarHBondContact OD1-N 3.34Å; D134-R160 PolarHBondContact OD2-N 3.23Å; D135-R160 IonicContact OD1-CZ 2.75Å; D135-R160 IonicContact OD1-NH1 3.8Å; D135-R160 PolarHBondContact OD1-NH1 3.22Å; D135-R160 IonicContact OD1-NH2 2.69Å; D135-R160 IonicContact OD2-CZ 3.48Å; D135-R160 IonicContact OD2-NH1 2.76Å; D135-R160 PolarHBondContact OD2-NH1 2.86Å; D135-R160 IonicContact OD2-NH2 2.8Å; R160-Q162 PolarHBondContact O-N 3.2Å
161	T	90	Very high	90	Very high	22 Å²	22	61 Å²	61	14%	0.135	32%	0.315	C	S	.	.			trans	-83.3	115.4	177.6	-54.1	0	0	0	0	110.7	Y56 G57 N60	Y56-T161 HydrophobicContact CD2-CG2 4.05Å; Y56-T161 HydrophobicContact CE2-CG2 3.95Å; G57-T161 PolarHBondContact O-OG1 3.06Å; N60-T161 HydrophobicContact CB-CG2 4.29Å; N60-T161 WeakPolarHBondContact CB-OG1 3.13Å; N60-T161 PolarHBondContact ND2-OG1 3.45Å
162	Q	86.9	Confident	89.5	Confident	82 Å²	82	54.4 Å²	54.4	38%	0.383	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	136.7	174.4	-172.8	-81.6	-29.7	0	0	111.5	R160 Q209	R160-Q162 PolarHBondContact O-N 3.2Å; Q162-Q209 PolarHBondContact NE2-O 2.89Å
163	G	81.6	Confident	89	Confident	15 Å²	15	52 Å²	52	16%	0.155	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	-5.3	168.6	0	0	0	0	0	116.6	Y56 R172	Y56-G163 PolarHBondContact OH-O 3.04Å; G163-R172 PolarHBondContact O-NH2 2.83Å
164	V	87.4	Confident	88	Confident	16 Å²	16	51.7 Å²	51.7	10%	0.097	26%	0.258	C	S	.	.			trans	-150.9	146.4	178.3	65	0	0	0	0	113.4	H55 Y56 L169	H55-V164 HydrophobicContact CB-CG2 4.1Å; Y56-V164 HydrophobicContact CD1-CB 4.44Å; Y56-V164 HydrophobicContact CD1-CG1 4.1Å; Y56-V164 HydrophobicContact CD2-CG1 3.98Å; Y56-V164 HydrophobicContact CE1-CB 3.64Å; Y56-V164 HydrophobicContact CE1-CG1 3.65Å; Y56-V164 HydrophobicContact CE1-CG2 4.08Å; Y56-V164 HydrophobicContact CE2-CB 4.21Å; Y56-V164 HydrophobicContact CE2-CG1 3.52Å; Y56-V164 HydrophobicContact CG-CG1 4.26Å; Y56-V164 WeakPolarHBondContact OH-CB 3.35Å; V164-L169 HydrophobicContact CG2-CD1 3.72Å; V164-L169 HydrophobicContact CG2-CD2 4.12Å; V164-L169 HydrophobicContact CG2-CG 3.82Å
165	S	86.4	Confident	86.7	Confident	34 Å²	34	53.7 Å²	53.7	24%	0.238	27%	0.272	C	S	.	.			trans	-150.5	163.6	158.5	65.7	0	0	0	0	110	T167 D168 L169	S165-T167 PolarHBondContact O-N 2.85Å; S165-D168 PolarHBondContact O-N 2.94Å; S165-D168 WeakPolarHBondContact OG-CB 3.3Å; S165-D168 PolarHBondContact OG-N 3.47Å; S165-D168 VanDerWaalsContact OG-N 3.14Å; S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 3.36Å
166	T	84.4	Confident	84.8	Confident	47 Å²	47	53.8 Å²	53.8	29%	0.288	27%	0.273	S	S	.	.	H	α-helix	trans	-55.6	-38.2	172.4	-49.8	0	0	0	0	112	M53 H55 L169 V170	M53-T166 HydrophobicContact CB-CG2 3.83Å; M53-T166 HydrophobicContact CG-CG2 4.25Å; H55-T166 PolarHBondContact NE2-N 2.82Å; T166-L169 PolarHBondContact O-N 3.1Å; T166-V170 HydrophobicContact CG2-CG2 4.41Å; T166-V170 WeakPolarHBondContact O-CB 3.29Å; T166-V170 VanDerWaalsContact O-CG2 3.26Å; T166-V170 WeakPolarHBondContact O-CG2 3.43Å; T166-V170 PolarHBondContact O-N 3.24Å
167	T	79.6	Confident	82.6	Confident	119 Å²	119	50.7 Å²	50.7	73%	0.73	27%	0.266	S	S	*	.	H	α-helix	trans	-64.8	-43.4	177.6	-49.2	0	0	0	0	112.4	S165 G171	S165-T167 PolarHBondContact O-N 2.85Å; T167-G171 PolarHBondContact O-N 2.88Å
168	D	83.7	Confident	80	Confident	30 Å²	30	54 Å²	54	16%	0.16	28%	0.279	C	S	.	.	H	α-helix	trans	-59.9	-53.9	173.6	155.6	44.4	0	0	0	110.7	S165 V170 G171 R172	S165-D168 PolarHBondContact O-N 2.94Å; S165-D168 WeakPolarHBondContact OG-CB 3.3Å; S165-D168 PolarHBondContact OG-N 3.47Å; S165-D168 VanDerWaalsContact OG-N 3.14Å; D168-V170 VanDerWaalsContact C-N 3.32Å; D168-V170 PolarHBondContact O-N 3.05Å; D168-G171 CarbonylContact O-C 3.57Å; D168-G171 WeakPolarHBondContact O-CA 3.23Å; D168-G171 PolarHBondContact O-N 3.19Å; D168-R172 WeakPolarHBondContact O-CG 3.47Å; D168-R172 PolarHBondContact O-N 3.05Å; D168-R172 IonicContact OD1-CZ 2.66Å; D168-R172 IonicContact OD1-NE 3.8Å; D168-R172 PolarHBondContact OD1-NE 3.46Å; D168-R172 IonicContact OD1-NH2 2.72Å; D168-R172 PolarHBondContact OD1-NH2 3.01Å; D168-R172 IonicContact OD2-CZ 2.89Å; D168-R172 IonicContact OD2-NE 2.62Å; D168-R172 PolarHBondContact OD2-NE 3.27Å; D168-R172 IonicContact OD2-NH2 2.68Å; D168-R172 PolarHBondContact OD2-NH2 3.28Å
169	L	86.8	Confident	77.4	Confident	2 Å²	2	57 Å²	57	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-40.7	179.6	-65.7	174.4	0	0	0	112.8	H55 V164 S165 T166 R172 M173 L241 I282 M283	H55-L169 HydrophobicContact CB-CD1 3.78Å; V164-L169 HydrophobicContact CG2-CD1 3.72Å; V164-L169 HydrophobicContact CG2-CD2 4.12Å; V164-L169 HydrophobicContact CG2-CG 3.82Å; S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 3.36Å; T166-L169 PolarHBondContact O-N 3.1Å; L169-R172 PolarHBondContact O-N 3.18Å; L169-M173 HydrophobicContact CB-CE 3.89Å; L169-M173 WeakPolarHBondContact O-CE 3.4Å; L169-M173 WeakPolarHBondContact O-CG 3.17Å; L169-M173 PolarHBondContact O-N 3.19Å; L169-L241 HydrophobicContact CD2-CD2 4.46Å; L169-I282 HydrophobicContact CD2-CG2 4.45Å; L169-M283 HydrophobicContact CD1-CE 3.52Å; L169-M283 HydrophobicContact CD2-CE 3.71Å; L169-M283 HydrophobicContact CD2-CG 4.08Å; L169-M283 HydrophobicContact CG-CE 4.29Å
170	V	84.2	Confident	75	Confident	39 Å²	39	53.4 Å²	53.4	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-41.7	173.2	167.5	0	0	0	0	110.9	T166 D168 M173 L174 I366	T166-V170 HydrophobicContact CG2-CG2 4.41Å; T166-V170 WeakPolarHBondContact O-CB 3.29Å; T166-V170 VanDerWaalsContact O-CG2 3.26Å; T166-V170 WeakPolarHBondContact O-CG2 3.43Å; T166-V170 PolarHBondContact O-N 3.24Å; D168-V170 VanDerWaalsContact C-N 3.32Å; D168-V170 PolarHBondContact O-N 3.05Å; V170-M173 PolarHBondContact O-N 3.2Å; V170-L174 HydrophobicContact CG1-CD1 3.97Å; V170-L174 HydrophobicContact CG1-CG 4.39Å; V170-L174 WeakPolarHBondContact O-CG 3.33Å; V170-L174 PolarHBondContact O-N 3.34Å; V170-I366 HydrophobicContact CG1-CG2 3.99Å; V170-I366 HydrophobicContact CG2-CD1 4.4Å; V170-I366 HydrophobicContact CG2-CG2 4.14Å
171	G	82.3	Confident	72.6	Confident	22 Å²	22	55.1 Å²	55.1	23%	0.227	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-50.4	173.1	0	0	0	0	0	112.6	T167 D168 M173 L174 L175	T167-G171 PolarHBondContact O-N 2.88Å; D168-G171 CarbonylContact O-C 3.57Å; D168-G171 WeakPolarHBondContact O-CA 3.23Å; D168-G171 PolarHBondContact O-N 3.19Å; G171-M173 PolarHBondContact O-N 3.44Å; G171-L174 PolarHBondContact O-N 3.34Å; G171-L174 VanDerWaalsContact O-N 3.14Å; G171-L175 WeakPolarHBondContact O-CG 3.49Å; G171-L175 PolarHBondContact O-N 3.3Å
172	R	85.4	Confident	70.1	Confident	15 Å²	15	57.6 Å²	57.6	6%	0.057	32%	0.322	C	S	.	.	H	α-helix	trans	-55.3	-39.3	175	-60.6	-177	-158.7	-172.1	7.3	112.2	G163 D168 L169 V207 I282 E287	G163-R172 PolarHBondContact O-NH2 2.83Å; D168-R172 WeakPolarHBondContact O-CG 3.47Å; D168-R172 PolarHBondContact O-N 3.05Å; D168-R172 IonicContact OD1-CZ 2.66Å; D168-R172 IonicContact OD1-NE 3.8Å; D168-R172 PolarHBondContact OD1-NE 3.46Å; D168-R172 IonicContact OD1-NH2 2.72Å; D168-R172 PolarHBondContact OD1-NH2 3.01Å; D168-R172 IonicContact OD2-CZ 2.89Å; D168-R172 IonicContact OD2-NE 2.62Å; D168-R172 PolarHBondContact OD2-NE 3.27Å; D168-R172 IonicContact OD2-NH2 2.68Å; D168-R172 PolarHBondContact OD2-NH2 3.28Å; L169-R172 PolarHBondContact O-N 3.18Å; R172-V207 HydrophobicContact CG-CB 4.49Å; R172-V207 HydrophobicContact CG-CG1 3.87Å; R172-I282 HydrophobicContact CB-CG2 3.73Å; R172-I282 VanDerWaalsContact CD-O 3.24Å; R172-I282 WeakPolarHBondContact CD-O 3.26Å; R172-I282 PolarHBondContact NH1-O 2.72Å; R172-E287 IonicContact CZ-OE1 3.1Å; R172-E287 IonicContact CZ-OE2 3.32Å; R172-E287 IonicContact NH1-OE1 3.18Å; R172-E287 PolarHBondContact NH1-OE1 3.45Å; R172-E287 VanDerWaalsContact NH1-OE1 3.16Å; R172-E287 IonicContact NH1-OE2 2.69Å; R172-E287 PolarHBondContact NH1-OE2 2.94Å; R172-E287 IonicContact NH2-OE1 2.74Å; R172-E287 PolarHBondContact NH2-OE1 3.39Å; R172-E287 IonicContact NH2-OE2 3.09Å
173	M	85.1	Confident	67.8	Low	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-74.2	-32.4	178.8	-70.4	-176.8	-109.7	0	0	113.6	M53 L169 V170 G171 L175 M176 L241 I282 V363 I366	M53-M173 HydrophobicContact CE-CE 3.73Å; L169-M173 HydrophobicContact CB-CE 3.89Å; L169-M173 WeakPolarHBondContact O-CE 3.4Å; L169-M173 WeakPolarHBondContact O-CG 3.17Å; L169-M173 PolarHBondContact O-N 3.19Å; V170-M173 PolarHBondContact O-N 3.2Å; G171-M173 PolarHBondContact O-N 3.44Å; M173-L175 VanDerWaalsContact C-N 3.35Å; M173-M176 VanDerWaalsContact O-CB 3.23Å; M173-M176 WeakPolarHBondContact O-CB 3.27Å; M173-M176 WeakPolarHBondContact O-CG 3.46Å; M173-M176 PolarHBondContact O-N 2.78Å; M173-L241 HydrophobicContact CE-CD1 3.76Å; M173-L241 HydrophobicContact CE-CD2 3.75Å; M173-L241 HydrophobicContact CE-CG 4.43Å; M173-L241 HydrophobicContact CG-CD1 4.38Å; M173-L241 HydrophobicContact SD-CD1 3.44Å; M173-L241 WeakPolarHBondContact SD-CD1 3.37Å; M173-I282 HydrophobicContact CE-CG2 4.43Å; M173-I282 HydrophobicContact CG-CD1 4.07Å; M173-I282 HydrophobicContact CG-CG1 4.04Å; M173-I282 HydrophobicContact CG-CG2 3.93Å; M173-V363 HydrophobicContact CB-CG2 4.28Å; M173-V363 HydrophobicContact CG-CG2 3.82Å; M173-V363 HydrophobicContact SD-CG2 3.65Å; M173-I366 HydrophobicContact CE-CD1 3.65Å; M173-I366 HydrophobicContact SD-CD1 3.39Å; M173-I366 WeakPolarHBondContact SD-CD1 3.08Å
174	L	78.2	Confident	65.8	Low	34 Å²	34	65.6 Å²	65.6	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-72.2	-27.9	173.9	-68.1	172.4	0	0	0	112.2	V170 G171 M176 T177 H180 I367 R370	V170-L174 HydrophobicContact CG1-CD1 3.97Å; V170-L174 HydrophobicContact CG1-CG 4.39Å; V170-L174 WeakPolarHBondContact O-CG 3.33Å; V170-L174 PolarHBondContact O-N 3.34Å; G171-L174 PolarHBondContact O-N 3.34Å; G171-L174 VanDerWaalsContact O-N 3.14Å; L174-M176 PolarHBondContact O-N 2.82Å; L174-T177 PolarHBondContact O-N 3.24Å; L174-T177 PolarHBondContact O-OG1 3.25Å; L174-T177 VanDerWaalsContact O-OG1 3.05Å; L174-H180 PolarHBondContact O-CD2 3.49Å; L174-H180 VanDerWaalsContact O-CD2 3.25Å; L174-I367 HydrophobicContact CD2-CG1 4.37Å; L174-R370 HydrophobicContact CD2-CG 4.39Å
175	L	69.3	Low	63.3	Low	96 Å²	96	73.5 Å²	73.5	50%	0.503	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-10.9	170.7	-67.9	171.4	0	0	0	113.7	G171 M173 N279	G171-L175 WeakPolarHBondContact O-CG 3.49Å; G171-L175 PolarHBondContact O-N 3.3Å; M173-L175 VanDerWaalsContact C-N 3.35Å; L175-N279 PolarHBondContact O-ND2 2.72Å
176	M	59.2	Low	61.1	Low	22 Å²	22	73.9 Å²	73.9	11%	0.108	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-25.7	176.2	-60.4	-72.8	-87.3	0	0	113	M173 L174 K178 K278 N279 Y280 I282	M173-M176 VanDerWaalsContact O-CB 3.23Å; M173-M176 WeakPolarHBondContact O-CB 3.27Å; M173-M176 WeakPolarHBondContact O-CG 3.46Å; M173-M176 PolarHBondContact O-N 2.78Å; L174-M176 PolarHBondContact O-N 2.82Å; M176-K178 PolarHBondContact O-N 2.86Å; M176-K278 HydrophobicContact CE-CB 3.56Å; M176-K278 HydrophobicContact CE-CD 4.03Å; M176-K278 HydrophobicContact CE-CG 4.45Å; M176-K278 HydrophobicContact SD-CB 4.32Å; M176-N279 HydrophobicContact SD-CB 3.48Å; M176-N279 WeakPolarHBondContact SD-CB 3.43Å; M176-N279 PolarHBondContact SD-N 3.26Å; M176-Y280 HydrophobicContact CE-CD1 3.63Å; M176-Y280 HydrophobicContact CE-CD2 3.58Å; M176-Y280 HydrophobicContact CE-CE1 3.65Å; M176-Y280 HydrophobicContact CE-CE2 3.66Å; M176-Y280 HydrophobicContact CE-CG 3.59Å; M176-I282 HydrophobicContact CE-CD1 3.89Å; M176-I282 HydrophobicContact CG-CD1 3.82Å; M176-I282 HydrophobicContact SD-CD1 3.73Å
177	T	51.7	Low	58.8	Low	41 Å²	41	75.6 Å²	75.6	25%	0.252	42%	0.421	S	S	.	.			trans	-92.8	94.8	-173.8	14.5	0	0	0	0	111.2	L174 A179 H180 I367	L174-T177 PolarHBondContact O-N 3.24Å; L174-T177 PolarHBondContact O-OG1 3.25Å; L174-T177 VanDerWaalsContact O-OG1 3.05Å; T177-A179 PolarHBondContact O-N 2.96Å; T177-H180 PolarHBondContact O-CD2 2.89Å; T177-H180 PolarHBondContact O-N 2.75Å; T177-H180 VanDerWaalsContact O-N 3.07Å; T177-H180 PolarHBondContact OG1-CD2 2.73Å; T177-H180 PolarHBondContact OG1-NE2 2.85Å; T177-I367 HydrophobicContact CG2-CD1 3.84Å
178	K	41.1	Very low	56.8	Low	186 Å²	186	74.9 Å²	74.9	81%	0.809	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-52.7	-16.9	176.1	-69	-166.4	175.4	-172.1	0	114.9	M176 H180	M176-K178 PolarHBondContact O-N 2.86Å; K178-H180 VanDerWaalsContact C-N 3.25Å; K178-H180 PolarHBondContact O-N 3.31Å
179	A	38.9	Very low	54.7	Low	69 Å²	69	78.6 Å²	78.6	57%	0.57	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-66.3	-16.5	175.7	0	0	0	0	0	114.6	T177 H181 S182	T177-A179 PolarHBondContact O-N 2.96Å; A179-H181 VanDerWaalsContact C-N 3.25Å; A179-H181 PolarHBondContact O-N 3.15Å; A179-S182 PolarHBondContact O-N 2.71Å; A179-S182 PolarHBondContact O-OG 3.07Å
180	H	43	Very low	52.2	Low	85 Å²	85	84.7 Å²	84.7	39%	0.394	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-73	-13.7	179.1	-66.4	-63	0	0	0	114.2	L174 T177 K178 S182	L174-H180 PolarHBondContact O-CD2 3.49Å; L174-H180 VanDerWaalsContact O-CD2 3.25Å; T177-H180 PolarHBondContact O-CD2 2.89Å; T177-H180 PolarHBondContact O-N 2.75Å; T177-H180 VanDerWaalsContact O-N 3.07Å; T177-H180 PolarHBondContact OG1-CD2 2.73Å; T177-H180 PolarHBondContact OG1-NE2 2.85Å; K178-H180 VanDerWaalsContact C-N 3.25Å; K178-H180 PolarHBondContact O-N 3.31Å; H180-S182 VanDerWaalsContact C-N 3.31Å
181	H	39.6	Very low	49.9	Very low	182 Å²	182	89.7 Å²	89.7	84%	0.843	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-84.9	-0.8	174	-63.7	130.1	0	0	0	113.9	A179	A179-H181 VanDerWaalsContact C-N 3.25Å; A179-H181 PolarHBondContact O-N 3.15Å
182	S	37.7	Very low	47.9	Very low	74 Å²	74	95.2 Å²	95.2	52%	0.517	49%	0.494	S	S	.	.	S	Bend	trans	-105.9	109.9	172.9	46.6	0	0	0	0	111.3	A179 H180	A179-S182 PolarHBondContact O-N 2.71Å; A179-S182 PolarHBondContact O-OG 3.07Å; H180-S182 VanDerWaalsContact C-N 3.31Å
183	N	39.2	Very low	45.8	Very low	162 Å²	162	98.5 Å²	98.5	87%	0.866	52%	0.515	S	S	*	.	S	Bend	trans	76.7	49.8	161.8	-50.9	-7.5	0	0	0	118.3
184	I	38.9	Very low	43.5	Very low	102 Å²	102	102.6 Å²	102.6	52%	0.523	54%	0.537	S	S	.	.			trans	-134.9	88.5	157.3	-54.8	-177.4	0	0	0	110.4	S186	I184-S186 VanDerWaalsContact C-N 3.33Å; I184-S186 PolarHBondContact O-N 3.43Å; I184-S186 VanDerWaalsContact O-N 3.13Å
185	D	35.7	Very low	41.5	Very low	182 Å²	182	107.3 Å²	107.3	97%	0.973	56%	0.563	S	S	*	*			trans	-76.2	87.7	159.4	-83.6	-47.5	0	0	0	108.9
186	S	40.2	Very low	40.2	Very low	43 Å²	43	108.5 Å²	108.5	30%	0.301	56%	0.564	S	S	.	*			trans	-135.3	113.9	172.1	178.7	0	0	0	0	108.8	I184 D188 Y189	I184-S186 VanDerWaalsContact C-N 3.33Å; I184-S186 PolarHBondContact O-N 3.43Å; I184-S186 VanDerWaalsContact O-N 3.13Å; S186-D188 PolarHBondContact O-N 3.06Å; S186-Y189 PolarHBondContact O-N 2.97Å; S186-Y189 VanDerWaalsContact O-N 3.17Å
187	S	35	Very low	39.2	Very low	83 Å²	83	109.9 Å²	109.9	58%	0.58	58%	0.584	S	S	*	*	H	α-helix	trans	-48.1	-35.4	-178.9	41.5	0	0	0	0	113.7	Y189 Q190	S187-Y189 VanDerWaalsContact C-N 3.31Å; S187-Y189 PolarHBondContact O-N 2.85Å; S187-Q190 PolarHBondContact O-N 3.17Å
188	D	36.7	Very low	38.6	Very low	103 Å²	103	116.3 Å²	116.3	55%	0.551	61%	0.609	S	S	*	*	H	α-helix	trans	-75.4	-24.5	-168.6	-52.5	2.8	0	0	0	111.2	S186 H192	S186-D188 PolarHBondContact O-N 3.06Å; D188-H192 PolarHBondContact O-CD2 3.18Å
189	Y	40.1	Very low	38.2	Very low	109 Å²	109	116.4 Å²	116.4	43%	0.427	61%	0.609	S	S	.	*	H	α-helix	trans	-75.4	-34	174.1	-81.6	-94	0	0	0	112.6	S186 S187 Q191 H192 T193 R370	S186-Y189 PolarHBondContact O-N 2.97Å; S186-Y189 VanDerWaalsContact O-N 3.17Å; S187-Y189 VanDerWaalsContact C-N 3.31Å; S187-Y189 PolarHBondContact O-N 2.85Å; Y189-Q191 VanDerWaalsContact C-N 3.32Å; Y189-Q191 PolarHBondContact O-N 3.34Å; Y189-H192 PolarHBondContact O-N 2.93Å; Y189-H192 VanDerWaalsContact O-N 3.11Å; Y189-T193 PolarHBondContact O-N 3.28Å; Y189-T193 PolarHBondContact O-OG1 3.48Å; Y189-R370 PolarHBondContact OH-NH2 2.68Å
190	Q	35.1	Very low	38.3	Very low	130 Å²	130	116.9 Å²	116.9	61%	0.607	62%	0.621	S	S	*	*	H	α-helix	trans	-61.8	-40.6	178.4	-90	175.4	-24	0	0	111.6	S187 H192 T193 D194	S187-Q190 PolarHBondContact O-N 3.17Å; Q190-H192 VanDerWaalsContact C-N 3.27Å; Q190-H192 PolarHBondContact O-N 2.98Å; Q190-T193 WeakPolarHBondContact CA-OG1 3.46Å; Q190-T193 PolarHBondContact O-N 3.17Å; Q190-T193 VanDerWaalsContact O-N 3.15Å; Q190-T193 PolarHBondContact O-OG1 3.3Å; Q190-D194 WeakPolarHBondContact O-CB 2.77Å; Q190-D194 PolarHBondContact O-N 2.91Å
191	Q	35.3	Very low	38	Very low	144 Å²	144	120.9 Å²	120.9	67%	0.673	64%	0.639	S	S	*	*	H	α-helix	trans	-60.6	-33.8	174.5	-68.7	-168.3	-6.7	0	0	113.3	Y189 N195	Y189-Q191 VanDerWaalsContact C-N 3.32Å; Y189-Q191 PolarHBondContact O-N 3.34Å; Q191-N195 PolarHBondContact O-ND2 3.25Å
192	H	40.5	Very low	37.9	Very low	137 Å²	137	114.6 Å²	114.6	63%	0.634	62%	0.616	S	S	*	*	H	α-helix	trans	-75.5	-33.2	175.6	-77.8	-58.4	0	0	0	112.8	D188 Y189 Q190 F196	D188-H192 PolarHBondContact O-CD2 3.18Å; Y189-H192 PolarHBondContact O-N 2.93Å; Y189-H192 VanDerWaalsContact O-N 3.11Å; Q190-H192 VanDerWaalsContact C-N 3.27Å; Q190-H192 PolarHBondContact O-N 2.98Å; H192-F196 VanDerWaalsContact O-CD2 3.32Å; H192-F196 WeakPolarHBondContact O-CD2 3.29Å
193	T	41.4	Very low	38.3	Very low	84 Å²	84	116.3 Å²	116.3	52%	0.515	63%	0.625	S	S	.	*	H	α-helix	trans	-75.4	-39.1	174.2	49.5	0	0	0	0	113.5	Y189 Q190 N195 F196	Y189-T193 PolarHBondContact O-N 3.28Å; Y189-T193 PolarHBondContact O-OG1 3.48Å; Q190-T193 WeakPolarHBondContact CA-OG1 3.46Å; Q190-T193 PolarHBondContact O-N 3.17Å; Q190-T193 VanDerWaalsContact O-N 3.15Å; Q190-T193 PolarHBondContact O-OG1 3.3Å; T193-N195 PolarHBondContact O-N 3.47Å; T193-F196 PolarHBondContact O-N 2.91Å
194	D	37.4	Very low	38.6	Very low	86 Å²	86	115.4 Å²	115.4	46%	0.46	61%	0.609	S	S	.	*	H	α-helix	trans	-68.4	-21.9	-178.3	-89.3	-48.7	0	0	0	113.2	Q190 F196 K198	Q190-D194 WeakPolarHBondContact O-CB 2.77Å; Q190-D194 PolarHBondContact O-N 2.91Å; D194-F196 VanDerWaalsContact C-N 3.26Å; D194-F196 PolarHBondContact O-N 3.35Å; D194-K198 WeakPolarHBondContact OD1-CE 3.38Å; D194-K198 IonicContact OD1-NZ 3.7Å; D194-K198 PolarHBondContact OD1-NZ 2.95Å
195	N	35.8	Very low	38.9	Very low	134 Å²	134	113.4 Å²	113.4	72%	0.717	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-14.2	171	-84.5	-56.3	0	0	0	113.8	Q191 T193 G197	Q191-N195 PolarHBondContact O-ND2 3.25Å; T193-N195 PolarHBondContact O-N 3.47Å; N195-G197 PolarHBondContact O-N 2.86Å
196	F	42.7	Very low	39.5	Very low	120 Å²	120	107.2 Å²	107.2	53%	0.526	58%	0.581	S	S	.	*	S	Bend	trans	-80.3	56	170.4	-75.4	-88.1	0	0	0	112.1	H192 T193 D194 V207	H192-F196 VanDerWaalsContact O-CD2 3.32Å; H192-F196 WeakPolarHBondContact O-CD2 3.29Å; T193-F196 PolarHBondContact O-N 2.91Å; D194-F196 VanDerWaalsContact C-N 3.26Å; D194-F196 PolarHBondContact O-N 3.35Å; F196-V207 HydrophobicContact CD1-CG1 4.44Å; F196-V207 HydrophobicContact CE1-CG1 4.44Å
197	G	37.5	Very low	40.4	Very low	51 Å²	51	107.9 Å²	107.9	53%	0.526	58%	0.583	S	S	.	*			trans	48.3	83.6	156.1	0	0	0	0	0	117.5	N195 K199	N195-G197 PolarHBondContact O-N 2.86Å; G197-K199 VanDerWaalsContact C-N 3.27Å; G197-K199 PolarHBondContact O-N 3.43Å
198	K	38.6	Very low	42	Very low	177 Å²	177	105 Å²	105	77%	0.77	56%	0.563	S	S	*	*			trans	-62.3	81.1	163.6	-80.4	171.6	170.8	148.7	0	112.2	D194	D194-K198 WeakPolarHBondContact OD1-CE 3.38Å; D194-K198 IonicContact OD1-NZ 3.7Å; D194-K198 PolarHBondContact OD1-NZ 2.95Å
199	K	33.6	Very low	43.8	Very low	188 Å²	188	107 Å²	107	82%	0.817	57%	0.569	S	S	*	*	S	Bend	trans	-148.4	124.3	162	-97.4	168.8	-173.1	175.7	0	109	G197 H201	G197-K199 VanDerWaalsContact C-N 3.27Å; G197-K199 PolarHBondContact O-N 3.43Å; K199-H201 PolarHBondContact O-N 3.47Å
200	G	40.3	Very low	45.7	Very low	79 Å²	79	102.5 Å²	102.5	81%	0.814	55%	0.552	S	S	*	*			trans	-72.9	114.4	-165.1	0	0	0	0	0	114.7
201	H	37.7	Very low	47.8	Very low	168 Å²	168	102.2 Å²	102.2	78%	0.778	55%	0.554	S	S	*	*			trans	-140.5	174.3	167.1	-74.2	-60.7	0	0	0	110.8	K199	K199-H201 PolarHBondContact O-N 3.47Å
202	S	36.8	Very low	50.2	Low	50 Å²	50	97.4 Å²	97.4	35%	0.35	53%	0.532	S	S	.	.			trans	-42	126.1	-175.7	165.7	0	0	0	0	114.2	W204 T205 G206	S202-W204 PolarHBondContact O-N 3.05Å; S202-W204 PolarHBondContact OG-N 3.47Å; S202-T205 VanDerWaalsContact CB-OG1 3.24Å; S202-T205 WeakPolarHBondContact CB-OG1 3.4Å; S202-T205 PolarHBondContact O-N 3.21Å; S202-T205 PolarHBondContact OG-OG1 2.94Å; S202-T205 VanDerWaalsContact OG-OG1 3.12Å; S202-G206 PolarHBondContact O-N 3.13Å; S202-G206 VanDerWaalsContact O-N 3.1Å
203	P	46.3	Very low	52.4	Low	110 Å²	110	94 Å²	94	71%	0.714	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.7	176.7	-25.9	34.7	0	0	0	114.8
204	W	45.2	Very low	54.8	Low	143 Å²	143	94.2 Å²	94.2	54%	0.542	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-14.1	-171.1	-45.4	101.2	0	0	0	113.5	S202 K278	S202-W204 PolarHBondContact O-N 3.05Å; S202-W204 PolarHBondContact OG-N 3.47Å; W204-K278 WeakPolarHBondContact CZ3-O 3.5Å
205	T	44.8	Very low	57.4	Low	60 Å²	60	95.3 Å²	95.3	37%	0.368	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.1	-4.7	-171.4	58.9	0	0	0	0	114.3	S202 V207 D269	S202-T205 VanDerWaalsContact CB-OG1 3.24Å; S202-T205 WeakPolarHBondContact CB-OG1 3.4Å; S202-T205 PolarHBondContact O-N 3.21Å; S202-T205 PolarHBondContact OG-OG1 2.94Å; S202-T205 VanDerWaalsContact OG-OG1 3.12Å; T205-V207 PolarHBondContact O-N 2.91Å; T205-D269 HydrophobicContact CG2-CB 4.48Å
206	G	47.7	Very low	60	Low	52 Å²	52	91 Å²	91	54%	0.536	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-3.2	-169.3	0	0	0	0	0	117.7	S202	S202-G206 PolarHBondContact O-N 3.13Å; S202-G206 VanDerWaalsContact O-N 3.1Å
207	V	59.8	Low	62.4	Low	57 Å²	57	87.6 Å²	87.6	35%	0.345	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-31.2	-171.7	-162.4	0	0	0	0	113.3	R172 F196 T205	R172-V207 HydrophobicContact CG-CB 4.49Å; R172-V207 HydrophobicContact CG-CG1 3.87Å; F196-V207 HydrophobicContact CD1-CG1 4.44Å; F196-V207 HydrophobicContact CE1-CG1 4.44Å; T205-V207 PolarHBondContact O-N 2.91Å
208	S	69.3	Low	65.1	Low	23 Å²	23	90.6 Å²	90.6	16%	0.161	49%	0.492	C	S	.	.			trans	-80.7	128.5	176	-179.4	0	0	0	0	111.2	F210 E287	S208-F210 VanDerWaalsContact C-N 3.34Å; S208-F210 VanDerWaalsContact OG-CB 3.29Å; S208-F210 WeakPolarHBondContact OG-CB 3.4Å; S208-F210 PolarHBondContact OG-N 3.32Å; S208-F210 VanDerWaalsContact OG-N 3.15Å; S208-E287 WeakPolarHBondContact CB-OE1 3.46Å; S208-E287 PolarHBondContact OG-OE1 3.04Å; S208-E287 PolarHBondContact OG-OE2 2.81Å
209	Q	73.9	Confident	67.7	Low	145 Å²	145	85.5 Å²	85.5	68%	0.678	47%	0.471	S	S	*	.			trans	-94.8	13.3	171.7	-59.2	-178.7	4.3	0	0	112.2	Q162 L211	Q162-Q209 PolarHBondContact NE2-O 2.89Å; Q209-L211 PolarHBondContact O-N 2.91Å
210	F	79.3	Confident	70.6	Confident	14 Å²	14	76.7 Å²	76.7	6%	0.061	43%	0.433	C	S	.	.			trans	-67.4	116.2	-175.1	174.9	-105.8	0	0	0	112.7	Y56 S208 Q212 K216 H286 E287 L290	Y56-F210 HydrophobicContact CD2-CE2 4.39Å; Y56-F210 AromaticContact CE2-CD2 3.66Å; Y56-F210 HydrophobicContact CE2-CD2 3.66Å; Y56-F210 AromaticContact CE2-CE2 3.55Å; Y56-F210 HydrophobicContact CE2-CE2 3.55Å; Y56-F210 HydrophobicContact CE2-CZ 4.41Å; Y56-F210 AromaticContact CZ-CD2 3.65Å; Y56-F210 AromaticContact CZ-CE2 3.97Å; Y56-F210 WeakPolarHBondContact OH-CD2 3.3Å; Y56-F210 WeakPolarHBondContact OH-CG 3.46Å; S208-F210 VanDerWaalsContact C-N 3.34Å; S208-F210 VanDerWaalsContact OG-CB 3.29Å; S208-F210 WeakPolarHBondContact OG-CB 3.4Å; S208-F210 PolarHBondContact OG-N 3.32Å; S208-F210 VanDerWaalsContact OG-N 3.15Å; F210-Q212 HydrophobicContact CD1-CB 4.3Å; F210-Q212 HydrophobicContact CE1-CB 3.67Å; F210-Q212 HydrophobicContact CE1-CG 4.22Å; F210-Q212 HydrophobicContact CZ-CB 4.4Å; F210-Q212 PolarHBondContact O-N 2.93Å; F210-K216 HydrophobicContact CE2-CD 3.8Å; F210-K216 HydrophobicContact CZ-CD 3.72Å; F210-H286 HydrophobicContact CD1-CB 4.1Å; F210-H286 HydrophobicContact CE1-CB 3.88Å; F210-E287 HydrophobicContact CB-CG 3.95Å; F210-E287 HydrophobicContact CD1-CG 3.92Å; F210-E287 HydrophobicContact CG-CG 3.98Å; F210-L290 HydrophobicContact CE1-CD1 4.46Å; F210-L290 HydrophobicContact CE2-CD1 4.02Å; F210-L290 HydrophobicContact CZ-CD1 3.51Å; F210-L290 HydrophobicContact CZ-CG 4.27Å
211	L	80.1	Confident	73.2	Confident	125 Å²	125	74.2 Å²	74.2	65%	0.654	41%	0.405	S	S	*	.			trans	-88.5	100.9	175.7	-63.6	176.9	0	0	0	110.3	Q209 K216	Q209-L211 PolarHBondContact O-N 2.91Å; L211-K216 WeakPolarHBondContact O-CE 3.47Å; L211-K216 PolarHBondContact O-NZ 3.4Å
212	Q	84.6	Confident	75.6	Confident	43 Å²	43	68.2 Å²	68.2	20%	0.201	38%	0.382	C	S	.	.			trans	-70.9	145.3	176.9	-174.3	59.8	-57.9	0	0	111.6	F210 I217 H286	F210-Q212 HydrophobicContact CD1-CB 4.3Å; F210-Q212 HydrophobicContact CE1-CB 3.67Å; F210-Q212 HydrophobicContact CE1-CG 4.22Å; F210-Q212 HydrophobicContact CZ-CB 4.4Å; F210-Q212 PolarHBondContact O-N 2.93Å; Q212-I217 HydrophobicContact CG-CD1 4.18Å; Q212-I217 HydrophobicContact CG-CG1 4.41Å; Q212-H286 HydrophobicContact CB-CB 3.95Å; Q212-H286 HydrophobicContact CG-CB 4.01Å
213	T	88.6	Confident	77.9	Confident	66 Å²	66	69 Å²	69	41%	0.405	40%	0.397	S	S	.	.			trans	-140.6	156.3	171.7	67.8	0	0	0	0	110.9	Q215 K216 I217	T213-Q215 PolarHBondContact O-N 2.84Å; T213-K216 PolarHBondContact O-N 3.1Å; T213-K216 VanDerWaalsContact O-N 3.12Å; T213-K216 PolarHBondContact OG1-N 2.96Å; T213-K216 VanDerWaalsContact OG1-N 3.16Å; T213-I217 PolarHBondContact O-N 2.92Å
214	S	91.6	Very high	80	Confident	88 Å²	88	69.7 Å²	69.7	62%	0.615	39%	0.391	S	S	*	.	H	α-helix	trans	-53.6	-41.6	171	49.8	0	0	0	0	111.6	K216 I217 I218	S214-K216 VanDerWaalsContact C-N 3.35Å; S214-K216 PolarHBondContact O-N 2.82Å; S214-I217 PolarHBondContact O-N 3.33Å; S214-I217 VanDerWaalsContact O-N 3.12Å; S214-I218 VanDerWaalsContact O-CG1 3.31Å; S214-I218 WeakPolarHBondContact O-CG1 3.38Å; S214-I218 PolarHBondContact O-N 3.03Å
215	Q	91.1	Very high	82.4	Confident	108 Å²	108	70.2 Å²	70.2	51%	0.505	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-37.7	177.7	-169.1	64.4	9.6	0	0	113.2	T213 Q219	T213-Q215 PolarHBondContact O-N 2.84Å; Q215-Q219 WeakPolarHBondContact O-CB 3.31Å; Q215-Q219 VanDerWaalsContact O-CG 3.24Å; Q215-Q219 WeakPolarHBondContact O-CG 3.31Å; Q215-Q219 PolarHBondContact O-N 2.74Å
216	K	91.6	Very high	84.9	Confident	44 Å²	44	70 Å²	70	19%	0.191	40%	0.399	C	S	.	.	H	α-helix	trans	-65.5	-39.1	173.9	-78.4	179.4	175.4	179.9	0	111.4	F210 L211 T213 S214 F220 L290	F210-K216 HydrophobicContact CE2-CD 3.8Å; F210-K216 HydrophobicContact CZ-CD 3.72Å; L211-K216 WeakPolarHBondContact O-CE 3.47Å; L211-K216 PolarHBondContact O-NZ 3.4Å; T213-K216 PolarHBondContact O-N 3.1Å; T213-K216 VanDerWaalsContact O-N 3.12Å; T213-K216 PolarHBondContact OG1-N 2.96Å; T213-K216 VanDerWaalsContact OG1-N 3.16Å; S214-K216 VanDerWaalsContact C-N 3.35Å; S214-K216 PolarHBondContact O-N 2.82Å; K216-F220 WeakPolarHBondContact O-CD2 3.45Å; K216-F220 PolarHBondContact O-N 2.76Å; K216-L290 HydrophobicContact CB-CD1 4.4Å
217	I	92.5	Very high	87.2	Confident	48 Å²	48	72.8 Å²	72.8	25%	0.246	40%	0.398	C	S	.	.	H	α-helix	trans	-67	-49.6	176.1	-61.7	170.5	0	0	0	110.5	Q212 T213 S214 Q219 F220 A221 L293 I303	Q212-I217 HydrophobicContact CG-CD1 4.18Å; Q212-I217 HydrophobicContact CG-CG1 4.41Å; T213-I217 PolarHBondContact O-N 2.92Å; S214-I217 PolarHBondContact O-N 3.33Å; S214-I217 VanDerWaalsContact O-N 3.12Å; I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 2.7Å; I217-F220 CarbonylContact O-C 3.44Å; I217-F220 WeakPolarHBondContact O-CA 3.29Å; I217-F220 PolarHBondContact O-N 3.34Å; I217-A221 WeakPolarHBondContact O-CB 3.43Å; I217-A221 PolarHBondContact O-N 3.32Å; I217-L293 HydrophobicContact CG2-CD1 4.37Å; I217-I303 HydrophobicContact CD1-CD1 4.21Å
218	I	93.9	Very high	88.9	Confident	114 Å²	114	76 Å²	76	59%	0.585	42%	0.42	S	S	*	.	H	α-helix	trans	-58.1	-38.8	178.7	-67.8	163.1	0	0	0	111.4	S214 F220	S214-I218 VanDerWaalsContact O-CG1 3.31Å; S214-I218 WeakPolarHBondContact O-CG1 3.38Å; S214-I218 PolarHBondContact O-N 3.03Å; I218-F220 PolarHBondContact O-N 3.28Å
219	Q	93.4	Very high	90.1	Very high	70 Å²	70	77.7 Å²	77.7	33%	0.327	44%	0.442	S	S	.	.	H	α-helix	trans	-67	-20.8	174.9	-76.7	176.4	-5.9	0	0	113.9	R63 Q215 I217	R63-Q219 WeakPolarHBondContact CD-O 3.24Å; Q215-Q219 WeakPolarHBondContact O-CB 3.31Å; Q215-Q219 VanDerWaalsContact O-CG 3.24Å; Q215-Q219 WeakPolarHBondContact O-CG 3.31Å; Q215-Q219 PolarHBondContact O-N 2.74Å; I217-Q219 VanDerWaalsContact C-N 3.27Å; I217-Q219 PolarHBondContact O-N 2.7Å
220	F	95.1	Very high	91.2	Very high	4 Å²	4	72.9 Å²	72.9	2%	0.018	42%	0.421	C	S	.	.	H	α-helix	trans	-104.1	-25.2	-178.9	-92.1	-109.5	0	0	0	113.8	N60 K104 W105 K216 I217 I218 L290 L293 A294	N60-F220 HydrophobicContact CB-CE2 3.95Å; N60-F220 HydrophobicContact CB-CZ 3.82Å; K104-F220 WeakPolarHBondContact CE-O 3.45Å; K104-F220 PolarHBondContact NZ-O 3.36Å; W105-F220 HydrophobicContact CH2-CB 4.47Å; W105-F220 AromaticContact CH2-CD1 3.71Å; W105-F220 HydrophobicContact CH2-CD1 3.71Å; W105-F220 HydrophobicContact CH2-CD2 4.36Å; W105-F220 AromaticContact CH2-CE1 3.97Å; W105-F220 HydrophobicContact CH2-CE1 3.97Å; W105-F220 AromaticContact CH2-CG 3.93Å; W105-F220 HydrophobicContact CH2-CG 3.93Å; W105-F220 HydrophobicContact CH2-CZ 4.41Å; W105-F220 HydrophobicContact CZ3-CD1 4.28Å; W105-F220 HydrophobicContact CZ3-CE1 4.13Å; K216-F220 WeakPolarHBondContact O-CD2 3.45Å; K216-F220 PolarHBondContact O-N 2.76Å; I217-F220 CarbonylContact O-C 3.44Å; I217-F220 WeakPolarHBondContact O-CA 3.29Å; I217-F220 PolarHBondContact O-N 3.34Å; I218-F220 PolarHBondContact O-N 3.28Å; F220-L290 HydrophobicContact CB-CD2 3.87Å; F220-L290 HydrophobicContact CD1-CB 3.9Å; F220-L290 HydrophobicContact CD1-CD2 4.19Å; F220-L290 WeakPolarHBondContact CD1-O 3.08Å; F220-L290 HydrophobicContact CD2-CD1 4.41Å; F220-L290 HydrophobicContact CD2-CD2 4.09Å; F220-L290 HydrophobicContact CE1-CB 3.89Å; F220-L290 WeakPolarHBondContact CE1-O 3.43Å; F220-L290 HydrophobicContact CE2-CD1 4.28Å; F220-L290 HydrophobicContact CG-CB 4.36Å; F220-L290 HydrophobicContact CG-CD2 3.8Å; F220-L290 HydrophobicContact CG-CG 4.49Å; F220-L290 HydrophobicContact CZ-CB 4.35Å; F220-L290 HydrophobicContact CZ-CD1 4.43Å; F220-L293 HydrophobicContact CB-CB 4.03Å; F220-L293 HydrophobicContact CB-CD1 4.15Å; F220-L293 HydrophobicContact CD1-CB 4.43Å; F220-A294 HydrophobicContact CD1-CB 4.29Å; F220-A294 HydrophobicContact CE1-CB 4.09Å
221	A	93.7	Very high	92.1	Very high	27 Å²	27	74.3 Å²	74.3	22%	0.223	43%	0.431	C	S	.	.	S	Bend	trans	-65.1	166.9	180	0	0	0	0	0	113	I217	I217-A221 WeakPolarHBondContact O-CB 3.43Å; I217-A221 PolarHBondContact O-N 3.32Å
222	S	87.7	Confident	93	Very high	41 Å²	41	69.1 Å²	69.1	29%	0.287	40%	0.404	S	S	.	.			trans	-82.5	-34.1	164.9	62.8	0	0	0	0	111.5	Q224 A299	S222-Q224 PolarHBondContact O-N 2.96Å; S222-Q224 PolarHBondContact O-NE2 3.42Å; S222-Q224 VanDerWaalsContact O-NE2 3.16Å; S222-Q224 PolarHBondContact OG-N 2.8Å; S222-A299 PolarHBondContact OG-O 3.33Å
223	G	86.6	Confident	93.7	Very high	66 Å²	66	67.1 Å²	67.1	68%	0.68	39%	0.394	S	S	*	.			trans	64.5	17.6	-172.2	0	0	0	0	0	113.9
224	Q	90.6	Very high	94.2	Very high	126 Å²	126	64 Å²	64	59%	0.589	38%	0.375	S	S	*	.			trans	-104.4	129.7	179.2	-53.9	-51.6	-69.7	0	0	109.5	S222 Y261	S222-Q224 PolarHBondContact O-N 2.96Å; S222-Q224 PolarHBondContact O-NE2 3.42Å; S222-Q224 VanDerWaalsContact O-NE2 3.16Å; S222-Q224 PolarHBondContact OG-N 2.8Å; Q224-Y261 WeakPolarHBondContact O-CE2 3.38Å; Q224-Y261 PolarHBondContact O-OH 2.89Å
225	E	94.8	Very high	94.5	Very high	153 Å²	153	59.8 Å²	59.8	72%	0.715	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-83.1	158.9	169.7	-62.8	-176.4	152.5	0	0	110.8	Q227	E225-Q227 PolarHBondContact O-N 3.33Å; E225-Q227 PolarHBondContact O-NE2 2.85Å
226	P	96.1	Very high	94.8	Very high	56 Å²	56	55 Å²	55	36%	0.364	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-58.9	131.6	176.4	-18.9	29	0	0	0	112.1	I232 Y261	P226-I232 HydrophobicContact CB-CD1 3.76Å; P226-I232 HydrophobicContact CB-CG1 4.11Å; P226-I232 HydrophobicContact CG-CD1 3.82Å; P226-I232 HydrophobicContact CG-CG1 4.35Å; P226-Y261 HydrophobicContact CB-CD1 4.44Å; P226-Y261 HydrophobicContact CB-CD2 4.03Å; P226-Y261 HydrophobicContact CB-CE2 4.23Å; P226-Y261 HydrophobicContact CB-CG 4.15Å; P226-Y261 HydrophobicContact CG-CD1 3.88Å; P226-Y261 HydrophobicContact CG-CD2 4.03Å; P226-Y261 HydrophobicContact CG-CE1 3.69Å; P226-Y261 HydrophobicContact CG-CE2 3.84Å; P226-Y261 HydrophobicContact CG-CG 4.05Å
227	Q	96.4	Very high	95.1	Very high	110 Å²	110	53.4 Å²	53.4	51%	0.514	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-95.9	157.8	-179.1	-59.9	-56.4	-61	0	0	112.2	E225 G229 D230	E225-Q227 PolarHBondContact O-N 3.33Å; E225-Q227 PolarHBondContact O-NE2 2.85Å; Q227-G229 PolarHBondContact O-N 3.4Å; Q227-G229 VanDerWaalsContact O-N 3.1Å; Q227-D230 PolarHBondContact N-OD2 2.96Å; Q227-D230 WeakPolarHBondContact O-CB 3.27Å; Q227-D230 PolarHBondContact O-N 2.91Å
228	P	95.3	Very high	95.3	Very high	124 Å²	124	51.8 Å²	51.8	81%	0.805	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	116.3	175.4	-25.9	35.8	0	0	0	112.4
229	G	94.9	Very high	95.5	Very high	60 Å²	60	46.7 Å²	46.7	62%	0.619	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	2.3	-176.6	0	0	0	0	0	115	Q227	Q227-G229 PolarHBondContact O-N 3.4Å; Q227-G229 VanDerWaalsContact O-N 3.1Å
230	D	97.6	Very high	95.7	Very high	43 Å²	43	43.4 Å²	43.4	23%	0.23	27%	0.273	C	S	.	.			trans	-71.9	150.8	161.3	-65.3	-10.1	0	0	0	110.1	Q227 K259	Q227-D230 PolarHBondContact N-OD2 2.96Å; Q227-D230 WeakPolarHBondContact O-CB 3.27Å; Q227-D230 PolarHBondContact O-N 2.91Å; D230-K259 CarbonylContact C-O 3.45Å; D230-K259 WeakPolarHBondContact CA-O 3.32Å
231	T	98.4	Very high	95.7	Very high	45 Å²	45	43.5 Å²	43.5	28%	0.276	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.3	172.5	-53.4	0	0	0	0	108.9	I233 A257 K259 Y261 D320	T231-I233 HydrophobicContact CG2-CG1 4.2Å; T231-I233 PolarHBondContact O-N 3.29Å; T231-A257 HydrophobicContact CG2-CB 4.09Å; T231-K259 PolarHBondContact N-O 3.42Å; T231-Y261 PolarHBondContact O-N 3.05Å; T231-D320 HydrophobicContact CG2-CB 3.91Å
232	I	98.6	Very high	95.9	Very high	16 Å²	16	43 Å²	43	8%	0.082	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	109.8	-175.4	-57.2	179.8	0	0	0	109.7	P226 Y261 I263 F317 K318 V319 D320 L321	P226-I232 HydrophobicContact CB-CD1 3.76Å; P226-I232 HydrophobicContact CB-CG1 4.11Å; P226-I232 HydrophobicContact CG-CD1 3.82Å; P226-I232 HydrophobicContact CG-CG1 4.35Å; I232-Y261 HydrophobicContact CG2-CD1 4.48Å; I232-I263 HydrophobicContact CG2-CD1 3.62Å; I232-I263 HydrophobicContact CG2-CG1 4.28Å; I232-F317 VanDerWaalsContact CD1-O 3.32Å; I232-F317 WeakPolarHBondContact CD1-O 3.4Å; I232-K318 HydrophobicContact CD1-CB 4.37Å; I232-V319 HydrophobicContact CG2-CG2 4.43Å; I232-D320 PolarHBondContact N-OD2 2.9Å; I232-D320 PolarHBondContact O-N 2.94Å; I232-L321 PolarHBondContact O-N 2.66Å
233	I	98.8	Very high	96.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.4	-176.5	-49.4	174.9	0	0	0	109.9	T231 V253 A257 P260 Y261 I262 I263 L321 C323	T231-I233 HydrophobicContact CG2-CG1 4.2Å; T231-I233 PolarHBondContact O-N 3.29Å; I233-V253 HydrophobicContact CB-CG1 4.38Å; I233-V253 HydrophobicContact CD1-CG1 4.22Å; I233-V253 HydrophobicContact CG2-CG1 3.57Å; I233-A257 HydrophobicContact CD1-CB 4.41Å; I233-P260 HydrophobicContact CD1-CB 4.01Å; I233-Y261 PolarHBondContact N-O 2.96Å; I233-I262 HydrophobicContact CB-CG1 4.24Å; I233-I262 HydrophobicContact CD1-CG1 4.48Å; I233-I262 WeakPolarHBondContact O-CA 3.38Å; I233-I263 PolarHBondContact O-N 3.45Å; I233-L321 CarbonylContact C-O 3.55Å; I233-L321 WeakPolarHBondContact CA-O 3.45Å; I233-L321 HydrophobicContact CB-CB 4.47Å; I233-L321 HydrophobicContact CD1-CD2 4.37Å; I233-L321 HydrophobicContact CG1-CB 4.14Å; I233-L321 HydrophobicContact CG1-CD2 4.36Å; I233-L321 HydrophobicContact CG2-CB 4.17Å; I233-L321 HydrophobicContact CG2-CD2 4.33Å; I233-C323 HydrophobicContact CG2-CB 4.46Å
234	Y	98.8	Very high	96.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	134.9	176.6	-177.6	-107.8	0	0	0	111.9	A236 I263 V302 A305 V309 L313 L321 V322 C323	Y234-A236 HydrophobicContact CE1-CB 3.85Å; Y234-I263 WeakPolarHBondContact CA-O 3.31Å; Y234-I263 HydrophobicContact CD2-CB 4.12Å; Y234-I263 HydrophobicContact CD2-CG2 3.89Å; Y234-I263 HydrophobicContact CE2-CG2 4.27Å; Y234-V302 HydrophobicContact CE2-CG2 4.3Å; Y234-A305 WeakPolarHBondContact OH-CB 3.37Å; Y234-V309 HydrophobicContact CD1-CG1 3.99Å; Y234-V309 HydrophobicContact CE1-CG1 3.95Å; Y234-V309 HydrophobicContact CE1-CG2 4.06Å; Y234-L313 HydrophobicContact CD1-CD2 3.98Å; Y234-L313 HydrophobicContact CD2-CD2 4.08Å; Y234-L313 HydrophobicContact CE1-CD1 4.37Å; Y234-L313 HydrophobicContact CE1-CD2 3.8Å; Y234-L313 HydrophobicContact CE2-CD1 4.32Å; Y234-L313 HydrophobicContact CE2-CD2 3.92Å; Y234-L313 HydrophobicContact CG-CD2 4.11Å; Y234-L321 PolarHBondContact N-O 2.98Å; Y234-V322 HydrophobicContact CD1-CG1 4.47Å; Y234-V322 WeakPolarHBondContact O-CA 3.47Å; Y234-C323 PolarHBondContact O-N 3.4Å
235	V	98.7	Very high	97.2	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	142.9	172.4	-56.4	0	0	0	0	109.8	F239 F249 L250 V253 I262 I263 V264 G265 C323	V235-F239 HydrophobicContact CG2-CZ 4.07Å; V235-F249 HydrophobicContact CB-CE1 3.9Å; V235-F249 HydrophobicContact CB-CZ 4.08Å; V235-F249 HydrophobicContact CG1-CE1 3.93Å; V235-F249 HydrophobicContact CG1-CZ 3.8Å; V235-F249 HydrophobicContact CG2-CE1 4.18Å; V235-L250 HydrophobicContact CG2-CD2 4.01Å; V235-V253 HydrophobicContact CG1-CG1 4.21Å; V235-V253 HydrophobicContact CG1-CG2 4.33Å; V235-I262 HydrophobicContact CG2-CG2 4.32Å; V235-I263 PolarHBondContact N-O 2.99Å; V235-V264 HydrophobicContact CG2-CB 4.25Å; V235-V264 HydrophobicContact CG2-CG1 4.24Å; V235-V264 HydrophobicContact CG2-CG2 3.76Å; V235-V264 CarbonylContact O-C 3.57Å; V235-V264 WeakPolarHBondContact O-CA 3.48Å; V235-G265 PolarHBondContact O-N 2.94Å; V235-C323 HydrophobicContact CG1-CB 3.8Å; V235-C323 WeakPolarHBondContact CG1-O 3.43Å
236	A	98.2	Very high	97.4	Very high	7 Å²	7	27.2 Å²	27.2	6%	0.058	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.9	-174.2	0	0	0	0	0	112.9	Y234 G265	Y234-A236 HydrophobicContact CE1-CB 3.85Å; A236-G265 WeakPolarHBondContact CA-O 3.24Å
237	G	97.6	Very high	97.5	Very high	11 Å²	11	24.6 Å²	24.6	11%	0.113	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.3	-160.7	171.9	0	0	0	0	0	115.4	G265 H267	G237-G265 PolarHBondContact N-O 3.45Å; G237-H267 PolarHBondContact O-N 3.1Å
238	A	97.1	Very high	97.6	Very high	14 Å²	14	20.3 Å²	20.3	12%	0.116	14%	0.136	C	C	.	.			trans	-74.3	-53.6	174.3	0	0	0	0	0	112	D240 V272 Y275 R288	A238-D240 HydrophobicContact CB-CB 4.26Å; A238-D240 PolarHBondContact O-N 3.5Å; A238-V272 HydrophobicContact CB-CG1 3.93Å; A238-V272 HydrophobicContact CB-CG2 4.02Å; A238-Y275 WeakPolarHBondContact CB-OH 3.38Å; A238-Y275 PolarHBondContact N-OH 3.29Å; A238-R288 WeakPolarHBondContact O-CD 3.45Å; A238-R288 PolarHBondContact O-NH1 2.71Å
239	F	97.8	Very high	97.8	Very high	7 Å²	7	15.4 Å²	15.4	3%	0.031	10%	0.102	C	C	.	.			trans	51.1	30.2	-166.2	-61.1	-92.8	0	0	0	113.5	V235 F242 H246 F249 L250 V264 L266 V292	V235-F239 HydrophobicContact CG2-CZ 4.07Å; F239-F242 HydrophobicContact CB-CD2 4.37Å; F239-F242 HydrophobicContact CD1-CD2 4.02Å; F239-F242 HydrophobicContact CD1-CE2 4.01Å; F239-H246 HydrophobicContact CD1-CB 4.06Å; F239-H246 AromaticContact CD1-CD2 3.38Å; F239-H246 WeakPolarHBondContact CD1-CD2 3.49Å; F239-H246 AromaticContact CD1-CG 3.83Å; F239-H246 HydrophobicContact CE1-CB 4.3Å; F239-H246 AromaticContact CE1-CD2 3.73Å; F239-F249 HydrophobicContact CZ-CE1 4.42Å; F239-L250 HydrophobicContact CE1-CD1 4.35Å; F239-V264 HydrophobicContact CD1-CG1 4.41Å; F239-V264 HydrophobicContact CD2-CG1 3.7Å; F239-V264 HydrophobicContact CE1-CG1 4.15Å; F239-V264 HydrophobicContact CE2-CG1 3.39Å; F239-V264 HydrophobicContact CG-CG1 4.21Å; F239-V264 HydrophobicContact CZ-CG1 3.64Å; F239-L266 HydrophobicContact CB-CD2 3.74Å; F239-L266 HydrophobicContact CD2-CD2 3.64Å; F239-L266 HydrophobicContact CG-CD2 3.99Å; F239-V292 HydrophobicContact CB-CG2 3.64Å; F239-V292 HydrophobicContact CD1-CG2 4.24Å; F239-V292 HydrophobicContact CG-CG2 4.07Å
240	D	96.8	Very high	98	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.011	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	138.2	176.9	-176.6	32.4	0	0	0	111.3	A238 Y280 P281 I282 M283 S359	A238-D240 HydrophobicContact CB-CB 4.26Å; A238-D240 PolarHBondContact O-N 3.5Å; D240-Y280 WeakPolarHBondContact OD2-CD1 3.39Å; D240-P281 HydrophobicContact CB-CB 3.96Å; D240-P281 VanDerWaalsContact CG-CB 3.49Å; D240-P281 VanDerWaalsContact OD2-CA 3.29Å; D240-P281 WeakPolarHBondContact OD2-CA 3.41Å; D240-I282 VanDerWaalsContact CG-N 3.32Å; D240-I282 PolarHBondContact OD1-N 2.86Å; D240-I282 PolarHBondContact OD2-N 2.86Å; D240-M283 PolarHBondContact OD1-N 2.92Å; D240-S359 PolarHBondContact O-OG 3.42Å
241	L	95.6	Very high	98	Very high	6 Å²	6	12.4 Å²	12.4	3%	0.031	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	56.3	-166.1	-59.9	176.6	0	0	0	111.8	L169 M173 H243 I282 M283 I362 V363	L169-L241 HydrophobicContact CD2-CD2 4.46Å; M173-L241 HydrophobicContact CE-CD1 3.76Å; M173-L241 HydrophobicContact CE-CD2 3.75Å; M173-L241 HydrophobicContact CE-CG 4.43Å; M173-L241 HydrophobicContact CG-CD1 4.38Å; M173-L241 HydrophobicContact SD-CD1 3.44Å; M173-L241 WeakPolarHBondContact SD-CD1 3.37Å; L241-H243 WeakPolarHBondContact O-CB 3.38Å; L241-H243 PolarHBondContact O-CD2 2.84Å; L241-H243 PolarHBondContact O-N 3.31Å; L241-I282 HydrophobicContact CD1-CB 4.31Å; L241-I282 HydrophobicContact CD1-CG1 4.07Å; L241-I282 HydrophobicContact CD2-CB 3.91Å; L241-I282 HydrophobicContact CD2-CG2 3.78Å; L241-I282 HydrophobicContact CG-CB 4.01Å; L241-I282 HydrophobicContact CG-CG1 4.27Å; L241-I282 HydrophobicContact CG-CG2 4.38Å; L241-M283 HydrophobicContact CD2-CE 4.06Å; L241-M283 HydrophobicContact CD2-CG 4.26Å; L241-M283 HydrophobicContact CD2-SD 4.43Å; L241-I362 HydrophobicContact CD1-CG2 4.39Å; L241-V363 HydrophobicContact CD1-CG2 4.41Å
242	F	98.1	Very high	98	Very high	15 Å²	15	11.3 Å²	11.3	7%	0.066	7%	0.066	C	C	.	.			trans	-43.2	122.5	-174.9	-173.6	-101.6	0	0	0	112.6	M99 F239 H246 V247 L250 S291 V292 C295	M99-F242 HydrophobicContact CE-CD1 3.75Å; M99-F242 HydrophobicContact CE-CE1 4.15Å; M99-F242 WeakPolarHBondContact CE-O 3.39Å; F239-F242 HydrophobicContact CB-CD2 4.37Å; F239-F242 HydrophobicContact CD1-CD2 4.02Å; F239-F242 HydrophobicContact CD1-CE2 4.01Å; F242-H246 HydrophobicContact CD2-CB 3.76Å; F242-H246 HydrophobicContact CE2-CB 3.53Å; F242-H246 HydrophobicContact CZ-CB 4.29Å; F242-V247 HydrophobicContact CE1-CG2 3.94Å; F242-V247 HydrophobicContact CZ-CG2 4.07Å; F242-L250 HydrophobicContact CE2-CD1 3.81Å; F242-L250 HydrophobicContact CZ-CD1 3.87Å; F242-S291 WeakPolarHBondContact CD1-O 3.36Å; F242-V292 HydrophobicContact CD2-CG2 3.67Å; F242-V292 HydrophobicContact CE2-CG2 4.03Å; F242-V292 HydrophobicContact CG-CG2 4.29Å; F242-C295 HydrophobicContact CE1-CB 4.04Å; F242-C295 HydrophobicContact CZ-CB 3.83Å
243	H	97.7	Very high	98	Very high	7 Å²	7	10.5 Å²	10.5	3%	0.032	6%	0.062	C	C	.	.			trans	-148.5	170.5	-158	57.7	62	0	0	0	112	L241 G245 H246 V247 L357 S359 I362	L241-H243 WeakPolarHBondContact O-CB 3.38Å; L241-H243 PolarHBondContact O-CD2 2.84Å; L241-H243 PolarHBondContact O-N 3.31Å; H243-G245 VanDerWaalsContact C-N 3.28Å; H243-G245 PolarHBondContact ND1-N 2.93Å; H243-G245 PolarHBondContact O-N 3.26Å; H243-G245 VanDerWaalsContact O-N 3.12Å; H243-H246 AromaticContact CD2-CE1 3.59Å; H243-H246 AromaticContact CD2-ND1 3.44Å; H243-H246 PolarHBondContact CD2-ND1 3.33Å; H243-H246 AromaticContact CE1-CE1 3.42Å; H243-H246 PolarHBondContact CE1-CE1 3.34Å; H243-H246 VanDerWaalsContact CE1-CE1 3.42Å; H243-H246 AromaticContact CE1-CG 3.92Å; H243-H246 AromaticContact CE1-ND1 3.19Å; H243-H246 PolarHBondContact CE1-ND1 2.89Å; H243-H246 AromaticContact CG-ND1 3.46Å; H243-H246 AromaticContact ND1-CE1 3.96Å; H243-H246 AromaticContact ND1-CG 3.99Å; H243-H246 PolarHBondContact ND1-N 2.83Å; H243-H246 AromaticContact ND1-ND1 3.29Å; H243-H246 PolarHBondContact ND1-ND1 3.48Å; H243-H246 AromaticContact NE2-CE1 3.15Å; H243-H246 PolarHBondContact NE2-CE1 3.08Å; H243-H246 AromaticContact NE2-ND1 3.29Å; H243-H246 PolarHBondContact NE2-ND1 2.97Å; H243-H246 WeakPolarHBondContact O-CA 3.28Å; H243-H246 WeakPolarHBondContact O-CB 3.2Å; H243-H246 PolarHBondContact O-N 3.45Å; H243-V247 PolarHBondContact O-N 3.14Å; H243-V247 VanDerWaalsContact O-N 3.14Å; H243-L357 HydrophobicContact CB-CD2 4.05Å; H243-L357 PolarHBondContact CE1-O 2.75Å; H243-S359 PolarHBondContact NE2-N 3.05Å; H243-I362 HydrophobicContact CB-CD1 3.58Å; H243-I362 WeakPolarHBondContact CD2-CD1 3.44Å
244	I	97.2	Very high	98	Very high	9 Å²	9	13.6 Å²	13.6	5%	0.046	8%	0.076	C	C	.	.	H	α-helix	trans	-55.2	-34.6	-175.1	52.1	86.7	0	0	0	114.8	E95 M99 H246 V247 D248 N355 L357	E95-I244 HydrophobicContact CB-CG1 4.24Å; E95-I244 HydrophobicContact CG-CD1 4.21Å; E95-I244 HydrophobicContact CG-CG1 4.18Å; E95-I244 WeakPolarHBondContact O-CG2 3.42Å; M99-I244 HydrophobicContact CB-CG2 3.68Å; M99-I244 HydrophobicContact CG-CG2 4.23Å; M99-I244 HydrophobicContact SD-CG2 3.75Å; I244-H246 VanDerWaalsContact C-N 3.27Å; I244-H246 PolarHBondContact O-N 3.35Å; I244-V247 WeakPolarHBondContact O-CB 3.1Å; I244-V247 PolarHBondContact O-N 3.25Å; I244-V247 VanDerWaalsContact O-N 3.08Å; I244-D248 WeakPolarHBondContact O-CB 3.49Å; I244-D248 PolarHBondContact O-N 3.12Å; I244-N355 WeakPolarHBondContact CD1-ND2 3.24Å; I244-L357 HydrophobicContact CD1-CB 4.14Å; I244-L357 HydrophobicContact CD1-CD2 3.5Å; I244-L357 VanDerWaalsContact CD1-CD2 3.5Å; I244-L357 HydrophobicContact CD1-CG 4.44Å; I244-L357 HydrophobicContact CG1-CD2 3.66Å
245	G	97.6	Very high	97.9	Very high	8 Å²	8	20.5 Å²	20.5	8%	0.082	11%	0.106	C	C	.	.	H	α-helix	trans	-59.7	-31.3	171.5	0	0	0	0	0	115	H243 F249	H243-G245 VanDerWaalsContact C-N 3.28Å; H243-G245 PolarHBondContact ND1-N 2.93Å; H243-G245 PolarHBondContact O-N 3.26Å; H243-G245 VanDerWaalsContact O-N 3.12Å; G245-F249 PolarHBondContact O-N 3.18Å
246	H	98.5	Very high	97.9	Very high	31 Å²	31	24.7 Å²	24.7	14%	0.144	13%	0.128	C	C	.	.	H	α-helix	trans	-78.7	-36.5	172.5	-63.7	112.4	0	0	0	111.6	F239 F242 H243 I244 L250	F239-H246 HydrophobicContact CD1-CB 4.06Å; F239-H246 AromaticContact CD1-CD2 3.38Å; F239-H246 WeakPolarHBondContact CD1-CD2 3.49Å; F239-H246 AromaticContact CD1-CG 3.83Å; F239-H246 HydrophobicContact CE1-CB 4.3Å; F239-H246 AromaticContact CE1-CD2 3.73Å; F242-H246 HydrophobicContact CD2-CB 3.76Å; F242-H246 HydrophobicContact CE2-CB 3.53Å; F242-H246 HydrophobicContact CZ-CB 4.29Å; H243-H246 AromaticContact CD2-CE1 3.59Å; H243-H246 AromaticContact CD2-ND1 3.44Å; H243-H246 PolarHBondContact CD2-ND1 3.33Å; H243-H246 AromaticContact CE1-CE1 3.42Å; H243-H246 PolarHBondContact CE1-CE1 3.34Å; H243-H246 VanDerWaalsContact CE1-CE1 3.42Å; H243-H246 AromaticContact CE1-CG 3.92Å; H243-H246 AromaticContact CE1-ND1 3.19Å; H243-H246 PolarHBondContact CE1-ND1 2.89Å; H243-H246 AromaticContact CG-ND1 3.46Å; H243-H246 AromaticContact ND1-CE1 3.96Å; H243-H246 AromaticContact ND1-CG 3.99Å; H243-H246 PolarHBondContact ND1-N 2.83Å; H243-H246 AromaticContact ND1-ND1 3.29Å; H243-H246 PolarHBondContact ND1-ND1 3.48Å; H243-H246 AromaticContact NE2-CE1 3.15Å; H243-H246 PolarHBondContact NE2-CE1 3.08Å; H243-H246 AromaticContact NE2-ND1 3.29Å; H243-H246 PolarHBondContact NE2-ND1 2.97Å; H243-H246 WeakPolarHBondContact O-CA 3.28Å; H243-H246 WeakPolarHBondContact O-CB 3.2Å; H243-H246 PolarHBondContact O-N 3.45Å; I244-H246 VanDerWaalsContact C-N 3.27Å; I244-H246 PolarHBondContact O-N 3.35Å; H246-L250 WeakPolarHBondContact O-CB 3.43Å; H246-L250 VanDerWaalsContact O-CG 3.27Å; H246-L250 WeakPolarHBondContact O-CG 3.44Å; H246-L250 PolarHBondContact O-N 3.25Å
247	V	98.6	Very high	97.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-47.3	173.6	172.4	0	0	0	0	110.7	M99 A102 F242 H243 I244 F249 L250 E251 Y297	M99-V247 HydrophobicContact SD-CG2 3.83Å; A102-V247 HydrophobicContact CB-CB 4.25Å; A102-V247 HydrophobicContact CB-CG1 3.5Å; A102-V247 HydrophobicContact CB-CG2 3.65Å; F242-V247 HydrophobicContact CE1-CG2 3.94Å; F242-V247 HydrophobicContact CZ-CG2 4.07Å; H243-V247 PolarHBondContact O-N 3.14Å; H243-V247 VanDerWaalsContact O-N 3.14Å; I244-V247 WeakPolarHBondContact O-CB 3.1Å; I244-V247 PolarHBondContact O-N 3.25Å; I244-V247 VanDerWaalsContact O-N 3.08Å; V247-F249 VanDerWaalsContact C-N 3.35Å; V247-F249 PolarHBondContact O-N 3.44Å; V247-L250 PolarHBondContact O-N 2.82Å; V247-E251 VanDerWaalsContact O-CB 3.29Å; V247-E251 WeakPolarHBondContact O-CB 3.38Å; V247-E251 PolarHBondContact O-N 3.28Å; V247-Y297 HydrophobicContact CG1-CE2 4.11Å
248	D	98.5	Very high	97.8	Very high	20 Å²	20	33.8 Å²	33.8	11%	0.107	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-37.9	-177.3	-67.6	3.4	0	0	0	111.6	K98 I244 A252 N355	K98-D248 WeakPolarHBondContact CD-OD1 3.5Å; K98-D248 VanDerWaalsContact CE-OD1 3.24Å; K98-D248 WeakPolarHBondContact CE-OD1 3.37Å; K98-D248 VanDerWaalsContact NZ-CG 3.34Å; K98-D248 IonicContact NZ-OD1 2.68Å; K98-D248 PolarHBondContact NZ-OD1 2.98Å; K98-D248 IonicContact NZ-OD2 3.45Å; I244-D248 WeakPolarHBondContact O-CB 3.49Å; I244-D248 PolarHBondContact O-N 3.12Å; D248-A252 WeakPolarHBondContact O-CB 3.27Å; D248-A252 PolarHBondContact O-N 3.2Å; D248-N355 HydrophobicContact CB-CB 4.09Å; D248-N355 PolarHBondContact OD2-ND2 3.42Å
249	F	98.7	Very high	97.8	Very high	22 Å²	22	38 Å²	38	10%	0.096	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-50.6	170	169.8	-111.3	0	0	0	111.9	V235 F239 G245 V247 E251 A252 V253 C323 V351	V235-F249 HydrophobicContact CB-CE1 3.9Å; V235-F249 HydrophobicContact CB-CZ 4.08Å; V235-F249 HydrophobicContact CG1-CE1 3.93Å; V235-F249 HydrophobicContact CG1-CZ 3.8Å; V235-F249 HydrophobicContact CG2-CE1 4.18Å; F239-F249 HydrophobicContact CZ-CE1 4.42Å; G245-F249 PolarHBondContact O-N 3.18Å; V247-F249 VanDerWaalsContact C-N 3.35Å; V247-F249 PolarHBondContact O-N 3.44Å; F249-E251 VanDerWaalsContact C-N 3.33Å; F249-E251 PolarHBondContact O-N 3.09Å; F249-A252 PolarHBondContact O-N 2.66Å; F249-V253 HydrophobicContact CD2-CG2 4.07Å; F249-V253 HydrophobicContact CE1-CG2 4.28Å; F249-V253 HydrophobicContact CE2-CG2 3.68Å; F249-V253 HydrophobicContact CZ-CG2 3.8Å; F249-V253 VanDerWaalsContact O-CG2 3.28Å; F249-V253 WeakPolarHBondContact O-CG2 3.47Å; F249-V253 PolarHBondContact O-N 2.94Å; F249-C323 HydrophobicContact CZ-CB 4.36Å; F249-V351 HydrophobicContact CD2-CB 4.32Å; F249-V351 HydrophobicContact CE2-CB 4.08Å
250	L	98.7	Very high	97.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-34.9	179.9	-70.5	166.8	0	0	0	112.3	V235 F239 F242 H246 V247 V253 H254 I262 V264 Y297 V298	V235-L250 HydrophobicContact CG2-CD2 4.01Å; F239-L250 HydrophobicContact CE1-CD1 4.35Å; F242-L250 HydrophobicContact CE2-CD1 3.81Å; F242-L250 HydrophobicContact CZ-CD1 3.87Å; H246-L250 WeakPolarHBondContact O-CB 3.43Å; H246-L250 VanDerWaalsContact O-CG 3.27Å; H246-L250 WeakPolarHBondContact O-CG 3.44Å; H246-L250 PolarHBondContact O-N 3.25Å; V247-L250 PolarHBondContact O-N 2.82Å; L250-V253 PolarHBondContact O-N 3.27Å; L250-H254 VanDerWaalsContact O-CB 3.26Å; L250-H254 WeakPolarHBondContact O-CB 3.28Å; L250-H254 PolarHBondContact O-N 2.93Å; L250-I262 HydrophobicContact CD2-CG2 4.01Å; L250-V264 HydrophobicContact CD2-CG2 4.03Å; L250-Y297 HydrophobicContact CB-CD2 4.17Å; L250-V298 HydrophobicContact CD1-CG2 3.9Å; L250-V298 HydrophobicContact CD2-CG2 4.39Å
251	E	98.6	Very high	97.9	Very high	39 Å²	39	39.6 Å²	39.6	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-42	172.6	-174.2	-172	166.6	0	0	111.4	K98 V247 F249 K255 Y297	K98-E251 WeakPolarHBondContact CE-OE2 3.44Å; K98-E251 IonicContact NZ-OE2 3.57Å; K98-E251 PolarHBondContact NZ-OE2 3.07Å; V247-E251 VanDerWaalsContact O-CB 3.29Å; V247-E251 WeakPolarHBondContact O-CB 3.38Å; V247-E251 PolarHBondContact O-N 3.28Å; F249-E251 VanDerWaalsContact C-N 3.33Å; F249-E251 PolarHBondContact O-N 3.09Å; E251-K255 WeakPolarHBondContact O-CD 3.33Å; E251-K255 WeakPolarHBondContact O-CG 3.36Å; E251-K255 PolarHBondContact O-N 3.44Å; E251-K255 IonicContact OE1-NZ 2.66Å; E251-K255 PolarHBondContact OE1-NZ 3.48Å; E251-Y297 HydrophobicContact CB-CD2 4.17Å; E251-Y297 HydrophobicContact CB-CE2 3.61Å; E251-Y297 HydrophobicContact CG-CE1 4.39Å; E251-Y297 HydrophobicContact CG-CE2 4.09Å
252	A	98.4	Very high	98	Very high	22 Å²	22	39.3 Å²	39.3	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-68.1	-40.6	176.1	0	0	0	0	0	111.9	D248 F249 K255 V351	D248-A252 WeakPolarHBondContact O-CB 3.27Å; D248-A252 PolarHBondContact O-N 3.2Å; F249-A252 PolarHBondContact O-N 2.66Å; A252-K255 PolarHBondContact O-N 3.42Å; A252-V351 HydrophobicContact CB-CG1 3.53Å
253	V	98.4	Very high	98	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.1	-41.4	174.2	174.2	0	0	0	0	111.4	I233 V235 F249 L250 K255 L256 I262 C323 V351	I233-V253 HydrophobicContact CB-CG1 4.38Å; I233-V253 HydrophobicContact CD1-CG1 4.22Å; I233-V253 HydrophobicContact CG2-CG1 3.57Å; V235-V253 HydrophobicContact CG1-CG1 4.21Å; V235-V253 HydrophobicContact CG1-CG2 4.33Å; F249-V253 HydrophobicContact CD2-CG2 4.07Å; F249-V253 HydrophobicContact CE1-CG2 4.28Å; F249-V253 HydrophobicContact CE2-CG2 3.68Å; F249-V253 HydrophobicContact CZ-CG2 3.8Å; F249-V253 VanDerWaalsContact O-CG2 3.28Å; F249-V253 WeakPolarHBondContact O-CG2 3.47Å; F249-V253 PolarHBondContact O-N 2.94Å; L250-V253 PolarHBondContact O-N 3.27Å; V253-K255 PolarHBondContact O-N 3.26Å; V253-L256 WeakPolarHBondContact O-CB 3.44Å; V253-L256 WeakPolarHBondContact O-CG 3.17Å; V253-L256 PolarHBondContact O-N 3Å; V253-L256 VanDerWaalsContact O-N 3.1Å; V253-I262 HydrophobicContact CB-CD1 4.3Å; V253-I262 HydrophobicContact CG1-CD1 3.81Å; V253-I262 HydrophobicContact CG1-CG1 4.14Å; V253-C323 HydrophobicContact CG1-CB 4.3Å; V253-C323 HydrophobicContact CG2-CB 3.78Å; V253-V351 HydrophobicContact CG2-CB 4.35Å; V253-V351 HydrophobicContact CG2-CG1 4.23Å; V253-V351 HydrophobicContact CG2-CG2 4.08Å
254	H	98.3	Very high	98.1	Very high	65 Å²	65	38.4 Å²	38.4	30%	0.301	19%	0.19	S	C	.	.	H	α-helix	trans	-64.4	-17.7	176.3	-171	-62.4	0	0	0	113	L250 L256 P260 I262 Y297	L250-H254 VanDerWaalsContact O-CB 3.26Å; L250-H254 WeakPolarHBondContact O-CB 3.28Å; L250-H254 PolarHBondContact O-N 2.93Å; H254-L256 VanDerWaalsContact C-N 3.34Å; H254-P260 HydrophobicContact CB-CG 4.32Å; H254-P260 WeakPolarHBondContact ND1-CG 3.47Å; H254-I262 HydrophobicContact CB-CD1 3.81Å; H254-Y297 HydrophobicContact CB-CD1 4.09Å; H254-Y297 HydrophobicContact CB-CG 4.41Å; H254-Y297 AromaticContact CD2-CD1 3.57Å; H254-Y297 AromaticContact CG-CD1 3.85Å
255	K	97.9	Very high	98.2	Very high	145 Å²	145	38 Å²	38	63%	0.63	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	2	176.1	-69.3	166.2	-172.2	172.7	0	113.5	E251 A252 V253	E251-K255 WeakPolarHBondContact O-CD 3.33Å; E251-K255 WeakPolarHBondContact O-CG 3.36Å; E251-K255 PolarHBondContact O-N 3.44Å; E251-K255 IonicContact OE1-NZ 2.66Å; E251-K255 PolarHBondContact OE1-NZ 3.48Å; A252-K255 PolarHBondContact O-N 3.42Å; V253-K255 PolarHBondContact O-N 3.26Å
256	L	97.4	Very high	98.2	Very high	87 Å²	87	37.6 Å²	37.6	46%	0.455	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.8	179.9	-58.9	178.7	0	0	0	114.2	V253 H254 L321 C323 V351	V253-L256 WeakPolarHBondContact O-CB 3.44Å; V253-L256 WeakPolarHBondContact O-CG 3.17Å; V253-L256 PolarHBondContact O-N 3Å; V253-L256 VanDerWaalsContact O-N 3.1Å; H254-L256 VanDerWaalsContact C-N 3.34Å; L256-L321 HydrophobicContact CB-CD2 4.36Å; L256-L321 HydrophobicContact CD1-CD2 3.91Å; L256-C323 VanDerWaalsContact CD1-SG 3.59Å; L256-V351 HydrophobicContact CD1-CG2 3.88Å
257	A	97.3	Very high	98.2	Very high	23 Å²	23	36.6 Å²	36.6	19%	0.19	18%	0.179	C	C	.	.	S	Bend	trans	-143.1	155.6	-179.9	0	0	0	0	0	111	T231 I233 P260	T231-A257 HydrophobicContact CG2-CB 4.09Å; I233-A257 HydrophobicContact CD1-CB 4.41Å; A257-P260 HydrophobicContact CB-CB 4.32Å
258	E	96	Very high	97.9	Very high	186 Å²	186	41.6 Å²	41.6	87%	0.869	20%	0.201	S	C	*	.	S	Bend	trans	-69.1	-36.4	175.2	-170.5	-173.9	150.4	0	0	111.8
259	K	97.3	Very high	97.6	Very high	104 Å²	104	41.5 Å²	41.5	45%	0.452	20%	0.2	S	C	.	.	S	Bend	trans	-128.8	78.4	178.1	-63.2	-176.5	-175.6	175.2	0	110.6	D230 T231	D230-K259 CarbonylContact C-O 3.45Å; D230-K259 WeakPolarHBondContact CA-O 3.32Å; T231-K259 PolarHBondContact N-O 3.42Å
260	P	97.9	Very high	97.2	Very high	24 Å²	24	46.7 Å²	46.7	16%	0.156	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	120.3	-176.7	31.6	-34.2	0	0	0	111.6	I233 H254 A257 I262	I233-P260 HydrophobicContact CD1-CB 4.01Å; H254-P260 HydrophobicContact CB-CG 4.32Å; H254-P260 WeakPolarHBondContact ND1-CG 3.47Å; A257-P260 HydrophobicContact CB-CB 4.32Å; P260-I262 HydrophobicContact CB-CD1 4.41Å; P260-I262 HydrophobicContact CB-CG1 4.28Å
261	Y	98.4	Very high	96.9	Very high	18 Å²	18	47.8 Å²	47.8	7%	0.071	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	93.5	166.6	-169.4	-80.1	0	0	0	108.7	Q224 P226 T231 I232 I233 I263 A299 E300	Q224-Y261 WeakPolarHBondContact O-CE2 3.38Å; Q224-Y261 PolarHBondContact O-OH 2.89Å; P226-Y261 HydrophobicContact CB-CD1 4.44Å; P226-Y261 HydrophobicContact CB-CD2 4.03Å; P226-Y261 HydrophobicContact CB-CE2 4.23Å; P226-Y261 HydrophobicContact CB-CG 4.15Å; P226-Y261 HydrophobicContact CG-CD1 3.88Å; P226-Y261 HydrophobicContact CG-CD2 4.03Å; P226-Y261 HydrophobicContact CG-CE1 3.69Å; P226-Y261 HydrophobicContact CG-CE2 3.84Å; P226-Y261 HydrophobicContact CG-CG 4.05Å; T231-Y261 PolarHBondContact O-N 3.05Å; I232-Y261 HydrophobicContact CG2-CD1 4.48Å; I233-Y261 PolarHBondContact N-O 2.96Å; Y261-I263 HydrophobicContact CD1-CD1 4.18Å; Y261-I263 HydrophobicContact CD1-CG1 3.76Å; Y261-I263 HydrophobicContact CE1-CD1 3.98Å; Y261-I263 HydrophobicContact CE1-CG1 3.64Å; Y261-A299 HydrophobicContact CD1-CB 3.96Å; Y261-A299 HydrophobicContact CD2-CB 3.74Å; Y261-A299 HydrophobicContact CE1-CB 3.87Å; Y261-A299 HydrophobicContact CE2-CB 3.66Å; Y261-A299 HydrophobicContact CG-CB 3.89Å; Y261-E300 HydrophobicContact CE1-CB 4.16Å
262	I	98.7	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.3	-175.2	-63.7	168.4	0	0	0	111	I233 V235 L250 V253 H254 P260 V264 Y297 A299 E300	I233-I262 HydrophobicContact CB-CG1 4.24Å; I233-I262 HydrophobicContact CD1-CG1 4.48Å; I233-I262 WeakPolarHBondContact O-CA 3.38Å; V235-I262 HydrophobicContact CG2-CG2 4.32Å; L250-I262 HydrophobicContact CD2-CG2 4.01Å; V253-I262 HydrophobicContact CB-CD1 4.3Å; V253-I262 HydrophobicContact CG1-CD1 3.81Å; V253-I262 HydrophobicContact CG1-CG1 4.14Å; H254-I262 HydrophobicContact CB-CD1 3.81Å; P260-I262 HydrophobicContact CB-CD1 4.41Å; P260-I262 HydrophobicContact CB-CG1 4.28Å; I262-V264 HydrophobicContact CG2-CG2 4.1Å; I262-Y297 WeakPolarHBondContact CB-O 3.45Å; I262-Y297 WeakPolarHBondContact CD1-O 3.22Å; I262-A299 WeakPolarHBondContact O-CB 3.47Å; I262-A299 PolarHBondContact O-N 3.34Å; I262-E300 PolarHBondContact O-N 3.03Å
263	I	98.7	Very high	96.3	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.9	173.8	-56	180	0	0	0	108.8	I232 I233 Y234 V235 Y261 E300 V302 F317	I232-I263 HydrophobicContact CG2-CD1 3.62Å; I232-I263 HydrophobicContact CG2-CG1 4.28Å; I233-I263 PolarHBondContact O-N 3.45Å; Y234-I263 WeakPolarHBondContact CA-O 3.31Å; Y234-I263 HydrophobicContact CD2-CB 4.12Å; Y234-I263 HydrophobicContact CD2-CG2 3.89Å; Y234-I263 HydrophobicContact CE2-CG2 4.27Å; V235-I263 PolarHBondContact N-O 2.99Å; Y261-I263 HydrophobicContact CD1-CD1 4.18Å; Y261-I263 HydrophobicContact CD1-CG1 3.76Å; Y261-I263 HydrophobicContact CE1-CD1 3.98Å; Y261-I263 HydrophobicContact CE1-CG1 3.64Å; I263-E300 WeakPolarHBondContact CA-O 3.26Å; I263-V302 HydrophobicContact CG2-CG2 3.68Å; I263-F317 HydrophobicContact CD1-CB 3.89Å; I263-F317 HydrophobicContact CD1-CD1 3.88Å; I263-F317 HydrophobicContact CD1-CG 3.99Å
264	V	98.8	Very high	96	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	112.4	179.1	-176.7	0	0	0	0	111.5	V235 F239 L250 I262 L266 V292 V298 E300 V301 V302	V235-V264 HydrophobicContact CG2-CB 4.25Å; V235-V264 HydrophobicContact CG2-CG1 4.24Å; V235-V264 HydrophobicContact CG2-CG2 3.76Å; V235-V264 CarbonylContact O-C 3.57Å; V235-V264 WeakPolarHBondContact O-CA 3.48Å; F239-V264 HydrophobicContact CD1-CG1 4.41Å; F239-V264 HydrophobicContact CD2-CG1 3.7Å; F239-V264 HydrophobicContact CE1-CG1 4.15Å; F239-V264 HydrophobicContact CE2-CG1 3.39Å; F239-V264 HydrophobicContact CG-CG1 4.21Å; F239-V264 HydrophobicContact CZ-CG1 3.64Å; L250-V264 HydrophobicContact CD2-CG2 4.03Å; I262-V264 HydrophobicContact CG2-CG2 4.1Å; V264-L266 HydrophobicContact CG1-CD2 4.06Å; V264-V292 HydrophobicContact CB-CG1 3.85Å; V264-V292 HydrophobicContact CG1-CG1 3.82Å; V264-V292 HydrophobicContact CG2-CG1 3.96Å; V264-V298 HydrophobicContact CG2-CB 4.46Å; V264-V298 HydrophobicContact CG2-CG1 3.91Å; V264-V298 HydrophobicContact CG2-CG2 3.74Å; V264-E300 PolarHBondContact N-O 3.38Å; V264-V301 HydrophobicContact CB-CG2 4.31Å; V264-V301 CarbonylContact O-C 3.56Å; V264-V301 VanDerWaalsContact O-CA 3.3Å; V264-V301 WeakPolarHBondContact O-CA 3.26Å; V264-V302 PolarHBondContact O-N 3.02Å
265	G	98.6	Very high	95.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.2	172.1	0	0	0	0	0	112.9	V235 A236 G237	V235-G265 PolarHBondContact O-N 2.94Å; A236-G265 WeakPolarHBondContact CA-O 3.24Å; G237-G265 PolarHBondContact N-O 3.45Å
266	L	98.5	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	110.4	176.9	-63.9	-174.8	0	0	0	111	F239 V264 V285 R288 V292 V301 V302 G304 A305	F239-L266 HydrophobicContact CB-CD2 3.74Å; F239-L266 HydrophobicContact CD2-CD2 3.64Å; F239-L266 HydrophobicContact CG-CD2 3.99Å; V264-L266 HydrophobicContact CG1-CD2 4.06Å; L266-V285 HydrophobicContact CB-CG2 4.32Å; L266-R288 HydrophobicContact CD1-CB 4.11Å; L266-V292 HydrophobicContact CD2-CG2 4.2Å; L266-V301 HydrophobicContact CD1-CG1 3.58Å; L266-V301 HydrophobicContact CG-CG1 3.82Å; L266-V302 PolarHBondContact N-O 3.12Å; L266-G304 CarbonylContact O-C 3.49Å; L266-G304 VanDerWaalsContact O-CA 3.26Å; L266-G304 WeakPolarHBondContact O-CA 3.39Å; L266-G304 PolarHBondContact O-N 3.5Å; L266-A305 PolarHBondContact O-N 3.32Å
267	H	97.5	Very high	94.4	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.046	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	143.6	174.4	-60.5	170.8	0	0	0	110.6	G237 E271 V272 Y275 R288 F307	G237-H267 PolarHBondContact O-N 3.1Å; H267-E271 HydrophobicContact CB-CB 4.4Å; H267-E271 HydrophobicContact CB-CG 4.47Å; H267-V272 HydrophobicContact CB-CG2 3.92Å; H267-Y275 AromaticContact ND1-CE1 3.63Å; H267-Y275 AromaticContact ND1-CZ 3.71Å; H267-Y275 PolarHBondContact ND1-OH 3.12Å; H267-Y275 VanDerWaalsContact ND1-OH 3.15Å; H267-R288 PolarHBondContact O-NH1 2.78Å; H267-R288 PolarHBondContact O-NH2 3.42Å; H267-F307 AromaticContact CE1-CD2 3.61Å; H267-F307 AromaticContact CE1-CE2 3.99Å; H267-F307 AromaticContact ND1-CD2 3.66Å
268	F	93.6	Very high	93.7	Very high	105 Å²	105	52.7 Å²	52.7	46%	0.461	23%	0.231	S	C	.	.			trans	-58.8	153.7	173.7	-79.1	-73.7	0	0	0	112.6	Q270 E271 V272 G304	F268-Q270 VanDerWaalsContact C-N 3.32Å; F268-Q270 PolarHBondContact O-N 3.01Å; F268-E271 HydrophobicContact CB-CB 4.4Å; F268-E271 WeakPolarHBondContact O-CA 3.21Å; F268-E271 WeakPolarHBondContact O-CB 3.44Å; F268-E271 PolarHBondContact O-N 3.33Å; F268-V272 WeakPolarHBondContact O-CG2 3.48Å; F268-V272 PolarHBondContact O-N 2.96Å; F268-G304 VanDerWaalsContact CE2-CA 3.43Å; F268-G304 WeakPolarHBondContact CE2-O 3.26Å; F268-G304 VanDerWaalsContact CZ-CA 3.46Å
269	D	92	Very high	93	Very high	18 Å²	18	46.9 Å²	46.9	10%	0.096	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-38.8	-175.1	-63.4	-41.8	0	0	0	112.9	T205 E271 V272 N273 P281 N284 V285 R288	T205-D269 HydrophobicContact CG2-CB 4.48Å; D269-E271 VanDerWaalsContact C-N 3.29Å; D269-E271 PolarHBondContact O-N 3.49Å; D269-V272 PolarHBondContact O-N 2.84Å; D269-N273 WeakPolarHBondContact O-CB 3.29Å; D269-N273 PolarHBondContact O-N 2.89Å; D269-P281 HydrophobicContact CB-CG 3.97Å; D269-P281 WeakPolarHBondContact O-CD 3.24Å; D269-P281 WeakPolarHBondContact OD1-CG 3.25Å; D269-N284 WeakPolarHBondContact OD1-CA 3.45Å; D269-V285 VanDerWaalsContact CG-N 3.33Å; D269-V285 PolarHBondContact OD1-N 2.97Å; D269-V285 PolarHBondContact OD2-N 3.43Å; D269-R288 IonicContact OD1-CZ 2.69Å; D269-R288 IonicContact OD1-NE 2.71Å; D269-R288 IonicContact OD1-NH2 3.65Å; D269-R288 PolarHBondContact OD1-NH2 3.15Å
270	Q	89.4	Confident	92.6	Very high	132 Å²	132	42 Å²	42	62%	0.617	19%	0.185	S	C	*	.	H	α-helix	trans	-64.6	-34.7	174.8	-57.3	82	-4.3	0	0	111.9	F268 N273 R274	F268-Q270 VanDerWaalsContact C-N 3.32Å; F268-Q270 PolarHBondContact O-N 3.01Å; Q270-N273 PolarHBondContact O-N 2.85Å; Q270-R274 PolarHBondContact O-N 3.31Å
271	E	92.9	Very high	92.3	Very high	23 Å²	23	41.5 Å²	41.5	11%	0.107	18%	0.182	C	C	.	.	H	α-helix	trans	-73.8	-44.2	178.9	-166.1	58.2	-135.5	0	0	110.8	H267 F268 D269 N273 R274 Y275 F307 K333	H267-E271 HydrophobicContact CB-CB 4.4Å; H267-E271 HydrophobicContact CB-CG 4.47Å; F268-E271 HydrophobicContact CB-CB 4.4Å; F268-E271 WeakPolarHBondContact O-CA 3.21Å; F268-E271 WeakPolarHBondContact O-CB 3.44Å; F268-E271 PolarHBondContact O-N 3.33Å; D269-E271 VanDerWaalsContact C-N 3.29Å; D269-E271 PolarHBondContact O-N 3.49Å; E271-N273 VanDerWaalsContact C-N 3.27Å; E271-N273 PolarHBondContact O-N 2.99Å; E271-R274 WeakPolarHBondContact O-CB 3.48Å; E271-R274 PolarHBondContact O-N 3.34Å; E271-R274 VanDerWaalsContact O-N 3.15Å; E271-R274 IonicContact OE1-CZ 3.73Å; E271-R274 IonicContact OE1-NE 2.75Å; E271-R274 PolarHBondContact OE1-NE 3.12Å; E271-R274 IonicContact OE1-NH2 3.33Å; E271-R274 PolarHBondContact OE1-NH2 3.19Å; E271-Y275 HydrophobicContact CG-CE1 4.48Å; E271-Y275 WeakPolarHBondContact O-CD1 3.27Å; E271-Y275 VanDerWaalsContact O-CE1 3.27Å; E271-Y275 WeakPolarHBondContact O-CE1 3.46Å; E271-Y275 PolarHBondContact O-N 3.12Å; E271-F307 HydrophobicContact CG-CB 3.97Å; E271-F307 HydrophobicContact CG-CD2 3.97Å; E271-F307 HydrophobicContact CG-CG 4.33Å; E271-K333 WeakPolarHBondContact OE1-CE 3.29Å; E271-K333 IonicContact OE1-NZ 2.66Å; E271-K333 WeakPolarHBondContact OE2-CE 3.44Å; E271-K333 IonicContact OE2-NZ 3.6Å; E271-K333 PolarHBondContact OE2-NZ 2.97Å
272	V	93.5	Very high	91.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-43.3	170.8	-178.7	0	0	0	0	110.3	A238 H267 F268 D269 R274 Y275 K276 P281	A238-V272 HydrophobicContact CB-CG1 3.93Å; A238-V272 HydrophobicContact CB-CG2 4.02Å; H267-V272 HydrophobicContact CB-CG2 3.92Å; F268-V272 WeakPolarHBondContact O-CG2 3.48Å; F268-V272 PolarHBondContact O-N 2.96Å; D269-V272 PolarHBondContact O-N 2.84Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 3.17Å; V272-Y275 HydrophobicContact CB-CE1 4.5Å; V272-Y275 HydrophobicContact CG2-CE1 4.49Å; V272-Y275 PolarHBondContact O-N 2.8Å; V272-K276 HydrophobicContact CG1-CB 4.34Å; V272-K276 HydrophobicContact CG1-CG 4.18Å; V272-K276 VanDerWaalsContact O-CB 3.31Å; V272-K276 WeakPolarHBondContact O-CB 3.5Å; V272-K276 PolarHBondContact O-N 3.16Å; V272-P281 HydrophobicContact CB-CB 4.44Å; V272-P281 HydrophobicContact CB-CG 4.24Å; V272-P281 HydrophobicContact CG1-CB 3.95Å; V272-P281 HydrophobicContact CG1-CG 4.27Å
273	N	91.2	Very high	91.6	Very high	30 Å²	30	41.2 Å²	41.2	16%	0.16	18%	0.181	C	C	.	.	H	α-helix	trans	-60.4	-39.5	176.4	-165.9	-93.3	0	0	0	112.8	D269 Q270 E271 Y275 R277 K278 Y280	D269-N273 WeakPolarHBondContact O-CB 3.29Å; D269-N273 PolarHBondContact O-N 2.89Å; Q270-N273 PolarHBondContact O-N 2.85Å; E271-N273 VanDerWaalsContact C-N 3.27Å; E271-N273 PolarHBondContact O-N 2.99Å; N273-Y275 PolarHBondContact O-N 3.39Å; N273-R277 WeakPolarHBondContact O-CA 3.38Å; N273-R277 PolarHBondContact O-N 2.79Å; N273-K278 PolarHBondContact ND2-O 3.36Å; N273-Y280 WeakPolarHBondContact CA-O 3.4Å; N273-Y280 WeakPolarHBondContact CB-O 3.27Å; N273-Y280 PolarHBondContact ND2-O 2.93Å
274	R	91.1	Very high	91.4	Very high	81 Å²	81	42.3 Å²	42.3	31%	0.306	19%	0.187	S	C	.	.	H	α-helix	trans	-53.8	-52.3	177.4	-178.1	-174.8	63.9	98.4	-2.1	112.2	Q270 E271 V272 P331 D332	Q270-R274 PolarHBondContact O-N 3.31Å; E271-R274 WeakPolarHBondContact O-CB 3.48Å; E271-R274 PolarHBondContact O-N 3.34Å; E271-R274 VanDerWaalsContact O-N 3.15Å; E271-R274 IonicContact OE1-CZ 3.73Å; E271-R274 IonicContact OE1-NE 2.75Å; E271-R274 PolarHBondContact OE1-NE 3.12Å; E271-R274 IonicContact OE1-NH2 3.33Å; E271-R274 PolarHBondContact OE1-NH2 3.19Å; V272-R274 VanDerWaalsContact C-N 3.35Å; V272-R274 PolarHBondContact O-N 3.17Å; R274-P331 PolarHBondContact NH1-O 3.19Å; R274-P331 VanDerWaalsContact NH1-O 3.09Å; R274-D332 IonicContact NH2-OD1 3.07Å
275	Y	90.4	Very high	91.2	Very high	32 Å²	32	42.6 Å²	42.6	13%	0.125	19%	0.189	C	C	.	.	H	α-helix	trans	-91.1	-30.8	-173.3	65.6	-96.7	0	0	0	113.9	A238 H267 E271 V272 N273 F307 Y330	A238-Y275 WeakPolarHBondContact CB-OH 3.38Å; A238-Y275 PolarHBondContact N-OH 3.29Å; H267-Y275 AromaticContact ND1-CE1 3.63Å; H267-Y275 AromaticContact ND1-CZ 3.71Å; H267-Y275 PolarHBondContact ND1-OH 3.12Å; H267-Y275 VanDerWaalsContact ND1-OH 3.15Å; E271-Y275 HydrophobicContact CG-CE1 4.48Å; E271-Y275 WeakPolarHBondContact O-CD1 3.27Å; E271-Y275 VanDerWaalsContact O-CE1 3.27Å; E271-Y275 WeakPolarHBondContact O-CE1 3.46Å; E271-Y275 PolarHBondContact O-N 3.12Å; V272-Y275 HydrophobicContact CB-CE1 4.5Å; V272-Y275 HydrophobicContact CG2-CE1 4.49Å; V272-Y275 PolarHBondContact O-N 2.8Å; N273-Y275 PolarHBondContact O-N 3.39Å; Y275-F307 AromaticContact CD1-CD2 4Å; Y275-F307 HydrophobicContact CD1-CD2 4Å; Y275-F307 AromaticContact CD1-CE2 3.49Å; Y275-F307 HydrophobicContact CD1-CE2 3.49Å; Y275-F307 VanDerWaalsContact CD1-CE2 3.49Å; Y275-F307 HydrophobicContact CD1-CZ 4.46Å; Y275-F307 AromaticContact CE1-CD2 3.89Å; Y275-F307 HydrophobicContact CE1-CD2 3.89Å; Y275-F307 AromaticContact CE1-CE2 3.62Å; Y275-F307 HydrophobicContact CE1-CE2 3.62Å; Y275-F307 HydrophobicContact CG-CE2 4.17Å; Y275-Y330 AromaticContact CD2-CD2 3.6Å; Y275-Y330 HydrophobicContact CD2-CD2 3.6Å; Y275-Y330 AromaticContact CD2-CE2 3.93Å; Y275-Y330 HydrophobicContact CD2-CE2 3.93Å; Y275-Y330 HydrophobicContact CE2-CD2 4.46Å; Y275-Y330 HydrophobicContact CG-CD2 4.06Å
276	K	87.1	Confident	91	Very high	50 Å²	50	46.3 Å²	46.3	22%	0.217	21%	0.206	C	C	.	.	H	α-helix	trans	-85.6	-22.4	174.7	-78.3	-62.9	-161.6	171.8	0	114.8	V272 Y280 D360	V272-K276 HydrophobicContact CG1-CB 4.34Å; V272-K276 HydrophobicContact CG1-CG 4.18Å; V272-K276 VanDerWaalsContact O-CB 3.31Å; V272-K276 WeakPolarHBondContact O-CB 3.5Å; V272-K276 PolarHBondContact O-N 3.16Å; K276-Y280 HydrophobicContact CB-CD2 3.7Å; K276-Y280 HydrophobicContact CB-CG 4.01Å; K276-Y280 HydrophobicContact CG-CD2 4.49Å; K276-D360 IonicContact NZ-OD2 2.68Å; K276-D360 PolarHBondContact NZ-OD2 3.31Å
277	R	84.6	Confident	90.8	Very high	186 Å²	186	46.3 Å²	46.3	70%	0.702	21%	0.206	S	C	*	.			trans	56.6	-161.2	-177.3	-52.8	177.4	-177.7	166.4	0.8	111.7	N273 Y280	N273-R277 WeakPolarHBondContact O-CA 3.38Å; N273-R277 PolarHBondContact O-N 2.79Å; R277-Y280 WeakPolarHBondContact O-CB 3.23Å; R277-Y280 WeakPolarHBondContact O-CD2 3.42Å; R277-Y280 PolarHBondContact O-N 3.2Å
278	K	81.6	Confident	90.8	Very high	104 Å²	104	45.8 Å²	45.8	45%	0.452	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	-148.4	-175	-46.7	172	-164.5	167	0	109.7	M176 W204 N273 Y280 D360	M176-K278 HydrophobicContact CE-CB 3.56Å; M176-K278 HydrophobicContact CE-CD 4.03Å; M176-K278 HydrophobicContact CE-CG 4.45Å; M176-K278 HydrophobicContact SD-CB 4.32Å; W204-K278 WeakPolarHBondContact CZ3-O 3.5Å; N273-K278 PolarHBondContact ND2-O 3.36Å; K278-Y280 VanDerWaalsContact C-N 3.33Å; K278-Y280 HydrophobicContact CB-CD2 4.23Å; K278-Y280 HydrophobicContact CD-CD2 4.19Å; K278-Y280 HydrophobicContact CD-CE2 3.78Å; K278-D360 IonicContact NZ-OD1 2.77Å; K278-D360 PolarHBondContact NZ-OD1 2.94Å
279	N	81.9	Confident	91	Very high	65 Å²	65	40.8 Å²	40.8	35%	0.348	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	32.9	173.7	-26.7	-32.6	0	0	0	111	L175 M176	L175-N279 PolarHBondContact O-ND2 2.72Å; M176-N279 HydrophobicContact SD-CB 3.48Å; M176-N279 WeakPolarHBondContact SD-CB 3.43Å; M176-N279 PolarHBondContact SD-N 3.26Å
280	Y	87.3	Confident	91.3	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.008	18%	0.178	C	C	.	.			trans	-75.4	150.8	172.9	-75.4	-61.6	0	0	0	111.1	M176 D240 N273 K276 R277 K278 I282 D360 V363	M176-Y280 HydrophobicContact CE-CD1 3.63Å; M176-Y280 HydrophobicContact CE-CD2 3.58Å; M176-Y280 HydrophobicContact CE-CE1 3.65Å; M176-Y280 HydrophobicContact CE-CE2 3.66Å; M176-Y280 HydrophobicContact CE-CG 3.59Å; D240-Y280 WeakPolarHBondContact OD2-CD1 3.39Å; N273-Y280 WeakPolarHBondContact CA-O 3.4Å; N273-Y280 WeakPolarHBondContact CB-O 3.27Å; N273-Y280 PolarHBondContact ND2-O 2.93Å; K276-Y280 HydrophobicContact CB-CD2 3.7Å; K276-Y280 HydrophobicContact CB-CG 4.01Å; K276-Y280 HydrophobicContact CG-CD2 4.49Å; R277-Y280 WeakPolarHBondContact O-CB 3.23Å; R277-Y280 WeakPolarHBondContact O-CD2 3.42Å; R277-Y280 PolarHBondContact O-N 3.2Å; K278-Y280 VanDerWaalsContact C-N 3.33Å; K278-Y280 HydrophobicContact CB-CD2 4.23Å; K278-Y280 HydrophobicContact CD-CD2 4.19Å; K278-Y280 HydrophobicContact CD-CE2 3.78Å; Y280-I282 HydrophobicContact CD1-CD1 4.05Å; Y280-I282 HydrophobicContact CD1-CG1 3.9Å; Y280-I282 HydrophobicContact CE1-CD1 4.13Å; Y280-I282 HydrophobicContact CE1-CG1 3.9Å; Y280-D360 VanDerWaalsContact CE2-OD1 3.24Å; Y280-D360 WeakPolarHBondContact CE2-OD1 3.37Å; Y280-D360 VanDerWaalsContact OH-CA 3.3Å; Y280-D360 WeakPolarHBondContact OH-CA 3.41Å; Y280-D360 PolarHBondContact OH-OD1 3.16Å; Y280-V363 HydrophobicContact CE1-CG2 4.48Å
281	P	92.3	Very high	91.7	Very high	13 Å²	13	34.1 Å²	34.1	8%	0.084	15%	0.15	C	C	.	.			cis	-80.2	154.1	-1.5	31.8	-31.2	0	0	0	113.1	D240 D269 V272 M283	D240-P281 HydrophobicContact CB-CB 3.96Å; D240-P281 VanDerWaalsContact CG-CB 3.49Å; D240-P281 VanDerWaalsContact OD2-CA 3.29Å; D240-P281 WeakPolarHBondContact OD2-CA 3.41Å; D269-P281 HydrophobicContact CB-CG 3.97Å; D269-P281 WeakPolarHBondContact O-CD 3.24Å; D269-P281 WeakPolarHBondContact OD1-CG 3.25Å; V272-P281 HydrophobicContact CB-CB 4.44Å; V272-P281 HydrophobicContact CB-CG 4.24Å; V272-P281 HydrophobicContact CG1-CB 3.95Å; V272-P281 HydrophobicContact CG1-CG 4.27Å; P281-M283 WeakPolarHBondContact CB-O 3.49Å; P281-M283 WeakPolarHBondContact CG-O 3.31Å
282	I	90.8	Very high	91.9	Very high	9 Å²	9	33 Å²	33	5%	0.046	15%	0.145	C	C	.	.	S	Bend	trans	-72	-34.6	176.3	-54.7	-57.7	0	0	0	111.1	L169 R172 M173 M176 D240 L241 Y280	L169-I282 HydrophobicContact CD2-CG2 4.45Å; R172-I282 HydrophobicContact CB-CG2 3.73Å; R172-I282 VanDerWaalsContact CD-O 3.24Å; R172-I282 WeakPolarHBondContact CD-O 3.26Å; R172-I282 PolarHBondContact NH1-O 2.72Å; M173-I282 HydrophobicContact CE-CG2 4.43Å; M173-I282 HydrophobicContact CG-CD1 4.07Å; M173-I282 HydrophobicContact CG-CG1 4.04Å; M173-I282 HydrophobicContact CG-CG2 3.93Å; M176-I282 HydrophobicContact CE-CD1 3.89Å; M176-I282 HydrophobicContact CG-CD1 3.82Å; M176-I282 HydrophobicContact SD-CD1 3.73Å; D240-I282 VanDerWaalsContact CG-N 3.32Å; D240-I282 PolarHBondContact OD1-N 2.86Å; D240-I282 PolarHBondContact OD2-N 2.86Å; L241-I282 HydrophobicContact CD1-CB 4.31Å; L241-I282 HydrophobicContact CD1-CG1 4.07Å; L241-I282 HydrophobicContact CD2-CB 3.91Å; L241-I282 HydrophobicContact CD2-CG2 3.78Å; L241-I282 HydrophobicContact CG-CB 4.01Å; L241-I282 HydrophobicContact CG-CG1 4.27Å; L241-I282 HydrophobicContact CG-CG2 4.38Å; Y280-I282 HydrophobicContact CD1-CD1 4.05Å; Y280-I282 HydrophobicContact CD1-CG1 3.9Å; Y280-I282 HydrophobicContact CE1-CD1 4.13Å; Y280-I282 HydrophobicContact CE1-CG1 3.9Å
283	M	92.7	Very high	92.2	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.015	15%	0.146	C	C	.	.	S	Bend	trans	-105	129.8	170.9	-70.1	178.9	174.5	0	0	110.4	H55 L169 D240 L241 P281 E287 R288	H55-M283 HydrophobicContact CB-CE 3.81Å; L169-M283 HydrophobicContact CD1-CE 3.52Å; L169-M283 HydrophobicContact CD2-CE 3.71Å; L169-M283 HydrophobicContact CD2-CG 4.08Å; L169-M283 HydrophobicContact CG-CE 4.29Å; D240-M283 PolarHBondContact OD1-N 2.92Å; L241-M283 HydrophobicContact CD2-CE 4.06Å; L241-M283 HydrophobicContact CD2-CG 4.26Å; L241-M283 HydrophobicContact CD2-SD 4.43Å; P281-M283 WeakPolarHBondContact CB-O 3.49Å; P281-M283 WeakPolarHBondContact CG-O 3.31Å; M283-E287 WeakPolarHBondContact CA-OE2 3.41Å; M283-E287 HydrophobicContact CB-CB 3.9Å; M283-E287 HydrophobicContact CG-CB 4.34Å; M283-R288 HydrophobicContact CB-CG 3.62Å; M283-R288 WeakPolarHBondContact O-CD 3.41Å; M283-R288 WeakPolarHBondContact O-CG 3.47Å; M283-R288 PolarHBondContact O-NE 2.91Å
284	N	93.3	Very high	92.5	Very high	25 Å²	25	31.8 Å²	31.8	13%	0.134	14%	0.139	C	C	.	.			trans	-67.9	168	176.1	74.9	37.5	0	0	0	111.7	D269 H286 E287 R288	D269-N284 WeakPolarHBondContact OD1-CA 3.45Å; N284-H286 PolarHBondContact O-N 3.45Å; N284-H286 VanDerWaalsContact O-N 3.08Å; N284-H286 WeakPolarHBondContact OD1-CA 3.34Å; N284-H286 WeakPolarHBondContact OD1-CB 3.46Å; N284-H286 PolarHBondContact OD1-N 3.04Å; N284-E287 PolarHBondContact N-OE2 3Å; N284-E287 PolarHBondContact O-N 3.16Å; N284-E287 VanDerWaalsContact O-N 3.07Å; N284-E287 WeakPolarHBondContact OD1-CG 3.32Å; N284-E287 PolarHBondContact OD1-N 3.21Å; N284-R288 WeakPolarHBondContact O-CG 3.36Å; N284-R288 PolarHBondContact O-N 2.95Å
285	V	94.6	Very high	92.9	Very high	7 Å²	7	28 Å²	28	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-56.8	-31.1	-174.6	71	0	0	0	0	113.2	L266 D269 T289 I303	L266-V285 HydrophobicContact CB-CG2 4.32Å; D269-V285 VanDerWaalsContact CG-N 3.33Å; D269-V285 PolarHBondContact OD1-N 2.97Å; D269-V285 PolarHBondContact OD2-N 3.43Å; V285-T289 WeakPolarHBondContact O-CB 3.3Å; V285-T289 PolarHBondContact O-N 2.86Å; V285-T289 PolarHBondContact O-OG1 3.19Å; V285-I303 HydrophobicContact CG2-CG2 4.1Å
286	H	94.2	Very high	93.2	Very high	77 Å²	77	31.5 Å²	31.5	36%	0.356	14%	0.138	S	C	.	.	H	α-helix	trans	-77.7	-37.7	178.4	-49.5	-54.9	0	0	0	112.8	F210 Q212 N284 T289 L290	F210-H286 HydrophobicContact CD1-CB 4.1Å; F210-H286 HydrophobicContact CE1-CB 3.88Å; Q212-H286 HydrophobicContact CB-CB 3.95Å; Q212-H286 HydrophobicContact CG-CB 4.01Å; N284-H286 PolarHBondContact O-N 3.45Å; N284-H286 VanDerWaalsContact O-N 3.08Å; N284-H286 WeakPolarHBondContact OD1-CA 3.34Å; N284-H286 WeakPolarHBondContact OD1-CB 3.46Å; N284-H286 PolarHBondContact OD1-N 3.04Å; H286-T289 WeakPolarHBondContact O-CB 3.38Å; H286-T289 PolarHBondContact O-N 3.15Å; H286-L290 PolarHBondContact O-N 3.44Å
287	E	95.5	Very high	93.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.4	-39.8	172.4	-66.3	177.2	130.4	0	0	111.3	Y56 R172 S208 F210 M283 N284 S291	Y56-E287 HydrophobicContact CD1-CB 4.17Å; Y56-E287 HydrophobicContact CE1-CB 3.67Å; Y56-E287 HydrophobicContact CE1-CG 3.6Å; Y56-E287 PolarHBondContact OH-OE1 3.44Å; R172-E287 IonicContact CZ-OE1 3.1Å; R172-E287 IonicContact CZ-OE2 3.32Å; R172-E287 IonicContact NH1-OE1 3.18Å; R172-E287 PolarHBondContact NH1-OE1 3.45Å; R172-E287 VanDerWaalsContact NH1-OE1 3.16Å; R172-E287 IonicContact NH1-OE2 2.69Å; R172-E287 PolarHBondContact NH1-OE2 2.94Å; R172-E287 IonicContact NH2-OE1 2.74Å; R172-E287 PolarHBondContact NH2-OE1 3.39Å; R172-E287 IonicContact NH2-OE2 3.09Å; S208-E287 WeakPolarHBondContact CB-OE1 3.46Å; S208-E287 PolarHBondContact OG-OE1 3.04Å; S208-E287 PolarHBondContact OG-OE2 2.81Å; F210-E287 HydrophobicContact CB-CG 3.95Å; F210-E287 HydrophobicContact CD1-CG 3.92Å; F210-E287 HydrophobicContact CG-CG 3.98Å; M283-E287 WeakPolarHBondContact CA-OE2 3.41Å; M283-E287 HydrophobicContact CB-CB 3.9Å; M283-E287 HydrophobicContact CG-CB 4.34Å; N284-E287 PolarHBondContact N-OE2 3Å; N284-E287 PolarHBondContact O-N 3.16Å; N284-E287 VanDerWaalsContact O-N 3.07Å; N284-E287 WeakPolarHBondContact OD1-CG 3.32Å; N284-E287 PolarHBondContact OD1-N 3.21Å; E287-S291 WeakPolarHBondContact O-CB 3.46Å; E287-S291 PolarHBondContact O-N 3.06Å; E287-S291 PolarHBondContact O-OG 2.97Å
288	R	97.4	Very high	94.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-41.2	173.2	-66.9	-176.5	-68.6	116.4	-4.9	111.5	A238 L266 H267 D269 M283 N284 L290 S291 V292	A238-R288 WeakPolarHBondContact O-CD 3.45Å; A238-R288 PolarHBondContact O-NH1 2.71Å; L266-R288 HydrophobicContact CD1-CB 4.11Å; H267-R288 PolarHBondContact O-NH1 2.78Å; H267-R288 PolarHBondContact O-NH2 3.42Å; D269-R288 IonicContact OD1-CZ 2.69Å; D269-R288 IonicContact OD1-NE 2.71Å; D269-R288 IonicContact OD1-NH2 3.65Å; D269-R288 PolarHBondContact OD1-NH2 3.15Å; M283-R288 HydrophobicContact CB-CG 3.62Å; M283-R288 WeakPolarHBondContact O-CD 3.41Å; M283-R288 WeakPolarHBondContact O-CG 3.47Å; M283-R288 PolarHBondContact O-NE 2.91Å; N284-R288 WeakPolarHBondContact O-CG 3.36Å; N284-R288 PolarHBondContact O-N 2.95Å; R288-L290 PolarHBondContact O-N 3.29Å; R288-S291 PolarHBondContact O-N 3.48Å; R288-S291 VanDerWaalsContact O-N 3.16Å; R288-V292 WeakPolarHBondContact O-CG2 3.43Å; R288-V292 PolarHBondContact O-N 3.14Å
289	T	97.9	Very high	95.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-53.3	-53.7	174.3	-61.5	0	0	0	0	111.5	V285 H286 S291 V292 L293 V301 I303	V285-T289 WeakPolarHBondContact O-CB 3.3Å; V285-T289 PolarHBondContact O-N 2.86Å; V285-T289 PolarHBondContact O-OG1 3.19Å; H286-T289 WeakPolarHBondContact O-CB 3.38Å; H286-T289 PolarHBondContact O-N 3.15Å; T289-S291 VanDerWaalsContact C-N 3.33Å; T289-S291 PolarHBondContact O-N 3.42Å; T289-V292 PolarHBondContact O-N 3.29Å; T289-L293 HydrophobicContact CG2-CD1 3.84Å; T289-L293 HydrophobicContact CG2-CG 4.43Å; T289-L293 WeakPolarHBondContact O-CB 3.38Å; T289-L293 WeakPolarHBondContact O-CG 3.45Å; T289-L293 PolarHBondContact O-N 3.19Å; T289-V301 HydrophobicContact CG2-CG1 4.22Å; T289-I303 HydrophobicContact CG2-CD1 3.74Å; T289-I303 HydrophobicContact CG2-CG1 3.86Å
290	L	97.5	Very high	96	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-66.7	-35.1	178.6	-62.6	-164.4	0	0	0	112.6	Y56 F210 K216 F220 H286 R288 V292 A294	Y56-L290 HydrophobicContact CD2-CB 4.47Å; Y56-L290 HydrophobicContact CD2-CD1 4.04Å; Y56-L290 HydrophobicContact CG-CB 4.17Å; F210-L290 HydrophobicContact CE1-CD1 4.46Å; F210-L290 HydrophobicContact CE2-CD1 4.02Å; F210-L290 HydrophobicContact CZ-CD1 3.51Å; F210-L290 HydrophobicContact CZ-CG 4.27Å; K216-L290 HydrophobicContact CB-CD1 4.4Å; F220-L290 HydrophobicContact CB-CD2 3.87Å; F220-L290 HydrophobicContact CD1-CB 3.9Å; F220-L290 HydrophobicContact CD1-CD2 4.19Å; F220-L290 WeakPolarHBondContact CD1-O 3.08Å; F220-L290 HydrophobicContact CD2-CD1 4.41Å; F220-L290 HydrophobicContact CD2-CD2 4.09Å; F220-L290 HydrophobicContact CE1-CB 3.89Å; F220-L290 WeakPolarHBondContact CE1-O 3.43Å; F220-L290 HydrophobicContact CE2-CD1 4.28Å; F220-L290 HydrophobicContact CG-CB 4.36Å; F220-L290 HydrophobicContact CG-CD2 3.8Å; F220-L290 HydrophobicContact CG-CG 4.49Å; F220-L290 HydrophobicContact CZ-CB 4.35Å; F220-L290 HydrophobicContact CZ-CD1 4.43Å; H286-L290 PolarHBondContact O-N 3.44Å; R288-L290 PolarHBondContact O-N 3.29Å; L290-V292 VanDerWaalsContact C-N 3.35Å; L290-V292 PolarHBondContact O-N 2.79Å; L290-A294 PolarHBondContact O-N 2.92Å
291	S	97.7	Very high	96.5	Very high	5 Å²	5	19.1 Å²	19.1	4%	0.035	9%	0.091	C	C	.	.	H	α-helix	trans	-66.7	-36.7	179.8	-56.9	0	0	0	0	112.3	F242 E287 R288 T289	F242-S291 WeakPolarHBondContact CD1-O 3.36Å; E287-S291 WeakPolarHBondContact O-CB 3.46Å; E287-S291 PolarHBondContact O-N 3.06Å; E287-S291 PolarHBondContact O-OG 2.97Å; R288-S291 PolarHBondContact O-N 3.48Å; R288-S291 VanDerWaalsContact O-N 3.16Å; T289-S291 VanDerWaalsContact C-N 3.33Å; T289-S291 PolarHBondContact O-N 3.42Å
292	V	98.4	Very high	96.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-78.7	-44.2	177.4	171.1	0	0	0	0	112.1	F239 F242 V264 L266 R288 T289 L290 A294 C295 V298 V301	F239-V292 HydrophobicContact CB-CG2 3.64Å; F239-V292 HydrophobicContact CD1-CG2 4.24Å; F239-V292 HydrophobicContact CG-CG2 4.07Å; F242-V292 HydrophobicContact CD2-CG2 3.67Å; F242-V292 HydrophobicContact CE2-CG2 4.03Å; F242-V292 HydrophobicContact CG-CG2 4.29Å; V264-V292 HydrophobicContact CB-CG1 3.85Å; V264-V292 HydrophobicContact CG1-CG1 3.82Å; V264-V292 HydrophobicContact CG2-CG1 3.96Å; L266-V292 HydrophobicContact CD2-CG2 4.2Å; R288-V292 WeakPolarHBondContact O-CG2 3.43Å; R288-V292 PolarHBondContact O-N 3.14Å; T289-V292 PolarHBondContact O-N 3.29Å; L290-V292 VanDerWaalsContact C-N 3.35Å; L290-V292 PolarHBondContact O-N 2.79Å; V292-A294 PolarHBondContact O-N 3.28Å; V292-A294 VanDerWaalsContact O-N 3.1Å; V292-C295 VanDerWaalsContact O-CB 3.28Å; V292-C295 WeakPolarHBondContact O-CB 3.33Å; V292-C295 PolarHBondContact O-N 3.33Å; V292-V298 HydrophobicContact CG1-CG1 4.17Å; V292-V298 HydrophobicContact CG1-CG2 4.01Å; V292-V301 HydrophobicContact CB-CG2 4.31Å; V292-V301 HydrophobicContact CG1-CG2 3.69Å
293	L	98.4	Very high	97	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-60.2	-21.4	177.2	-76.1	176.1	0	0	0	113.6	K104 I217 F220 T289 C295 V301	K104-L293 VanDerWaalsContact CE-O 3.24Å; K104-L293 WeakPolarHBondContact CE-O 3.37Å; K104-L293 PolarHBondContact NZ-O 2.88Å; I217-L293 HydrophobicContact CG2-CD1 4.37Å; F220-L293 HydrophobicContact CB-CB 4.03Å; F220-L293 HydrophobicContact CB-CD1 4.15Å; F220-L293 HydrophobicContact CD1-CB 4.43Å; T289-L293 HydrophobicContact CG2-CD1 3.84Å; T289-L293 HydrophobicContact CG2-CG 4.43Å; T289-L293 WeakPolarHBondContact O-CB 3.38Å; T289-L293 WeakPolarHBondContact O-CG 3.45Å; T289-L293 PolarHBondContact O-N 3.19Å; L293-C295 VanDerWaalsContact C-N 3.27Å; L293-C295 PolarHBondContact O-N 3.05Å; L293-V301 HydrophobicContact CD2-CB 4.04Å; L293-V301 HydrophobicContact CD2-CG2 3.59Å; L293-V301 HydrophobicContact CG-CB 4.29Å; L293-V301 HydrophobicContact CG-CG2 3.8Å
294	A	98.3	Very high	96.9	Very high	3 Å²	3	23.3 Å²	23.3	3%	0.025	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.8	174.2	0	0	0	0	0	114.2	I103 K104 W105 F220 L290 V292	I103-A294 WeakPolarHBondContact CA-O 3.39Å; K104-A294 PolarHBondContact N-O 3.15Å; W105-A294 HydrophobicContact CH2-CB 4.45Å; W105-A294 HydrophobicContact CZ3-CB 3.92Å; F220-A294 HydrophobicContact CD1-CB 4.29Å; F220-A294 HydrophobicContact CE1-CB 4.09Å; L290-A294 PolarHBondContact O-N 2.92Å; V292-A294 PolarHBondContact O-N 3.28Å; V292-A294 VanDerWaalsContact O-N 3.1Å
295	C	98.6	Very high	97.1	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.014	11%	0.111	C	C	.	.	B	Isolated β-bridge	trans	-75	135.8	-176.8	-172	0	0	0	0	111.7	A102 F242 V292 L293 Y297 V298	A102-C295 CarbonylContact O-C 3.57Å; A102-C295 WeakPolarHBondContact O-CA 3.35Å; F242-C295 HydrophobicContact CE1-CB 4.04Å; F242-C295 HydrophobicContact CZ-CB 3.83Å; V292-C295 VanDerWaalsContact O-CB 3.28Å; V292-C295 WeakPolarHBondContact O-CB 3.33Å; V292-C295 PolarHBondContact O-N 3.33Å; L293-C295 VanDerWaalsContact C-N 3.27Å; L293-C295 PolarHBondContact O-N 3.05Å; C295-Y297 PolarHBondContact O-N 3.23Å; C295-V298 HydrophobicContact CB-CG2 3.97Å; C295-V298 PolarHBondContact O-N 3.01Å
296	R	98.3	Very high	97.2	Very high	104 Å²	104	24.4 Å²	24.4	39%	0.392	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19	-179.3	72.8	170.3	63.7	-116.9	-4.2	115	R101 A102 I103 K104 V106	R101-R296 VanDerWaalsContact O-CZ 3.23Å; R101-R296 PolarHBondContact O-NE 2.93Å; R101-R296 PolarHBondContact O-NH2 3.48Å; A102-R296 PolarHBondContact O-N 3.41Å; I103-R296 PolarHBondContact O-NH2 3.27Å; K104-R296 HydrophobicContact CB-CB 3.8Å; V106-R296 PolarHBondContact O-NH2 2.96Å
297	Y	98.4	Very high	97.3	Very high	44 Å²	44	21.8 Å²	21.8	17%	0.173	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5	-179	-50.6	-55.4	0	0	0	113.2	V247 L250 E251 H254 I262 C295	V247-Y297 HydrophobicContact CG1-CE2 4.11Å; L250-Y297 HydrophobicContact CB-CD2 4.17Å; E251-Y297 HydrophobicContact CB-CD2 4.17Å; E251-Y297 HydrophobicContact CB-CE2 3.61Å; E251-Y297 HydrophobicContact CG-CE1 4.39Å; E251-Y297 HydrophobicContact CG-CE2 4.09Å; H254-Y297 HydrophobicContact CB-CD1 4.09Å; H254-Y297 HydrophobicContact CB-CG 4.41Å; H254-Y297 AromaticContact CD2-CD1 3.57Å; H254-Y297 AromaticContact CG-CD1 3.85Å; I262-Y297 WeakPolarHBondContact CB-O 3.45Å; I262-Y297 WeakPolarHBondContact CD1-O 3.22Å; C295-Y297 PolarHBondContact O-N 3.23Å
298	V	98.4	Very high	97.4	Very high	7 Å²	7	23 Å²	23	4%	0.042	12%	0.123	C	C	.	.			trans	-102.7	123.7	-175.6	178	0	0	0	0	110.2	L250 V264 V292 C295 E300 V301	L250-V298 HydrophobicContact CD1-CG2 3.9Å; L250-V298 HydrophobicContact CD2-CG2 4.39Å; V264-V298 HydrophobicContact CG2-CB 4.46Å; V264-V298 HydrophobicContact CG2-CG1 3.91Å; V264-V298 HydrophobicContact CG2-CG2 3.74Å; V292-V298 HydrophobicContact CG1-CG1 4.17Å; V292-V298 HydrophobicContact CG1-CG2 4.01Å; C295-V298 HydrophobicContact CB-CG2 3.97Å; C295-V298 PolarHBondContact O-N 3.01Å; V298-E300 WeakPolarHBondContact CG1-O 3.46Å; V298-V301 HydrophobicContact CG1-CG2 4.03Å
299	A	97.8	Very high	97.4	Very high	16 Å²	16	23.2 Å²	23.2	13%	0.132	12%	0.124	C	C	.	.	S	Bend	trans	-83.9	-48.8	173.4	0	0	0	0	0	111.1	S222 Y261 I262	S222-A299 PolarHBondContact OG-O 3.33Å; Y261-A299 HydrophobicContact CD1-CB 3.96Å; Y261-A299 HydrophobicContact CD2-CB 3.74Å; Y261-A299 HydrophobicContact CE1-CB 3.87Å; Y261-A299 HydrophobicContact CE2-CB 3.66Å; Y261-A299 HydrophobicContact CG-CB 3.89Å; I262-A299 WeakPolarHBondContact O-CB 3.47Å; I262-A299 PolarHBondContact O-N 3.34Å
300	E	97.7	Very high	97.4	Very high	70 Å²	70	25.8 Å²	25.8	33%	0.327	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.9	-173.5	-173	54.4	-74.3	0	0	113	Y261 I262 I263 V264 V298	Y261-E300 HydrophobicContact CE1-CB 4.16Å; I262-E300 PolarHBondContact O-N 3.03Å; I263-E300 WeakPolarHBondContact CA-O 3.26Å; V264-E300 PolarHBondContact N-O 3.38Å; V298-E300 WeakPolarHBondContact CG1-O 3.46Å
301	V	98.2	Very high	97.4	Very high	11 Å²	11	30.3 Å²	30.3	7%	0.067	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.3	-179.7	169	0	0	0	0	112.2	V264 L266 T289 V292 L293 V298 I303	V264-V301 HydrophobicContact CB-CG2 4.31Å; V264-V301 CarbonylContact O-C 3.56Å; V264-V301 VanDerWaalsContact O-CA 3.3Å; V264-V301 WeakPolarHBondContact O-CA 3.26Å; L266-V301 HydrophobicContact CD1-CG1 3.58Å; L266-V301 HydrophobicContact CG-CG1 3.82Å; T289-V301 HydrophobicContact CG2-CG1 4.22Å; V292-V301 HydrophobicContact CB-CG2 4.31Å; V292-V301 HydrophobicContact CG1-CG2 3.69Å; L293-V301 HydrophobicContact CD2-CB 4.04Å; L293-V301 HydrophobicContact CD2-CG2 3.59Å; L293-V301 HydrophobicContact CG-CB 4.29Å; L293-V301 HydrophobicContact CG-CG2 3.8Å; V298-V301 HydrophobicContact CG1-CG2 4.03Å; V301-I303 HydrophobicContact CG1-CG1 4.1Å; V301-I303 PolarHBondContact O-N 3.39Å
302	V	97.8	Very high	97.4	Very high	26 Å²	26	35 Å²	35	16%	0.158	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	100.4	168.6	-174.6	0	0	0	0	108.9	Y234 I263 V264 L266 G304 A305 F317	Y234-V302 HydrophobicContact CE2-CG2 4.3Å; I263-V302 HydrophobicContact CG2-CG2 3.68Å; V264-V302 PolarHBondContact O-N 3.02Å; L266-V302 PolarHBondContact N-O 3.12Å; V302-G304 PolarHBondContact O-N 3.01Å; V302-A305 HydrophobicContact CB-CB 4.25Å; V302-A305 HydrophobicContact CG1-CB 4.02Å; V302-F317 HydrophobicContact CG2-CD2 4.44Å; V302-F317 HydrophobicContact CG2-CE1 4.38Å; V302-F317 HydrophobicContact CG2-CE2 3.57Å; V302-F317 HydrophobicContact CG2-CZ 3.54Å
303	I	95.8	Very high	97.4	Very high	72 Å²	72	35.6 Å²	35.6	37%	0.369	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	109.3	179.1	-49.9	175.3	0	0	0	109.1	I217 V285 T289 V301	I217-I303 HydrophobicContact CD1-CD1 4.21Å; V285-I303 HydrophobicContact CG2-CG2 4.1Å; T289-I303 HydrophobicContact CG2-CD1 3.74Å; T289-I303 HydrophobicContact CG2-CG1 3.86Å; V301-I303 HydrophobicContact CG1-CG1 4.1Å; V301-I303 PolarHBondContact O-N 3.39Å
304	G	91.9	Very high	97.4	Very high	14 Å²	14	35.6 Å²	35.6	14%	0.144	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.4	42.7	-177	0	0	0	0	0	113.3	L266 F268 V302	L266-G304 CarbonylContact O-C 3.49Å; L266-G304 VanDerWaalsContact O-CA 3.26Å; L266-G304 WeakPolarHBondContact O-CA 3.39Å; L266-G304 PolarHBondContact O-N 3.5Å; F268-G304 VanDerWaalsContact CE2-CA 3.43Å; F268-G304 WeakPolarHBondContact CE2-O 3.26Å; F268-G304 VanDerWaalsContact CZ-CA 3.46Å; V302-G304 PolarHBondContact O-N 3.01Å
305	A	96.8	Very high	97.4	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.017	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	146	174.8	0	0	0	0	0	112.2	Y234 L266 V302	Y234-A305 WeakPolarHBondContact OH-CB 3.37Å; L266-A305 PolarHBondContact O-N 3.32Å; V302-A305 HydrophobicContact CB-CB 4.25Å; V302-A305 HydrophobicContact CG1-CB 4.02Å
306	P	96.3	Very high	97.3	Very high	54 Å²	54	45.3 Å²	45.3	35%	0.351	23%	0.234	S	C	.	.			trans	-63.9	156.6	169.8	30	-35.7	0	0	0	111	A308 T310 L313	P306-A308 WeakPolarHBondContact CG-O 3.44Å; P306-T310 HydrophobicContact CB-CG2 4.49Å; P306-T310 HydrophobicContact CG-CG2 4.35Å; P306-L313 HydrophobicContact CG-CD1 3.83Å
307	F	96.8	Very high	97.3	Very high	21 Å²	21	43 Å²	43	9%	0.092	23%	0.227	C	C	.	.	S	Bend	trans	-72.7	-49	179.3	-174.4	-94.1	0	0	0	111.9	H267 E271 Y275 Y330 D332 P338	H267-F307 AromaticContact CE1-CD2 3.61Å; H267-F307 AromaticContact CE1-CE2 3.99Å; H267-F307 AromaticContact ND1-CD2 3.66Å; E271-F307 HydrophobicContact CG-CB 3.97Å; E271-F307 HydrophobicContact CG-CD2 3.97Å; E271-F307 HydrophobicContact CG-CG 4.33Å; Y275-F307 AromaticContact CD1-CD2 4Å; Y275-F307 HydrophobicContact CD1-CD2 4Å; Y275-F307 AromaticContact CD1-CE2 3.49Å; Y275-F307 HydrophobicContact CD1-CE2 3.49Å; Y275-F307 VanDerWaalsContact CD1-CE2 3.49Å; Y275-F307 HydrophobicContact CD1-CZ 4.46Å; Y275-F307 AromaticContact CE1-CD2 3.89Å; Y275-F307 HydrophobicContact CE1-CD2 3.89Å; Y275-F307 AromaticContact CE1-CE2 3.62Å; Y275-F307 HydrophobicContact CE1-CE2 3.62Å; Y275-F307 HydrophobicContact CG-CE2 4.17Å; F307-Y330 WeakPolarHBondContact CE1-O 3.19Å; F307-Y330 VanDerWaalsContact CZ-O 3.3Å; F307-Y330 WeakPolarHBondContact CZ-O 3.33Å; F307-D332 HydrophobicContact CD1-CB 3.81Å; F307-D332 VanDerWaalsContact CD1-CG 3.47Å; F307-D332 WeakPolarHBondContact CD1-OD2 3.4Å; F307-D332 HydrophobicContact CE1-CB 4.11Å; F307-P338 HydrophobicContact CD1-CB 3.83Å; F307-P338 HydrophobicContact CD1-CG 4.33Å; F307-P338 HydrophobicContact CE1-CB 3.75Å; F307-P338 HydrophobicContact CE1-CG 3.72Å; F307-P338 HydrophobicContact CZ-CG 4.34Å; F307-P338 WeakPolarHBondContact O-CB 3.39Å
308	A	97.6	Very high	97.3	Very high	26 Å²	26	48.6 Å²	48.6	22%	0.215	25%	0.252	C	S	.	.	S	Bend	trans	-73.4	137.2	165.8	0	0	0	0	0	111.5	P306 T310 D332 P338	P306-A308 WeakPolarHBondContact CG-O 3.44Å; A308-T310 PolarHBondContact O-N 3.36Å; A308-D332 PolarHBondContact N-OD2 2.95Å; A308-P338 HydrophobicContact CB-CB 4.37Å
309	V	98.1	Very high	97.3	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.024	25%	0.253	C	S	.	.			trans	-78	88.3	174.7	-173.2	0	0	0	0	108.6	Y234 L313 L314 V322 P338 Y339 P342	Y234-V309 HydrophobicContact CD1-CG1 3.99Å; Y234-V309 HydrophobicContact CE1-CG1 3.95Å; Y234-V309 HydrophobicContact CE1-CG2 4.06Å; V309-L313 HydrophobicContact CG1-CD2 4.42Å; V309-L314 HydrophobicContact CG1-CD1 4.42Å; V309-L314 HydrophobicContact CG1-CD2 3.7Å; V309-L314 HydrophobicContact CG1-CG 4.04Å; V309-V322 HydrophobicContact CG1-CG2 4.41Å; V309-P338 PolarHBondContact N-O 3.01Å; V309-Y339 HydrophobicContact CG2-CD1 3.64Å; V309-Y339 HydrophobicContact CG2-CE1 3.61Å; V309-P342 HydrophobicContact CB-CG 4.06Å; V309-P342 HydrophobicContact CG1-CG 4.08Å
310	T	97.4	Very high	97.3	Very high	54 Å²	54	51.9 Å²	51.9	33%	0.331	27%	0.267	S	S	.	.			trans	-69.9	155.1	-171.7	68	0	0	0	0	112.9	P306 A308 D312 L313 L314	P306-T310 HydrophobicContact CB-CG2 4.49Å; P306-T310 HydrophobicContact CG-CG2 4.35Å; A308-T310 PolarHBondContact O-N 3.36Å; T310-D312 PolarHBondContact O-N 3.48Å; T310-L313 PolarHBondContact O-N 3.42Å; T310-L313 WeakPolarHBondContact OG1-CB 3.44Å; T310-L313 PolarHBondContact OG1-N 3.25Å; T310-L314 PolarHBondContact O-N 2.81Å
311	K	97.9	Very high	97.3	Very high	99 Å²	99	49.9 Å²	49.9	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-47.7	-49.6	169.5	159.2	179.8	174.9	-48.6	0	111.1	L313 L314 D315 E341	K311-L313 VanDerWaalsContact C-N 3.31Å; K311-L313 PolarHBondContact O-N 2.99Å; K311-L314 PolarHBondContact O-N 2.89Å; K311-D315 VanDerWaalsContact CE-OD2 3.22Å; K311-D315 WeakPolarHBondContact CE-OD2 3.41Å; K311-D315 VanDerWaalsContact CG-OD2 3.29Å; K311-D315 WeakPolarHBondContact CG-OD2 3.49Å; K311-D315 IonicContact NZ-OD2 3.71Å; K311-D315 PolarHBondContact NZ-OD2 3.5Å; K311-D315 WeakPolarHBondContact O-CB 3.49Å; K311-D315 PolarHBondContact O-N 2.7Å; K311-E341 HydrophobicContact CB-CG 4.33Å
312	D	97.5	Very high	97.3	Very high	103 Å²	103	49.3 Å²	49.3	55%	0.551	26%	0.256	S	S	*	.	H	α-helix	trans	-72.6	-27.1	-170.2	-52	-43.2	0	0	0	112	T310 H316	T310-D312 PolarHBondContact O-N 3.48Å; D312-H316 WeakPolarHBondContact O-CB 3.33Å; D312-H316 PolarHBondContact O-N 3Å
313	L	98	Very high	97.4	Very high	14 Å²	14	48.1 Å²	48.1	7%	0.073	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-47.3	169.3	-175.4	154.9	0	0	0	111.2	Y234 P306 V309 T310 K311 D315 H316 F317	Y234-L313 HydrophobicContact CD1-CD2 3.98Å; Y234-L313 HydrophobicContact CD2-CD2 4.08Å; Y234-L313 HydrophobicContact CE1-CD1 4.37Å; Y234-L313 HydrophobicContact CE1-CD2 3.8Å; Y234-L313 HydrophobicContact CE2-CD1 4.32Å; Y234-L313 HydrophobicContact CE2-CD2 3.92Å; Y234-L313 HydrophobicContact CG-CD2 4.11Å; P306-L313 HydrophobicContact CG-CD1 3.83Å; V309-L313 HydrophobicContact CG1-CD2 4.42Å; T310-L313 PolarHBondContact O-N 3.42Å; T310-L313 WeakPolarHBondContact OG1-CB 3.44Å; T310-L313 PolarHBondContact OG1-N 3.25Å; K311-L313 VanDerWaalsContact C-N 3.31Å; K311-L313 PolarHBondContact O-N 2.99Å; L313-D315 VanDerWaalsContact C-N 3.35Å; L313-D315 PolarHBondContact O-N 2.97Å; L313-H316 PolarHBondContact O-N 3.48Å; L313-F317 HydrophobicContact CD2-CD2 4.16Å; L313-F317 HydrophobicContact CG-CD2 4.02Å; L313-F317 HydrophobicContact CG-CE2 4.2Å; L313-F317 WeakPolarHBondContact O-CD2 3.48Å; L313-F317 PolarHBondContact O-N 3.13Å; L313-F317 VanDerWaalsContact O-N 3.13Å
314	L	98.2	Very high	97.5	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-41.9	178.3	-63.5	175.2	0	0	0	111.9	V309 T310 K311 K318 V319 V322 E341 P342	V309-L314 HydrophobicContact CG1-CD1 4.42Å; V309-L314 HydrophobicContact CG1-CD2 3.7Å; V309-L314 HydrophobicContact CG1-CG 4.04Å; T310-L314 PolarHBondContact O-N 2.81Å; K311-L314 PolarHBondContact O-N 2.89Å; L314-K318 WeakPolarHBondContact O-CA 3.3Å; L314-K318 PolarHBondContact O-N 3.29Å; L314-V319 HydrophobicContact CD2-CB 3.74Å; L314-V319 HydrophobicContact CD2-CG1 3.85Å; L314-V319 HydrophobicContact CD2-CG2 4.04Å; L314-V319 PolarHBondContact O-N 2.76Å; L314-V322 HydrophobicContact CD2-CG2 3.64Å; L314-E341 HydrophobicContact CD1-CG 3.7Å; L314-P342 HydrophobicContact CD1-CB 4.3Å
315	D	97.9	Very high	97.6	Very high	67 Å²	67	46 Å²	46	36%	0.358	24%	0.235	S	C	.	.	H	α-helix	trans	-71.8	-39.1	-179.3	-62.9	-7.6	0	0	0	111.8	K311 L313 K318 R345	K311-D315 VanDerWaalsContact CE-OD2 3.22Å; K311-D315 WeakPolarHBondContact CE-OD2 3.41Å; K311-D315 VanDerWaalsContact CG-OD2 3.29Å; K311-D315 WeakPolarHBondContact CG-OD2 3.49Å; K311-D315 IonicContact NZ-OD2 3.71Å; K311-D315 PolarHBondContact NZ-OD2 3.5Å; K311-D315 WeakPolarHBondContact O-CB 3.49Å; K311-D315 PolarHBondContact O-N 2.7Å; L313-D315 VanDerWaalsContact C-N 3.35Å; L313-D315 PolarHBondContact O-N 2.97Å; D315-K318 PolarHBondContact O-N 3.43Å; D315-R345 IonicContact OD1-CZ 2.64Å; D315-R345 IonicContact OD1-NH1 3.77Å; D315-R345 PolarHBondContact OD1-NH1 3Å; D315-R345 IonicContact OD1-NH2 2.67Å; D315-R345 PolarHBondContact OD1-NH2 3Å; D315-R345 IonicContact OD2-NH2 2.72Å
316	H	97.6	Very high	97.5	Very high	141 Å²	141	52.9 Å²	52.9	65%	0.653	27%	0.265	S	S	*	.	H	α-helix	trans	-66.1	-48.9	179.4	178	78.1	0	0	0	112.2	D312 L313 K318	D312-H316 WeakPolarHBondContact O-CB 3.33Å; D312-H316 PolarHBondContact O-N 3Å; L313-H316 PolarHBondContact O-N 3.48Å; H316-K318 VanDerWaalsContact C-N 3.31Å
317	F	97.3	Very high	97.3	Very high	57 Å²	57	54.1 Å²	54.1	25%	0.25	27%	0.272	C	S	.	.	H	α-helix	trans	-84	-3.7	178.5	-66.8	-65.8	0	0	0	113.7	I232 I263 V302 L313 V319	I232-F317 VanDerWaalsContact CD1-O 3.32Å; I232-F317 WeakPolarHBondContact CD1-O 3.4Å; I263-F317 HydrophobicContact CD1-CB 3.89Å; I263-F317 HydrophobicContact CD1-CD1 3.88Å; I263-F317 HydrophobicContact CD1-CG 3.99Å; V302-F317 HydrophobicContact CG2-CD2 4.44Å; V302-F317 HydrophobicContact CG2-CE1 4.38Å; V302-F317 HydrophobicContact CG2-CE2 3.57Å; V302-F317 HydrophobicContact CG2-CZ 3.54Å; L313-F317 HydrophobicContact CD2-CD2 4.16Å; L313-F317 HydrophobicContact CG-CD2 4.02Å; L313-F317 HydrophobicContact CG-CE2 4.2Å; L313-F317 WeakPolarHBondContact O-CD2 3.48Å; L313-F317 PolarHBondContact O-N 3.13Å; L313-F317 VanDerWaalsContact O-N 3.13Å; F317-V319 HydrophobicContact CB-CG2 3.78Å; F317-V319 PolarHBondContact O-N 3.28Å
318	K	97.8	Very high	97.1	Very high	160 Å²	160	59.4 Å²	59.4	70%	0.696	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	50.1	-177.5	-53.7	179.4	-174.7	175.6	0	112.6	I232 L314 D315 H316 D320	I232-K318 HydrophobicContact CD1-CB 4.37Å; L314-K318 WeakPolarHBondContact O-CA 3.3Å; L314-K318 PolarHBondContact O-N 3.29Å; D315-K318 PolarHBondContact O-N 3.43Å; H316-K318 VanDerWaalsContact C-N 3.31Å; K318-D320 PolarHBondContact O-N 3.24Å
319	V	98.3	Very high	96.9	Very high	10 Å²	10	61.2 Å²	61.2	6%	0.061	30%	0.302	C	S	.	.			trans	-71.4	118.6	-170.6	179.1	0	0	0	0	111.9	I232 L314 F317 L321 V322	I232-V319 HydrophobicContact CG2-CG2 4.43Å; L314-V319 HydrophobicContact CD2-CB 3.74Å; L314-V319 HydrophobicContact CD2-CG1 3.85Å; L314-V319 HydrophobicContact CD2-CG2 4.04Å; L314-V319 PolarHBondContact O-N 2.76Å; F317-V319 HydrophobicContact CB-CG2 3.78Å; F317-V319 PolarHBondContact O-N 3.28Å; V319-L321 WeakPolarHBondContact CG1-O 3.42Å; V319-V322 HydrophobicContact CG1-CG2 3.9Å
320	D	98.3	Very high	96.7	Very high	82 Å²	82	64.5 Å²	64.5	44%	0.439	31%	0.314	S	S	.	.	S	Bend	trans	-80.6	-28	175.7	-59.6	-62.5	0	0	0	112.8	T231 I232 K318 L347	T231-D320 HydrophobicContact CG2-CB 3.91Å; I232-D320 PolarHBondContact N-OD2 2.9Å; I232-D320 PolarHBondContact O-N 2.94Å; K318-D320 PolarHBondContact O-N 3.24Å; D320-L347 WeakPolarHBondContact O-CD2 3.49Å
321	L	98.3	Very high	96.6	Very high	28 Å²	28	65.4 Å²	65.4	15%	0.147	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	139.8	-174.2	-155.4	72.8	0	0	0	111.4	I232 I233 Y234 L256 V319 R349	I232-L321 PolarHBondContact O-N 2.66Å; I233-L321 CarbonylContact C-O 3.55Å; I233-L321 WeakPolarHBondContact CA-O 3.45Å; I233-L321 HydrophobicContact CB-CB 4.47Å; I233-L321 HydrophobicContact CD1-CD2 4.37Å; I233-L321 HydrophobicContact CG1-CB 4.14Å; I233-L321 HydrophobicContact CG1-CD2 4.36Å; I233-L321 HydrophobicContact CG2-CB 4.17Å; I233-L321 HydrophobicContact CG2-CD2 4.33Å; Y234-L321 PolarHBondContact N-O 2.98Å; L256-L321 HydrophobicContact CB-CD2 4.36Å; L256-L321 HydrophobicContact CD1-CD2 3.91Å; V319-L321 WeakPolarHBondContact CG1-O 3.42Å; L321-R349 HydrophobicContact CD1-CG 3.68Å; L321-R349 HydrophobicContact CD2-CG 4.25Å; L321-R349 HydrophobicContact CG-CG 4.08Å
322	V	98.7	Very high	96.4	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	130.5	169.4	-179.6	0	0	0	0	109	Y234 V309 L314 V319 Y339 P342 L347 L348 R349	Y234-V322 HydrophobicContact CD1-CG1 4.47Å; Y234-V322 WeakPolarHBondContact O-CA 3.47Å; V309-V322 HydrophobicContact CG1-CG2 4.41Å; L314-V322 HydrophobicContact CD2-CG2 3.64Å; V319-V322 HydrophobicContact CG1-CG2 3.9Å; V322-Y339 HydrophobicContact CG1-CD1 3.88Å; V322-Y339 HydrophobicContact CG1-CE1 3.77Å; V322-P342 HydrophobicContact CB-CB 3.87Å; V322-P342 HydrophobicContact CB-CG 4.35Å; V322-P342 HydrophobicContact CG1-CB 4.33Å; V322-P342 HydrophobicContact CG1-CG 4.25Å; V322-P342 HydrophobicContact CG2-CB 3.6Å; V322-P342 HydrophobicContact CG2-CG 4.2Å; V322-L347 PolarHBondContact N-O 2Å; V322-L348 HydrophobicContact CB-CD1 4.28Å; V322-L348 HydrophobicContact CG1-CD1 3.91Å; V322-L348 CarbonylContact O-C 3.58Å; V322-L348 WeakPolarHBondContact O-CA 3.39Å; V322-R349 PolarHBondContact O-N 2.92Å
323	C	98.5	Very high	96.2	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.7	177.5	-61.4	0	0	0	0	112.6	I233 Y234 V235 F249 V253 L256 R349 V351	I233-C323 HydrophobicContact CG2-CB 4.46Å; Y234-C323 PolarHBondContact O-N 3.4Å; V235-C323 HydrophobicContact CG1-CB 3.8Å; V235-C323 WeakPolarHBondContact CG1-O 3.43Å; F249-C323 HydrophobicContact CZ-CB 4.36Å; V253-C323 HydrophobicContact CG1-CB 4.3Å; V253-C323 HydrophobicContact CG2-CB 3.78Å; L256-C323 VanDerWaalsContact CD1-SG 3.59Å; C323-R349 WeakPolarHBondContact CA-O 3.49Å; C323-V351 HydrophobicContact CB-CG2 3.89Å
324	H	97.8	Very high	96	Very high	33 Å²	33	69.3 Å²	69.3	15%	0.153	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	153.7	169	-174.5	74	0	0	0	109.4	T327 E328 I329 Y339 R349 T350 V351	H324-T327 PolarHBondContact CE1-OG1 3.15Å; H324-T327 WeakPolarHBondContact NE2-CA 3.39Å; H324-T327 PolarHBondContact NE2-O 2.98Å; H324-T327 PolarHBondContact NE2-OG1 2.78Å; H324-E328 PolarHBondContact NE2-O 3.42Å; H324-I329 VanDerWaalsContact CD2-CG1 3.41Å; H324-I329 WeakPolarHBondContact CD2-CG1 3.47Å; H324-I329 VanDerWaalsContact NE2-CG1 3.33Å; H324-I329 WeakPolarHBondContact NE2-CG1 3.4Å; H324-Y339 HydrophobicContact CB-CE1 4.4Å; H324-Y339 HydrophobicContact CB-CE2 4.15Å; H324-Y339 AromaticContact CG-CE2 3.93Å; H324-Y339 AromaticContact CG-CZ 3.94Å; H324-Y339 AromaticContact ND1-CE2 3.8Å; H324-Y339 AromaticContact ND1-CZ 3.71Å; H324-Y339 PolarHBondContact ND1-OH 2.89Å; H324-R349 PolarHBondContact N-O 3.42Å; H324-R349 VanDerWaalsContact N-O 3.15Å; H324-T350 WeakPolarHBondContact O-CA 3.34Å; H324-V351 PolarHBondContact O-N 2.96Å
325	G	95.2	Very high	95.8	Very high	9 Å²	9	71.8 Å²	71.8	9%	0.093	37%	0.366	C	S	.	.			trans	-73.1	-174.9	178.8	0	0	0	0	0	113.2	T327 V351	G325-T327 PolarHBondContact O-N 3.07Å; G325-V351 CarbonylContact C-O 3.54Å; G325-V351 WeakPolarHBondContact CA-O 3.49Å
326	K	94.3	Very high	95.8	Very high	147 Å²	147	70.8 Å²	70.8	64%	0.639	37%	0.365	S	S	*	.	S	Bend	trans	-76.9	11.3	163.4	-75.2	-171.1	176	172.2	0	114	T350 V351 D352	K326-T350 HydrophobicContact CG-CG2 4.16Å; K326-V351 PolarHBondContact N-O 2.76Å; K326-D352 HydrophobicContact CD-CB 4.06Å; K326-D352 WeakPolarHBondContact CD-OD2 3.29Å; K326-D352 VanDerWaalsContact CE-OD2 3.26Å; K326-D352 WeakPolarHBondContact CE-OD2 3.45Å; K326-D352 HydrophobicContact CG-CB 4.44Å; K326-D352 IonicContact NZ-OD2 3.29Å; K326-D352 PolarHBondContact NZ-OD2 3.26Å
327	T	93	Very high	95.8	Very high	80 Å²	80	66.7 Å²	66.7	49%	0.491	35%	0.348	S	S	.	.	S	Bend	trans	-77.1	153	176.7	44.7	0	0	0	0	111.8	H324 G325 I329	H324-T327 PolarHBondContact CE1-OG1 3.15Å; H324-T327 WeakPolarHBondContact NE2-CA 3.39Å; H324-T327 PolarHBondContact NE2-O 2.98Å; H324-T327 PolarHBondContact NE2-OG1 2.78Å; G325-T327 PolarHBondContact O-N 3.07Å; T327-I329 PolarHBondContact O-N 3.08Å
328	E	91.2	Very high	95.8	Very high	132 Å²	132	64.3 Å²	64.3	62%	0.617	34%	0.338	S	S	*	.			trans	-52.4	132.1	175	-173.5	176.8	-158.1	0	0	111.9	H324 Y330	H324-E328 PolarHBondContact NE2-O 3.42Å; E328-Y330 HydrophobicContact CG-CD1 4.29Å; E328-Y330 HydrophobicContact CG-CE1 3.8Å; E328-Y330 WeakPolarHBondContact OE2-CE1 3.11Å; E328-Y330 PolarHBondContact OE2-OH 2.84Å
329	I	93.9	Very high	95.8	Very high	63 Å²	63	57.1 Å²	57.1	32%	0.323	31%	0.306	S	S	.	.			trans	-97.5	112.4	172	-63	169.2	0	0	0	107.1	H324 T327 P338 Y339	H324-I329 VanDerWaalsContact CD2-CG1 3.41Å; H324-I329 WeakPolarHBondContact CD2-CG1 3.47Å; H324-I329 VanDerWaalsContact NE2-CG1 3.33Å; H324-I329 WeakPolarHBondContact NE2-CG1 3.4Å; T327-I329 PolarHBondContact O-N 3.08Å; I329-P338 HydrophobicContact CG2-CG 3.66Å; I329-Y339 HydrophobicContact CD1-CD2 3.86Å; I329-Y339 HydrophobicContact CD1-CE2 4.08Å; I329-Y339 HydrophobicContact CG1-CD2 4.29Å; I329-Y339 HydrophobicContact CG1-CE2 4.13Å; I329-Y339 HydrophobicContact CG2-CD2 3.89Å; I329-Y339 HydrophobicContact CG2-CE2 4.12Å
330	Y	93.4	Very high	95.8	Very high	74 Å²	74	59 Å²	59	29%	0.29	32%	0.323	S	S	.	.			trans	-76.7	141.7	173.6	-58.5	-67.6	0	0	0	110.7	Y275 F307 E328 P338	Y275-Y330 AromaticContact CD2-CD2 3.6Å; Y275-Y330 HydrophobicContact CD2-CD2 3.6Å; Y275-Y330 AromaticContact CD2-CE2 3.93Å; Y275-Y330 HydrophobicContact CD2-CE2 3.93Å; Y275-Y330 HydrophobicContact CE2-CD2 4.46Å; Y275-Y330 HydrophobicContact CG-CD2 4.06Å; F307-Y330 WeakPolarHBondContact CE1-O 3.19Å; F307-Y330 VanDerWaalsContact CZ-O 3.3Å; F307-Y330 WeakPolarHBondContact CZ-O 3.33Å; E328-Y330 HydrophobicContact CG-CD1 4.29Å; E328-Y330 HydrophobicContact CG-CE1 3.8Å; E328-Y330 WeakPolarHBondContact OE2-CE1 3.11Å; E328-Y330 PolarHBondContact OE2-OH 2.84Å; Y330-P338 WeakPolarHBondContact O-CG 3.49Å
331	P	94.9	Very high	95.8	Very high	73 Å²	73	56.3 Å²	56.3	47%	0.474	31%	0.308	S	S	.	.			trans	-61.7	154.7	169.1	-23.5	34.3	0	0	0	113.2	R274 S336	R274-P331 PolarHBondContact NH1-O 3.19Å; R274-P331 VanDerWaalsContact NH1-O 3.09Å; P331-S336 WeakPolarHBondContact CA-O 3.48Å
332	D	94.6	Very high	95.7	Very high	28 Å²	28	55 Å²	55	15%	0.15	30%	0.301	C	S	.	.			trans	-72.2	179.5	168.4	-148	-26.7	0	0	0	110.8	R274 F307 A308 D334 G335 S336	R274-D332 IonicContact NH2-OD1 3.07Å; F307-D332 HydrophobicContact CD1-CB 3.81Å; F307-D332 VanDerWaalsContact CD1-CG 3.47Å; F307-D332 WeakPolarHBondContact CD1-OD2 3.4Å; F307-D332 HydrophobicContact CE1-CB 4.11Å; A308-D332 PolarHBondContact N-OD2 2.95Å; D332-D334 PolarHBondContact O-N 3.27Å; D332-G335 PolarHBondContact O-N 3.04Å; D332-S336 PolarHBondContact N-O 2.76Å
333	K	92.7	Very high	95.7	Very high	143 Å²	143	59.7 Å²	59.7	62%	0.622	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.8	-170.7	-66	154.9	-171.1	160.5	0	114	E271	E271-K333 WeakPolarHBondContact OE1-CE 3.29Å; E271-K333 IonicContact OE1-NZ 2.66Å; E271-K333 WeakPolarHBondContact OE2-CE 3.44Å; E271-K333 IonicContact OE2-NZ 3.6Å; E271-K333 PolarHBondContact OE2-NZ 2.97Å
334	D	94.3	Very high	95.7	Very high	126 Å²	126	68.8 Å²	68.8	67%	0.674	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.2	174.5	64.2	-11.8	0	0	0	113.1	D332 S336	D332-D334 PolarHBondContact O-N 3.27Å; D334-S336 VanDerWaalsContact C-N 3.35Å; D334-S336 WeakPolarHBondContact OD1-CB 3.4Å; D334-S336 PolarHBondContact OD1-N 3.03Å; D334-S336 PolarHBondContact OD1-OG 3.05Å; D334-S336 PolarHBondContact OD2-OG 3.02Å
335	G	94.9	Very high	95.7	Very high	55 Å²	55	71.5 Å²	71.5	57%	0.567	36%	0.364	S	S	*	.	S	Bend	trans	84	4.1	-174.2	0	0	0	0	0	114.5	D332	D332-G335 PolarHBondContact O-N 3.04Å
336	S	96.4	Very high	95.8	Very high	46 Å²	46	73.5 Å²	73.5	32%	0.322	39%	0.385	S	S	.	.			trans	-71.9	160.6	176.8	68.8	0	0	0	0	112.9	P331 D332 D334	P331-S336 WeakPolarHBondContact CA-O 3.48Å; D332-S336 PolarHBondContact N-O 2.76Å; D334-S336 VanDerWaalsContact C-N 3.35Å; D334-S336 WeakPolarHBondContact OD1-CB 3.4Å; D334-S336 PolarHBondContact OD1-N 3.03Å; D334-S336 PolarHBondContact OD1-OG 3.05Å; D334-S336 PolarHBondContact OD2-OG 3.02Å
337	D	97.3	Very high	95.9	Very high	55 Å²	55	68.2 Å²	68.2	29%	0.294	36%	0.364	S	S	.	.			trans	-80.8	116	173.2	169.1	15.2	0	0	0	109.8	Y339 A340 K343	D337-Y339 PolarHBondContact O-N 3.19Å; D337-Y339 PolarHBondContact OD1-N 2.9Å; D337-A340 HydrophobicContact CB-CB 4.24Å; D337-A340 VanDerWaalsContact O-CB 3.23Å; D337-A340 WeakPolarHBondContact O-CB 3.29Å; D337-A340 PolarHBondContact O-N 3.41Å; D337-K343 VanDerWaalsContact CG-NZ 3.32Å; D337-K343 IonicContact OD1-NZ 2.72Å; D337-K343 PolarHBondContact OD1-NZ 2.86Å; D337-K343 VanDerWaalsContact OD2-CD 3.26Å; D337-K343 WeakPolarHBondContact OD2-CD 3.4Å; D337-K343 WeakPolarHBondContact OD2-CE 3.42Å; D337-K343 IonicContact OD2-NZ 3.73Å; D337-K343 PolarHBondContact OD2-NZ 3.01Å
338	P	97.6	Very high	96.2	Very high	6 Å²	6	65.8 Å²	65.8	4%	0.039	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-14.8	-177.5	26.9	-36.2	0	0	0	113.6	F307 A308 V309 I329 Y330	F307-P338 HydrophobicContact CD1-CB 3.83Å; F307-P338 HydrophobicContact CD1-CG 4.33Å; F307-P338 HydrophobicContact CE1-CB 3.75Å; F307-P338 HydrophobicContact CE1-CG 3.72Å; F307-P338 HydrophobicContact CZ-CG 4.34Å; F307-P338 WeakPolarHBondContact O-CB 3.39Å; A308-P338 HydrophobicContact CB-CB 4.37Å; V309-P338 PolarHBondContact N-O 3.01Å; I329-P338 HydrophobicContact CG2-CG 3.66Å; Y330-P338 WeakPolarHBondContact O-CG 3.49Å
339	Y	98.1	Very high	96.5	Very high	10 Å²	10	66.4 Å²	66.4	4%	0.039	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	14.5	175.2	-64.9	-79.2	0	0	0	113.5	V309 V322 H324 I329 D337 E341 P342 K343 L348	V309-Y339 HydrophobicContact CG2-CD1 3.64Å; V309-Y339 HydrophobicContact CG2-CE1 3.61Å; V322-Y339 HydrophobicContact CG1-CD1 3.88Å; V322-Y339 HydrophobicContact CG1-CE1 3.77Å; H324-Y339 HydrophobicContact CB-CE1 4.4Å; H324-Y339 HydrophobicContact CB-CE2 4.15Å; H324-Y339 AromaticContact CG-CE2 3.93Å; H324-Y339 AromaticContact CG-CZ 3.94Å; H324-Y339 AromaticContact ND1-CE2 3.8Å; H324-Y339 AromaticContact ND1-CZ 3.71Å; H324-Y339 PolarHBondContact ND1-OH 2.89Å; I329-Y339 HydrophobicContact CD1-CD2 3.86Å; I329-Y339 HydrophobicContact CD1-CE2 4.08Å; I329-Y339 HydrophobicContact CG1-CD2 4.29Å; I329-Y339 HydrophobicContact CG1-CE2 4.13Å; I329-Y339 HydrophobicContact CG2-CD2 3.89Å; I329-Y339 HydrophobicContact CG2-CE2 4.12Å; D337-Y339 PolarHBondContact O-N 3.19Å; D337-Y339 PolarHBondContact OD1-N 2.9Å; Y339-E341 VanDerWaalsContact C-N 3.32Å; Y339-E341 PolarHBondContact O-N 2.77Å; Y339-P342 HydrophobicContact CD1-CG 4.07Å; Y339-P342 VanDerWaalsContact O-CD 3.28Å; Y339-P342 WeakPolarHBondContact O-CD 3.36Å; Y339-P342 WeakPolarHBondContact O-CG 3.44Å; Y339-K343 WeakPolarHBondContact O-CB 3.21Å; Y339-K343 VanDerWaalsContact O-CG 3.25Å; Y339-K343 WeakPolarHBondContact O-CG 3.4Å; Y339-K343 PolarHBondContact O-N 3.48Å; Y339-L348 HydrophobicContact CD1-CD1 3.76Å; Y339-L348 HydrophobicContact CE1-CD1 4.26Å; Y339-L348 HydrophobicContact CG-CD1 4.15Å; Y339-L348 HydrophobicContact CG-CD2 4.47Å
340	A	97.9	Very high	96.6	Very high	49 Å²	49	68.2 Å²	68.2	41%	0.405	36%	0.358	S	S	.	.	H	α-helix	trans	-56.5	-41.4	-179.8	0	0	0	0	0	113.2	D337 K343 R344	D337-A340 HydrophobicContact CB-CB 4.24Å; D337-A340 VanDerWaalsContact O-CB 3.23Å; D337-A340 WeakPolarHBondContact O-CB 3.29Å; D337-A340 PolarHBondContact O-N 3.41Å; A340-K343 PolarHBondContact O-N 3.38Å; A340-R344 WeakPolarHBondContact O-CB 3.33Å; A340-R344 PolarHBondContact O-N 3.35Å
341	E	98.1	Very high	96.8	Very high	26 Å²	26	65.3 Å²	65.3	12%	0.121	35%	0.348	C	S	.	.	H	α-helix	trans	-67.9	-52.6	179.2	175.6	65.6	173.1	0	0	113.4	K311 L314 Y339 K343 R344 R345	K311-E341 HydrophobicContact CB-CG 4.33Å; L314-E341 HydrophobicContact CD1-CG 3.7Å; Y339-E341 VanDerWaalsContact C-N 3.32Å; Y339-E341 PolarHBondContact O-N 2.77Å; E341-K343 PolarHBondContact O-N 2.67Å; E341-R344 VanDerWaalsContact CD-NH2 3.29Å; E341-R344 WeakPolarHBondContact O-CB 3.36Å; E341-R344 PolarHBondContact O-N 2.82Å; E341-R344 VanDerWaalsContact O-N 3.1Å; E341-R344 IonicContact OE1-NH2 3.35Å; E341-R344 PolarHBondContact OE1-NH2 2.83Å; E341-R344 VanDerWaalsContact OE1-NH2 3.09Å; E341-R344 IonicContact OE2-CZ 2.83Å; E341-R344 IonicContact OE2-NE 2.71Å; E341-R344 PolarHBondContact OE2-NE 2.87Å; E341-R344 IonicContact OE2-NH2 3.6Å; E341-R344 PolarHBondContact OE2-NH2 3.17Å; E341-R345 PolarHBondContact O-N 2.8Å; E341-R345 IonicContact OE1-CZ 3.5Å; E341-R345 VanDerWaalsContact OE1-CZ 3.29Å; E341-R345 IonicContact OE1-NE 2.69Å; E341-R345 PolarHBondContact OE1-NE 2.98Å; E341-R345 IonicContact OE1-NH2 3.49Å; E341-R345 PolarHBondContact OE1-NH2 3.31Å
342	P	98.1	Very high	96.9	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.1	-23.8	175.1	23.9	-32.9	0	0	0	113.4	V309 L314 V322 Y339 G346 L347 L348	V309-P342 HydrophobicContact CB-CG 4.06Å; V309-P342 HydrophobicContact CG1-CG 4.08Å; L314-P342 HydrophobicContact CD1-CB 4.3Å; V322-P342 HydrophobicContact CB-CB 3.87Å; V322-P342 HydrophobicContact CB-CG 4.35Å; V322-P342 HydrophobicContact CG1-CB 4.33Å; V322-P342 HydrophobicContact CG1-CG 4.25Å; V322-P342 HydrophobicContact CG2-CB 3.6Å; V322-P342 HydrophobicContact CG2-CG 4.2Å; Y339-P342 HydrophobicContact CD1-CG 4.07Å; Y339-P342 VanDerWaalsContact O-CD 3.28Å; Y339-P342 WeakPolarHBondContact O-CD 3.36Å; Y339-P342 WeakPolarHBondContact O-CG 3.44Å; P342-G346 PolarHBondContact O-N 2.86Å; P342-L347 HydrophobicContact CB-CB 4.3Å; P342-L347 PolarHBondContact O-N 2.85Å; P342-L348 HydrophobicContact CB-CB 4.46Å; P342-L348 PolarHBondContact O-N 3.16Å
343	K	97.7	Very high	96.9	Very high	99 Å²	99	65.7 Å²	65.7	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-47.9	166.5	-74.8	171.3	-175.5	172.3	0	111.6	D337 Y339 A340 E341 R345 G346 L348	D337-K343 VanDerWaalsContact CG-NZ 3.32Å; D337-K343 IonicContact OD1-NZ 2.72Å; D337-K343 PolarHBondContact OD1-NZ 2.86Å; D337-K343 VanDerWaalsContact OD2-CD 3.26Å; D337-K343 WeakPolarHBondContact OD2-CD 3.4Å; D337-K343 WeakPolarHBondContact OD2-CE 3.42Å; D337-K343 IonicContact OD2-NZ 3.73Å; D337-K343 PolarHBondContact OD2-NZ 3.01Å; Y339-K343 WeakPolarHBondContact O-CB 3.21Å; Y339-K343 VanDerWaalsContact O-CG 3.25Å; Y339-K343 WeakPolarHBondContact O-CG 3.4Å; Y339-K343 PolarHBondContact O-N 3.48Å; A340-K343 PolarHBondContact O-N 3.38Å; E341-K343 PolarHBondContact O-N 2.67Å; K343-R345 PolarHBondContact O-N 2.87Å; K343-G346 PolarHBondContact O-N 3.32Å; K343-L348 HydrophobicContact CD-CD2 4.02Å; K343-L348 HydrophobicContact CG-CB 4.09Å; K343-L348 HydrophobicContact CG-CD2 3.55Å; K343-L348 HydrophobicContact CG-CG 4.47Å
344	R	97.8	Very high	97	Very high	191 Å²	191	62.2 Å²	62.2	72%	0.721	35%	0.354	S	S	*	.	H	α-helix	trans	-57.2	-32.9	176.9	-175.6	174.5	74.2	129.5	4.6	112.6	A340 E341	A340-R344 WeakPolarHBondContact O-CB 3.33Å; A340-R344 PolarHBondContact O-N 3.35Å; E341-R344 VanDerWaalsContact CD-NH2 3.29Å; E341-R344 WeakPolarHBondContact O-CB 3.36Å; E341-R344 PolarHBondContact O-N 2.82Å; E341-R344 VanDerWaalsContact O-N 3.1Å; E341-R344 IonicContact OE1-NH2 3.35Å; E341-R344 PolarHBondContact OE1-NH2 2.83Å; E341-R344 VanDerWaalsContact OE1-NH2 3.09Å; E341-R344 IonicContact OE2-CZ 2.83Å; E341-R344 IonicContact OE2-NE 2.71Å; E341-R344 PolarHBondContact OE2-NE 2.87Å; E341-R344 IonicContact OE2-NH2 3.6Å; E341-R344 PolarHBondContact OE2-NH2 3.17Å
345	R	97.7	Very high	96.9	Very high	89 Å²	89	58.1 Å²	58.1	34%	0.336	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-6.2	175.7	-63.1	-177.6	-173.2	-151.9	3	115	D315 E341 K343 L347	D315-R345 IonicContact OD1-CZ 2.64Å; D315-R345 IonicContact OD1-NH1 3.77Å; D315-R345 PolarHBondContact OD1-NH1 3Å; D315-R345 IonicContact OD1-NH2 2.67Å; D315-R345 PolarHBondContact OD1-NH2 3Å; D315-R345 IonicContact OD2-NH2 2.72Å; E341-R345 PolarHBondContact O-N 2.8Å; E341-R345 IonicContact OE1-CZ 3.5Å; E341-R345 VanDerWaalsContact OE1-CZ 3.29Å; E341-R345 IonicContact OE1-NE 2.69Å; E341-R345 PolarHBondContact OE1-NE 2.98Å; E341-R345 IonicContact OE1-NH2 3.49Å; E341-R345 PolarHBondContact OE1-NH2 3.31Å; K343-R345 PolarHBondContact O-N 2.87Å; R345-L347 VanDerWaalsContact C-N 3.28Å; R345-L347 HydrophobicContact CB-CD1 3.8Å; R345-L347 HydrophobicContact CB-CD2 4.49Å; R345-L347 HydrophobicContact CB-CG 3.64Å; R345-L347 HydrophobicContact CG-CD1 4.45Å; R345-L347 PolarHBondContact O-N 3.41Å
346	G	97.8	Very high	96.9	Very high	52 Å²	52	62.1 Å²	62.1	54%	0.536	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.9	12.8	-175.5	0	0	0	0	0	115.5	P342 K343	P342-G346 PolarHBondContact O-N 2.86Å; K343-G346 PolarHBondContact O-N 3.32Å
347	L	97.3	Very high	96.8	Very high	35 Å²	35	60.6 Å²	60.6	18%	0.183	33%	0.333	C	S	.	.			trans	-86.9	-19	-174.8	-51.6	176.6	0	0	0	113.5	D320 V322 P342 R345	D320-L347 WeakPolarHBondContact O-CD2 3.49Å; V322-L347 PolarHBondContact N-O 2Å; P342-L347 HydrophobicContact CB-CB 4.3Å; P342-L347 PolarHBondContact O-N 2.85Å; R345-L347 VanDerWaalsContact C-N 3.28Å; R345-L347 HydrophobicContact CB-CD1 3.8Å; R345-L347 HydrophobicContact CB-CD2 4.49Å; R345-L347 HydrophobicContact CB-CG 3.64Å; R345-L347 HydrophobicContact CG-CD1 4.45Å; R345-L347 PolarHBondContact O-N 3.41Å
348	L	98	Very high	96.7	Very high	30 Å²	30	60.3 Å²	60.3	16%	0.157	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	129.2	-177.5	-175.2	70.5	0	0	0	112.3	V322 Y339 P342 K343	V322-L348 HydrophobicContact CB-CD1 4.28Å; V322-L348 HydrophobicContact CG1-CD1 3.91Å; V322-L348 CarbonylContact O-C 3.58Å; V322-L348 WeakPolarHBondContact O-CA 3.39Å; Y339-L348 HydrophobicContact CD1-CD1 3.76Å; Y339-L348 HydrophobicContact CE1-CD1 4.26Å; Y339-L348 HydrophobicContact CG-CD1 4.15Å; Y339-L348 HydrophobicContact CG-CD2 4.47Å; P342-L348 HydrophobicContact CB-CB 4.46Å; P342-L348 PolarHBondContact O-N 3.16Å; K343-L348 HydrophobicContact CD-CD2 4.02Å; K343-L348 HydrophobicContact CG-CB 4.09Å; K343-L348 HydrophobicContact CG-CD2 3.55Å; K343-L348 HydrophobicContact CG-CG 4.47Å
349	R	97.4	Very high	96.4	Very high	145 Å²	145	60.4 Å²	60.4	55%	0.547	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.6	167	-55.9	-61.8	178.1	175.7	-1.5	110.8	L321 V322 C323 H324	L321-R349 HydrophobicContact CD1-CG 3.68Å; L321-R349 HydrophobicContact CD2-CG 4.25Å; L321-R349 HydrophobicContact CG-CG 4.08Å; V322-R349 PolarHBondContact O-N 2.92Å; C323-R349 WeakPolarHBondContact CA-O 3.49Å; H324-R349 PolarHBondContact N-O 3.42Å; H324-R349 VanDerWaalsContact N-O 3.15Å
350	T	97.3	Very high	96	Very high	100 Å²	100	61.6 Å²	61.6	61%	0.613	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	125.9	166.5	-51.9	0	0	0	0	108.8	H324 K326	H324-T350 WeakPolarHBondContact O-CA 3.34Å; K326-T350 HydrophobicContact CG-CG2 4.16Å
351	V	97.3	Very high	95.8	Very high	13 Å²	13	61 Å²	61	8%	0.079	34%	0.336	C	S	.	.			trans	-114.1	135.8	-178.5	-176.3	0	0	0	0	109.4	F249 A252 V253 L256 C323 H324 G325 K326	F249-V351 HydrophobicContact CD2-CB 4.32Å; F249-V351 HydrophobicContact CE2-CB 4.08Å; A252-V351 HydrophobicContact CB-CG1 3.53Å; V253-V351 HydrophobicContact CG2-CB 4.35Å; V253-V351 HydrophobicContact CG2-CG1 4.23Å; V253-V351 HydrophobicContact CG2-CG2 4.08Å; L256-V351 HydrophobicContact CD1-CG2 3.88Å; C323-V351 HydrophobicContact CB-CG2 3.89Å; H324-V351 PolarHBondContact O-N 2.96Å; G325-V351 CarbonylContact C-O 3.54Å; G325-V351 WeakPolarHBondContact CA-O 3.49Å; K326-V351 PolarHBondContact N-O 2.76Å
352	D	96.7	Very high	95.5	Very high	79 Å²	79	59.8 Å²	59.8	42%	0.422	33%	0.331	S	S	.	.			trans	-91.3	125.7	170.8	-159.2	-12.8	0	0	0	109.8	K326 G354	K326-D352 HydrophobicContact CD-CB 4.06Å; K326-D352 WeakPolarHBondContact CD-OD2 3.29Å; K326-D352 VanDerWaalsContact CE-OD2 3.26Å; K326-D352 WeakPolarHBondContact CE-OD2 3.45Å; K326-D352 HydrophobicContact CG-CB 4.44Å; K326-D352 IonicContact NZ-OD2 3.29Å; K326-D352 PolarHBondContact NZ-OD2 3.26Å; D352-G354 VanDerWaalsContact C-N 3.31Å; D352-G354 PolarHBondContact OD1-N 2.93Å
353	S	94.7	Very high	95.1	Very high	30 Å²	30	60 Å²	60	21%	0.21	33%	0.332	C	S	.	.			trans	-80.3	-15.8	170.2	55.3	0	0	0	0	112.3	N355	S353-N355 PolarHBondContact O-N 3.22Å; S353-N355 PolarHBondContact OG-N 3.07Å; S353-N355 VanDerWaalsContact OG-N 3.09Å; S353-N355 PolarHBondContact OG-O 3.14Å; S353-N355 VanDerWaalsContact OG-O 3.07Å
354	G	94.6	Very high	94.7	Very high	71 Å²	71	60.6 Å²	60.6	73%	0.732	34%	0.337	S	S	*	.	S	Bend	trans	66.7	7.7	-164.3	0	0	0	0	0	113.5	D352	D352-G354 VanDerWaalsContact C-N 3.31Å; D352-G354 PolarHBondContact OD1-N 2.93Å
355	N	93.3	Very high	94.4	Very high	40 Å²	40	55.1 Å²	55.1	21%	0.214	32%	0.316	C	S	.	.			trans	-129.8	124.8	-166.2	-160.8	-50.4	0	0	0	112.5	I244 D248 S353 L357	I244-N355 WeakPolarHBondContact CD1-ND2 3.24Å; D248-N355 HydrophobicContact CB-CB 4.09Å; D248-N355 PolarHBondContact OD2-ND2 3.42Å; S353-N355 PolarHBondContact O-N 3.22Å; S353-N355 PolarHBondContact OG-N 3.07Å; S353-N355 VanDerWaalsContact OG-N 3.09Å; S353-N355 PolarHBondContact OG-O 3.14Å; S353-N355 VanDerWaalsContact OG-O 3.07Å; N355-L357 WeakPolarHBondContact OD1-CB 3.43Å; N355-L357 PolarHBondContact OD1-N 3.11Å
356	T	93.6	Very high	93.9	Very high	138 Å²	138	51.2 Å²	51.2	85%	0.847	30%	0.302	S	S	*	.			trans	-96.2	2.3	-176.6	55.5	0	0	0	0	114.2	T358	T356-T358 PolarHBondContact O-N 3.31Å
357	L	94.8	Very high	93.1	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.073	28%	0.281	C	S	.	.			trans	-67.5	132.1	179.4	-172.9	72.2	0	0	0	111.5	F91 H243 I244 N355 A361 I362	F91-L357 HydrophobicContact CE1-CD1 4.45Å; F91-L357 HydrophobicContact CE1-CD2 3.7Å; F91-L357 HydrophobicContact CZ-CD2 4.34Å; H243-L357 HydrophobicContact CB-CD2 4.05Å; H243-L357 PolarHBondContact CE1-O 2.75Å; I244-L357 HydrophobicContact CD1-CB 4.14Å; I244-L357 HydrophobicContact CD1-CD2 3.5Å; I244-L357 VanDerWaalsContact CD1-CD2 3.5Å; I244-L357 HydrophobicContact CD1-CG 4.44Å; I244-L357 HydrophobicContact CG1-CD2 3.66Å; N355-L357 WeakPolarHBondContact OD1-CB 3.43Å; N355-L357 PolarHBondContact OD1-N 3.11Å; L357-A361 HydrophobicContact CD1-CB 4.23Å; L357-I362 HydrophobicContact CD1-CD1 4.5Å; L357-I362 HydrophobicContact CD1-CG1 3.77Å; L357-I362 HydrophobicContact CD2-CD1 4.08Å; L357-I362 HydrophobicContact CD2-CG1 4.16Å; L357-I362 HydrophobicContact CG-CD1 4.25Å; L357-I362 HydrophobicContact CG-CG1 4.05Å
358	T	94.2	Very high	92.5	Very high	50 Å²	50	54.6 Å²	54.6	31%	0.307	30%	0.301	S	S	.	.			trans	-132.5	162	174.9	60	0	0	0	0	110.7	T356 D360 A361 I362	T356-T358 PolarHBondContact O-N 3.31Å; T358-D360 PolarHBondContact O-N 2.65Å; T358-A361 WeakPolarHBondContact O-CA 3.48Å; T358-A361 WeakPolarHBondContact O-CB 3.46Å; T358-A361 PolarHBondContact O-N 3.25Å; T358-A361 PolarHBondContact OG1-N 3.3Å; T358-I362 WeakPolarHBondContact O-CG1 3.3Å; T358-I362 PolarHBondContact O-N 3.26Å
359	S	91.6	Very high	91.7	Very high	8 Å²	8	55.5 Å²	55.5	6%	0.056	31%	0.306	C	S	.	.	H	α-helix	trans	-51.9	-40.2	173	-33	0	0	0	0	112.2	D240 H243 I362 V363	D240-S359 PolarHBondContact O-OG 3.42Å; H243-S359 PolarHBondContact NE2-N 3.05Å; S359-I362 PolarHBondContact O-N 3.41Å; S359-V363 WeakPolarHBondContact O-CG2 3.36Å; S359-V363 PolarHBondContact O-N 2.69Å
360	D	91	Very high	90.7	Very high	34 Å²	34	52.1 Å²	52.1	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-62.7	-42	174.1	-72.2	-81.1	0	0	0	112.7	K276 K278 Y280 T358 I362 V363 Q364	K276-D360 IonicContact NZ-OD2 2.68Å; K276-D360 PolarHBondContact NZ-OD2 3.31Å; K278-D360 IonicContact NZ-OD1 2.77Å; K278-D360 PolarHBondContact NZ-OD1 2.94Å; Y280-D360 VanDerWaalsContact CE2-OD1 3.24Å; Y280-D360 WeakPolarHBondContact CE2-OD1 3.37Å; Y280-D360 VanDerWaalsContact OH-CA 3.3Å; Y280-D360 WeakPolarHBondContact OH-CA 3.41Å; Y280-D360 PolarHBondContact OH-OD1 3.16Å; T358-D360 PolarHBondContact O-N 2.65Å; D360-I362 VanDerWaalsContact C-N 3.34Å; D360-I362 PolarHBondContact O-N 3.17Å; D360-V363 PolarHBondContact O-N 2.79Å; D360-Q364 WeakPolarHBondContact O-CG 3.33Å; D360-Q364 PolarHBondContact O-N 2.72Å
361	A	92.8	Very high	89.8	Confident	36 Å²	36	52.1 Å²	52.1	30%	0.298	29%	0.289	S	S	.	.	H	α-helix	trans	-66.2	-35.6	176.7	0	0	0	0	0	112.3	L357 T358 Q364 R365	L357-A361 HydrophobicContact CD1-CB 4.23Å; T358-A361 WeakPolarHBondContact O-CA 3.48Å; T358-A361 WeakPolarHBondContact O-CB 3.46Å; T358-A361 PolarHBondContact O-N 3.25Å; T358-A361 PolarHBondContact OG1-N 3.3Å; A361-Q364 PolarHBondContact O-N 2.91Å; A361-R365 WeakPolarHBondContact O-CG 3.07Å; A361-R365 PolarHBondContact O-N 3.17Å
362	I	92.6	Very high	88.8	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-46.9	174.5	-64.2	167.6	0	0	0	110.7	M53 F91 L241 H243 L357 T358 S359 D360 Q364 R365 I366	M53-I362 HydrophobicContact CE-CG2 3.76Å; M53-I362 HydrophobicContact SD-CG2 3.7Å; F91-I362 HydrophobicContact CE1-CD1 4.46Å; F91-I362 HydrophobicContact CE1-CG1 4.18Å; F91-I362 HydrophobicContact CZ-CD1 3.87Å; F91-I362 HydrophobicContact CZ-CG1 3.86Å; F91-I362 HydrophobicContact CZ-CG2 4.24Å; L241-I362 HydrophobicContact CD1-CG2 4.39Å; H243-I362 HydrophobicContact CB-CD1 3.58Å; H243-I362 WeakPolarHBondContact CD2-CD1 3.44Å; L357-I362 HydrophobicContact CD1-CD1 4.5Å; L357-I362 HydrophobicContact CD1-CG1 3.77Å; L357-I362 HydrophobicContact CD2-CD1 4.08Å; L357-I362 HydrophobicContact CD2-CG1 4.16Å; L357-I362 HydrophobicContact CG-CD1 4.25Å; L357-I362 HydrophobicContact CG-CG1 4.05Å; T358-I362 WeakPolarHBondContact O-CG1 3.3Å; T358-I362 PolarHBondContact O-N 3.26Å; S359-I362 PolarHBondContact O-N 3.41Å; D360-I362 VanDerWaalsContact C-N 3.34Å; D360-I362 PolarHBondContact O-N 3.17Å; I362-Q364 VanDerWaalsContact C-N 3.27Å; I362-Q364 PolarHBondContact O-N 3.49Å; I362-R365 WeakPolarHBondContact O-CB 3.29Å; I362-R365 PolarHBondContact O-N 3.06Å; I362-R365 VanDerWaalsContact O-N 3.12Å; I362-I366 HydrophobicContact CG2-CD1 3.95Å; I362-I366 WeakPolarHBondContact O-CG1 3.37Å; I362-I366 PolarHBondContact O-N 3.2Å
363	V	89.4	Confident	87.8	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-55.6	-43.6	174.1	170.5	0	0	0	0	110.6	M173 L241 Y280 S359 D360 I366 I367	M173-V363 HydrophobicContact CB-CG2 4.28Å; M173-V363 HydrophobicContact CG-CG2 3.82Å; M173-V363 HydrophobicContact SD-CG2 3.65Å; L241-V363 HydrophobicContact CD1-CG2 4.41Å; Y280-V363 HydrophobicContact CE1-CG2 4.48Å; S359-V363 WeakPolarHBondContact O-CG2 3.36Å; S359-V363 PolarHBondContact O-N 2.69Å; D360-V363 PolarHBondContact O-N 2.79Å; V363-I366 PolarHBondContact O-N 3.4Å; V363-I367 HydrophobicContact CG1-CD1 3.68Å; V363-I367 WeakPolarHBondContact O-CD1 3.22Å; V363-I367 VanDerWaalsContact O-CG1 3.3Å; V363-I367 WeakPolarHBondContact O-CG1 3.23Å; V363-I367 PolarHBondContact O-N 3.29Å
364	Q	89.5	Confident	86.9	Confident	112 Å²	112	57.6 Å²	57.6	52%	0.523	31%	0.309	S	S	.	.	H	α-helix	trans	-66.2	-38.4	175.9	-65.4	-49	-61.2	0	0	113.7	D360 A361 I362 I366 K368	D360-Q364 WeakPolarHBondContact O-CG 3.33Å; D360-Q364 PolarHBondContact O-N 2.72Å; A361-Q364 PolarHBondContact O-N 2.91Å; I362-Q364 VanDerWaalsContact C-N 3.27Å; I362-Q364 PolarHBondContact O-N 3.49Å; Q364-I366 VanDerWaalsContact C-N 3.34Å; Q364-I366 PolarHBondContact O-N 2.81Å; Q364-K368 VanDerWaalsContact O-CB 3.29Å; Q364-K368 WeakPolarHBondContact O-CB 3.4Å; Q364-K368 PolarHBondContact O-N 3.04Å
365	R	91.1	Very high	86	Confident	76 Å²	76	56.6 Å²	56.6	29%	0.287	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-44.6	173.4	-71.3	-179.2	-176.6	-159.9	9.1	111.2	V90 E95 A361 I362 K368 N369	V90-R365 HydrophobicContact CG1-CB 3.94Å; V90-R365 PolarHBondContact O-NH1 2.93Å; E95-R365 VanDerWaalsContact CD-NH1 3.32Å; E95-R365 IonicContact OE1-CZ 2.79Å; E95-R365 IonicContact OE1-NH1 3.2Å; E95-R365 PolarHBondContact OE1-NH1 2.88Å; E95-R365 VanDerWaalsContact OE1-NH1 3.07Å; E95-R365 IonicContact OE1-NH2 2.63Å; E95-R365 PolarHBondContact OE1-NH2 3.26Å; E95-R365 IonicContact OE2-CZ 2.72Å; E95-R365 IonicContact OE2-NH1 4Å; E95-R365 PolarHBondContact OE2-NH1 3.25Å; E95-R365 IonicContact OE2-NH2 2.8Å; A361-R365 WeakPolarHBondContact O-CG 3.07Å; A361-R365 PolarHBondContact O-N 3.17Å; I362-R365 WeakPolarHBondContact O-CB 3.29Å; I362-R365 PolarHBondContact O-N 3.06Å; I362-R365 VanDerWaalsContact O-N 3.12Å; R365-K368 PolarHBondContact O-N 3.49Å; R365-N369 WeakPolarHBondContact O-CB 3.49Å; R365-N369 PolarHBondContact O-N 3.02Å
366	I	86.4	Confident	85.1	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.036	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-48.8	179.7	-69.8	163.6	0	0	0	111.3	M53 V90 V170 M173 I362 V363 Q364 K368 N369 R370	M53-I366 HydrophobicContact CE-CD1 3.99Å; M53-I366 HydrophobicContact SD-CD1 3.9Å; V90-I366 HydrophobicContact CG1-CG1 3.79Å; V90-I366 HydrophobicContact CG2-CG1 4.04Å; V170-I366 HydrophobicContact CG1-CG2 3.99Å; V170-I366 HydrophobicContact CG2-CD1 4.4Å; V170-I366 HydrophobicContact CG2-CG2 4.14Å; M173-I366 HydrophobicContact CE-CD1 3.65Å; M173-I366 HydrophobicContact SD-CD1 3.39Å; M173-I366 WeakPolarHBondContact SD-CD1 3.08Å; I362-I366 HydrophobicContact CG2-CD1 3.95Å; I362-I366 WeakPolarHBondContact O-CG1 3.37Å; I362-I366 PolarHBondContact O-N 3.2Å; V363-I366 PolarHBondContact O-N 3.4Å; Q364-I366 VanDerWaalsContact C-N 3.34Å; Q364-I366 PolarHBondContact O-N 2.81Å; I366-K368 VanDerWaalsContact C-N 3.33Å; I366-K368 PolarHBondContact O-N 2.89Å; I366-N369 PolarHBondContact O-N 3.19Å; I366-R370 WeakPolarHBondContact O-CB 3.45Å; I366-R370 PolarHBondContact O-N 3.19Å
367	I	82.6	Confident	84.2	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.108	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-44.1	177.8	-66.6	162.3	0	0	0	110.6	L174 T177 V363 R370 L371	L174-I367 HydrophobicContact CD2-CG1 4.37Å; T177-I367 HydrophobicContact CG2-CD1 3.84Å; V363-I367 HydrophobicContact CG1-CD1 3.68Å; V363-I367 WeakPolarHBondContact O-CD1 3.22Å; V363-I367 VanDerWaalsContact O-CG1 3.3Å; V363-I367 WeakPolarHBondContact O-CG1 3.23Å; V363-I367 PolarHBondContact O-N 3.29Å; I367-R370 WeakPolarHBondContact O-CB 3.39Å; I367-R370 PolarHBondContact O-N 3.31Å; I367-L371 HydrophobicContact CG2-CD1 4.1Å; I367-L371 WeakPolarHBondContact O-CG 3.26Å; I367-L371 PolarHBondContact O-N 2.92Å
368	K	84.3	Confident	83.4	Confident	136 Å²	136	63.8 Å²	63.8	59%	0.591	31%	0.31	S	S	*	.	H	α-helix	trans	-61	-46.4	176.2	-176.6	178.7	177.7	-178.3	0	112.1	Q364 R365 I366 R370 L371 L372	Q364-K368 VanDerWaalsContact O-CB 3.29Å; Q364-K368 WeakPolarHBondContact O-CB 3.4Å; Q364-K368 PolarHBondContact O-N 3.04Å; R365-K368 PolarHBondContact O-N 3.49Å; I366-K368 VanDerWaalsContact C-N 3.33Å; I366-K368 PolarHBondContact O-N 2.89Å; K368-R370 VanDerWaalsContact C-N 3.29Å; K368-R370 PolarHBondContact O-N 3.31Å; K368-L371 PolarHBondContact O-N 2.88Å; K368-L372 HydrophobicContact CG-CD1 4.11Å; K368-L372 WeakPolarHBondContact O-CB 3.34Å; K368-L372 VanDerWaalsContact O-CG 3.29Å; K368-L372 WeakPolarHBondContact O-CG 3.28Å; K368-L372 PolarHBondContact O-N 3.04Å
369	N	80.6	Confident	82.8	Confident	50 Å²	50	68.8 Å²	68.8	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-64.7	-34.2	177.9	-77.4	7.8	0	0	0	112	P89 R365 I366 L372 F373	P89-N369 PolarHBondContact O-ND2 2.8Å; R365-N369 WeakPolarHBondContact O-CB 3.49Å; R365-N369 PolarHBondContact O-N 3.02Å; I366-N369 PolarHBondContact O-N 3.19Å; N369-L372 PolarHBondContact O-N 3.24Å; N369-F373 PolarHBondContact O-N 3.1Å
370	R	77.2	Confident	82.1	Confident	74 Å²	74	74.3 Å²	74.3	28%	0.279	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-49.9	175.1	-177.8	63.5	-171.9	-152.6	-0.1	112.1	L174 Y189 I366 I367 K368 L372 F373 E374	L174-R370 HydrophobicContact CD2-CG 4.39Å; Y189-R370 PolarHBondContact OH-NH2 2.68Å; I366-R370 WeakPolarHBondContact O-CB 3.45Å; I366-R370 PolarHBondContact O-N 3.19Å; I367-R370 WeakPolarHBondContact O-CB 3.39Å; I367-R370 PolarHBondContact O-N 3.31Å; K368-R370 VanDerWaalsContact C-N 3.29Å; K368-R370 PolarHBondContact O-N 3.31Å; R370-L372 VanDerWaalsContact C-N 3.27Å; R370-L372 PolarHBondContact O-N 2.84Å; R370-F373 WeakPolarHBondContact O-CA 3.47Å; R370-F373 WeakPolarHBondContact O-CB 3.48Å; R370-F373 PolarHBondContact O-N 2.97Å; R370-E374 IonicContact CZ-OE1 3.41Å; R370-E374 VanDerWaalsContact CZ-OE1 3.3Å; R370-E374 IonicContact NE-OE1 3.16Å; R370-E374 PolarHBondContact NE-OE1 2.78Å; R370-E374 IonicContact NH2-OE1 3.86Å; R370-E374 PolarHBondContact NH2-OE1 3.31Å; R370-E374 PolarHBondContact O-N 2.97Å
371	L	77.4	Confident	81.5	Confident	99 Å²	99	77.1 Å²	77.1	52%	0.518	36%	0.363	S	S	.	.	H	α-helix	trans	-60.1	-37.4	176.2	-67.4	169.1	0	0	0	112	I367 K368 F373 A375	I367-L371 HydrophobicContact CG2-CD1 4.1Å; I367-L371 WeakPolarHBondContact O-CG 3.26Å; I367-L371 PolarHBondContact O-N 2.92Å; K368-L371 PolarHBondContact O-N 2.88Å; L371-F373 VanDerWaalsContact C-N 3.34Å; L371-A375 VanDerWaalsContact O-CB 3.23Å; L371-A375 WeakPolarHBondContact O-CB 3.44Å; L371-A375 PolarHBondContact O-N 2.99Å
372	L	77.3	Confident	81.1	Confident	93 Å²	93	78.2 Å²	78.2	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-71.8	-22.5	174.5	-70.3	171.4	0	0	0	113.8	K368 N369 R370 R376	K368-L372 HydrophobicContact CG-CD1 4.11Å; K368-L372 WeakPolarHBondContact O-CB 3.34Å; K368-L372 VanDerWaalsContact O-CG 3.29Å; K368-L372 WeakPolarHBondContact O-CG 3.28Å; K368-L372 PolarHBondContact O-N 3.04Å; N369-L372 PolarHBondContact O-N 3.24Å; R370-L372 VanDerWaalsContact C-N 3.27Å; R370-L372 PolarHBondContact O-N 2.84Å; L372-R376 VanDerWaalsContact O-CG 3.29Å; L372-R376 WeakPolarHBondContact O-CG 3.27Å; L372-R376 PolarHBondContact O-N 3Å; L372-R376 PolarHBondContact O-NE 2.94Å
373	F	75	Confident	80.5	Confident	86 Å²	86	85.6 Å²	85.6	38%	0.377	40%	0.404	S	S	.	.	H	α-helix	trans	-77.2	-49.9	171.1	175.6	-101.5	0	0	0	110.6	N369 R370 L371 A375 R376 N377	N369-F373 PolarHBondContact O-N 3.1Å; R370-F373 WeakPolarHBondContact O-CA 3.47Å; R370-F373 WeakPolarHBondContact O-CB 3.48Å; R370-F373 PolarHBondContact O-N 2.97Å; L371-F373 VanDerWaalsContact C-N 3.34Å; F373-A375 VanDerWaalsContact C-N 3.34Å; F373-A375 PolarHBondContact O-N 2.9Å; F373-R376 WeakPolarHBondContact O-CA 3.36Å; F373-R376 WeakPolarHBondContact O-CB 3.4Å; F373-R376 PolarHBondContact O-N 3.37Å; F373-N377 VanDerWaalsContact CE1-ND2 3.27Å; F373-N377 WeakPolarHBondContact CE1-ND2 3.13Å; F373-N377 WeakPolarHBondContact CZ-ND2 3.36Å; F373-N377 PolarHBondContact O-N 2.88Å; F373-N377 PolarHBondContact O-OD1 3.49Å
374	E	75.1	Confident	80.2	Confident	59 Å²	59	89.8 Å²	89.8	28%	0.276	42%	0.423	S	S	.	.	H	α-helix	trans	-59.3	-43.3	177.8	-69.3	166	168.9	0	0	111.8	R370 R376 N377 K378	R370-E374 IonicContact CZ-OE1 3.41Å; R370-E374 VanDerWaalsContact CZ-OE1 3.3Å; R370-E374 IonicContact NE-OE1 3.16Å; R370-E374 PolarHBondContact NE-OE1 2.78Å; R370-E374 IonicContact NH2-OE1 3.86Å; R370-E374 PolarHBondContact NH2-OE1 3.31Å; R370-E374 PolarHBondContact O-N 2.97Å; E374-R376 VanDerWaalsContact C-N 3.26Å; E374-R376 PolarHBondContact O-N 3.15Å; E374-N377 PolarHBondContact O-N 2.94Å; E374-K378 WeakPolarHBondContact O-CB 3.26Å; E374-K378 PolarHBondContact O-N 3.02Å
375	A	76.7	Confident	80	Confident	49 Å²	49	88.9 Å²	88.9	41%	0.405	42%	0.42	S	S	.	.	H	α-helix	trans	-67.3	-20.5	175.1	0	0	0	0	0	114.3	L371 F373 K379	L371-A375 VanDerWaalsContact O-CB 3.23Å; L371-A375 WeakPolarHBondContact O-CB 3.44Å; L371-A375 PolarHBondContact O-N 2.99Å; F373-A375 VanDerWaalsContact C-N 3.34Å; F373-A375 PolarHBondContact O-N 2.9Å; A375-K379 WeakPolarHBondContact O-CD 3.47Å; A375-K379 VanDerWaalsContact O-CG 3.27Å; A375-K379 WeakPolarHBondContact O-CG 3.25Å
376	R	74.3	Confident	79.7	Confident	128 Å²	128	87.7 Å²	87.7	48%	0.483	43%	0.427	S	S	.	.	H	α-helix	trans	-82.9	-44.7	171.6	-79.9	-176.6	-63.8	154.5	1.9	111.4	L372 F373 E374 K379 K380	L372-R376 VanDerWaalsContact O-CG 3.29Å; L372-R376 WeakPolarHBondContact O-CG 3.27Å; L372-R376 PolarHBondContact O-N 3Å; L372-R376 PolarHBondContact O-NE 2.94Å; F373-R376 WeakPolarHBondContact O-CA 3.36Å; F373-R376 WeakPolarHBondContact O-CB 3.4Å; F373-R376 PolarHBondContact O-N 3.37Å; E374-R376 VanDerWaalsContact C-N 3.26Å; E374-R376 PolarHBondContact O-N 3.15Å; R376-K379 PolarHBondContact O-N 2.82Å; R376-K380 PolarHBondContact O-N 2.62Å
377	N	74.4	Confident	79.7	Confident	57 Å²	57	91 Å²	91	31%	0.305	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-49	178.9	-70.9	11.4	0	0	0	111.1	F373 E374 K379 K380 E381	F373-N377 VanDerWaalsContact CE1-ND2 3.27Å; F373-N377 WeakPolarHBondContact CE1-ND2 3.13Å; F373-N377 WeakPolarHBondContact CZ-ND2 3.36Å; F373-N377 PolarHBondContact O-N 2.88Å; F373-N377 PolarHBondContact O-OD1 3.49Å; E374-N377 PolarHBondContact O-N 2.94Å; N377-K379 PolarHBondContact O-N 3.43Å; N377-K379 VanDerWaalsContact O-N 3.12Å; N377-K380 CarbonylContact O-C 3.53Å; N377-K380 WeakPolarHBondContact O-CA 3.32Å; N377-K380 WeakPolarHBondContact O-CB 3.47Å; N377-K380 PolarHBondContact O-N 3.32Å; N377-E381 WeakPolarHBondContact CB-OE1 2.98Å; N377-E381 WeakPolarHBondContact O-CG 3.47Å; N377-E381 PolarHBondContact O-N 3.02Å
378	K	79	Confident	79.8	Confident	159 Å²	159	94.4 Å²	94.4	69%	0.691	47%	0.465	S	S	*	.	H	α-helix	trans	-57.2	-31.6	175.5	-169.9	168.4	-174.4	168.9	0	113.6	E374 A382	E374-K378 WeakPolarHBondContact O-CB 3.26Å; E374-K378 PolarHBondContact O-N 3.02Å; K378-A382 VanDerWaalsContact O-CB 3.24Å; K378-A382 WeakPolarHBondContact O-CB 3.33Å; K378-A382 PolarHBondContact O-N 3.28Å
379	K	79.7	Confident	79.9	Confident	154 Å²	154	93 Å²	93	67%	0.67	46%	0.46	S	S	*	.	H	α-helix	trans	-78.1	-26.4	173.6	-75.6	178.5	-177.1	-177.9	0	113.5	A375 R376 N377 K383	A375-K379 WeakPolarHBondContact O-CD 3.47Å; A375-K379 VanDerWaalsContact O-CG 3.27Å; A375-K379 WeakPolarHBondContact O-CG 3.25Å; R376-K379 PolarHBondContact O-N 2.82Å; N377-K379 PolarHBondContact O-N 3.43Å; N377-K379 VanDerWaalsContact O-N 3.12Å; K379-K383 WeakPolarHBondContact O-CG 3.5Å
380	K	77.7	Confident	80.1	Confident	124 Å²	124	93 Å²	93	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-75.9	-52.8	173.7	-177.8	-175.2	163.6	-175.6	0	110	R376 N377 A382 K383 E384	R376-K380 PolarHBondContact O-N 2.62Å; N377-K380 CarbonylContact O-C 3.53Å; N377-K380 WeakPolarHBondContact O-CA 3.32Å; N377-K380 WeakPolarHBondContact O-CB 3.47Å; N377-K380 PolarHBondContact O-N 3.32Å; K380-A382 VanDerWaalsContact C-N 3.33Å; K380-A382 PolarHBondContact O-N 2.88Å; K380-K383 WeakPolarHBondContact O-CA 3.39Å; K380-K383 WeakPolarHBondContact O-CB 3.31Å; K380-K383 PolarHBondContact O-N 3.4Å; K380-E384 VanDerWaalsContact CE-CD 3.41Å; K380-E384 WeakPolarHBondContact CE-OE1 3.24Å; K380-E384 WeakPolarHBondContact CE-OE2 3.38Å; K380-E384 HydrophobicContact CG-CG 4.5Å; K380-E384 IonicContact NZ-OE1 3.76Å; K380-E384 PolarHBondContact O-N 3.42Å
381	E	78.9	Confident	80.4	Confident	94 Å²	94	94.9 Å²	94.9	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-52.1	-48.7	175.2	-68.2	150.9	-152.6	0	0	111.5	N377 K383 E384 I385	N377-E381 WeakPolarHBondContact CB-OE1 2.98Å; N377-E381 WeakPolarHBondContact O-CG 3.47Å; N377-E381 PolarHBondContact O-N 3.02Å; E381-K383 VanDerWaalsContact C-N 3.27Å; E381-K383 PolarHBondContact O-N 3.48Å; E381-E384 PolarHBondContact O-N 3.02Å; E381-I385 WeakPolarHBondContact O-CB 3.49Å; E381-I385 VanDerWaalsContact O-CG1 3.26Å; E381-I385 WeakPolarHBondContact O-CG1 3.48Å; E381-I385 PolarHBondContact O-N 2.92Å
382	A	82.9	Confident	80.7	Confident	58 Å²	58	96 Å²	96	48%	0.479	48%	0.482	S	S	.	.	H	α-helix	trans	-61.1	-32.7	177.8	0	0	0	0	0	113.5	K378 K380 A386	K378-A382 VanDerWaalsContact O-CB 3.24Å; K378-A382 WeakPolarHBondContact O-CB 3.33Å; K378-A382 PolarHBondContact O-N 3.28Å; K380-A382 VanDerWaalsContact C-N 3.33Å; K380-A382 PolarHBondContact O-N 2.88Å; A382-A386 VanDerWaalsContact O-CB 3.31Å; A382-A386 WeakPolarHBondContact O-CB 3.37Å; A382-A386 PolarHBondContact O-N 3.35Å
383	K	81.6	Confident	81	Confident	157 Å²	157	99.2 Å²	99.2	68%	0.683	49%	0.487	S	S	*	.	H	α-helix	trans	-73.5	-43.4	173.6	-75.9	178.7	174.5	-168.8	0	111.8	K379 K380 E381 A386 V387	K379-K383 WeakPolarHBondContact O-CG 3.5Å; K380-K383 WeakPolarHBondContact O-CA 3.39Å; K380-K383 WeakPolarHBondContact O-CB 3.31Å; K380-K383 PolarHBondContact O-N 3.4Å; E381-K383 VanDerWaalsContact C-N 3.27Å; E381-K383 PolarHBondContact O-N 3.48Å; K383-A386 PolarHBondContact O-N 3.05Å; K383-V387 WeakPolarHBondContact O-CG2 3.48Å; K383-V387 PolarHBondContact O-N 3.41Å
384	E	82.8	Confident	81.2	Confident	92 Å²	92	100.2 Å²	100.2	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-43.3	-179.8	-70.9	172	155	0	0	111	K380 E381 A386 V387 I388	K380-E384 VanDerWaalsContact CE-CD 3.41Å; K380-E384 WeakPolarHBondContact CE-OE1 3.24Å; K380-E384 WeakPolarHBondContact CE-OE2 3.38Å; K380-E384 HydrophobicContact CG-CG 4.5Å; K380-E384 IonicContact NZ-OE1 3.76Å; K380-E384 PolarHBondContact O-N 3.42Å; E381-E384 PolarHBondContact O-N 3.02Å; E384-A386 PolarHBondContact O-N 3.42Å; E384-V387 PolarHBondContact O-N 3.29Å; E384-I388 VanDerWaalsContact O-CG1 3.29Å; E384-I388 WeakPolarHBondContact O-CG1 3.23Å; E384-I388 PolarHBondContact O-N 2.85Å
385	I	84.2	Confident	81.4	Confident	93 Å²	93	103.2 Å²	103.2	48%	0.477	51%	0.507	S	S	.	.	H	α-helix	trans	-59.6	-44.8	172	-67.4	166	0	0	0	111	E381 V387 I388 Q389	E381-I385 WeakPolarHBondContact O-CB 3.49Å; E381-I385 VanDerWaalsContact O-CG1 3.26Å; E381-I385 WeakPolarHBondContact O-CG1 3.48Å; E381-I385 PolarHBondContact O-N 2.92Å; I385-V387 PolarHBondContact O-N 3.07Å; I385-I388 PolarHBondContact O-N 3.37Å; I385-Q389 HydrophobicContact CG2-CG 4.44Å; I385-Q389 WeakPolarHBondContact O-CB 3.41Å; I385-Q389 VanDerWaalsContact O-CG 3.31Å; I385-Q389 WeakPolarHBondContact O-CG 3.08Å; I385-Q389 PolarHBondContact O-N 3.15Å
386	A	85.9	Confident	81.5	Confident	52 Å²	52	105.9 Å²	105.9	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-38.6	178.3	0	0	0	0	0	112.8	A382 K383 E384 Q389 A390	A382-A386 VanDerWaalsContact O-CB 3.31Å; A382-A386 WeakPolarHBondContact O-CB 3.37Å; A382-A386 PolarHBondContact O-N 3.35Å; K383-A386 PolarHBondContact O-N 3.05Å; E384-A386 PolarHBondContact O-N 3.42Å; A386-Q389 PolarHBondContact O-N 2.87Å; A386-A390 WeakPolarHBondContact O-CB 3.3Å; A386-A390 PolarHBondContact O-N 2.64Å
387	V	85.6	Confident	81.5	Confident	77 Å²	77	105.8 Å²	105.8	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-65	-45.9	174.4	169.8	0	0	0	0	111.1	K383 E384 I385 Q389 A390 M391	K383-V387 WeakPolarHBondContact O-CG2 3.48Å; K383-V387 PolarHBondContact O-N 3.41Å; E384-V387 PolarHBondContact O-N 3.29Å; I385-V387 PolarHBondContact O-N 3.07Å; V387-Q389 VanDerWaalsContact C-N 3.33Å; V387-Q389 PolarHBondContact O-N 3.13Å; V387-A390 PolarHBondContact O-N 3.35Å; V387-M391 HydrophobicContact CG1-CE 3.82Å; V387-M391 HydrophobicContact CG1-SD 4.09Å; V387-M391 WeakPolarHBondContact O-CG 3.33Å; V387-M391 PolarHBondContact O-N 2.87Å
388	I	84.4	Confident	81.4	Confident	92 Å²	92	109.7 Å²	109.7	47%	0.472	53%	0.53	S	S	.	.	H	α-helix	trans	-61.8	-41.1	177.3	-67.9	163.7	0	0	0	111	E384 I385 M391 K392	E384-I388 VanDerWaalsContact O-CG1 3.29Å; E384-I388 WeakPolarHBondContact O-CG1 3.23Å; E384-I388 PolarHBondContact O-N 2.85Å; I385-I388 PolarHBondContact O-N 3.37Å; I388-M391 PolarHBondContact O-N 3.32Å; I388-K392 WeakPolarHBondContact O-CG 3.24Å; I388-K392 PolarHBondContact O-N 3.35Å
389	Q	86.8	Confident	80.9	Confident	105 Å²	105	106.3 Å²	106.3	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-65.9	-38.9	175.5	-73.3	178	4	0	0	112.4	I385 A386 V387 R393	I385-Q389 HydrophobicContact CG2-CG 4.44Å; I385-Q389 WeakPolarHBondContact O-CB 3.41Å; I385-Q389 VanDerWaalsContact O-CG 3.31Å; I385-Q389 WeakPolarHBondContact O-CG 3.08Å; I385-Q389 PolarHBondContact O-N 3.15Å; A386-Q389 PolarHBondContact O-N 2.87Å; V387-Q389 VanDerWaalsContact C-N 3.33Å; V387-Q389 PolarHBondContact O-N 3.13Å; Q389-R393 WeakPolarHBondContact O-CG 3.48Å; Q389-R393 PolarHBondContact O-N 3.09Å; Q389-R393 VanDerWaalsContact O-N 3.13Å
390	A	85.3	Confident	80.3	Confident	51 Å²	51	104.9 Å²	104.9	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-66.3	-42	175.9	0	0	0	0	0	112	A386 V387 R393 Q394	A386-A390 WeakPolarHBondContact O-CB 3.3Å; A386-A390 PolarHBondContact O-N 2.64Å; V387-A390 PolarHBondContact O-N 3.35Å; A390-R393 PolarHBondContact O-N 2.69Å; A390-Q394 PolarHBondContact O-N 2.74Å; A390-Q394 VanDerWaalsContact O-N 3.12Å
391	M	83.8	Confident	79.5	Confident	113 Å²	113	100.8 Å²	100.8	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-60.2	-49.4	175.1	-73.3	175.5	170.5	0	0	111.5	V387 I388 R393 Q394 E395	V387-M391 HydrophobicContact CG1-CE 3.82Å; V387-M391 HydrophobicContact CG1-SD 4.09Å; V387-M391 WeakPolarHBondContact O-CG 3.33Å; V387-M391 PolarHBondContact O-N 2.87Å; I388-M391 PolarHBondContact O-N 3.32Å; M391-R393 VanDerWaalsContact C-N 3.34Å; M391-R393 PolarHBondContact O-N 3.46Å; M391-Q394 PolarHBondContact O-N 2.77Å; M391-Q394 VanDerWaalsContact O-N 3.13Å; M391-E395 PolarHBondContact O-N 3.48Å
392	K	83.9	Confident	78.6	Confident	124 Å²	124	105.8 Å²	105.8	54%	0.539	53%	0.525	S	S	.	.	H	α-helix	trans	-58.4	-42.3	177.8	-74.3	-176	176.2	-169.6	0	112.9	I388 Q394 E395 E396	I388-K392 WeakPolarHBondContact O-CG 3.24Å; I388-K392 PolarHBondContact O-N 3.35Å; K392-Q394 PolarHBondContact O-N 2.77Å; K392-E395 PolarHBondContact O-N 3.15Å; K392-E396 WeakPolarHBondContact O-CG 3.41Å; K392-E396 PolarHBondContact O-N 3.1Å
393	R	83.6	Confident	77.3	Confident	160 Å²	160	106.6 Å²	106.6	60%	0.604	53%	0.527	S	S	*	.	H	α-helix	trans	-60.5	-43.7	175.2	-72.6	176.3	-174.8	-176.2	3	112.1	Q389 A390 M391 E395 E396 E397	Q389-R393 WeakPolarHBondContact O-CG 3.48Å; Q389-R393 PolarHBondContact O-N 3.09Å; Q389-R393 VanDerWaalsContact O-N 3.13Å; A390-R393 PolarHBondContact O-N 2.69Å; M391-R393 VanDerWaalsContact C-N 3.34Å; M391-R393 PolarHBondContact O-N 3.46Å; R393-E395 VanDerWaalsContact C-N 3.31Å; R393-E395 PolarHBondContact O-N 3.4Å; R393-E396 PolarHBondContact O-N 3.12Å; R393-E397 WeakPolarHBondContact O-CB 3.08Å; R393-E397 VanDerWaalsContact O-CG 3.27Å; R393-E397 WeakPolarHBondContact O-CG 3.45Å; R393-E397 PolarHBondContact O-N 3.31Å
394	Q	79.2	Confident	76.1	Confident	107 Å²	107	106.7 Å²	106.7	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-31.6	175.7	-71.1	-173.2	-1.2	0	0	113.1	A390 M391 K392 K398	A390-Q394 PolarHBondContact O-N 2.74Å; A390-Q394 VanDerWaalsContact O-N 3.12Å; M391-Q394 PolarHBondContact O-N 2.77Å; M391-Q394 VanDerWaalsContact O-N 3.13Å; K392-Q394 PolarHBondContact O-N 2.77Å; Q394-K398 VanDerWaalsContact O-CB 3.32Å; Q394-K398 WeakPolarHBondContact O-CB 3.15Å; Q394-K398 WeakPolarHBondContact O-CD 3.18Å; Q394-K398 WeakPolarHBondContact O-CG 3.47Å; Q394-K398 PolarHBondContact O-N 2.72Å
395	E	79	Confident	74.8	Confident	122 Å²	122	106.1 Å²	106.1	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-71.6	-42.1	173.8	-69.7	-179.3	141.3	0	0	111.9	M391 K392 R393 K398 T399	M391-E395 PolarHBondContact O-N 3.48Å; K392-E395 PolarHBondContact O-N 3.15Å; R393-E395 VanDerWaalsContact C-N 3.31Å; R393-E395 PolarHBondContact O-N 3.4Å; E395-K398 PolarHBondContact O-N 3.47Å; E395-T399 WeakPolarHBondContact O-CB 3.44Å; E395-T399 PolarHBondContact O-N 2.9Å; E395-T399 PolarHBondContact O-OG1 3.44Å
396	E	77.7	Confident	73.3	Confident	105 Å²	105	108.8 Å²	108.8	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-43.5	172.8	-72.6	177.3	-144.5	0	0	112.1	K392 R393 T399 K400	K392-E396 WeakPolarHBondContact O-CG 3.41Å; K392-E396 PolarHBondContact O-N 3.1Å; R393-E396 PolarHBondContact O-N 3.12Å; E396-T399 PolarHBondContact O-N 2.67Å; E396-K400 WeakPolarHBondContact O-CB 3.4Å; E396-K400 VanDerWaalsContact O-CG 3.31Å; E396-K400 WeakPolarHBondContact O-CG 3.32Å; E396-K400 PolarHBondContact O-N 3.43Å; E396-K400 IonicContact OE2-NZ 2.81Å
397	E	76.3	Confident	71.5	Confident	126 Å²	126	116.4 Å²	116.4	59%	0.589	59%	0.588	S	S	*	*	H	α-helix	trans	-64.5	-46.3	176.6	-74.6	166.7	179.8	0	0	111.8	R393 T399 K400 G401	R393-E397 WeakPolarHBondContact O-CB 3.08Å; R393-E397 VanDerWaalsContact O-CG 3.27Å; R393-E397 WeakPolarHBondContact O-CG 3.45Å; R393-E397 PolarHBondContact O-N 3.31Å; E397-T399 VanDerWaalsContact C-N 3.28Å; E397-T399 PolarHBondContact O-N 2.92Å; E397-K400 PolarHBondContact O-N 3.07Å; E397-G401 PolarHBondContact O-N 3.29Å
398	K	71.3	Confident	70.8	Confident	138 Å²	138	118.4 Å²	118.4	60%	0.6	59%	0.594	S	S	*	*	H	α-helix	trans	-61.4	-35.9	174.2	-75.8	167.3	-173.9	168	0	112.5	Q394 E395 R402	Q394-K398 VanDerWaalsContact O-CB 3.32Å; Q394-K398 WeakPolarHBondContact O-CB 3.15Å; Q394-K398 WeakPolarHBondContact O-CD 3.18Å; Q394-K398 WeakPolarHBondContact O-CG 3.47Å; Q394-K398 PolarHBondContact O-N 2.72Å; E395-K398 PolarHBondContact O-N 3.47Å; K398-R402 PolarHBondContact O-N 3.03Å
399	T	69.5	Low	70	Confident	88 Å²	88	119.8 Å²	119.8	54%	0.54	60%	0.6	S	S	.	*	H	α-helix	trans	-69.4	-48.4	177.8	-56.1	0	0	0	0	110.7	E395 E396 E397 G401 R402 S403	E395-T399 WeakPolarHBondContact O-CB 3.44Å; E395-T399 PolarHBondContact O-N 2.9Å; E395-T399 PolarHBondContact O-OG1 3.44Å; E396-T399 PolarHBondContact O-N 2.67Å; E397-T399 VanDerWaalsContact C-N 3.28Å; E397-T399 PolarHBondContact O-N 2.92Å; T399-G401 PolarHBondContact O-N 2.64Å; T399-R402 PolarHBondContact O-N 2.63Å; T399-S403 PolarHBondContact O-N 3.09Å; T399-S403 PolarHBondContact O-OG 3.4Å
400	K	65.8	Low	69.1	Low	124 Å²	124	120.6 Å²	120.6	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-59.6	-43.7	175.2	-72.4	163.9	-175	160.3	0	111.9	E396 E397 R402 S403 Q404	E396-K400 WeakPolarHBondContact O-CB 3.4Å; E396-K400 VanDerWaalsContact O-CG 3.31Å; E396-K400 WeakPolarHBondContact O-CG 3.32Å; E396-K400 PolarHBondContact O-N 3.43Å; E396-K400 IonicContact OE2-NZ 2.81Å; E397-K400 PolarHBondContact O-N 3.07Å; K400-R402 PolarHBondContact O-N 2.92Å; K400-S403 PolarHBondContact O-N 2.8Å; K400-Q404 PolarHBondContact O-N 2.92Å
401	G	61.2	Low	68.2	Low	38 Å²	38	124.7 Å²	124.7	39%	0.392	62%	0.617	S	S	.	*	H	α-helix	trans	-62.1	-38.8	175.7	0	0	0	0	0	113.3	E397 T399 Q404 A405	E397-G401 PolarHBondContact O-N 3.29Å; T399-G401 PolarHBondContact O-N 2.64Å; G401-Q404 PolarHBondContact O-N 3.32Å; G401-A405 PolarHBondContact O-N 3.33Å; G401-A405 VanDerWaalsContact O-N 3.16Å
402	R	59.1	Low	67.2	Low	200 Å²	200	125.4 Å²	125.4	76%	0.755	62%	0.621	S	S	*	*	H	α-helix	trans	-64	-41.2	171.4	-93.5	-177.9	162.2	178.1	-5.8	112.7	K398 T399 K400 Q404 A405	K398-R402 PolarHBondContact O-N 3.03Å; T399-R402 PolarHBondContact O-N 2.63Å; K400-R402 PolarHBondContact O-N 2.92Å; R402-Q404 VanDerWaalsContact C-N 3.3Å; R402-Q404 PolarHBondContact O-N 2.95Å; R402-A405 PolarHBondContact O-N 3.24Å
403	S	57.4	Low	66.1	Low	74 Å²	74	125.5 Å²	125.5	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-66.5	-30	176.7	-61.2	0	0	0	0	113.3	T399 K400	T399-S403 PolarHBondContact O-N 3.09Å; T399-S403 PolarHBondContact O-OG 3.4Å; K400-S403 PolarHBondContact O-N 2.8Å
404	Q	56.3	Low	64.8	Low	159 Å²	159	123.1 Å²	123.1	74%	0.743	63%	0.628	S	S	*	*	H	α-helix	trans	-82.2	-14.6	175.4	-72.4	-175.5	-49.6	0	0	114.2	K400 G401 R402	K400-Q404 PolarHBondContact O-N 2.92Å; G401-Q404 PolarHBondContact O-N 3.32Å; R402-Q404 VanDerWaalsContact C-N 3.3Å; R402-Q404 PolarHBondContact O-N 2.95Å
405	A	55.3	Low	63.7	Low	80 Å²	80	124.3 Å²	124.3	66%	0.661	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	13.5	175.5	0	0	0	0	0	113.4	G401 R402	G401-A405 PolarHBondContact O-N 3.33Å; G401-A405 VanDerWaalsContact O-N 3.16Å; R402-A405 PolarHBondContact O-N 3.24Å
406	L	53	Low	62.4	Low	150 Å²	150	124.5 Å²	124.5	79%	0.785	64%	0.643	S	S	*	*			trans	-122.5	17.5	178.3	-85.1	165	0	0	0	112.1
407	L	46.5	Very low	61.1	Low	212 Å²	212	126.3 Å²	126.3	100%	1.11	66%	0.657	S	S	*	*			trans	-129.9	0	174.1	-75.2	167.5	0	0	0	108.6

Retrieved 407 of 407 residues in 156.7 ms (Link to these results)

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