A0A087YGY8_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087YGY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 484 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	40.1	Very low	32.9	Very low	206 Å²	206	149.9 Å²	149.9	100%	1.015	84%	0.836	S	S	*	*				0	106	0	-84.5	174	-176.6	0	0	107.1
2	E	28.4	Very low	32.3	Very low	198 Å²	198	146.7 Å²	146.7	93%	0.925	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-84.9	120.9	167.9	-70.7	-178.4	157.5	0	0	107
3	L	39.7	Very low	32	Very low	126 Å²	126	142.9 Å²	142.9	66%	0.66	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-102.7	121.1	-175.6	-70.9	165.3	0	0	0	108.9
4	S	32	Very low	31.7	Very low	107 Å²	107	149.6 Å²	149.6	75%	0.748	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.5	143.2	174.2	50.7	0	0	0	0	111.7
5	P	33.2	Very low	31.3	Very low	126 Å²	126	144.9 Å²	144.9	82%	0.818	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.3	137.9	176.8	31.6	-31.3	0	0	0	111.4
6	V	36.3	Very low	30.9	Very low	138 Å²	138	140.7 Å²	140.7	84%	0.836	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-93.8	133	174.1	177.4	0	0	0	0	110
7	C	28.1	Very low	31	Very low	123 Å²	123	141.8 Å²	141.8	83%	0.831	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-63.9	146.5	178.3	-69.1	0	0	0	0	113.2
8	S	34.5	Very low	31	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-93	135.7	170.6	-42.7	0	0	0	0	109.2
9	E	29.9	Very low	31.1	Very low	200 Å²	200	146.7 Å²	146.7	94%	0.935	83%	0.832	S	S	*	*			trans	-159.8	151.8	156.1	-114.5	172	-153	0	0	112.5
10	D	28.9	Very low	31.1	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	83%	0.829	S	S	*	*			trans	-92.9	159.6	-152	-80.2	-54.5	0	0	0	117.2
11	I	31.1	Very low	31.2	Very low	158 Å²	158	146.5 Å²	146.5	81%	0.81	84%	0.835	S	S	*	*			trans	-15.9	130.5	156.3	-58.3	164.7	0	0	0	117.9
12	S	25.1	Very low	31	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	82%	0.818	S	S	*	*				-169.2	131	119	66.5	0	0	0	0	115.8
13	S	28.6	Very low	31.3	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	81%	0.814	S	S	*	*			trans	29.8	114.7	141.4	169.3	0	0	0	0	120.9
14	Y	28.2	Very low	31.3	Very low	236 Å²	236	138.2 Å²	138.2	93%	0.925	82%	0.821	S	S	*	*				-157.4	129.8	126.2	-104.9	-79.1	0	0	0	110.5
15	G	25.1	Very low	31.7	Very low	80 Å²	80	144.4 Å²	144.4	83%	0.825	83%	0.828	S	S	*	*			trans	-81.3	147.2	179.8	0	0	0	0	0	113.3
16	G	25.3	Very low	32.5	Very low	77 Å²	77	148 Å²	148	79%	0.794	83%	0.831	S	S	*	*			trans	-168.5	105.2	172.5	0	0	0	0	0	110.6	L18	G16-L18 PolarHBondContact O-N 2.83Å
17	I	32.7	Very low	33.6	Very low	160 Å²	160	152.5 Å²	152.5	82%	0.821	83%	0.833	S	S	*	*			trans	-73.1	115.6	178.7	-67.7	165.2	0	0	0	109
18	L	31.4	Very low	35.9	Very low	170 Å²	170	156.2 Å²	156.2	89%	0.89	84%	0.835	S	S	*	*			trans	-135.6	113	155.9	-77.1	173.6	0	0	0	108.7	G16 S20	G16-L18 PolarHBondContact O-N 2.83Å; L18-S20 PolarHBondContact O-N 2.74Å
19	K	31.8	Very low	38.2	Very low	206 Å²	206	153.7 Å²	153.7	90%	0.896	81%	0.812	S	S	*	*			trans	-65	125	173.3	-69.9	177	175.7	178	0	108.8
20	S	30.9	Very low	41.1	Very low	111 Å²	111	147 Å²	147	78%	0.776	79%	0.787	S	S	*	*			trans	-137	124.7	155.6	57.1	0	0	0	0	108.9	L18 A22	L18-S20 PolarHBondContact O-N 2.74Å; S20-A22 PolarHBondContact O-N 3.01Å; S20-A22 VanDerWaalsContact O-N 3.09Å
21	D	34.8	Very low	44.1	Very low	179 Å²	179	147.7 Å²	147.7	96%	0.957	78%	0.783	S	S	*	*			trans	-66.6	99	176.7	-80.8	-47.4	0	0	0	110.1
22	A	34.1	Very low	47	Very low	78 Å²	78	145.6 Å²	145.6	65%	0.645	77%	0.773	S	S	*	*			trans	-139.7	85.6	160	0	0	0	0	0	107.7	S20 H24	S20-A22 PolarHBondContact O-N 3.01Å; S20-A22 VanDerWaalsContact O-N 3.09Å; A22-H24 PolarHBondContact O-N 2.97Å
23	A	35.6	Very low	50.3	Low	103 Å²	103	141.3 Å²	141.3	85%	0.851	74%	0.742	S	S	*	*			trans	-70.5	64.6	173.9	0	0	0	0	0	111.3	R25	A23-R25 VanDerWaalsContact C-N 3.3Å; A23-R25 PolarHBondContact O-N 3.29Å
24	H	38.6	Very low	53.5	Low	175 Å²	175	140.9 Å²	140.9	81%	0.81	73%	0.729	S	S	*	*			trans	-74.7	92.1	150.5	-92.4	73.9	0	0	0	106.5	A22 K26	A22-H24 PolarHBondContact O-N 2.97Å; H24-K26 PolarHBondContact O-N 3.05Å
25	R	41.4	Very low	56.7	Low	237 Å²	237	134.6 Å²	134.6	89%	0.894	71%	0.711	S	S	*	*			trans	-57.2	94.5	161.9	-87.5	-176.7	-179.2	-179.7	1	107.2	A23 R27	A23-R25 VanDerWaalsContact C-N 3.3Å; A23-R25 PolarHBondContact O-N 3.29Å; R25-R27 PolarHBondContact O-N 3.31Å
26	K	49.5	Very low	60.1	Low	200 Å²	200	133.4 Å²	133.4	87%	0.87	69%	0.686	S	S	*	*			trans	-55.9	105.5	160.8	-80.4	-177.7	177	176.8	0	105.4	H24 K28	H24-K26 PolarHBondContact O-N 3.05Å; K26-K28 PolarHBondContact O-N 3.19Å; K26-K28 VanDerWaalsContact O-N 3.08Å
27	R	59.4	Low	63.5	Low	234 Å²	234	130.5 Å²	130.5	88%	0.883	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-56	119.3	171.9	-75.5	172.7	83.5	173.5	3.5	105.8	R25 I29	R25-R27 PolarHBondContact O-N 3.31Å; R27-I29 PolarHBondContact O-N 2.99Å; R27-I29 VanDerWaalsContact O-N 3.16Å
28	K	76.5	Confident	66.6	Low	201 Å²	201	127.7 Å²	127.7	87%	0.874	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-62.5	117.9	173.4	-169.6	172.9	-178	176	0	106.5	K26	K26-K28 PolarHBondContact O-N 3.19Å; K26-K28 VanDerWaalsContact O-N 3.08Å
29	I	82.8	Confident	69.7	Low	61 Å²	61	123 Å²	123	31%	0.313	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-62.5	145.8	179.2	-61.3	157.2	0	0	0	107.6	R27 V33 E34 T54	R27-I29 PolarHBondContact O-N 2.99Å; R27-I29 VanDerWaalsContact O-N 3.16Å; I29-V33 HydrophobicContact CG2-CB 3.54Å; I29-V33 HydrophobicContact CG2-CG1 3.39Å; I29-E34 HydrophobicContact CB-CG 4.48Å; I29-E34 HydrophobicContact CG2-CG 4.15Å; I29-T54 WeakPolarHBondContact CD1-O 3.38Å
30	S	90.6	Very high	72.9	Confident	59 Å²	59	113.3 Å²	113.3	41%	0.413	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-69.9	149	177.8	67.8	0	0	0	0	110	D32 V33 E34	S30-D32 PolarHBondContact O-N 3.44Å; S30-V33 PolarHBondContact O-N 3.47Å; S30-V33 VanDerWaalsContact OG-CG2 3.3Å; S30-V33 WeakPolarHBondContact OG-CG2 3.34Å; S30-V33 PolarHBondContact OG-N 3.29Å; S30-E34 PolarHBondContact O-N 2.89Å; S30-E34 VanDerWaalsContact O-N 3.1Å
31	K	92.1	Very high	76.1	Confident	167 Å²	167	110.6 Å²	110.6	73%	0.726	55%	0.548	S	S	*	.	H	α-helix	trans	-55.7	-34.6	176.1	-71.7	-174	175.1	-175.4	0	112.3	V33 E34 L35	K31-V33 VanDerWaalsContact C-N 3.34Å; K31-V33 PolarHBondContact O-N 2.89Å; K31-E34 PolarHBondContact O-N 3.32Å; K31-L35 WeakPolarHBondContact O-CG 3.44Å; K31-L35 PolarHBondContact O-N 3.2Å
32	D	92.8	Very high	79.1	Confident	115 Å²	115	109 Å²	109	62%	0.615	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-39.9	178.3	-56	-33	0	0	0	111.6	S30 L35 D36	S30-D32 PolarHBondContact O-N 3.44Å; D32-L35 PolarHBondContact O-N 2.98Å; D32-D36 WeakPolarHBondContact O-CB 3.17Å; D32-D36 PolarHBondContact O-N 3.18Å
33	V	94.1	Very high	82.1	Confident	20 Å²	20	106.1 Å²	106.1	12%	0.121	51%	0.508	C	S	.	.	H	α-helix	trans	-69.8	-38	176.5	171.5	0	0	0	0	111.1	I29 S30 K31 D36 I37 K56	I29-V33 HydrophobicContact CG2-CB 3.54Å; I29-V33 HydrophobicContact CG2-CG1 3.39Å; S30-V33 PolarHBondContact O-N 3.47Å; S30-V33 VanDerWaalsContact OG-CG2 3.3Å; S30-V33 WeakPolarHBondContact OG-CG2 3.34Å; S30-V33 PolarHBondContact OG-N 3.29Å; K31-V33 VanDerWaalsContact C-N 3.34Å; K31-V33 PolarHBondContact O-N 2.89Å; V33-D36 PolarHBondContact O-N 3.3Å; V33-I37 HydrophobicContact CG1-CD1 3.83Å; V33-I37 HydrophobicContact CG1-CG1 4.4Å; V33-I37 VanDerWaalsContact O-CG1 3.23Å; V33-I37 WeakPolarHBondContact O-CG1 3.14Å; V33-I37 PolarHBondContact O-N 3.37Å; V33-K56 HydrophobicContact CG1-CB 3.85Å; V33-K56 HydrophobicContact CG2-CB 4.09Å
34	E	95.1	Very high	85.1	Confident	90 Å²	90	101.2 Å²	101.2	42%	0.421	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-46.1	173.7	-67.9	173.4	174.6	0	0	111.2	I29 S30 K31 I37 E38	I29-E34 HydrophobicContact CB-CG 4.48Å; I29-E34 HydrophobicContact CG2-CG 4.15Å; S30-E34 PolarHBondContact O-N 2.89Å; S30-E34 VanDerWaalsContact O-N 3.1Å; K31-E34 PolarHBondContact O-N 3.32Å; E34-I37 PolarHBondContact O-N 3.18Å; E34-E38 WeakPolarHBondContact O-CG 3.43Å; E34-E38 PolarHBondContact O-N 3.42Å
35	L	95.8	Very high	87.9	Confident	103 Å²	103	95.2 Å²	95.2	54%	0.539	45%	0.445	S	S	.	.	H	α-helix	trans	-62.9	-41.7	176.4	-70.4	172.4	0	0	0	112.6	K31 D32 I37 E38 S39	K31-L35 WeakPolarHBondContact O-CG 3.44Å; K31-L35 PolarHBondContact O-N 3.2Å; D32-L35 PolarHBondContact O-N 2.98Å; L35-I37 VanDerWaalsContact C-N 3.33Å; L35-I37 PolarHBondContact O-N 3.33Å; L35-E38 PolarHBondContact O-N 2.93Å; L35-S39 WeakPolarHBondContact O-CB 3.35Å; L35-S39 PolarHBondContact O-N 3.48Å
36	D	96.4	Very high	90.6	Very high	56 Å²	56	87.6 Å²	87.6	30%	0.299	42%	0.419	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175.3	-86.9	-2.1	0	0	0	111.5	D32 V33 S39 L40 K56 Y66	D32-D36 WeakPolarHBondContact O-CB 3.17Å; D32-D36 PolarHBondContact O-N 3.18Å; V33-D36 PolarHBondContact O-N 3.3Å; D36-S39 WeakPolarHBondContact O-CB 3.33Å; D36-S39 PolarHBondContact O-N 2.87Å; D36-L40 WeakPolarHBondContact O-CB 3.35Å; D36-L40 PolarHBondContact O-N 3.37Å; D36-K56 IonicContact OD2-NZ 3.19Å; D36-K56 PolarHBondContact OD2-NZ 3.11Å; D36-Y66 HydrophobicContact CB-CE1 4.17Å
37	I	97.5	Very high	92.9	Very high	16 Å²	16	78.1 Å²	78.1	8%	0.082	38%	0.378	C	S	.	.	H	α-helix	trans	-65.8	-44.2	178	-69.8	168.1	0	0	0	110.7	V33 E34 L35 S39 L40 Y41 I53 Y66	V33-I37 HydrophobicContact CG1-CD1 3.83Å; V33-I37 HydrophobicContact CG1-CG1 4.4Å; V33-I37 VanDerWaalsContact O-CG1 3.23Å; V33-I37 WeakPolarHBondContact O-CG1 3.14Å; V33-I37 PolarHBondContact O-N 3.37Å; E34-I37 PolarHBondContact O-N 3.18Å; L35-I37 VanDerWaalsContact C-N 3.33Å; L35-I37 PolarHBondContact O-N 3.33Å; I37-S39 VanDerWaalsContact C-N 3.32Å; I37-S39 PolarHBondContact O-N 2.95Å; I37-L40 WeakPolarHBondContact O-CB 3.48Å; I37-L40 PolarHBondContact O-N 3.18Å; I37-Y41 HydrophobicContact CG2-CD2 3.83Å; I37-Y41 HydrophobicContact CG2-CE2 3.43Å; I37-Y41 VanDerWaalsContact CG2-CE2 3.43Å; I37-Y41 VanDerWaalsContact O-CD2 3.28Å; I37-Y41 WeakPolarHBondContact O-CD2 3.37Å; I37-Y41 PolarHBondContact O-N 3.09Å; I37-I53 HydrophobicContact CD1-CG2 3.93Å; I37-I53 HydrophobicContact CG1-CG2 3.81Å; I37-I53 HydrophobicContact CG2-CB 3.96Å; I37-I53 HydrophobicContact CG2-CG2 4.06Å; I37-Y66 HydrophobicContact CG1-CD1 3.93Å; I37-Y66 HydrophobicContact CG1-CE1 4.1Å
38	E	97.3	Very high	94.6	Very high	100 Å²	100	70.5 Å²	70.5	47%	0.467	36%	0.361	S	S	.	.	H	α-helix	trans	-60.6	-42.4	174.9	-75.2	-176.3	-167.6	0	0	112.1	E34 L35 L40 Y41 K42	E34-E38 WeakPolarHBondContact O-CG 3.43Å; E34-E38 PolarHBondContact O-N 3.42Å; L35-E38 PolarHBondContact O-N 2.93Å; E38-L40 VanDerWaalsContact C-N 3.32Å; E38-L40 PolarHBondContact O-N 3.38Å; E38-Y41 PolarHBondContact O-N 3.15Å; E38-K42 WeakPolarHBondContact O-CG 3.43Å; E38-K42 PolarHBondContact O-N 3.31Å; E38-K42 IonicContact OE2-NZ 3.96Å
39	S	97.3	Very high	95.5	Very high	72 Å²	72	69.8 Å²	69.8	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-42.7	175.5	-172.3	0	0	0	0	111.2	L35 D36 I37 K42 A43	L35-S39 WeakPolarHBondContact O-CB 3.35Å; L35-S39 PolarHBondContact O-N 3.48Å; D36-S39 WeakPolarHBondContact O-CB 3.33Å; D36-S39 PolarHBondContact O-N 2.87Å; I37-S39 VanDerWaalsContact C-N 3.32Å; I37-S39 PolarHBondContact O-N 2.95Å; S39-K42 PolarHBondContact O-N 2.88Å; S39-A43 WeakPolarHBondContact O-CB 3.45Å; S39-A43 PolarHBondContact O-N 3.28Å
40	L	98	Very high	96.2	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-43.5	176.7	179	57.9	0	0	0	112.5	D36 I37 E38 K42 A43 V44 L47 I53 Y66 H84 V124	D36-L40 WeakPolarHBondContact O-CB 3.35Å; D36-L40 PolarHBondContact O-N 3.37Å; I37-L40 WeakPolarHBondContact O-CB 3.48Å; I37-L40 PolarHBondContact O-N 3.18Å; E38-L40 VanDerWaalsContact C-N 3.32Å; E38-L40 PolarHBondContact O-N 3.38Å; L40-K42 VanDerWaalsContact C-N 3.35Å; L40-K42 PolarHBondContact O-N 3.17Å; L40-A43 PolarHBondContact O-N 3.17Å; L40-V44 PolarHBondContact O-N 2.87Å; L40-L47 HydrophobicContact CD1-CD1 3.99Å; L40-L47 HydrophobicContact CD2-CD1 4.28Å; L40-L47 HydrophobicContact CG-CD1 3.86Å; L40-I53 HydrophobicContact CD2-CD1 3.76Å; L40-I53 HydrophobicContact CG-CD1 4.37Å; L40-Y66 HydrophobicContact CD2-CD1 4.45Å; L40-Y66 HydrophobicContact CD2-CD2 3.52Å; L40-Y66 HydrophobicContact CD2-CE2 3.68Å; L40-Y66 HydrophobicContact CD2-CG 3.95Å; L40-H84 HydrophobicContact CD1-CB 3.95Å; L40-V124 HydrophobicContact CD1-CG2 3.84Å
41	Y	98.4	Very high	96.5	Very high	55 Å²	55	67.5 Å²	67.5	22%	0.216	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-38.5	174.9	-73.2	-55.1	0	0	0	112.5	I37 E38 A43 V44 P45 L47 F51 I53	I37-Y41 HydrophobicContact CG2-CD2 3.83Å; I37-Y41 HydrophobicContact CG2-CE2 3.43Å; I37-Y41 VanDerWaalsContact CG2-CE2 3.43Å; I37-Y41 VanDerWaalsContact O-CD2 3.28Å; I37-Y41 WeakPolarHBondContact O-CD2 3.37Å; I37-Y41 PolarHBondContact O-N 3.09Å; E38-Y41 PolarHBondContact O-N 3.15Å; Y41-A43 VanDerWaalsContact C-N 3.35Å; Y41-V44 CarbonylContact O-C 3.57Å; Y41-V44 VanDerWaalsContact O-C 3.27Å; Y41-P45 WeakPolarHBondContact O-CA 3.33Å; Y41-P45 VanDerWaalsContact O-N 3.14Å; Y41-L47 HydrophobicContact CD1-CB 3.9Å; Y41-L47 HydrophobicContact CE1-CB 4.05Å; Y41-F51 PolarHBondContact OH-O 2.98Å; Y41-F51 VanDerWaalsContact OH-O 3.09Å; Y41-I53 HydrophobicContact CD1-CD1 4.32Å; Y41-I53 HydrophobicContact CE1-CD1 3.69Å; Y41-I53 HydrophobicContact CE1-CG1 4.02Å; Y41-I53 HydrophobicContact CE2-CB 4.49Å; Y41-I53 HydrophobicContact CE2-CD1 4.38Å; Y41-I53 WeakPolarHBondContact OH-CB 3.41Å; Y41-I53 WeakPolarHBondContact OH-CG1 3.36Å; Y41-I53 PolarHBondContact OH-N 3.11Å
42	K	97.8	Very high	96.8	Very high	146 Å²	146	66.1 Å²	66.1	64%	0.635	33%	0.333	S	S	*	.	H	α-helix	trans	-64.5	-41.8	175.3	-71.8	168.5	-174.7	164.6	0	111.3	E38 S39 L40	E38-K42 WeakPolarHBondContact O-CG 3.43Å; E38-K42 PolarHBondContact O-N 3.31Å; E38-K42 IonicContact OE2-NZ 3.96Å; S39-K42 PolarHBondContact O-N 2.88Å; L40-K42 VanDerWaalsContact C-N 3.35Å; L40-K42 PolarHBondContact O-N 3.17Å
43	A	97.5	Very high	97	Very high	16 Å²	16	61.3 Å²	61.3	13%	0.132	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-42.4	178.3	0	0	0	0	0	112.8	S39 L40 Y41 K119 H122	S39-A43 WeakPolarHBondContact O-CB 3.45Å; S39-A43 PolarHBondContact O-N 3.28Å; L40-A43 PolarHBondContact O-N 3.17Å; Y41-A43 VanDerWaalsContact C-N 3.35Å; A43-K119 WeakPolarHBondContact O-CD 3.27Å; A43-H122 HydrophobicContact CB-CB 4.34Å; A43-H122 WeakPolarHBondContact CB-ND1 3.47Å
44	V	98.2	Very high	97.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-130.3	79.9	-179.8	-169.5	0	0	0	0	110	L40 Y41 Q46 L47 F117 H122 V124	L40-V44 PolarHBondContact O-N 2.87Å; Y41-V44 CarbonylContact O-C 3.57Å; Y41-V44 VanDerWaalsContact O-C 3.27Å; V44-Q46 VanDerWaalsContact CG1-OE1 3.25Å; V44-Q46 PolarHBondContact O-N 2.86Å; V44-L47 HydrophobicContact CB-CD1 3.9Å; V44-L47 HydrophobicContact CB-CG 4.03Å; V44-L47 HydrophobicContact CG1-CD1 4.22Å; V44-L47 HydrophobicContact CG1-CG 3.88Å; V44-L47 WeakPolarHBondContact O-CB 3.47Å; V44-L47 WeakPolarHBondContact O-CG 3.47Å; V44-L47 PolarHBondContact O-N 2.81Å; V44-F117 HydrophobicContact CG1-CB 3.77Å; V44-H122 HydrophobicContact CG2-CB 3.7Å; V44-V124 HydrophobicContact CG2-CG2 3.96Å
45	P	97.8	Very high	97.2	Very high	50 Å²	50	61.3 Å²	61.3	33%	0.325	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18	-172.8	-25.3	35.4	0	0	0	115.2	Y41 L47 S48 K119	Y41-P45 WeakPolarHBondContact O-CA 3.33Å; Y41-P45 VanDerWaalsContact O-N 3.14Å; P45-L47 PolarHBondContact O-N 3.24Å; P45-S48 PolarHBondContact O-N 3.17Å; P45-S48 PolarHBondContact O-OG 3.07Å; P45-K119 HydrophobicContact CG-CD 4.3Å
46	Q	97.4	Very high	97.2	Very high	77 Å²	77	58 Å²	58	36%	0.36	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-26.8	174.3	-57.7	87.8	-7.1	0	0	111.8	V44 S48 K49 F117	V44-Q46 VanDerWaalsContact CG1-OE1 3.25Å; V44-Q46 PolarHBondContact O-N 2.86Å; Q46-S48 PolarHBondContact O-N 2.9Å; Q46-K49 PolarHBondContact O-N 3.49Å; Q46-F117 HydrophobicContact CB-CD1 3.67Å; Q46-F117 HydrophobicContact CB-CE1 3.86Å; Q46-F117 HydrophobicContact CG-CD1 4.45Å
47	L	97.8	Very high	97.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-64.4	-37.3	-178.3	-65.2	179.2	0	0	0	112.7	L40 Y41 V44 P45 K49 V50 F51 L82 F117 V124	L40-L47 HydrophobicContact CD1-CD1 3.99Å; L40-L47 HydrophobicContact CD2-CD1 4.28Å; L40-L47 HydrophobicContact CG-CD1 3.86Å; Y41-L47 HydrophobicContact CD1-CB 3.9Å; Y41-L47 HydrophobicContact CE1-CB 4.05Å; V44-L47 HydrophobicContact CB-CD1 3.9Å; V44-L47 HydrophobicContact CB-CG 4.03Å; V44-L47 HydrophobicContact CG1-CD1 4.22Å; V44-L47 HydrophobicContact CG1-CG 3.88Å; V44-L47 WeakPolarHBondContact O-CB 3.47Å; V44-L47 WeakPolarHBondContact O-CG 3.47Å; V44-L47 PolarHBondContact O-N 2.81Å; P45-L47 PolarHBondContact O-N 3.24Å; L47-K49 PolarHBondContact O-N 2.94Å; L47-V50 PolarHBondContact O-N 3Å; L47-F51 HydrophobicContact CD2-CD2 3.88Å; L47-F51 HydrophobicContact CD2-CE2 4.14Å; L47-F51 PolarHBondContact O-N 3.25Å; L47-L82 HydrophobicContact CD1-CD2 4.41Å; L47-L82 HydrophobicContact CD2-CD2 3.97Å; L47-F117 HydrophobicContact CD2-CB 4.33Å; L47-F117 HydrophobicContact CD2-CD1 4.49Å; L47-F117 HydrophobicContact CD2-CD2 3.65Å; L47-F117 HydrophobicContact CD2-CE2 4.08Å; L47-F117 HydrophobicContact CD2-CG 3.89Å; L47-V124 HydrophobicContact CD1-CG1 4.28Å; L47-V124 HydrophobicContact CD1-CG2 4.14Å; L47-V124 HydrophobicContact CD2-CG1 4.36Å
48	S	96.4	Very high	97	Very high	75 Å²	75	58.8 Å²	58.8	52%	0.524	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-67.6	-18.4	-177.8	61.6	0	0	0	0	113.3	P45 Q46	P45-S48 PolarHBondContact O-N 3.17Å; P45-S48 PolarHBondContact O-OG 3.07Å; Q46-S48 PolarHBondContact O-N 2.9Å
49	K	95.6	Very high	96.8	Very high	185 Å²	185	61.1 Å²	61.1	80%	0.804	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-83.6	-18.2	175.8	-59.5	-176.2	179.3	-176	0	113.1	Q46 L47	Q46-K49 PolarHBondContact O-N 3.49Å; L47-K49 PolarHBondContact O-N 2.94Å
50	V	96.3	Very high	96.4	Very high	57 Å²	57	59.7 Å²	59.7	35%	0.345	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-39.3	-168.6	-176.3	0	0	0	0	111.9	L47 A70 F117	L47-V50 PolarHBondContact O-N 3Å; V50-A70 WeakPolarHBondContact O-CB 3.5Å; V50-F117 HydrophobicContact CG2-CZ 4.3Å
51	F	97.9	Very high	96	Very high	15 Å²	15	65.1 Å²	65.1	7%	0.066	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.6	-172.6	-60.5	-82.4	0	0	0	111.8	Y41 L47 I53 E69 A70 F80 L82 F117 V126	Y41-F51 PolarHBondContact OH-O 2.98Å; Y41-F51 VanDerWaalsContact OH-O 3.09Å; L47-F51 HydrophobicContact CD2-CD2 3.88Å; L47-F51 HydrophobicContact CD2-CE2 4.14Å; L47-F51 PolarHBondContact O-N 3.25Å; F51-I53 HydrophobicContact CB-CG1 4.29Å; F51-E69 WeakPolarHBondContact CA-O 2.84Å; F51-A70 HydrophobicContact CD1-CB 3.74Å; F51-A70 HydrophobicContact CE1-CB 3.67Å; F51-F80 HydrophobicContact CD1-CD2 4.39Å; F51-F80 HydrophobicContact CE1-CB 4.08Å; F51-F80 AromaticContact CE1-CD2 3.77Å; F51-F80 HydrophobicContact CE1-CD2 3.77Å; F51-F80 HydrophobicContact CE1-CE2 4.47Å; F51-F80 AromaticContact CE1-CG 3.96Å; F51-F80 HydrophobicContact CE1-CG 3.96Å; F51-L82 HydrophobicContact CB-CD2 4.27Å; F51-L82 HydrophobicContact CD1-CD1 4.34Å; F51-L82 HydrophobicContact CD1-CD2 4.38Å; F51-L82 HydrophobicContact CD2-CD2 3.95Å; F51-L82 HydrophobicContact CE2-CD2 4.44Å; F51-L82 HydrophobicContact CG-CD2 3.93Å; F51-F117 HydrophobicContact CE2-CD2 4.47Å; F51-F117 AromaticContact CE2-CE2 3.58Å; F51-F117 HydrophobicContact CE2-CE2 3.58Å; F51-F117 HydrophobicContact CE2-CZ 4Å; F51-F117 HydrophobicContact CZ-CE2 4.28Å; F51-V126 HydrophobicContact CE1-CG1 4.06Å; F51-V126 HydrophobicContact CE2-CG2 4.21Å; F51-V126 HydrophobicContact CZ-CG1 3.73Å; F51-V126 HydrophobicContact CZ-CG2 4.03Å
52	R	97.5	Very high	95.8	Very high	139 Å²	139	65.7 Å²	65.7	53%	0.525	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	97.8	158.2	-173.3	177.9	70.5	160.5	15.8	108.6	G68 E69 R77	R52-G68 WeakPolarHBondContact O-CA 3.44Å; R52-E69 IonicContact CZ-OE2 3.76Å; R52-E69 PolarHBondContact N-O 2.93Å; R52-E69 IonicContact NE-OE2 2.84Å; R52-E69 PolarHBondContact NE-OE2 2.93Å; R52-E69 VanDerWaalsContact NE-OE2 3.13Å; R52-E69 IonicContact NH2-OE2 3.59Å; R52-E69 PolarHBondContact NH2-OE2 3.19Å; R52-E69 PolarHBondContact O-N 3.23Å; R52-R77 VanDerWaalsContact CZ-NH2 3.25Å
53	I	97.8	Very high	95.7	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.072	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	125.5	176.8	-55.1	176	0	0	0	109.6	I37 L40 Y41 F51 Y66 L67 L82	I37-I53 HydrophobicContact CD1-CG2 3.93Å; I37-I53 HydrophobicContact CG1-CG2 3.81Å; I37-I53 HydrophobicContact CG2-CB 3.96Å; I37-I53 HydrophobicContact CG2-CG2 4.06Å; L40-I53 HydrophobicContact CD2-CD1 3.76Å; L40-I53 HydrophobicContact CG-CD1 4.37Å; Y41-I53 HydrophobicContact CD1-CD1 4.32Å; Y41-I53 HydrophobicContact CE1-CD1 3.69Å; Y41-I53 HydrophobicContact CE1-CG1 4.02Å; Y41-I53 HydrophobicContact CE2-CB 4.49Å; Y41-I53 HydrophobicContact CE2-CD1 4.38Å; Y41-I53 WeakPolarHBondContact OH-CB 3.41Å; Y41-I53 WeakPolarHBondContact OH-CG1 3.36Å; Y41-I53 PolarHBondContact OH-N 3.11Å; F51-I53 HydrophobicContact CB-CG1 4.29Å; I53-Y66 HydrophobicContact CG2-CD1 4.24Å; I53-Y66 HydrophobicContact CG2-CG 4.32Å; I53-L67 CarbonylContact C-O 3.53Å; I53-L67 WeakPolarHBondContact CA-O 3.34Å; I53-L82 HydrophobicContact CD1-CD2 4.14Å; I53-L82 HydrophobicContact CG1-CD2 4.25Å
54	T	95.7	Very high	95.7	Very high	43 Å²	43	59.4 Å²	59.4	26%	0.264	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-25.1	-171.3	57.1	0	0	0	0	114.3	I29 L67	I29-T54 WeakPolarHBondContact CD1-O 3.38Å; T54-L67 PolarHBondContact N-O 2.97Å; T54-L67 PolarHBondContact OG1-O 3.38Å
55	D	96.8	Very high	95.7	Very high	66 Å²	66	60.8 Å²	60.8	35%	0.353	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	163.3	-178.2	-155.2	-2.1	0	0	0	111.9	I57 Y66 L67	D55-I57 HydrophobicContact CB-CG2 4.34Å; D55-Y66 CarbonylContact O-C 3.59Å; D55-Y66 VanDerWaalsContact O-CA 3.23Å; D55-Y66 WeakPolarHBondContact O-CA 3.37Å; D55-Y66 WeakPolarHBondContact O-CB 3.32Å; D55-L67 HydrophobicContact CB-CB 4.37Å; D55-L67 PolarHBondContact N-O 2.91Å; D55-L67 PolarHBondContact O-N 3.02Å
56	K	96.9	Very high	95.7	Very high	34 Å²	34	58.7 Å²	58.7	15%	0.148	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.3	166.5	-171.1	-177.3	-170.7	-176.2	0	108.4	V33 D36 E59 S64 V65 Y66	V33-K56 HydrophobicContact CG1-CB 3.85Å; V33-K56 HydrophobicContact CG2-CB 4.09Å; D36-K56 IonicContact OD2-NZ 3.19Å; D36-K56 PolarHBondContact OD2-NZ 3.11Å; K56-E59 WeakPolarHBondContact CE-OE2 3.33Å; K56-E59 VanDerWaalsContact NZ-CD 3.34Å; K56-E59 IonicContact NZ-OE1 2.79Å; K56-E59 IonicContact NZ-OE2 2.81Å; K56-E59 PolarHBondContact NZ-OE2 3.49Å; K56-S64 WeakPolarHBondContact CE-OG 3.28Å; K56-V65 CarbonylContact C-O 3.55Å; K56-Y66 HydrophobicContact CB-CD1 3.88Å; K56-Y66 HydrophobicContact CB-CE1 3.89Å; K56-Y66 HydrophobicContact CD-CE1 4.07Å; K56-Y66 HydrophobicContact CG-CD1 4.03Å; K56-Y66 HydrophobicContact CG-CE1 3.77Å
57	I	95.1	Very high	95.7	Very high	60 Å²	60	56.2 Å²	56.2	31%	0.308	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-9.3	-172.4	58.7	171.5	0	0	0	113.7	D55 V65 L67 A81 Y129	D55-I57 HydrophobicContact CB-CG2 4.34Å; I57-V65 HydrophobicContact CD1-CG1 3.99Å; I57-V65 HydrophobicContact CG1-CB 4.19Å; I57-V65 HydrophobicContact CG1-CG1 3.87Å; I57-V65 WeakPolarHBondContact CG1-O 3.48Å; I57-V65 PolarHBondContact N-O 2.94Å; I57-L67 HydrophobicContact CD1-CB 4.31Å; I57-L67 HydrophobicContact CG2-CB 3.69Å; I57-A81 HydrophobicContact CD1-CB 4.43Å; I57-Y129 HydrophobicContact CD1-CD2 4.1Å; I57-Y129 HydrophobicContact CD1-CE2 3.95Å
58	G	93.4	Very high	95.7	Very high	28 Å²	28	56.2 Å²	56.2	29%	0.289	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	148.9	177.6	0	0	0	0	0	112.9	V65	G58-V65 PolarHBondContact N-O 3.49Å; G58-V65 VanDerWaalsContact N-O 3.09Å; G58-V65 PolarHBondContact O-N 3.23Å
59	E	93.4	Very high	95.8	Very high	150 Å²	150	54 Å²	54	70%	0.701	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	133.8	173.2	-174.6	167.1	172.3	0	0	109.2	K56	K56-E59 WeakPolarHBondContact CE-OE2 3.33Å; K56-E59 VanDerWaalsContact NZ-CD 3.34Å; K56-E59 IonicContact NZ-OE1 2.79Å; K56-E59 IonicContact NZ-OE2 2.81Å; K56-E59 PolarHBondContact NZ-OE2 3.49Å
60	G	89.4	Confident	95.9	Very high	41 Å²	41	45.5 Å²	45.5	42%	0.423	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	173.8	178.2	0	0	0	0	0	111.1	F62 S63	G60-F62 PolarHBondContact O-N 3.02Å; G60-S63 PolarHBondContact N-O 3.36Å; G60-S63 PolarHBondContact O-N 3Å
61	T	89.6	Confident	95.8	Very high	116 Å²	116	49.8 Å²	49.8	71%	0.712	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.8	-175.8	-49.1	0	0	0	0	113.8
62	F	92.5	Very high	95.5	Very high	67 Å²	67	52 Å²	52	29%	0.294	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-2.8	-172.9	-53.1	-69.6	0	0	0	114.2	G60 I86 R93 L192	G60-F62 PolarHBondContact O-N 3.02Å; F62-I86 HydrophobicContact CD1-CD1 4Å; F62-I86 PolarHBondContact O-N 3.26Å; F62-R93 VanDerWaalsContact CD2-NH2 3.35Å; F62-R93 VanDerWaalsContact CE1-NH1 3.26Å; F62-L192 HydrophobicContact CD2-CD2 4.08Å; F62-L192 HydrophobicContact CD2-CG 4.48Å; F62-L192 HydrophobicContact CE2-CD1 4.26Å; F62-L192 HydrophobicContact CE2-CD2 3.57Å; F62-L192 HydrophobicContact CE2-CG 4.24Å; F62-L192 HydrophobicContact CZ-CD2 4.03Å
63	S	96.3	Very high	95	Very high	8 Å²	8	52.3 Å²	52.3	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.4	156	-178	59.2	0	0	0	0	113.1	G60 K83 H84	G60-S63 PolarHBondContact N-O 3.36Å; G60-S63 PolarHBondContact O-N 3Å; S63-K83 WeakPolarHBondContact OG-CE 3.47Å; S63-H84 CarbonylContact C-O 3.27Å; S63-H84 WeakPolarHBondContact CA-O 3.37Å; S63-H84 VanDerWaalsContact CB-O 3.27Å; S63-H84 WeakPolarHBondContact CB-O 3.47Å
64	S	97.6	Very high	94.7	Very high	22 Å²	22	56.1 Å²	56.1	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.9	161.3	-65.3	0	0	0	0	109.3	K56 Y66 K83 H84	K56-S64 WeakPolarHBondContact CE-OG 3.28Å; S64-Y66 VanDerWaalsContact CB-CE2 3.48Å; S64-K83 CarbonylContact O-C 3.59Å; S64-K83 WeakPolarHBondContact O-CA 3.2Å; S64-H84 PolarHBondContact N-O 3.45Å; S64-H84 PolarHBondContact O-N 3.03Å
65	V	98.1	Very high	94.4	Very high	29 Å²	29	56 Å²	56	18%	0.176	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.2	179.4	-169.3	0	0	0	0	109.3	K56 I57 G58 A81 L82 K83	K56-V65 CarbonylContact C-O 3.55Å; I57-V65 HydrophobicContact CD1-CG1 3.99Å; I57-V65 HydrophobicContact CG1-CB 4.19Å; I57-V65 HydrophobicContact CG1-CG1 3.87Å; I57-V65 WeakPolarHBondContact CG1-O 3.48Å; I57-V65 PolarHBondContact N-O 2.94Å; G58-V65 PolarHBondContact N-O 3.49Å; G58-V65 VanDerWaalsContact N-O 3.09Å; G58-V65 PolarHBondContact O-N 3.23Å; V65-A81 HydrophobicContact CG1-CB 4.06Å; V65-L82 CarbonylContact C-O 3.55Å; V65-L82 WeakPolarHBondContact CA-O 3.47Å; V65-K83 HydrophobicContact CG2-CB 4.28Å; V65-K83 HydrophobicContact CG2-CG 4.13Å
66	Y	98.4	Very high	94.3	Very high	7 Å²	7	59.3 Å²	59.3	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.5	-178.1	-57.4	-96.5	0	0	0	110.6	D36 I37 L40 I53 D55 K56 S64 A81 L82 H84	D36-Y66 HydrophobicContact CB-CE1 4.17Å; I37-Y66 HydrophobicContact CG1-CD1 3.93Å; I37-Y66 HydrophobicContact CG1-CE1 4.1Å; L40-Y66 HydrophobicContact CD2-CD1 4.45Å; L40-Y66 HydrophobicContact CD2-CD2 3.52Å; L40-Y66 HydrophobicContact CD2-CE2 3.68Å; L40-Y66 HydrophobicContact CD2-CG 3.95Å; I53-Y66 HydrophobicContact CG2-CD1 4.24Å; I53-Y66 HydrophobicContact CG2-CG 4.32Å; D55-Y66 CarbonylContact O-C 3.59Å; D55-Y66 VanDerWaalsContact O-CA 3.23Å; D55-Y66 WeakPolarHBondContact O-CA 3.37Å; D55-Y66 WeakPolarHBondContact O-CB 3.32Å; K56-Y66 HydrophobicContact CB-CD1 3.88Å; K56-Y66 HydrophobicContact CB-CE1 3.89Å; K56-Y66 HydrophobicContact CD-CE1 4.07Å; K56-Y66 HydrophobicContact CG-CD1 4.03Å; K56-Y66 HydrophobicContact CG-CE1 3.77Å; S64-Y66 VanDerWaalsContact CB-CE2 3.48Å; Y66-A81 CarbonylContact O-C 3.55Å; Y66-A81 WeakPolarHBondContact O-CA 3.39Å; Y66-L82 PolarHBondContact N-O 2.61Å; Y66-L82 PolarHBondContact O-N 3.23Å; Y66-H84 HydrophobicContact CE2-CB 4.14Å
67	L	98.3	Very high	94.2	Very high	24 Å²	24	64.6 Å²	64.6	13%	0.126	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	125	169.6	-178.8	62.3	0	0	0	108.2	I53 T54 D55 I57 M79 Y129	I53-L67 CarbonylContact C-O 3.53Å; I53-L67 WeakPolarHBondContact CA-O 3.34Å; T54-L67 PolarHBondContact N-O 2.97Å; T54-L67 PolarHBondContact OG1-O 3.38Å; D55-L67 HydrophobicContact CB-CB 4.37Å; D55-L67 PolarHBondContact N-O 2.91Å; D55-L67 PolarHBondContact O-N 3.02Å; I57-L67 HydrophobicContact CD1-CB 4.31Å; I57-L67 HydrophobicContact CG2-CB 3.69Å; L67-M79 HydrophobicContact CD1-CB 4.31Å; L67-M79 HydrophobicContact CD1-CE 3.43Å; L67-M79 VanDerWaalsContact CD1-CE 3.43Å; L67-M79 HydrophobicContact CD2-CE 3.74Å; L67-M79 HydrophobicContact CG-CE 3.42Å; L67-M79 VanDerWaalsContact CG-CE 3.42Å; L67-Y129 HydrophobicContact CD1-CD1 3.87Å; L67-Y129 HydrophobicContact CD1-CD2 3.53Å; L67-Y129 HydrophobicContact CD1-CE1 4.1Å; L67-Y129 HydrophobicContact CD1-CE2 3.8Å; L67-Y129 HydrophobicContact CD1-CG 3.56Å
68	G	97.8	Very high	94.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	155.9	175.3	0	0	0	0	0	111.9	R52 M79 F80	R52-G68 WeakPolarHBondContact O-CA 3.44Å; G68-M79 CarbonylContact O-C 3.14Å; G68-M79 WeakPolarHBondContact O-CA 3.4Å; G68-F80 PolarHBondContact N-O 2.92Å; G68-F80 PolarHBondContact O-N 3.33Å
69	E	97.7	Very high	94.4	Very high	28 Å²	28	66.3 Å²	66.3	13%	0.131	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.2	179.7	-175.9	-178.6	-148.6	0	0	109.4	F51 R52 R77 E78 M79	F51-E69 WeakPolarHBondContact CA-O 2.84Å; R52-E69 IonicContact CZ-OE2 3.76Å; R52-E69 PolarHBondContact N-O 2.93Å; R52-E69 IonicContact NE-OE2 2.84Å; R52-E69 PolarHBondContact NE-OE2 2.93Å; R52-E69 VanDerWaalsContact NE-OE2 3.13Å; R52-E69 IonicContact NH2-OE2 3.59Å; R52-E69 PolarHBondContact NH2-OE2 3.19Å; R52-E69 PolarHBondContact O-N 3.23Å; E69-R77 VanDerWaalsContact CD-NE 3.29Å; E69-R77 HydrophobicContact CG-CB 4.26Å; E69-R77 IonicContact OE1-CZ 3.53Å; E69-R77 IonicContact OE1-NE 2.69Å; E69-R77 PolarHBondContact OE1-NE 2.85Å; E69-R77 IonicContact OE1-NH2 3.35Å; E69-R77 PolarHBondContact OE1-NH2 3.43Å; E69-R77 IonicContact OE2-CZ 3.07Å; E69-R77 IonicContact OE2-NE 3.49Å; E69-R77 IonicContact OE2-NH2 2.79Å; E69-R77 PolarHBondContact OE2-NH2 3.11Å; E69-E78 WeakPolarHBondContact CA-O 3.23Å; E69-M79 HydrophobicContact CB-CE 4.24Å; E69-M79 HydrophobicContact CB-SD 3.73Å; E69-M79 HydrophobicContact CG-SD 3.79Å
70	A	97	Very high	94.7	Very high	7 Å²	7	59.6 Å²	59.6	6%	0.058	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.9	173.4	0	0	0	0	0	110.8	V50 F51 R77 E78 F80	V50-A70 WeakPolarHBondContact O-CB 3.5Å; F51-A70 HydrophobicContact CD1-CB 3.74Å; F51-A70 HydrophobicContact CE1-CB 3.67Å; A70-R77 WeakPolarHBondContact O-CA 3.44Å; A70-E78 PolarHBondContact N-O 2.92Å; A70-E78 PolarHBondContact O-N 3.31Å; A70-F80 HydrophobicContact CB-CD2 4.03Å; A70-F80 HydrophobicContact CB-CE2 3.85Å
71	Q	94.7	Very high	95.1	Very high	147 Å²	147	58.1 Å²	58.1	69%	0.687	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	122.1	169.2	-170.6	172.2	26.8	0	0	109
72	M	91.4	Very high	95.5	Very high	62 Å²	62	52.6 Å²	52.6	31%	0.305	26%	0.257	S	S	.	.			trans	-79.4	163.7	178.1	-54.3	-58.3	-86.6	0	0	110.3	D74 G75 R76 E78 F80	M72-D74 VanDerWaalsContact CB-OD1 3.3Å; M72-D74 WeakPolarHBondContact CB-OD1 3.36Å; M72-D74 PolarHBondContact O-N 3.36Å; M72-G75 WeakPolarHBondContact O-CA 3.46Å; M72-G75 PolarHBondContact O-N 3.36Å; M72-R76 WeakPolarHBondContact CB-O 3.39Å; M72-R76 WeakPolarHBondContact CG-O 3.3Å; M72-R76 PolarHBondContact N-O 2.73Å; M72-E78 WeakPolarHBondContact CE-OE2 3.47Å; M72-E78 HydrophobicContact CG-CB 4.08Å; M72-E78 HydrophobicContact CG-CG 3.73Å; M72-E78 HydrophobicContact SD-CB 4.16Å; M72-E78 HydrophobicContact SD-CG 4.3Å; M72-F80 HydrophobicContact CE-CZ 4.34Å; M72-F80 HydrophobicContact SD-CE2 4.19Å; M72-F80 HydrophobicContact SD-CZ 4.03Å
73	H	88	Confident	95.8	Very high	145 Å²	145	49.9 Å²	49.9	67%	0.671	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.6	-180	-76.1	-73	0	0	0	114.1	G75	H73-G75 PolarHBondContact O-N 2.95Å
74	D	91.1	Very high	95.9	Very high	95 Å²	95	50.8 Å²	50.8	51%	0.508	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	8.1	176.2	60.5	13.6	0	0	0	113	M72 R76	M72-D74 VanDerWaalsContact CB-OD1 3.3Å; M72-D74 WeakPolarHBondContact CB-OD1 3.36Å; M72-D74 PolarHBondContact O-N 3.36Å; D74-R76 PolarHBondContact O-N 2.81Å; D74-R76 VanDerWaalsContact OD1-CB 3.23Å; D74-R76 WeakPolarHBondContact OD1-CB 3.44Å; D74-R76 WeakPolarHBondContact OD1-CG 3.36Å; D74-R76 PolarHBondContact OD1-N 2.72Å; D74-R76 IonicContact OD1-NE 3.3Å; D74-R76 IonicContact OD2-CZ 2.78Å; D74-R76 IonicContact OD2-NE 2.71Å; D74-R76 PolarHBondContact OD2-NE 2.93Å; D74-R76 IonicContact OD2-NH2 2.74Å; D74-R76 PolarHBondContact OD2-NH2 3.39Å
75	G	90.1	Very high	95.9	Very high	40 Å²	40	49.9 Å²	49.9	41%	0.412	24%	0.241	S	C	.	.	S	Bend	trans	80.4	-7.6	-179.2	0	0	0	0	0	114.3	M72 H73	M72-G75 WeakPolarHBondContact O-CA 3.46Å; M72-G75 PolarHBondContact O-N 3.36Å; H73-G75 PolarHBondContact O-N 2.95Å
76	R	93.8	Very high	95.7	Very high	136 Å²	136	51 Å²	51	51%	0.513	25%	0.246	S	C	.	.			trans	-66.4	149.1	176.7	-64.8	-172.2	-66.5	118.2	14.3	110.2	M72 D74 E78	M72-R76 WeakPolarHBondContact CB-O 3.39Å; M72-R76 WeakPolarHBondContact CG-O 3.3Å; M72-R76 PolarHBondContact N-O 2.73Å; D74-R76 PolarHBondContact O-N 2.81Å; D74-R76 VanDerWaalsContact OD1-CB 3.23Å; D74-R76 WeakPolarHBondContact OD1-CB 3.44Å; D74-R76 WeakPolarHBondContact OD1-CG 3.36Å; D74-R76 PolarHBondContact OD1-N 2.72Å; D74-R76 IonicContact OD1-NE 3.3Å; D74-R76 IonicContact OD2-CZ 2.78Å; D74-R76 IonicContact OD2-NE 2.71Å; D74-R76 PolarHBondContact OD2-NE 2.93Å; D74-R76 IonicContact OD2-NH2 2.74Å; D74-R76 PolarHBondContact OD2-NH2 3.39Å; R76-E78 IonicContact CZ-OE1 2.91Å; R76-E78 IonicContact NH1-OE1 2.93Å; R76-E78 PolarHBondContact NH1-OE1 2.98Å; R76-E78 IonicContact NH2-OE1 3.54Å; R76-E78 PolarHBondContact NH2-OE1 3.19Å
77	R	94.1	Very high	95.5	Very high	144 Å²	144	52.7 Å²	52.7	54%	0.543	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	123.3	173.9	-68	167.6	66.4	160.1	8.7	108.1	R52 E69 A70	R52-R77 VanDerWaalsContact CZ-NH2 3.25Å; E69-R77 VanDerWaalsContact CD-NE 3.29Å; E69-R77 HydrophobicContact CG-CB 4.26Å; E69-R77 IonicContact OE1-CZ 3.53Å; E69-R77 IonicContact OE1-NE 2.69Å; E69-R77 PolarHBondContact OE1-NE 2.85Å; E69-R77 IonicContact OE1-NH2 3.35Å; E69-R77 PolarHBondContact OE1-NH2 3.43Å; E69-R77 IonicContact OE2-CZ 3.07Å; E69-R77 IonicContact OE2-NE 3.49Å; E69-R77 IonicContact OE2-NH2 2.79Å; E69-R77 PolarHBondContact OE2-NH2 3.11Å; A70-R77 WeakPolarHBondContact O-CA 3.44Å
78	E	96.1	Very high	95.3	Very high	57 Å²	57	57.5 Å²	57.5	27%	0.266	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144.4	-179.4	-70.4	-170.1	-171.6	0	0	110.5	E69 A70 M72 R76 F80	E69-E78 WeakPolarHBondContact CA-O 3.23Å; A70-E78 PolarHBondContact N-O 2.92Å; A70-E78 PolarHBondContact O-N 3.31Å; M72-E78 WeakPolarHBondContact CE-OE2 3.47Å; M72-E78 HydrophobicContact CG-CB 4.08Å; M72-E78 HydrophobicContact CG-CG 3.73Å; M72-E78 HydrophobicContact SD-CB 4.16Å; M72-E78 HydrophobicContact SD-CG 4.3Å; R76-E78 IonicContact CZ-OE1 2.91Å; R76-E78 IonicContact NH1-OE1 2.93Å; R76-E78 PolarHBondContact NH1-OE1 2.98Å; R76-E78 IonicContact NH2-OE1 3.54Å; R76-E78 PolarHBondContact NH2-OE1 3.19Å; E78-F80 HydrophobicContact CB-CE2 3.62Å; E78-F80 HydrophobicContact CB-CZ 3.95Å; E78-F80 WeakPolarHBondContact O-CD2 3.49Å
79	M	97.8	Very high	95.1	Very high	67 Å²	67	58.2 Å²	58.2	33%	0.33	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.6	179	-59.8	-57.4	-62.1	0	0	109.9	L67 G68 E69 Y129	L67-M79 HydrophobicContact CD1-CB 4.31Å; L67-M79 HydrophobicContact CD1-CE 3.43Å; L67-M79 VanDerWaalsContact CD1-CE 3.43Å; L67-M79 HydrophobicContact CD2-CE 3.74Å; L67-M79 HydrophobicContact CG-CE 3.42Å; L67-M79 VanDerWaalsContact CG-CE 3.42Å; G68-M79 CarbonylContact O-C 3.14Å; G68-M79 WeakPolarHBondContact O-CA 3.4Å; E69-M79 HydrophobicContact CB-CE 4.24Å; E69-M79 HydrophobicContact CB-SD 3.73Å; E69-M79 HydrophobicContact CG-SD 3.79Å; M79-Y129 VanDerWaalsContact C-CB 3.47Å; M79-Y129 HydrophobicContact CB-CD1 3.79Å; M79-Y129 HydrophobicContact CB-CG 4.13Å; M79-Y129 VanDerWaalsContact O-CB 3.27Å; M79-Y129 WeakPolarHBondContact O-CB 3.46Å; M79-Y129 PolarHBondContact O-N 3Å; M79-Y129 VanDerWaalsContact O-N 3.12Å
80	F	98.4	Very high	94.9	Very high	9 Å²	9	61.8 Å²	61.8	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.5	-178.8	-66	-85.6	0	0	0	111.1	F51 G68 A70 M72 E78 L82 T114 V126 M127	F51-F80 HydrophobicContact CD1-CD2 4.39Å; F51-F80 HydrophobicContact CE1-CB 4.08Å; F51-F80 AromaticContact CE1-CD2 3.77Å; F51-F80 HydrophobicContact CE1-CD2 3.77Å; F51-F80 HydrophobicContact CE1-CE2 4.47Å; F51-F80 AromaticContact CE1-CG 3.96Å; F51-F80 HydrophobicContact CE1-CG 3.96Å; G68-F80 PolarHBondContact N-O 2.92Å; G68-F80 PolarHBondContact O-N 3.33Å; A70-F80 HydrophobicContact CB-CD2 4.03Å; A70-F80 HydrophobicContact CB-CE2 3.85Å; M72-F80 HydrophobicContact CE-CZ 4.34Å; M72-F80 HydrophobicContact SD-CE2 4.19Å; M72-F80 HydrophobicContact SD-CZ 4.03Å; E78-F80 HydrophobicContact CB-CE2 3.62Å; E78-F80 HydrophobicContact CB-CZ 3.95Å; E78-F80 WeakPolarHBondContact O-CD2 3.49Å; F80-L82 HydrophobicContact CB-CD1 4.27Å; F80-T114 HydrophobicContact CE1-CG2 3.92Å; F80-V126 HydrophobicContact CB-CG1 3.96Å; F80-V126 HydrophobicContact CD1-CG1 3.69Å; F80-V126 HydrophobicContact CG-CG1 3.97Å; F80-M127 CarbonylContact C-O 3.6Å; F80-M127 WeakPolarHBondContact CA-O 3.4Å
81	A	98.6	Very high	94.7	Very high	11 Å²	11	65.7 Å²	65.7	9%	0.091	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.8	165.8	0	0	0	0	0	108.8	I57 V65 Y66 M127	I57-A81 HydrophobicContact CD1-CB 4.43Å; V65-A81 HydrophobicContact CG1-CB 4.06Å; Y66-A81 CarbonylContact O-C 3.55Å; Y66-A81 WeakPolarHBondContact O-CA 3.39Å; A81-M127 HydrophobicContact CB-CE 4.29Å; A81-M127 PolarHBondContact N-O 2.85Å; A81-M127 PolarHBondContact O-N 3.12Å
82	L	98.7	Very high	94.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	101.8	178.7	-65.6	87.2	0	0	0	108.6	L47 F51 I53 V65 Y66 F80 H84 V124	L47-L82 HydrophobicContact CD1-CD2 4.41Å; L47-L82 HydrophobicContact CD2-CD2 3.97Å; F51-L82 HydrophobicContact CB-CD2 4.27Å; F51-L82 HydrophobicContact CD1-CD1 4.34Å; F51-L82 HydrophobicContact CD1-CD2 4.38Å; F51-L82 HydrophobicContact CD2-CD2 3.95Å; F51-L82 HydrophobicContact CE2-CD2 4.44Å; F51-L82 HydrophobicContact CG-CD2 3.93Å; I53-L82 HydrophobicContact CD1-CD2 4.14Å; I53-L82 HydrophobicContact CG1-CD2 4.25Å; V65-L82 CarbonylContact C-O 3.55Å; V65-L82 WeakPolarHBondContact CA-O 3.47Å; Y66-L82 PolarHBondContact N-O 2.61Å; Y66-L82 PolarHBondContact O-N 3.23Å; F80-L82 HydrophobicContact CB-CD1 4.27Å; L82-H84 PolarHBondContact O-N 3.36Å; L82-V124 HydrophobicContact CB-CG1 3.96Å; L82-V124 HydrophobicContact CD2-CG1 4.36Å
83	K	98.4	Very high	94.7	Very high	9 Å²	9	60.1 Å²	60.1	4%	0.039	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	103	178.1	-177.5	178.6	-170.4	-177.6	0	109.9	S63 S64 V65 L85 E97 V124 I125 M127 D189	S63-K83 WeakPolarHBondContact OG-CE 3.47Å; S64-K83 CarbonylContact O-C 3.59Å; S64-K83 WeakPolarHBondContact O-CA 3.2Å; V65-K83 HydrophobicContact CG2-CB 4.28Å; V65-K83 HydrophobicContact CG2-CG 4.13Å; K83-L85 HydrophobicContact CD-CD2 4.08Å; K83-L85 HydrophobicContact CG-CD2 4.03Å; K83-E97 IonicContact NZ-OE1 3.88Å; K83-E97 PolarHBondContact NZ-OE1 2.94Å; K83-V124 CarbonylContact O-C 3.5Å; K83-V124 WeakPolarHBondContact O-CA 3.49Å; K83-I125 HydrophobicContact CB-CB 4.43Å; K83-I125 PolarHBondContact N-O 2.87Å; K83-I125 PolarHBondContact O-N 2.77Å; K83-M127 HydrophobicContact CB-CE 3.58Å; K83-M127 HydrophobicContact CD-CE 4.29Å; K83-D189 VanDerWaalsContact NZ-CG 3.33Å; K83-D189 IonicContact NZ-OD1 3.02Å; K83-D189 PolarHBondContact NZ-OD1 3.07Å
84	H	98.4	Very high	95.1	Very high	27 Å²	27	54.4 Å²	54.4	13%	0.125	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	112	172.4	179.6	-147.2	0	0	0	109.6	L40 S63 S64 Y66 L82 H122 V124	L40-H84 HydrophobicContact CD1-CB 3.95Å; S63-H84 CarbonylContact C-O 3.27Å; S63-H84 WeakPolarHBondContact CA-O 3.37Å; S63-H84 VanDerWaalsContact CB-O 3.27Å; S63-H84 WeakPolarHBondContact CB-O 3.47Å; S64-H84 PolarHBondContact N-O 3.45Å; S64-H84 PolarHBondContact O-N 3.03Å; Y66-H84 HydrophobicContact CE2-CB 4.14Å; L82-H84 PolarHBondContact O-N 3.36Å; H84-H122 AromaticContact CE1-ND1 3.54Å; H84-H122 AromaticContact NE2-CG 3.96Å; H84-H122 AromaticContact NE2-ND1 3.11Å; H84-H122 PolarHBondContact NE2-ND1 3.26Å; H84-H122 VanDerWaalsContact NE2-ND1 3.11Å; H84-V124 HydrophobicContact CB-CG2 4.09Å
85	L	96.9	Very high	95.4	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	145.5	177.7	-56.3	-178.1	0	0	0	110.3	K83 I94 V123 I125	K83-L85 HydrophobicContact CD-CD2 4.08Å; K83-L85 HydrophobicContact CG-CD2 4.03Å; L85-I94 HydrophobicContact CD1-CB 4.12Å; L85-I94 HydrophobicContact CD1-CD1 4.44Å; L85-I94 HydrophobicContact CD1-CG1 3.79Å; L85-I94 HydrophobicContact CD1-CG2 3.69Å; L85-V123 HydrophobicContact CD1-CB 4.31Å; L85-V123 HydrophobicContact CD1-CG1 4.14Å; L85-V123 PolarHBondContact N-O 3.4Å; L85-I125 HydrophobicContact CD1-CD1 4.08Å; L85-I125 HydrophobicContact CD1-CG1 4.48Å; L85-I125 HydrophobicContact CD2-CD1 4.48Å
86	I	94.1	Very high	95.6	Very high	53 Å²	53	49.9 Å²	49.9	27%	0.272	25%	0.254	S	S	.	.			trans	-59.5	135.1	175	62	173.9	0	0	0	109.6	F62 T88 S89	F62-I86 HydrophobicContact CD1-CD1 4Å; F62-I86 PolarHBondContact O-N 3.26Å; I86-T88 WeakPolarHBondContact CD1-OG1 3.4Å; I86-T88 PolarHBondContact O-N 3.27Å; I86-T88 VanDerWaalsContact O-N 3.11Å; I86-S89 WeakPolarHBondContact CG1-OG 3.43Å; I86-S89 VanDerWaalsContact O-CB 3.23Å; I86-S89 WeakPolarHBondContact O-CB 3.5Å; I86-S89 PolarHBondContact O-N 3.02Å; I86-S89 PolarHBondContact O-OG 3.01Å
87	P	94.1	Very high	95.8	Very high	42 Å²	42	43.9 Å²	43.9	27%	0.273	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.9	-174.8	-22	32.1	0	0	0	114.3	S89 D121	P87-S89 PolarHBondContact O-N 3.33Å; P87-D121 WeakPolarHBondContact CA-O 3.27Å; P87-D121 HydrophobicContact CB-CB 3.98Å; P87-D121 WeakPolarHBondContact CB-OD2 3.08Å
88	T	93.8	Very high	96	Very high	125 Å²	125	39.3 Å²	39.3	77%	0.767	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	0.1	174.7	57	0	0	0	0	113.9	I86 H90	I86-T88 WeakPolarHBondContact CD1-OG1 3.4Å; I86-T88 PolarHBondContact O-N 3.27Å; I86-T88 VanDerWaalsContact O-N 3.11Å; T88-H90 PolarHBondContact O-N 3.3Å
89	S	93.4	Very high	96	Very high	15 Å²	15	38.6 Å²	38.6	11%	0.105	21%	0.214	C	C	.	.	S	Bend	trans	-68.5	130	177.1	-66.2	0	0	0	0	111.3	I86 P87	I86-S89 WeakPolarHBondContact CG1-OG 3.43Å; I86-S89 VanDerWaalsContact O-CB 3.23Å; I86-S89 WeakPolarHBondContact O-CB 3.5Å; I86-S89 PolarHBondContact O-N 3.02Å; I86-S89 PolarHBondContact O-OG 3.01Å; P87-S89 PolarHBondContact O-N 3.33Å
90	H	93.5	Very high	96	Very high	103 Å²	103	35.4 Å²	35.4	48%	0.477	20%	0.198	S	C	.	.			trans	-63.7	137	178.1	-168.4	-93.3	0	0	0	111.3	T88 T92 R93 I94	T88-H90 PolarHBondContact O-N 3.3Å; H90-T92 VanDerWaalsContact C-N 3.3Å; H90-T92 PolarHBondContact CE1-OG1 2.82Å; H90-T92 WeakPolarHBondContact ND1-CB 3.19Å; H90-T92 PolarHBondContact ND1-N 2.84Å; H90-T92 PolarHBondContact ND1-OG1 2.9Å; H90-T92 PolarHBondContact O-N 2.95Å; H90-R93 HydrophobicContact CB-CB 4.46Å; H90-R93 WeakPolarHBondContact O-CA 3.23Å; H90-R93 WeakPolarHBondContact O-CB 3.37Å; H90-R93 PolarHBondContact O-N 2.96Å; H90-I94 PolarHBondContact O-N 3.25Å
91	P	94.1	Very high	96	Very high	89 Å²	89	35.1 Å²	35.1	58%	0.578	20%	0.197	S	C	*	.	H	α-helix	trans	-52.7	-41.6	-178.2	-30.3	36	0	0	0	114.4	R93 I94 A95	P91-R93 VanDerWaalsContact C-N 3.27Å; P91-R93 PolarHBondContact O-N 2.85Å; P91-I94 PolarHBondContact O-N 2.83Å; P91-A95 WeakPolarHBondContact O-CB 3.23Å; P91-A95 PolarHBondContact O-N 2.79Å
92	T	92.5	Very high	96	Very high	32 Å²	32	38.7 Å²	38.7	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-60.3	-35.2	176	-44.7	0	0	0	0	112.8	H90 A96 L207	H90-T92 VanDerWaalsContact C-N 3.3Å; H90-T92 PolarHBondContact CE1-OG1 2.82Å; H90-T92 WeakPolarHBondContact ND1-CB 3.19Å; H90-T92 PolarHBondContact ND1-N 2.84Å; H90-T92 PolarHBondContact ND1-OG1 2.9Å; H90-T92 PolarHBondContact O-N 2.95Å; T92-A96 WeakPolarHBondContact O-CB 3.27Å; T92-A96 PolarHBondContact O-N 2.98Å; T92-L207 HydrophobicContact CG2-CD2 3.87Å; T92-L207 HydrophobicContact CG2-CG 4.07Å
93	R	94.1	Very high	95.9	Very high	60 Å²	60	42.3 Å²	42.3	23%	0.226	24%	0.237	C	C	.	.	H	α-helix	trans	-70.4	-43.8	177.9	-178.2	-177.8	179.9	-172.9	-5.9	110.8	F62 H90 P91 A96 E97 G191	F62-R93 VanDerWaalsContact CD2-NH2 3.35Å; F62-R93 VanDerWaalsContact CE1-NH1 3.26Å; H90-R93 HydrophobicContact CB-CB 4.46Å; H90-R93 WeakPolarHBondContact O-CA 3.23Å; H90-R93 WeakPolarHBondContact O-CB 3.37Å; H90-R93 PolarHBondContact O-N 2.96Å; P91-R93 VanDerWaalsContact C-N 3.27Å; P91-R93 PolarHBondContact O-N 2.85Å; R93-A96 PolarHBondContact O-N 2.94Å; R93-E97 PolarHBondContact O-N 2.91Å; R93-G191 PolarHBondContact NE-O 3Å; R93-G191 PolarHBondContact NH2-O 2.8Å
94	I	95.8	Very high	95.9	Very high	24 Å²	24	41.9 Å²	41.9	12%	0.123	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-49.9	176.1	-61.6	174.5	0	0	0	110.1	L85 H90 P91 A96 E97 L98 V123	L85-I94 HydrophobicContact CD1-CB 4.12Å; L85-I94 HydrophobicContact CD1-CD1 4.44Å; L85-I94 HydrophobicContact CD1-CG1 3.79Å; L85-I94 HydrophobicContact CD1-CG2 3.69Å; H90-I94 PolarHBondContact O-N 3.25Å; P91-I94 PolarHBondContact O-N 2.83Å; I94-A96 PolarHBondContact O-N 3.48Å; I94-E97 PolarHBondContact O-N 3.09Å; I94-L98 PolarHBondContact O-N 2.89Å; I94-V123 HydrophobicContact CD1-CB 4.46Å; I94-V123 HydrophobicContact CD1-CG2 4Å; I94-V123 HydrophobicContact CG2-CB 4.26Å; I94-V123 HydrophobicContact CG2-CG1 3.8Å; I94-V123 HydrophobicContact CG2-CG2 4.2Å
95	A	96.2	Very high	95.8	Very high	39 Å²	39	41.2 Å²	41.2	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-65.1	-38.8	-179.3	0	0	0	0	0	112	P91 L98 Q99 L203	P91-A95 WeakPolarHBondContact O-CB 3.23Å; P91-A95 PolarHBondContact O-N 2.79Å; A95-L98 PolarHBondContact O-N 3.22Å; A95-Q99 WeakPolarHBondContact O-CB 3.43Å; A95-Q99 PolarHBondContact O-N 2.93Å; A95-L203 VanDerWaalsContact C-CD1 3.49Å; A95-L203 HydrophobicContact CB-CD1 3.56Å
96	A	95.8	Very high	95.8	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	27%	0.266	C	S	.	.	H	α-helix	trans	-64	-42.8	175.2	0	0	0	0	0	112.4	T92 R93 I94 Q99 C100 L203 L204 L207	T92-A96 WeakPolarHBondContact O-CB 3.27Å; T92-A96 PolarHBondContact O-N 2.98Å; R93-A96 PolarHBondContact O-N 2.94Å; I94-A96 PolarHBondContact O-N 3.48Å; A96-Q99 PolarHBondContact O-N 3.46Å; A96-C100 PolarHBondContact O-N 3.49Å; A96-C100 PolarHBondContact O-SG 2.79Å; A96-L203 HydrophobicContact CB-CB 3.8Å; A96-L204 HydrophobicContact CB-CD2 3.88Å; A96-L204 HydrophobicContact CB-CG 4.48Å; A96-L207 HydrophobicContact CB-CD1 3.87Å
97	E	97.3	Very high	96	Very high	10 Å²	10	48.2 Å²	48.2	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-45.6	174.7	176.3	169.3	-174.4	0	0	111.5	K83 R93 I94 Q99 C100 L101 I125 F190 G191	K83-E97 IonicContact NZ-OE1 3.88Å; K83-E97 PolarHBondContact NZ-OE1 2.94Å; R93-E97 PolarHBondContact O-N 2.91Å; I94-E97 PolarHBondContact O-N 3.09Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 3.38Å; E97-C100 WeakPolarHBondContact O-CB 3.49Å; E97-C100 PolarHBondContact O-N 2.97Å; E97-L101 HydrophobicContact CG-CD1 4.43Å; E97-L101 WeakPolarHBondContact O-CG 3.14Å; E97-L101 PolarHBondContact O-N 3.36Å; E97-L101 VanDerWaalsContact O-N 3.12Å; E97-I125 HydrophobicContact CG-CD1 4.21Å; E97-F190 HydrophobicContact CG-CB 4.15Å; E97-G191 VanDerWaalsContact OE2-CA 3.23Å; E97-G191 WeakPolarHBondContact OE2-CA 3.38Å
98	L	97.4	Very high	96.1	Very high	47 Å²	47	50 Å²	50	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-63.1	-38.9	176.6	-172.3	62.8	0	0	0	111.9	I94 A95 L101 T102 V113 C116	I94-L98 PolarHBondContact O-N 2.89Å; A95-L98 PolarHBondContact O-N 3.22Å; L98-L101 PolarHBondContact O-N 3.38Å; L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.96Å; L98-T102 PolarHBondContact O-OG1 2.98Å; L98-V113 HydrophobicContact CD1-CB 4.34Å; L98-V113 HydrophobicContact CD1-CG1 4.15Å; L98-V113 HydrophobicContact CD1-CG2 3.81Å; L98-C116 HydrophobicContact CD1-CB 4.25Å; L98-C116 HydrophobicContact CD2-CB 4.19Å
99	Q	97.5	Very high	96.4	Very high	42 Å²	42	45.3 Å²	45.3	20%	0.196	25%	0.253	C	S	.	.	H	α-helix	trans	-65.9	-39.7	177.3	-165.5	176.9	43.2	0	0	111.6	A95 A96 E97 T102 L103 I201 L203	A95-Q99 WeakPolarHBondContact O-CB 3.43Å; A95-Q99 PolarHBondContact O-N 2.93Å; A96-Q99 PolarHBondContact O-N 3.46Å; E97-Q99 VanDerWaalsContact C-N 3.32Å; E97-Q99 PolarHBondContact O-N 3.38Å; Q99-T102 PolarHBondContact O-N 2.95Å; Q99-L103 HydrophobicContact CG-CD1 3.65Å; Q99-L103 HydrophobicContact CG-CG 4.12Å; Q99-L103 WeakPolarHBondContact O-CB 3.35Å; Q99-L103 WeakPolarHBondContact O-CG 3.48Å; Q99-L103 PolarHBondContact O-N 2.84Å; Q99-I201 HydrophobicContact CB-CG2 4.09Å; Q99-I201 HydrophobicContact CG-CG2 3.91Å; Q99-L203 HydrophobicContact CB-CD1 4.29Å; Q99-L203 VanDerWaalsContact OE1-N 3.13Å
100	C	98.1	Very high	96.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-50.2	171.9	-69.4	0	0	0	0	111.7	A96 E97 T102 A104 G105 I166 F190	A96-C100 PolarHBondContact O-N 3.49Å; A96-C100 PolarHBondContact O-SG 2.79Å; E97-C100 WeakPolarHBondContact O-CB 3.49Å; E97-C100 PolarHBondContact O-N 2.97Å; C100-T102 VanDerWaalsContact C-N 3.29Å; C100-T102 PolarHBondContact O-N 3.43Å; C100-A104 WeakPolarHBondContact O-CA 3.47Å; C100-A104 WeakPolarHBondContact O-CB 3.48Å; C100-A104 PolarHBondContact O-N 3.41Å; C100-G105 PolarHBondContact O-N 3.27Å; C100-I166 HydrophobicContact CB-CD1 4.33Å; C100-F190 HydrophobicContact CB-CB 3.77Å; C100-F190 HydrophobicContact CB-CD1 3.81Å; C100-F190 HydrophobicContact CB-CD2 4.17Å; C100-F190 HydrophobicContact CB-CE1 4.48Å; C100-F190 HydrophobicContact CB-CG 3.63Å
101	L	98	Very high	96.9	Very high	3 Å²	3	40.8 Å²	40.8	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-33.2	-179.9	-67.3	170.1	0	0	0	112.6	E97 L98 G105 M111 V113 I125 M127 F190	E97-L101 HydrophobicContact CG-CD1 4.43Å; E97-L101 WeakPolarHBondContact O-CG 3.14Å; E97-L101 PolarHBondContact O-N 3.36Å; E97-L101 VanDerWaalsContact O-N 3.12Å; L98-L101 PolarHBondContact O-N 3.38Å; L101-G105 WeakPolarHBondContact O-CA 3.33Å; L101-G105 PolarHBondContact O-N 3.36Å; L101-M111 HydrophobicContact CD2-CB 4.44Å; L101-M111 VanDerWaalsContact CD2-O 3.23Å; L101-M111 WeakPolarHBondContact CD2-O 3.37Å; L101-V113 HydrophobicContact CB-CB 3.96Å; L101-V113 HydrophobicContact CB-CG1 4.02Å; L101-V113 HydrophobicContact CD1-CB 4.47Å; L101-I125 HydrophobicContact CD1-CD1 4.28Å; L101-I125 HydrophobicContact CD1-CG2 3.89Å; L101-M127 HydrophobicContact CD1-SD 4.38Å; L101-F190 HydrophobicContact CD2-CD2 3.65Å; L101-F190 HydrophobicContact CD2-CE2 3.86Å; L101-F190 HydrophobicContact CG-CD2 4.12Å
102	T	97.5	Very high	97.1	Very high	86 Å²	86	37.1 Å²	37.1	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-78.1	-43.9	-178.8	-53.9	0	0	0	0	112.1	L98 Q99 C100 V113	L98-T102 WeakPolarHBondContact O-CB 3.42Å; L98-T102 PolarHBondContact O-N 2.96Å; L98-T102 PolarHBondContact O-OG1 2.98Å; Q99-T102 PolarHBondContact O-N 2.95Å; C100-T102 VanDerWaalsContact C-N 3.29Å; C100-T102 PolarHBondContact O-N 3.43Å; T102-V113 WeakPolarHBondContact OG1-CG1 3.25Å
103	L	97.3	Very high	97.3	Very high	77 Å²	77	37.4 Å²	37.4	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-89.5	-39.9	-173.2	-62.2	-176.2	0	0	0	113.2	Q99 F164 I201	Q99-L103 HydrophobicContact CG-CD1 3.65Å; Q99-L103 HydrophobicContact CG-CG 4.12Å; Q99-L103 WeakPolarHBondContact O-CB 3.35Å; Q99-L103 WeakPolarHBondContact O-CG 3.48Å; Q99-L103 PolarHBondContact O-N 2.84Å; L103-F164 HydrophobicContact CB-CE1 4.46Å; L103-I201 HydrophobicContact CB-CD1 3.97Å; L103-I201 HydrophobicContact CD1-CD1 3.84Å; L103-I201 HydrophobicContact CG-CD1 4.47Å
104	A	97.5	Very high	97.5	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-22.4	-178.9	0	0	0	0	0	112.7	C100 H160 F164 I166	C100-A104 WeakPolarHBondContact O-CA 3.47Å; C100-A104 WeakPolarHBondContact O-CB 3.48Å; C100-A104 PolarHBondContact O-N 3.41Å; A104-H160 PolarHBondContact O-CD2 3.08Å; A104-H160 PolarHBondContact O-NE2 3.28Å; A104-F164 HydrophobicContact CB-CD1 4.39Å; A104-F164 HydrophobicContact CB-CD2 4.08Å; A104-F164 HydrophobicContact CB-CE2 4.42Å; A104-F164 HydrophobicContact CB-CG 4.09Å; A104-I166 HydrophobicContact CB-CD1 3.88Å
105	G	97.7	Very high	97.5	Very high	13 Å²	13	43.9 Å²	43.9	13%	0.134	24%	0.243	C	C	.	.			trans	-78.3	171.7	-176.5	0	0	0	0	0	115.6	C100 L101 R107 M111	C100-G105 PolarHBondContact O-N 3.27Å; L101-G105 WeakPolarHBondContact O-CA 3.33Å; L101-G105 PolarHBondContact O-N 3.36Å; G105-R107 VanDerWaalsContact C-N 3.34Å; G105-M111 VanDerWaalsContact CA-O 3.25Å; G105-M111 WeakPolarHBondContact CA-O 3.45Å
106	G	97.1	Very high	97.6	Very high	65 Å²	65	43.9 Å²	43.9	67%	0.67	24%	0.24	S	C	*	.	S	Bend	trans	85.5	-0.7	176.5	0	0	0	0	0	115	V110	G106-V110 PolarHBondContact N-O 3.13Å
107	R	97.1	Very high	97.7	Very high	139 Å²	139	45.1 Å²	45.1	53%	0.525	25%	0.245	S	C	.	.	S	Bend	trans	-151.3	168.5	-179.4	60.2	179.9	170.2	172	-0.2	111.6	G105 N109 V110 H160	G105-R107 VanDerWaalsContact C-N 3.34Å; R107-N109 PolarHBondContact O-N 3.43Å; R107-N109 VanDerWaalsContact O-N 3.12Å; R107-V110 WeakPolarHBondContact O-CB 3.29Å; R107-V110 PolarHBondContact O-N 2.91Å; R107-H160 PolarHBondContact NE-CE1 3.38Å
108	E	97.6	Very high	97.7	Very high	78 Å²	78	52.8 Å²	52.8	36%	0.364	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	37.1	172.9	-61.2	-66.6	99.3	0	0	113.5	V110 K156 A157 H160	E108-V110 VanDerWaalsContact C-N 3.28Å; E108-V110 PolarHBondContact O-N 3.44Å; E108-K156 WeakPolarHBondContact OE1-CE 3.36Å; E108-K156 IonicContact OE1-NZ 3.03Å; E108-K156 PolarHBondContact OE1-NZ 3.24Å; E108-K156 WeakPolarHBondContact OE2-CE 3.38Å; E108-K156 IonicContact OE2-NZ 3.2Å; E108-A157 VanDerWaalsContact O-CA 3.31Å; E108-A157 WeakPolarHBondContact O-CA 3.07Å; E108-H160 HydrophobicContact CB-CB 3.76Å; E108-H160 HydrophobicContact CG-CB 4.36Å
109	N	98.4	Very high	97.7	Very high	28 Å²	28	54.2 Å²	54.2	15%	0.15	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	28.6	-175.5	-38.8	-52.8	0	0	0	114.1	R107 H153 A157 Y185 A186 L187	R107-N109 PolarHBondContact O-N 3.43Å; R107-N109 VanDerWaalsContact O-N 3.12Å; N109-H153 WeakPolarHBondContact ND2-CB 3.47Å; N109-H153 PolarHBondContact ND2-ND1 3.18Å; N109-H153 PolarHBondContact ND2-O 3.43Å; N109-H153 PolarHBondContact OD1-ND1 2.93Å; N109-A157 HydrophobicContact CB-CB 4.21Å; N109-Y185 WeakPolarHBondContact CB-O 3.48Å; N109-A186 CarbonylContact O-C 3.59Å; N109-A186 WeakPolarHBondContact O-CA 3.31Å; N109-L187 PolarHBondContact O-N 3.15Å
110	V	98.7	Very high	97.6	Very high	6 Å²	6	58.9 Å²	58.9	4%	0.036	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-110.1	129.2	173	-176.6	0	0	0	0	110	G106 R107 E108 G112 A157 I161 F190	G106-V110 PolarHBondContact N-O 3.13Å; R107-V110 WeakPolarHBondContact O-CB 3.29Å; R107-V110 PolarHBondContact O-N 2.91Å; E108-V110 VanDerWaalsContact C-N 3.28Å; E108-V110 PolarHBondContact O-N 3.44Å; V110-G112 PolarHBondContact O-N 3.33Å; V110-A157 HydrophobicContact CG2-CB 4.06Å; V110-I161 HydrophobicContact CG1-CG2 4.19Å; V110-I161 HydrophobicContact CG2-CG2 3.72Å; V110-F190 HydrophobicContact CG1-CE2 3.81Å; V110-F190 HydrophobicContact CG1-CZ 3.51Å
111	M	98.6	Very high	97.5	Very high	17 Å²	17	62.7 Å²	62.7	8%	0.084	32%	0.32	C	S	.	.			trans	-61.4	131.7	-179.4	-175.3	57.1	73.4	0	0	111.1	L101 G105 M127 L177 A186 L187 V188	L101-M111 HydrophobicContact CD2-CB 4.44Å; L101-M111 VanDerWaalsContact CD2-O 3.23Å; L101-M111 WeakPolarHBondContact CD2-O 3.37Å; G105-M111 VanDerWaalsContact CA-O 3.25Å; G105-M111 WeakPolarHBondContact CA-O 3.45Å; M111-M127 HydrophobicContact CG-CB 4.21Å; M111-M127 HydrophobicContact CG-CG 4.29Å; M111-M127 HydrophobicContact CG-SD 3.97Å; M111-M127 HydrophobicContact SD-CB 4.14Å; M111-L177 HydrophobicContact CE-CD1 4.18Å; M111-A186 HydrophobicContact CE-CB 3.86Å; M111-L187 VanDerWaalsContact CB-O 3.27Å; M111-L187 WeakPolarHBondContact CB-O 3.48Å; M111-L187 PolarHBondContact N-O 2.76Å; M111-V188 HydrophobicContact CB-CB 4.49Å; M111-V188 HydrophobicContact CB-CG1 3.67Å; M111-V188 HydrophobicContact CE-CG1 3.99Å; M111-V188 HydrophobicContact CG-CG1 3.99Å
112	G	98	Very high	97.5	Very high	11 Å²	11	64.7 Å²	64.7	11%	0.113	33%	0.33	C	S	.	.			trans	-91.2	179.9	172.5	0	0	0	0	0	112.1	V110 M127	V110-G112 PolarHBondContact O-N 3.33Å; G112-M127 WeakPolarHBondContact O-CG 3.47Å
113	V	98.1	Very high	97.5	Very high	38 Å²	38	61 Å²	61	23%	0.23	31%	0.306	C	S	.	.			trans	-117.5	138.7	171.7	59.1	0	0	0	0	109.6	L98 L101 T102 Y115 I125	L98-V113 HydrophobicContact CD1-CB 4.34Å; L98-V113 HydrophobicContact CD1-CG1 4.15Å; L98-V113 HydrophobicContact CD1-CG2 3.81Å; L101-V113 HydrophobicContact CB-CB 3.96Å; L101-V113 HydrophobicContact CB-CG1 4.02Å; L101-V113 HydrophobicContact CD1-CB 4.47Å; T102-V113 WeakPolarHBondContact OG1-CG1 3.25Å; V113-Y115 WeakPolarHBondContact CG2-O 3.21Å; V113-I125 HydrophobicContact CB-CG2 4.45Å; V113-I125 HydrophobicContact CG2-CG2 3.68Å
114	T	96.9	Very high	97.6	Very high	72 Å²	72	57.3 Å²	57.3	44%	0.442	29%	0.287	S	S	.	.			trans	-91.2	-47.1	172.9	-55.6	0	0	0	0	110.4	F80 V126 P128	F80-T114 HydrophobicContact CE1-CG2 3.92Å; T114-V126 PolarHBondContact N-O 2.94Å; T114-P128 WeakPolarHBondContact OG1-CD 3.23Å
115	Y	96.9	Very high	97.6	Very high	149 Å²	149	57.3 Å²	57.3	58%	0.584	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.2	171.3	-177.9	-151.7	-110.1	0	0	0	111.8	V113 F117 V126	V113-Y115 WeakPolarHBondContact CG2-O 3.21Å; Y115-F117 HydrophobicContact CD1-CD2 4.08Å; Y115-F117 HydrophobicContact CD1-CE1 4.34Å; Y115-F117 AromaticContact CD1-CE2 3.67Å; Y115-F117 HydrophobicContact CD1-CE2 3.67Å; Y115-F117 AromaticContact CD1-CZ 3.83Å; Y115-F117 HydrophobicContact CD1-CZ 3.83Å; Y115-F117 HydrophobicContact CE1-CE1 4.27Å; Y115-F117 HydrophobicContact CE1-CE2 4.39Å; Y115-F117 HydrophobicContact CE1-CZ 4.16Å; Y115-V126 PolarHBondContact N-O 3.33Å; Y115-V126 PolarHBondContact O-N 3.34Å
116	C	97.9	Very high	97.7	Very high	39 Å²	39	56.8 Å²	56.8	26%	0.264	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	128.2	173.7	-173.3	0	0	0	0	110.1	L98 V123 V124	L98-C116 HydrophobicContact CD1-CB 4.25Å; L98-C116 HydrophobicContact CD2-CB 4.19Å; C116-V123 VanDerWaalsContact SG-CG1 3.6Å; C116-V124 WeakPolarHBondContact CA-O 3.26Å
117	F	98.2	Very high	97.7	Very high	27 Å²	27	54.4 Å²	54.4	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	144.1	171	-67.2	-91.5	0	0	0	110	V44 Q46 L47 V50 F51 Y115 V123 V124 V126	V44-F117 HydrophobicContact CG1-CB 3.77Å; Q46-F117 HydrophobicContact CB-CD1 3.67Å; Q46-F117 HydrophobicContact CB-CE1 3.86Å; Q46-F117 HydrophobicContact CG-CD1 4.45Å; L47-F117 HydrophobicContact CD2-CB 4.33Å; L47-F117 HydrophobicContact CD2-CD1 4.49Å; L47-F117 HydrophobicContact CD2-CD2 3.65Å; L47-F117 HydrophobicContact CD2-CE2 4.08Å; L47-F117 HydrophobicContact CD2-CG 3.89Å; V50-F117 HydrophobicContact CG2-CZ 4.3Å; F51-F117 HydrophobicContact CE2-CD2 4.47Å; F51-F117 AromaticContact CE2-CE2 3.58Å; F51-F117 HydrophobicContact CE2-CE2 3.58Å; F51-F117 HydrophobicContact CE2-CZ 4Å; F51-F117 HydrophobicContact CZ-CE2 4.28Å; Y115-F117 HydrophobicContact CD1-CD2 4.08Å; Y115-F117 HydrophobicContact CD1-CE1 4.34Å; Y115-F117 AromaticContact CD1-CE2 3.67Å; Y115-F117 HydrophobicContact CD1-CE2 3.67Å; Y115-F117 AromaticContact CD1-CZ 3.83Å; Y115-F117 HydrophobicContact CD1-CZ 3.83Å; Y115-F117 HydrophobicContact CE1-CE1 4.27Å; Y115-F117 HydrophobicContact CE1-CE2 4.39Å; Y115-F117 HydrophobicContact CE1-CZ 4.16Å; F117-V123 WeakPolarHBondContact O-CA 3.23Å; F117-V124 HydrophobicContact CB-CB 4.44Å; F117-V124 PolarHBondContact N-O 3.03Å; F117-V124 PolarHBondContact O-N 2.83Å; F117-V126 HydrophobicContact CD2-CG2 3.79Å; F117-V126 HydrophobicContact CE2-CG2 3.82Å
118	R	97.4	Very high	97.7	Very high	172 Å²	172	50.8 Å²	50.8	65%	0.649	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	135	173.2	-179.1	173.8	114.5	103.2	-4.7	110.6	E120 H122 V123	R118-E120 PolarHBondContact NH1-O 2.9Å; R118-H122 WeakPolarHBondContact CA-O 3.47Å; R118-V123 HydrophobicContact CB-CG2 4.31Å; R118-V123 HydrophobicContact CG-CG2 3.89Å
119	K	97.4	Very high	97.8	Very high	76 Å²	76	50.5 Å²	50.5	33%	0.33	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	118.3	161.7	-179.8	176.3	166.2	-160.2	0	107.1	A43 P45 D121 H122	A43-K119 WeakPolarHBondContact O-CD 3.27Å; P45-K119 HydrophobicContact CG-CD 4.3Å; K119-D121 PolarHBondContact O-N 3.12Å; K119-H122 PolarHBondContact N-O 2.88Å; K119-H122 WeakPolarHBondContact O-CB 3.36Å; K119-H122 PolarHBondContact O-N 3.33Å
120	E	95.6	Very high	97.7	Very high	140 Å²	140	50.5 Å²	50.5	65%	0.654	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	-125.6	-176.6	-63.3	165.8	-152.4	0	0	111.5	R118	R118-E120 PolarHBondContact NH1-O 2.9Å
121	D	95.5	Very high	97.6	Very high	80 Å²	80	55.1 Å²	55.1	43%	0.428	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.2	178	60.2	-23.6	0	0	0	113.6	P87 K119	P87-D121 WeakPolarHBondContact CA-O 3.27Å; P87-D121 HydrophobicContact CB-CB 3.98Å; P87-D121 WeakPolarHBondContact CB-OD2 3.08Å; K119-D121 PolarHBondContact O-N 3.12Å
122	H	97.5	Very high	97.5	Very high	46 Å²	46	57.8 Å²	57.8	21%	0.213	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	119.9	175	-67.5	-100.1	0	0	0	111.4	A43 V44 H84 R118 K119	A43-H122 HydrophobicContact CB-CB 4.34Å; A43-H122 WeakPolarHBondContact CB-ND1 3.47Å; V44-H122 HydrophobicContact CG2-CB 3.7Å; H84-H122 AromaticContact CE1-ND1 3.54Å; H84-H122 AromaticContact NE2-CG 3.96Å; H84-H122 AromaticContact NE2-ND1 3.11Å; H84-H122 PolarHBondContact NE2-ND1 3.26Å; H84-H122 VanDerWaalsContact NE2-ND1 3.11Å; R118-H122 WeakPolarHBondContact CA-O 3.47Å; K119-H122 PolarHBondContact N-O 2.88Å; K119-H122 WeakPolarHBondContact O-CB 3.36Å; K119-H122 PolarHBondContact O-N 3.33Å
123	V	98.4	Very high	97.2	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.3	177.8	179.9	0	0	0	0	110.2	L85 I94 C116 F117 R118	L85-V123 HydrophobicContact CD1-CB 4.31Å; L85-V123 HydrophobicContact CD1-CG1 4.14Å; L85-V123 PolarHBondContact N-O 3.4Å; I94-V123 HydrophobicContact CD1-CB 4.46Å; I94-V123 HydrophobicContact CD1-CG2 4Å; I94-V123 HydrophobicContact CG2-CB 4.26Å; I94-V123 HydrophobicContact CG2-CG1 3.8Å; I94-V123 HydrophobicContact CG2-CG2 4.2Å; C116-V123 VanDerWaalsContact SG-CG1 3.6Å; F117-V123 WeakPolarHBondContact O-CA 3.23Å; R118-V123 HydrophobicContact CB-CG2 4.31Å; R118-V123 HydrophobicContact CG-CG2 3.89Å
124	V	98.6	Very high	97	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	112.8	179.8	-179.4	0	0	0	0	109.3	L40 V44 L47 L82 K83 H84 C116 F117	L40-V124 HydrophobicContact CD1-CG2 3.84Å; V44-V124 HydrophobicContact CG2-CG2 3.96Å; L47-V124 HydrophobicContact CD1-CG1 4.28Å; L47-V124 HydrophobicContact CD1-CG2 4.14Å; L47-V124 HydrophobicContact CD2-CG1 4.36Å; L82-V124 HydrophobicContact CB-CG1 3.96Å; L82-V124 HydrophobicContact CD2-CG1 4.36Å; K83-V124 CarbonylContact O-C 3.5Å; K83-V124 WeakPolarHBondContact O-CA 3.49Å; H84-V124 HydrophobicContact CB-CG2 4.09Å; C116-V124 WeakPolarHBondContact CA-O 3.26Å; F117-V124 HydrophobicContact CB-CB 4.44Å; F117-V124 PolarHBondContact N-O 3.03Å; F117-V124 PolarHBondContact O-N 2.83Å
125	I	98.6	Very high	96.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.9	175.9	-56.2	178.6	0	0	0	108.2	K83 L85 E97 L101 V113 M127	K83-I125 HydrophobicContact CB-CB 4.43Å; K83-I125 PolarHBondContact N-O 2.87Å; K83-I125 PolarHBondContact O-N 2.77Å; L85-I125 HydrophobicContact CD1-CD1 4.08Å; L85-I125 HydrophobicContact CD1-CG1 4.48Å; L85-I125 HydrophobicContact CD2-CD1 4.48Å; E97-I125 HydrophobicContact CG-CD1 4.21Å; L101-I125 HydrophobicContact CD1-CD1 4.28Å; L101-I125 HydrophobicContact CD1-CG2 3.89Å; V113-I125 HydrophobicContact CB-CG2 4.45Å; V113-I125 HydrophobicContact CG2-CG2 3.68Å; I125-M127 HydrophobicContact CG2-CG 4.01Å; I125-M127 HydrophobicContact CG2-SD 4.39Å
126	V	98.5	Very high	96.8	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.9	179.1	-176.5	0	0	0	0	109	F51 F80 T114 Y115 F117	F51-V126 HydrophobicContact CE1-CG1 4.06Å; F51-V126 HydrophobicContact CE2-CG2 4.21Å; F51-V126 HydrophobicContact CZ-CG1 3.73Å; F51-V126 HydrophobicContact CZ-CG2 4.03Å; F80-V126 HydrophobicContact CB-CG1 3.96Å; F80-V126 HydrophobicContact CD1-CG1 3.69Å; F80-V126 HydrophobicContact CG-CG1 3.97Å; T114-V126 PolarHBondContact N-O 2.94Å; Y115-V126 PolarHBondContact N-O 3.33Å; Y115-V126 PolarHBondContact O-N 3.34Å; F117-V126 HydrophobicContact CD2-CG2 3.79Å; F117-V126 HydrophobicContact CE2-CG2 3.82Å
127	M	98.4	Very high	96.7	Very high	16 Å²	16	57.9 Å²	57.9	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	153.6	-178.3	-59	165.8	-70	0	0	110.2	F80 A81 K83 L101 M111 G112 I125 Y129	F80-M127 CarbonylContact C-O 3.6Å; F80-M127 WeakPolarHBondContact CA-O 3.4Å; A81-M127 HydrophobicContact CB-CE 4.29Å; A81-M127 PolarHBondContact N-O 2.85Å; A81-M127 PolarHBondContact O-N 3.12Å; K83-M127 HydrophobicContact CB-CE 3.58Å; K83-M127 HydrophobicContact CD-CE 4.29Å; L101-M127 HydrophobicContact CD1-SD 4.38Å; M111-M127 HydrophobicContact CG-CB 4.21Å; M111-M127 HydrophobicContact CG-CG 4.29Å; M111-M127 HydrophobicContact CG-SD 3.97Å; M111-M127 HydrophobicContact SD-CB 4.14Å; G112-M127 WeakPolarHBondContact O-CG 3.47Å; I125-M127 HydrophobicContact CG2-CG 4.01Å; I125-M127 HydrophobicContact CG2-SD 4.39Å; M127-Y129 PolarHBondContact O-N 3.06Å
128	P	97.4	Very high	96.6	Very high	62 Å²	62	57.5 Å²	57.5	40%	0.403	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	131.4	170.1	-24	34.3	0	0	0	110.8	T114	T114-P128 WeakPolarHBondContact OG1-CD 3.23Å
129	Y	98	Very high	96.5	Very high	73 Å²	73	50 Å²	50	29%	0.286	26%	0.258	S	S	.	.			trans	-75.3	133.3	173.9	174.6	-111.2	0	0	0	110.3	I57 L67 M79 M127 E131	I57-Y129 HydrophobicContact CD1-CD2 4.1Å; I57-Y129 HydrophobicContact CD1-CE2 3.95Å; L67-Y129 HydrophobicContact CD1-CD1 3.87Å; L67-Y129 HydrophobicContact CD1-CD2 3.53Å; L67-Y129 HydrophobicContact CD1-CE1 4.1Å; L67-Y129 HydrophobicContact CD1-CE2 3.8Å; L67-Y129 HydrophobicContact CD1-CG 3.56Å; M79-Y129 VanDerWaalsContact C-CB 3.47Å; M79-Y129 HydrophobicContact CB-CD1 3.79Å; M79-Y129 HydrophobicContact CB-CG 4.13Å; M79-Y129 VanDerWaalsContact O-CB 3.27Å; M79-Y129 WeakPolarHBondContact O-CB 3.46Å; M79-Y129 PolarHBondContact O-N 3Å; M79-Y129 VanDerWaalsContact O-N 3.12Å; M127-Y129 PolarHBondContact O-N 3.06Å; Y129-E131 HydrophobicContact CE1-CB 4.01Å
130	M	97.2	Very high	96.2	Very high	28 Å²	28	49.7 Å²	49.7	14%	0.138	28%	0.276	C	S	.	.			trans	-118.3	113.5	171.5	179.7	-179.5	-143.8	0	0	108.6	H132 L177 N179 T184 Y185 A186	M130-H132 PolarHBondContact O-N 2.71Å; M130-H132 PolarHBondContact O-ND1 3.17Å; M130-L177 HydrophobicContact CB-CD1 4.16Å; M130-L177 HydrophobicContact SD-CB 3.74Å; M130-L177 HydrophobicContact SD-CD1 4.29Å; M130-N179 HydrophobicContact CE-CB 4.47Å; M130-T184 WeakPolarHBondContact CE-O 3.37Å; M130-T184 WeakPolarHBondContact CE-OG1 3.49Å; M130-Y185 VanDerWaalsContact CE-N 3.31Å; M130-A186 HydrophobicContact SD-CB 3.61Å
131	E	96.4	Very high	96.1	Very high	102 Å²	102	46.1 Å²	46.1	48%	0.477	27%	0.266	S	S	.	.			trans	-60.2	132	167.9	-172.6	-172.4	174.1	0	0	108.8	Y129 N179	Y129-E131 HydrophobicContact CE1-CB 4.01Å; E131-N179 VanDerWaalsContact O-CB 3.24Å; E131-N179 WeakPolarHBondContact O-CB 3.45Å; E131-N179 PolarHBondContact O-ND2 2.79Å
132	H	96.2	Very high	96	Very high	73 Å²	73	42.6 Å²	42.6	34%	0.338	25%	0.248	S	C	.	.			trans	-147.8	161.9	-175.3	59	-81.7	0	0	0	110.9	M130 L177 Y178	M130-H132 PolarHBondContact O-N 2.71Å; M130-H132 PolarHBondContact O-ND1 3.17Å; H132-L177 HydrophobicContact CB-CB 4.12Å; H132-Y178 VanDerWaalsContact CA-O 3.29Å; H132-Y178 WeakPolarHBondContact CA-O 3.41Å; H132-Y178 WeakPolarHBondContact CB-O 3.44Å
133	Q	92.6	Very high	95.8	Very high	43 Å²	43	43.1 Å²	43.1	20%	0.201	26%	0.256	C	S	.	.			trans	-106.4	144.6	173.4	-64.3	80.6	42	0	0	110.2	I138 Y178	Q133-I138 HydrophobicContact CB-CD1 4.19Å; Q133-I138 HydrophobicContact CB-CG2 4.08Å; Q133-I138 HydrophobicContact CG-CG2 4.46Å; Q133-Y178 PolarHBondContact N-O 3.19Å; Q133-Y178 PolarHBondContact OE1-O 3.06Å
134	A	94.3	Very high	95.3	Very high	49 Å²	49	46.6 Å²	46.6	41%	0.405	27%	0.269	S	S	.	.			trans	-72.1	132.8	170.5	0	0	0	0	0	109.4	V136 D137	A134-V136 HydrophobicContact CB-CG1 4.01Å; A134-V136 PolarHBondContact O-N 3.33Å; A134-D137 PolarHBondContact O-N 2.68Å
135	I	94.5	Very high	95	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-35.4	-179.1	-72.3	-54.8	0	0	0	112.1	D137 I138 I139 Y150 P173 Y178 L341	I135-D137 PolarHBondContact O-N 2.66Å; I135-D137 VanDerWaalsContact O-N 3.15Å; I135-I138 HydrophobicContact CD1-CD1 3.94Å; I135-I138 HydrophobicContact CD1-CG1 4.13Å; I135-I138 PolarHBondContact O-N 2.79Å; I135-I138 VanDerWaalsContact O-N 3.12Å; I135-I139 HydrophobicContact CG2-CB 4.22Å; I135-I139 HydrophobicContact CG2-CD1 4.17Å; I135-I139 HydrophobicContact CG2-CG1 4.41Å; I135-I139 VanDerWaalsContact O-CB 3.25Å; I135-I139 WeakPolarHBondContact O-CB 3.46Å; I135-I139 PolarHBondContact O-N 2.95Å; I135-Y150 HydrophobicContact CD1-CD2 4.31Å; I135-Y150 HydrophobicContact CD1-CE2 3.62Å; I135-Y150 HydrophobicContact CG1-CE2 4.17Å; I135-P173 HydrophobicContact CB-CB 3.86Å; I135-P173 HydrophobicContact CG1-CB 3.77Å; I135-P173 HydrophobicContact CG2-CB 4.38Å; I135-Y178 HydrophobicContact CD1-CD1 4.14Å; I135-L341 HydrophobicContact CG2-CD2 4.04Å
136	V	94.4	Very high	94.9	Very high	82 Å²	82	51.8 Å²	51.8	50%	0.497	29%	0.293	S	S	.	.	H	α-helix	trans	-55.1	-32.7	177.4	68.1	0	0	0	0	113.1	A134 Y346	A134-V136 HydrophobicContact CB-CG1 4.01Å; A134-V136 PolarHBondContact O-N 3.33Å; V136-Y346 HydrophobicContact CB-CD1 3.92Å; V136-Y346 HydrophobicContact CB-CE1 4.33Å; V136-Y346 HydrophobicContact CG2-CD1 4.2Å
137	D	95.2	Very high	94.8	Very high	130 Å²	130	51.9 Å²	51.9	70%	0.695	29%	0.294	S	S	*	.	H	α-helix	trans	-80.9	-28.6	-177.5	-59.3	-32.2	0	0	0	112.3	A134 I135	A134-D137 PolarHBondContact O-N 2.68Å; I135-D137 PolarHBondContact O-N 2.66Å; I135-D137 VanDerWaalsContact O-N 3.15Å
138	I	95.8	Very high	94.6	Very high	18 Å²	18	54.8 Å²	54.8	9%	0.092	30%	0.304	C	S	.	.	H	α-helix	trans	-109.5	-14.1	-171.9	66.6	174.8	0	0	0	113.9	Q133 I135 G140 S141 L142 Y178	Q133-I138 HydrophobicContact CB-CD1 4.19Å; Q133-I138 HydrophobicContact CB-CG2 4.08Å; Q133-I138 HydrophobicContact CG-CG2 4.46Å; I135-I138 HydrophobicContact CD1-CD1 3.94Å; I135-I138 HydrophobicContact CD1-CG1 4.13Å; I135-I138 PolarHBondContact O-N 2.79Å; I135-I138 VanDerWaalsContact O-N 3.12Å; I138-G140 VanDerWaalsContact C-N 3.25Å; I138-G140 PolarHBondContact O-N 2.93Å; I138-G140 VanDerWaalsContact O-N 3.11Å; I138-S141 CarbonylContact O-C 3.54Å; I138-S141 WeakPolarHBondContact O-CA 3.23Å; I138-S141 PolarHBondContact O-N 3.13Å; I138-S141 PolarHBondContact O-OG 2.77Å; I138-L142 HydrophobicContact CD1-CD1 4.49Å; I138-L142 HydrophobicContact CD1-CD2 3.95Å; I138-L142 HydrophobicContact CD1-CG 4.45Å; I138-L142 HydrophobicContact CG1-CD1 4.31Å; I138-L142 HydrophobicContact CG1-CD2 4.29Å; I138-L142 HydrophobicContact CG1-CG 4.28Å; I138-L142 PolarHBondContact O-N 2.67Å; I138-Y178 HydrophobicContact CD1-CD1 3.79Å; I138-Y178 HydrophobicContact CD1-CE1 3.8Å
139	I	95.1	Very high	94.5	Very high	15 Å²	15	53.3 Å²	53.3	8%	0.077	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-53.7	-37.2	-170.1	-165.2	167.1	0	0	0	114.1	I135 S141 S340 L341	I135-I139 HydrophobicContact CG2-CB 4.22Å; I135-I139 HydrophobicContact CG2-CD1 4.17Å; I135-I139 HydrophobicContact CG2-CG1 4.41Å; I135-I139 VanDerWaalsContact O-CB 3.25Å; I135-I139 WeakPolarHBondContact O-CB 3.46Å; I135-I139 PolarHBondContact O-N 2.95Å; I139-S141 VanDerWaalsContact C-N 3.28Å; I139-S141 PolarHBondContact O-N 2.63Å; I139-S340 VanDerWaalsContact CD1-O 3.31Å; I139-S340 WeakPolarHBondContact CD1-O 3.3Å; I139-L341 HydrophobicContact CD1-CD2 4.44Å; I139-L341 HydrophobicContact CG1-CD2 4.2Å
140	G	91.9	Very high	94.5	Very high	69 Å²	69	49.9 Å²	49.9	71%	0.711	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-73.9	-16.2	177.7	0	0	0	0	0	114.5	I138	I138-G140 VanDerWaalsContact C-N 3.25Å; I138-G140 PolarHBondContact O-N 2.93Å; I138-G140 VanDerWaalsContact O-N 3.11Å
141	S	94.3	Very high	94.5	Very high	66 Å²	66	48.7 Å²	48.7	46%	0.462	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-111.1	-0.2	-175.8	73.4	0	0	0	0	113.9	I138 I139 S143 R180	I138-S141 CarbonylContact O-C 3.54Å; I138-S141 WeakPolarHBondContact O-CA 3.23Å; I138-S141 PolarHBondContact O-N 3.13Å; I138-S141 PolarHBondContact O-OG 2.77Å; I139-S141 VanDerWaalsContact C-N 3.28Å; I139-S141 PolarHBondContact O-N 2.63Å; S141-S143 PolarHBondContact O-N 2.68Å; S141-R180 PolarHBondContact O-NH2 3.11Å; S141-R180 PolarHBondContact OG-NH1 3.03Å
142	L	93.7	Very high	94.6	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.031	27%	0.268	C	S	.	.			trans	-72.3	128	177.1	-70.4	173.2	0	0	0	109.9	I138 E146 V147 Y178 L341 R400	I138-L142 HydrophobicContact CD1-CD1 4.49Å; I138-L142 HydrophobicContact CD1-CD2 3.95Å; I138-L142 HydrophobicContact CD1-CG 4.45Å; I138-L142 HydrophobicContact CG1-CD1 4.31Å; I138-L142 HydrophobicContact CG1-CD2 4.29Å; I138-L142 HydrophobicContact CG1-CG 4.28Å; I138-L142 PolarHBondContact O-N 2.67Å; L142-E146 HydrophobicContact CD2-CB 4.03Å; L142-V147 HydrophobicContact CB-CG2 4.02Å; L142-Y178 HydrophobicContact CD2-CE1 4.08Å; L142-L341 HydrophobicContact CD1-CD2 3.7Å; L142-R400 PolarHBondContact O-NH2 2.95Å
143	S	92.6	Very high	94.7	Very high	56 Å²	56	46.6 Å²	46.6	39%	0.392	26%	0.26	S	S	.	.			trans	-70.2	160.6	168.4	63.9	0	0	0	0	110.8	S141 E145 E146 V147	S141-S143 PolarHBondContact O-N 2.68Å; S143-E145 VanDerWaalsContact C-N 3.27Å; S143-E145 PolarHBondContact O-N 2.87Å; S143-E146 WeakPolarHBondContact CB-OE2 2.99Å; S143-E146 PolarHBondContact N-OE2 2.8Å; S143-E146 PolarHBondContact O-N 3.09Å; S143-E146 VanDerWaalsContact OG-CD 3.31Å; S143-E146 WeakPolarHBondContact OG-CG 3.46Å; S143-E146 PolarHBondContact OG-N 2.83Å; S143-E146 PolarHBondContact OG-OE2 2.84Å; S143-V147 WeakPolarHBondContact O-CG2 3.5Å; S143-V147 PolarHBondContact O-N 3.28Å
144	Y	88.6	Confident	95	Very high	80 Å²	80	44.5 Å²	44.5	31%	0.314	25%	0.251	S	S	.	.	H	α-helix	trans	-55.7	-43.8	175.3	178.3	-92.1	0	0	0	112.1	E146 V147 R148 F470 G474 P475	Y144-E146 VanDerWaalsContact C-N 3.33Å; Y144-E146 PolarHBondContact O-N 3.48Å; Y144-V147 WeakPolarHBondContact O-CB 3.44Å; Y144-V147 PolarHBondContact O-N 3.39Å; Y144-V147 VanDerWaalsContact O-N 3.16Å; Y144-R148 PolarHBondContact O-N 2.8Å; Y144-F470 HydrophobicContact CD2-CE2 4.23Å; Y144-F470 HydrophobicContact CD2-CZ 4.01Å; Y144-F470 HydrophobicContact CE2-CD2 4.31Å; Y144-F470 HydrophobicContact CE2-CE1 4.31Å; Y144-F470 AromaticContact CE2-CE2 3.31Å; Y144-F470 HydrophobicContact CE2-CE2 3.31Å; Y144-F470 AromaticContact CE2-CZ 3.29Å; Y144-F470 HydrophobicContact CE2-CZ 3.29Å; Y144-F470 AromaticContact CZ-CE2 3.91Å; Y144-F470 AromaticContact CZ-CZ 3.72Å; Y144-F470 PolarHBondContact OH-O 3.3Å; Y144-F470 VanDerWaalsContact OH-O 3.08Å; Y144-G474 WeakPolarHBondContact OH-CA 3.44Å; Y144-P475 HydrophobicContact CD2-CG 4.43Å; Y144-P475 HydrophobicContact CE1-CG 4.48Å; Y144-P475 HydrophobicContact CE2-CG 4.29Å
145	E	92.3	Very high	95.1	Very high	81 Å²	81	44.1 Å²	44.1	38%	0.379	24%	0.241	S	C	.	.	H	α-helix	trans	-63.5	-38.6	179.6	-180	56.8	-162.6	0	0	112.2	S143 R148 L149	S143-E145 VanDerWaalsContact C-N 3.27Å; S143-E145 PolarHBondContact O-N 2.87Å; E145-R148 WeakPolarHBondContact O-CB 3.32Å; E145-R148 PolarHBondContact O-N 3.45Å; E145-R148 IonicContact OE1-CZ 2.63Å; E145-R148 IonicContact OE1-NE 3.64Å; E145-R148 IonicContact OE1-NH2 3.56Å; E145-R148 PolarHBondContact OE1-NH2 3.05Å; E145-R148 IonicContact OE2-CZ 3.12Å; E145-R148 IonicContact OE2-NE 2.67Å; E145-R148 PolarHBondContact OE2-NE 3.45Å; E145-R148 IonicContact OE2-NH2 3.13Å; E145-R148 PolarHBondContact OE2-NH2 2.88Å; E145-L149 HydrophobicContact CG-CD1 4.25Å; E145-L149 WeakPolarHBondContact O-CB 3.42Å; E145-L149 WeakPolarHBondContact O-CG 3.22Å; E145-L149 PolarHBondContact O-N 3.23Å
146	E	95.9	Very high	95.3	Very high	29 Å²	29	46.6 Å²	46.6	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-38.3	174.5	-70.8	168	121.3	0	0	112.1	L142 S143 Y144 L149 Y150 R180	L142-E146 HydrophobicContact CD2-CB 4.03Å; S143-E146 WeakPolarHBondContact CB-OE2 2.99Å; S143-E146 PolarHBondContact N-OE2 2.8Å; S143-E146 PolarHBondContact O-N 3.09Å; S143-E146 VanDerWaalsContact OG-CD 3.31Å; S143-E146 WeakPolarHBondContact OG-CG 3.46Å; S143-E146 PolarHBondContact OG-N 2.83Å; S143-E146 PolarHBondContact OG-OE2 2.84Å; Y144-E146 VanDerWaalsContact C-N 3.33Å; Y144-E146 PolarHBondContact O-N 3.48Å; E146-L149 PolarHBondContact O-N 2.78Å; E146-Y150 WeakPolarHBondContact O-CB 3.23Å; E146-Y150 PolarHBondContact O-N 2.74Å; E146-R180 VanDerWaalsContact CD-NH2 3.32Å; E146-R180 IonicContact OE1-CZ 3.13Å; E146-R180 VanDerWaalsContact OE1-CZ 3.26Å; E146-R180 IonicContact OE1-NE 2.68Å; E146-R180 PolarHBondContact OE1-NE 3.42Å; E146-R180 IonicContact OE1-NH2 2.95Å; E146-R180 PolarHBondContact OE1-NH2 3Å; E146-R180 IonicContact OE2-CZ 3.07Å; E146-R180 IonicContact OE2-NE 3.12Å; E146-R180 IonicContact OE2-NH2 2.65Å; E146-R180 PolarHBondContact OE2-NH2 2.83Å
147	V	95.9	Very high	95.5	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-44.5	173.5	174.1	0	0	0	0	110.4	L142 S143 Y144 Y150 I151 L338 L341 L342 F470	L142-V147 HydrophobicContact CB-CG2 4.02Å; S143-V147 WeakPolarHBondContact O-CG2 3.5Å; S143-V147 PolarHBondContact O-N 3.28Å; Y144-V147 WeakPolarHBondContact O-CB 3.44Å; Y144-V147 PolarHBondContact O-N 3.39Å; Y144-V147 VanDerWaalsContact O-N 3.16Å; V147-Y150 PolarHBondContact O-N 3.31Å; V147-I151 WeakPolarHBondContact O-CG1 3.38Å; V147-I151 PolarHBondContact O-N 3.1Å; V147-L338 HydrophobicContact CG1-CD1 4.14Å; V147-L341 HydrophobicContact CG1-CB 3.84Å; V147-L341 HydrophobicContact CG1-CD1 4.03Å; V147-L341 HydrophobicContact CG2-CB 4.11Å; V147-L342 HydrophobicContact CG1-CD2 4.13Å; V147-F470 HydrophobicContact CG1-CE1 4.02Å; V147-F470 HydrophobicContact CG1-CZ 3.88Å
148	R	94.7	Very high	95.6	Very high	77 Å²	77	36.7 Å²	36.7	29%	0.291	20%	0.196	S	C	.	.	H	α-helix	trans	-59.5	-49.2	177.3	-167.5	-174.8	72.7	86.9	3	111.5	Y144 E145 I151 Y152	Y144-R148 PolarHBondContact O-N 2.8Å; E145-R148 WeakPolarHBondContact O-CB 3.32Å; E145-R148 PolarHBondContact O-N 3.45Å; E145-R148 IonicContact OE1-CZ 2.63Å; E145-R148 IonicContact OE1-NE 3.64Å; E145-R148 IonicContact OE1-NH2 3.56Å; E145-R148 PolarHBondContact OE1-NH2 3.05Å; E145-R148 IonicContact OE2-CZ 3.12Å; E145-R148 IonicContact OE2-NE 2.67Å; E145-R148 PolarHBondContact OE2-NE 3.45Å; E145-R148 IonicContact OE2-NH2 3.13Å; E145-R148 PolarHBondContact OE2-NH2 2.88Å; R148-I151 PolarHBondContact O-N 3.36Å; R148-Y152 WeakPolarHBondContact O-CB 3.48Å; R148-Y152 PolarHBondContact O-N 2.93Å
149	L	95.2	Very high	95.7	Very high	32 Å²	32	40.7 Å²	40.7	17%	0.168	21%	0.213	C	C	.	.	H	α-helix	trans	-65.7	-41.4	178.2	-72.1	172.7	0	0	0	112.4	E145 E146 I151 Y152 H153	E145-L149 HydrophobicContact CG-CD1 4.25Å; E145-L149 WeakPolarHBondContact O-CB 3.42Å; E145-L149 WeakPolarHBondContact O-CG 3.22Å; E145-L149 PolarHBondContact O-N 3.23Å; E146-L149 PolarHBondContact O-N 2.78Å; L149-I151 VanDerWaalsContact C-N 3.35Å; L149-I151 PolarHBondContact O-N 3.49Å; L149-Y152 PolarHBondContact O-N 3.5Å; L149-H153 PolarHBondContact O-CD2 3.28Å; L149-H153 VanDerWaalsContact O-CD2 3.3Å; L149-H153 PolarHBondContact O-N 3.48Å
150	Y	97.9	Very high	95.9	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-48.8	176.6	-175.4	-79.2	0	0	0	111.3	I135 E146 V147 H153 L154 F176 Y178 Y185 I337 L341	I135-Y150 HydrophobicContact CD1-CD2 4.31Å; I135-Y150 HydrophobicContact CD1-CE2 3.62Å; I135-Y150 HydrophobicContact CG1-CE2 4.17Å; E146-Y150 WeakPolarHBondContact O-CB 3.23Å; E146-Y150 PolarHBondContact O-N 2.74Å; V147-Y150 PolarHBondContact O-N 3.31Å; Y150-H153 PolarHBondContact O-N 2.87Å; Y150-L154 WeakPolarHBondContact O-CB 3.27Å; Y150-L154 PolarHBondContact O-N 3.04Å; Y150-F176 HydrophobicContact CD1-CD1 4.36Å; Y150-F176 HydrophobicContact CD1-CE1 4.28Å; Y150-F176 HydrophobicContact CD2-CD1 4.49Å; Y150-F176 HydrophobicContact CD2-CE1 4.36Å; Y150-F176 AromaticContact CE1-CD1 3.71Å; Y150-F176 HydrophobicContact CE1-CD1 3.71Å; Y150-F176 HydrophobicContact CE1-CE1 4.08Å; Y150-F176 AromaticContact CE2-CD1 3.85Å; Y150-F176 HydrophobicContact CE2-CD1 3.85Å; Y150-F176 HydrophobicContact CE2-CE1 4.16Å; Y150-F176 HydrophobicContact CG-CE1 4.43Å; Y150-F176 AromaticContact CZ-CD1 3.45Å; Y150-F176 VanDerWaalsContact CZ-CD1 3.45Å; Y150-F176 PolarHBondContact OH-O 3.28Å; Y150-Y178 AromaticContact CD2-CD1 3.79Å; Y150-Y178 HydrophobicContact CD2-CD1 3.79Å; Y150-Y178 HydrophobicContact CD2-CD2 4.35Å; Y150-Y178 HydrophobicContact CD2-CE1 4.3Å; Y150-Y178 AromaticContact CD2-CG 3.81Å; Y150-Y178 HydrophobicContact CD2-CG 3.81Å; Y150-Y178 AromaticContact CE2-CD1 4Å; Y150-Y178 HydrophobicContact CE2-CD1 4Å; Y150-Y178 AromaticContact CE2-CG 3.94Å; Y150-Y178 HydrophobicContact CE2-CG 3.94Å; Y150-Y185 HydrophobicContact CD2-CD1 4.45Å; Y150-Y185 HydrophobicContact CD2-CE1 4.12Å; Y150-I337 HydrophobicContact CE1-CG2 3.77Å; Y150-L341 HydrophobicContact CD1-CD1 3.74Å; Y150-L341 HydrophobicContact CE1-CD1 4.17Å; Y150-L341 HydrophobicContact CG-CD1 4.31Å
151	I	97.8	Very high	96.2	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-69.6	-38.6	179.6	-65.6	-64.7	0	0	0	111.5	V147 R148 L149 H153 L154 L155 I337 L338 L341 I467 I471	V147-I151 WeakPolarHBondContact O-CG1 3.38Å; V147-I151 PolarHBondContact O-N 3.1Å; R148-I151 PolarHBondContact O-N 3.36Å; L149-I151 VanDerWaalsContact C-N 3.35Å; L149-I151 PolarHBondContact O-N 3.49Å; I151-H153 PolarHBondContact O-N 3.04Å; I151-L154 HydrophobicContact CD1-CD2 4.27Å; I151-L154 PolarHBondContact O-N 3.18Å; I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.3Å; I151-L155 VanDerWaalsContact O-CG 3.28Å; I151-L155 WeakPolarHBondContact O-CG 3.42Å; I151-L155 PolarHBondContact O-N 2.98Å; I151-I337 HydrophobicContact CD1-CG2 4.3Å; I151-L338 HydrophobicContact CD1-CB 3.85Å; I151-L338 HydrophobicContact CD1-CD1 4.43Å; I151-L338 HydrophobicContact CG1-CB 4.27Å; I151-L338 HydrophobicContact CG1-CD1 3.91Å; I151-L341 HydrophobicContact CD1-CD1 4.03Å; I151-L341 HydrophobicContact CG1-CD1 4.15Å; I151-I467 HydrophobicContact CG2-CG2 4.42Å; I151-I471 HydrophobicContact CG2-CD1 4.23Å
152	Y	97	Very high	96.3	Very high	93 Å²	93	35.9 Å²	35.9	37%	0.365	16%	0.164	S	C	.	.	H	α-helix	trans	-56.8	-49.8	173.2	171.5	-99.7	0	0	0	111.9	R148 L149 L154 L155 K156	R148-Y152 WeakPolarHBondContact O-CB 3.48Å; R148-Y152 PolarHBondContact O-N 2.93Å; L149-Y152 PolarHBondContact O-N 3.5Å; Y152-L154 VanDerWaalsContact C-N 3.33Å; Y152-L154 PolarHBondContact O-N 3.13Å; Y152-L155 PolarHBondContact O-N 3.15Å; Y152-K156 HydrophobicContact CE1-CD 4.49Å; Y152-K156 WeakPolarHBondContact O-CB 3.47Å; Y152-K156 PolarHBondContact O-N 3.12Å
153	H	98.5	Very high	96.5	Very high	38 Å²	38	41.1 Å²	41.1	18%	0.176	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-32.2	179.7	-82.4	-94.4	0	0	0	112.8	N109 L149 Y150 I151 K156 A157 F176 Y185	N109-H153 WeakPolarHBondContact ND2-CB 3.47Å; N109-H153 PolarHBondContact ND2-ND1 3.18Å; N109-H153 PolarHBondContact ND2-O 3.43Å; N109-H153 PolarHBondContact OD1-ND1 2.93Å; L149-H153 PolarHBondContact O-CD2 3.28Å; L149-H153 VanDerWaalsContact O-CD2 3.3Å; L149-H153 PolarHBondContact O-N 3.48Å; Y150-H153 PolarHBondContact O-N 2.87Å; I151-H153 PolarHBondContact O-N 3.04Å; H153-K156 PolarHBondContact O-N 2.88Å; H153-A157 PolarHBondContact O-N 2.9Å; H153-F176 HydrophobicContact CB-CZ 4.01Å; H153-Y185 HydrophobicContact CB-CD1 3.88Å; H153-Y185 HydrophobicContact CB-CD2 3.53Å; H153-Y185 HydrophobicContact CB-CE1 4.27Å; H153-Y185 HydrophobicContact CB-CE2 3.95Å; H153-Y185 HydrophobicContact CB-CG 3.49Å; H153-Y185 VanDerWaalsContact CB-CG 3.49Å; H153-Y185 AromaticContact CD2-CD2 3.61Å; H153-Y185 AromaticContact CD2-CE2 3.29Å; H153-Y185 WeakPolarHBondContact CD2-CE2 3.49Å; H153-Y185 AromaticContact CD2-CZ 3.89Å; H153-Y185 AromaticContact CE1-CD2 3.79Å; H153-Y185 AromaticContact CE1-CE2 3.92Å; H153-Y185 AromaticContact CG-CD2 3.2Å; H153-Y185 AromaticContact CG-CE2 3.43Å; H153-Y185 VanDerWaalsContact CG-CE2 3.43Å; H153-Y185 AromaticContact CG-CG 3.76Å; H153-Y185 AromaticContact ND1-CD2 3.32Å; H153-Y185 VanDerWaalsContact ND1-CD2 3.32Å; H153-Y185 WeakPolarHBondContact ND1-CD2 3.48Å; H153-Y185 AromaticContact ND1-CE2 3.81Å; H153-Y185 AromaticContact NE2-CD2 3.99Å; H153-Y185 AromaticContact NE2-CE2 3.66Å
154	L	98.7	Very high	96.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-48.8	172	175.2	60	0	0	0	111	Y150 I151 Y152 K156 A157 L158 I171 F176 A334 I337	Y150-L154 WeakPolarHBondContact O-CB 3.27Å; Y150-L154 PolarHBondContact O-N 3.04Å; I151-L154 HydrophobicContact CD1-CD2 4.27Å; I151-L154 PolarHBondContact O-N 3.18Å; Y152-L154 VanDerWaalsContact C-N 3.33Å; Y152-L154 PolarHBondContact O-N 3.13Å; L154-K156 VanDerWaalsContact C-N 3.29Å; L154-K156 PolarHBondContact O-N 2.8Å; L154-A157 WeakPolarHBondContact O-CB 3.48Å; L154-A157 PolarHBondContact O-N 3.36Å; L154-L158 HydrophobicContact CD1-CG 4.36Å; L154-L158 HydrophobicContact CG-CD1 4.44Å; L154-L158 WeakPolarHBondContact O-CG 3.49Å; L154-L158 PolarHBondContact O-N 2.81Å; L154-I171 HydrophobicContact CD1-CG2 4.22Å; L154-F176 VanDerWaalsContact CA-CZ 3.41Å; L154-F176 HydrophobicContact CB-CD1 4.15Å; L154-F176 HydrophobicContact CB-CE1 3.74Å; L154-F176 HydrophobicContact CB-CE2 4.37Å; L154-F176 HydrophobicContact CB-CZ 3.86Å; L154-F176 HydrophobicContact CD1-CB 4.37Å; L154-F176 HydrophobicContact CD1-CD1 4.21Å; L154-F176 HydrophobicContact CD1-CD2 3.93Å; L154-F176 HydrophobicContact CD1-CE2 4.25Å; L154-F176 HydrophobicContact CD1-CG 3.92Å; L154-F176 VanDerWaalsContact N-CZ 3.27Å; L154-A334 HydrophobicContact CD2-CB 3.7Å; L154-A334 HydrophobicContact CG-CB 4.33Å; L154-I337 HydrophobicContact CD2-CD1 3.87Å
155	L	97.9	Very high	97.1	Very high	40 Å²	40	36 Å²	36	21%	0.209	16%	0.161	C	C	.	.	H	α-helix	trans	-66.8	-32.5	178.6	-66.3	171.5	0	0	0	112.4	I151 Y152 L158 K159 I467 I471	I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.3Å; I151-L155 VanDerWaalsContact O-CG 3.28Å; I151-L155 WeakPolarHBondContact O-CG 3.42Å; I151-L155 PolarHBondContact O-N 2.98Å; Y152-L155 PolarHBondContact O-N 3.15Å; L155-L158 HydrophobicContact CD2-CD1 4.42Å; L155-L158 PolarHBondContact O-N 3.3Å; L155-K159 VanDerWaalsContact O-CB 3.27Å; L155-K159 WeakPolarHBondContact O-CB 3.48Å; L155-K159 PolarHBondContact O-N 3.01Å; L155-I467 HydrophobicContact CD1-CG2 3.42Å; L155-I467 VanDerWaalsContact CD1-CG2 3.42Å; L155-I467 HydrophobicContact CD2-CG2 4.3Å; L155-I467 HydrophobicContact CG-CG2 4.42Å; L155-I471 HydrophobicContact CD1-CD1 3.25Å
156	K	97.5	Very high	97.4	Very high	61 Å²	61	32.1 Å²	32.1	27%	0.265	14%	0.143	S	C	.	.	H	α-helix	trans	-60.2	-46.1	171.6	-174.5	175	178.4	-171.6	0	111.1	E108 Y152 H153 L154 H160	E108-K156 WeakPolarHBondContact OE1-CE 3.36Å; E108-K156 IonicContact OE1-NZ 3.03Å; E108-K156 PolarHBondContact OE1-NZ 3.24Å; E108-K156 WeakPolarHBondContact OE2-CE 3.38Å; E108-K156 IonicContact OE2-NZ 3.2Å; Y152-K156 HydrophobicContact CE1-CD 4.49Å; Y152-K156 WeakPolarHBondContact O-CB 3.47Å; Y152-K156 PolarHBondContact O-N 3.12Å; H153-K156 PolarHBondContact O-N 2.88Å; L154-K156 VanDerWaalsContact C-N 3.29Å; L154-K156 PolarHBondContact O-N 2.8Å; K156-H160 PolarHBondContact O-N 3.48Å; K156-H160 VanDerWaalsContact O-N 3.14Å
157	A	98.8	Very high	97.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.1	-45.2	174.3	0	0	0	0	0	112.3	E108 N109 V110 H153 L154 H160 I161 F176 L187	E108-A157 VanDerWaalsContact O-CA 3.31Å; E108-A157 WeakPolarHBondContact O-CA 3.07Å; N109-A157 HydrophobicContact CB-CB 4.21Å; V110-A157 HydrophobicContact CG2-CB 4.06Å; H153-A157 PolarHBondContact O-N 2.9Å; L154-A157 WeakPolarHBondContact O-CB 3.48Å; L154-A157 PolarHBondContact O-N 3.36Å; A157-H160 WeakPolarHBondContact O-CB 3.47Å; A157-H160 PolarHBondContact O-N 3.32Å; A157-I161 PolarHBondContact O-N 2.95Å; A157-F176 HydrophobicContact CB-CE2 4.34Å; A157-L187 HydrophobicContact CB-CB 3.96Å; A157-L187 HydrophobicContact CB-CD2 4.06Å
158	L	98.4	Very high	97.6	Very high	3 Å²	3	30.7 Å²	30.7	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-62	-48.3	178.8	-69.9	-175	0	0	0	112.1	L154 L155 H160 I161 H162 I171 L187 D330 A334	L154-L158 HydrophobicContact CD1-CG 4.36Å; L154-L158 HydrophobicContact CG-CD1 4.44Å; L154-L158 WeakPolarHBondContact O-CG 3.49Å; L154-L158 PolarHBondContact O-N 2.81Å; L155-L158 HydrophobicContact CD2-CD1 4.42Å; L155-L158 PolarHBondContact O-N 3.3Å; L158-H160 PolarHBondContact O-N 3.4Å; L158-I161 HydrophobicContact CD2-CD1 4.05Å; L158-I161 HydrophobicContact CD2-CG1 4.48Å; L158-I161 WeakPolarHBondContact O-CG1 3.24Å; L158-I161 PolarHBondContact O-N 2.89Å; L158-H162 VanDerWaalsContact O-CB 3.22Å; L158-H162 WeakPolarHBondContact O-CB 3.46Å; L158-H162 PolarHBondContact O-CD2 2.82Å; L158-H162 PolarHBondContact O-N 2.85Å; L158-H162 PolarHBondContact O-ND1 3.36Å; L158-I171 HydrophobicContact CD2-CD1 3.57Å; L158-I171 HydrophobicContact CD2-CG1 3.89Å; L158-L187 HydrophobicContact CD2-CD2 4.38Å; L158-D330 HydrophobicContact CD2-CB 4.09Å; L158-A334 HydrophobicContact CD1-CB 3.86Å
159	K	97.7	Very high	97.7	Very high	102 Å²	102	27.5 Å²	27.5	44%	0.443	13%	0.125	S	C	.	.	H	α-helix	trans	-52.7	-47	175.3	178.8	-178	176.6	-177.9	0	110.6	L155 H162 Q163	L155-K159 VanDerWaalsContact O-CB 3.27Å; L155-K159 WeakPolarHBondContact O-CB 3.48Å; L155-K159 PolarHBondContact O-N 3.01Å; K159-H162 PolarHBondContact O-N 2.78Å; K159-Q163 WeakPolarHBondContact O-CG 3.3Å; K159-Q163 PolarHBondContact O-N 3.22Å; K159-Q163 VanDerWaalsContact O-N 3.13Å
160	H	98.3	Very high	97.9	Very high	9 Å²	9	26.3 Å²	26.3	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-54.5	179.5	-178.3	67.6	0	0	0	111.9	A104 R107 E108 K156 A157 L158 H162 Q163 F164	A104-H160 PolarHBondContact O-CD2 3.08Å; A104-H160 PolarHBondContact O-NE2 3.28Å; R107-H160 PolarHBondContact NE-CE1 3.38Å; E108-H160 HydrophobicContact CB-CB 3.76Å; E108-H160 HydrophobicContact CG-CB 4.36Å; K156-H160 PolarHBondContact O-N 3.48Å; K156-H160 VanDerWaalsContact O-N 3.14Å; A157-H160 WeakPolarHBondContact O-CB 3.47Å; A157-H160 PolarHBondContact O-N 3.32Å; L158-H160 PolarHBondContact O-N 3.4Å; H160-H162 VanDerWaalsContact C-N 3.27Å; H160-H162 PolarHBondContact O-N 3.22Å; H160-Q163 WeakPolarHBondContact O-CB 3.14Å; H160-Q163 PolarHBondContact O-N 3.28Å; H160-Q163 VanDerWaalsContact O-N 3.15Å; H160-F164 AromaticContact CE1-CE2 3.52Å; H160-F164 AromaticContact NE2-CE2 3.87Å; H160-F164 WeakPolarHBondContact O-CD2 2.72Å
161	I	98.4	Very high	97.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-30.2	-179.2	64.1	160.4	0	0	0	112.9	V110 A157 L158 Q163 F164 G165 I166 H168 L187 F190	V110-I161 HydrophobicContact CG1-CG2 4.19Å; V110-I161 HydrophobicContact CG2-CG2 3.72Å; A157-I161 PolarHBondContact O-N 2.95Å; L158-I161 HydrophobicContact CD2-CD1 4.05Å; L158-I161 HydrophobicContact CD2-CG1 4.48Å; L158-I161 WeakPolarHBondContact O-CG1 3.24Å; L158-I161 PolarHBondContact O-N 2.89Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 3.11Å; I161-F164 PolarHBondContact O-N 2.85Å; I161-G165 PolarHBondContact O-N 3.27Å; I161-I166 HydrophobicContact CB-CB 4.19Å; I161-I166 HydrophobicContact CB-CD1 4.37Å; I161-I166 WeakPolarHBondContact O-CB 3.47Å; I161-I166 PolarHBondContact O-N 3.38Å; I161-H168 HydrophobicContact CD1-CB 3.85Å; I161-L187 HydrophobicContact CD1-CD2 3.82Å; I161-L187 HydrophobicContact CG1-CD2 4.42Å; I161-L187 HydrophobicContact CG2-CD2 4.32Å; I161-F190 HydrophobicContact CD1-CE1 4.43Å; I161-F190 HydrophobicContact CG2-CE1 3.99Å; I161-F190 HydrophobicContact CG2-CZ 4.03Å
162	H	97.6	Very high	97.9	Very high	41 Å²	41	27.9 Å²	27.9	19%	0.19	13%	0.125	C	C	.	.	H	α-helix	trans	-69.8	-29.7	177.2	-67.2	176	0	0	0	111.8	L158 K159 H160 F164 G165 I166 T327 D330	L158-H162 VanDerWaalsContact O-CB 3.22Å; L158-H162 WeakPolarHBondContact O-CB 3.46Å; L158-H162 PolarHBondContact O-CD2 2.82Å; L158-H162 PolarHBondContact O-N 2.85Å; L158-H162 PolarHBondContact O-ND1 3.36Å; K159-H162 PolarHBondContact O-N 2.78Å; H160-H162 VanDerWaalsContact C-N 3.27Å; H160-H162 PolarHBondContact O-N 3.22Å; H162-F164 VanDerWaalsContact C-N 3.26Å; H162-F164 PolarHBondContact O-N 3.14Å; H162-G165 WeakPolarHBondContact O-CA 3.06Å; H162-G165 PolarHBondContact O-N 3.1Å; H162-I166 PolarHBondContact CD2-O 3.36Å; H162-I166 VanDerWaalsContact CD2-O 3.24Å; H162-T327 HydrophobicContact CB-CG2 4.06Å; H162-T327 VanDerWaalsContact CD2-CG2 3.49Å; H162-T327 WeakPolarHBondContact CD2-CG2 3.33Å; H162-T327 PolarHBondContact CE1-O 3.43Å; H162-D330 IonicContact CD2-OD2 2.68Å; H162-D330 IonicContact NE2-OD2 2.77Å; H162-D330 PolarHBondContact NE2-OD2 2.78Å
163	Q	97.1	Very high	97.9	Very high	115 Å²	115	24 Å²	24	54%	0.537	11%	0.111	S	C	.	.	H	α-helix	trans	-65.6	-29	171.3	-72.4	169.2	-25.7	0	0	112.6	K159 H160 I161 G165 Q200	K159-Q163 WeakPolarHBondContact O-CG 3.3Å; K159-Q163 PolarHBondContact O-N 3.22Å; K159-Q163 VanDerWaalsContact O-N 3.13Å; H160-Q163 WeakPolarHBondContact O-CB 3.14Å; H160-Q163 PolarHBondContact O-N 3.28Å; H160-Q163 VanDerWaalsContact O-N 3.15Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 3.11Å; Q163-G165 PolarHBondContact O-N 2.71Å; Q163-Q200 PolarHBondContact O-NE2 3.37Å
164	F	97.3	Very high	97.8	Very high	25 Å²	25	27.2 Å²	27.2	11%	0.11	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.1	170	-73.3	-97.1	0	0	0	112.6	L103 A104 H160 I161 H162 I166 S199 Q200 I201	L103-F164 HydrophobicContact CB-CE1 4.46Å; A104-F164 HydrophobicContact CB-CD1 4.39Å; A104-F164 HydrophobicContact CB-CD2 4.08Å; A104-F164 HydrophobicContact CB-CE2 4.42Å; A104-F164 HydrophobicContact CB-CG 4.09Å; H160-F164 AromaticContact CE1-CE2 3.52Å; H160-F164 AromaticContact NE2-CE2 3.87Å; H160-F164 WeakPolarHBondContact O-CD2 2.72Å; I161-F164 PolarHBondContact O-N 2.85Å; H162-F164 VanDerWaalsContact C-N 3.26Å; H162-F164 PolarHBondContact O-N 3.14Å; F164-I166 VanDerWaalsContact C-N 3.28Å; F164-I166 HydrophobicContact CB-CD1 3.86Å; F164-I166 HydrophobicContact CB-CG1 3.95Å; F164-I166 PolarHBondContact O-N 3.33Å; F164-S199 PolarHBondContact O-OG 2.85Å; F164-Q200 HydrophobicContact CD1-CB 4.2Å; F164-Q200 PolarHBondContact O-N 3.28Å; F164-I201 HydrophobicContact CD1-CD1 4.2Å
165	G	96.8	Very high	97.8	Very high	3 Å²	3	27.8 Å²	27.8	3%	0.031	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	29.4	-177.2	0	0	0	0	0	113.4	I161 H162 Q163 T196 S199	I161-G165 PolarHBondContact O-N 3.27Å; H162-G165 WeakPolarHBondContact O-CA 3.06Å; H162-G165 PolarHBondContact O-N 3.1Å; Q163-G165 PolarHBondContact O-N 2.71Å; G165-T196 WeakPolarHBondContact CA-OG1 3.27Å; G165-T196 PolarHBondContact O-N 2.9Å; G165-T196 PolarHBondContact O-OG1 3.41Å; G165-S199 WeakPolarHBondContact O-CB 3.12Å; G165-S199 PolarHBondContact O-OG 3.2Å
166	I	97.9	Very high	97.8	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.6	177.2	-58.4	169.5	0	0	0	109	C100 A104 I161 H162 F164 F190 A193 I201 L204	C100-I166 HydrophobicContact CB-CD1 4.33Å; A104-I166 HydrophobicContact CB-CD1 3.88Å; I161-I166 HydrophobicContact CB-CB 4.19Å; I161-I166 HydrophobicContact CB-CD1 4.37Å; I161-I166 WeakPolarHBondContact O-CB 3.47Å; I161-I166 PolarHBondContact O-N 3.38Å; H162-I166 PolarHBondContact CD2-O 3.36Å; H162-I166 VanDerWaalsContact CD2-O 3.24Å; F164-I166 VanDerWaalsContact C-N 3.28Å; F164-I166 HydrophobicContact CB-CD1 3.86Å; F164-I166 HydrophobicContact CB-CG1 3.95Å; F164-I166 PolarHBondContact O-N 3.33Å; I166-F190 HydrophobicContact CG2-CD1 4.1Å; I166-F190 HydrophobicContact CG2-CE1 4.21Å; I166-A193 HydrophobicContact CG2-CB 4Å; I166-I201 HydrophobicContact CD1-CD1 4.21Å; I166-I201 HydrophobicContact CD1-CG1 3.81Å; I166-I201 HydrophobicContact CG1-CG1 3.69Å; I166-L204 HydrophobicContact CB-CD1 4.5Å; I166-L204 HydrophobicContact CG1-CD1 4.04Å; I166-L204 HydrophobicContact CG2-CD1 4.3Å
167	I	97.5	Very high	97.8	Very high	3 Å²	3	24 Å²	24	2%	0.015	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.2	164.6	-48.6	172.5	0	0	0	106.5	R169 A193 Q194 T196 T327 I329	I167-R169 HydrophobicContact CB-CG 4.37Å; I167-R169 HydrophobicContact CG2-CG 3.85Å; I167-A193 CarbonylContact O-C 3.49Å; I167-A193 VanDerWaalsContact O-CA 3.23Å; I167-A193 WeakPolarHBondContact O-CA 3.46Å; I167-Q194 PolarHBondContact N-O 3.43Å; I167-Q194 PolarHBondContact O-N 3.44Å; I167-T196 HydrophobicContact CD1-CG2 4.06Å; I167-T196 HydrophobicContact CG1-CG2 3.85Å; I167-T327 HydrophobicContact CG1-CG2 4Å; I167-I329 HydrophobicContact CG2-CD1 3.57Å; I167-I329 HydrophobicContact CG2-CG1 3.71Å
168	H	98.3	Very high	97.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.116	C	C	.	.			trans	-72.3	-38.1	-174.2	-170.3	-59.3	0	0	0	112.5	I161 D170 I171 V188 D189 F190 D330	I161-H168 HydrophobicContact CD1-CB 3.85Å; H168-D170 PolarHBondContact ND1-N 3.13Å; H168-D170 PolarHBondContact O-N 2.87Å; H168-D170 VanDerWaalsContact O-N 3.11Å; H168-I171 HydrophobicContact CB-CD1 3.6Å; H168-I171 HydrophobicContact CB-CG1 4.04Å; H168-I171 VanDerWaalsContact CG-CD1 3.43Å; H168-V188 PolarHBondContact CE1-O 3.14Å; H168-V188 PolarHBondContact NE2-O 3.5Å; H168-D189 PolarHBondContact CE1-O 3.36Å; H168-D189 PolarHBondContact NE2-O 3.16Å; H168-F190 AromaticContact CD2-CE1 3.93Å; H168-D330 PolarHBondContact N-OD1 2.91Å; H168-D330 PolarHBondContact N-OD2 3.43Å
169	R	97.7	Very high	97.8	Very high	10 Å²	10	24.2 Å²	24.2	4%	0.038	12%	0.117	C	C	.	.	S	Bend	trans	67.9	-4	177.6	-47.7	-169	49.5	94	18.6	117.2	I167 L192 P306 A308 G309 Q325 I329 D330	I167-R169 HydrophobicContact CB-CG 4.37Å; I167-R169 HydrophobicContact CG2-CG 3.85Å; R169-L192 VanDerWaalsContact CD-O 3.27Å; R169-L192 WeakPolarHBondContact CD-O 3.46Å; R169-P306 VanDerWaalsContact NH1-CB 3.31Å; R169-P306 PolarHBondContact NH2-O 3.27Å; R169-A308 PolarHBondContact NH2-O 3.3Å; R169-G309 VanDerWaalsContact O-CA 3.24Å; R169-G309 WeakPolarHBondContact O-CA 3.33Å; R169-Q325 VanDerWaalsContact CZ-OE1 3.29Å; R169-I329 HydrophobicContact CG-CD1 4.14Å; R169-D330 PolarHBondContact N-OD1 3.14Å
170	D	97.9	Very high	97.7	Very high	7 Å²	7	22.9 Å²	22.9	4%	0.037	11%	0.109	C	C	.	.			trans	-143.2	41.2	-177	-156	38.6	0	0	0	112.2	H168 K172 N175 L192 G309 T310	H168-D170 PolarHBondContact ND1-N 3.13Å; H168-D170 PolarHBondContact O-N 2.87Å; H168-D170 VanDerWaalsContact O-N 3.11Å; D170-K172 PolarHBondContact O-N 3.09Å; D170-K172 IonicContact OD1-NZ 3.7Å; D170-K172 WeakPolarHBondContact OD2-CE 3.47Å; D170-K172 IonicContact OD2-NZ 3.55Å; D170-K172 PolarHBondContact OD2-NZ 3.05Å; D170-N175 PolarHBondContact O-ND2 3.35Å; D170-N175 PolarHBondContact OD2-ND2 3.29Å; D170-N175 VanDerWaalsContact OD2-ND2 3.14Å; D170-L192 HydrophobicContact CB-CB 4.45Å; D170-L192 HydrophobicContact CB-CD1 3.86Å; D170-G309 WeakPolarHBondContact OD1-CA 3.42Å; D170-T310 WeakPolarHBondContact OD1-CB 3.37Å; D170-T310 PolarHBondContact OD1-N 2.97Å; D170-T310 PolarHBondContact OD1-OG1 3.38Å
171	I	98.5	Very high	97.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	14%	0.142	C	C	.	.			trans	-68.4	118.2	172.1	-57.9	-56.9	0	0	0	108.9	L154 L158 H168 L187 D330 S333 I337	L154-I171 HydrophobicContact CD1-CG2 4.22Å; L158-I171 HydrophobicContact CD2-CD1 3.57Å; L158-I171 HydrophobicContact CD2-CG1 3.89Å; H168-I171 HydrophobicContact CB-CD1 3.6Å; H168-I171 HydrophobicContact CB-CG1 4.04Å; H168-I171 VanDerWaalsContact CG-CD1 3.43Å; I171-L187 HydrophobicContact CD1-CD1 3.6Å; I171-L187 HydrophobicContact CD1-CD2 4.25Å; I171-D330 HydrophobicContact CG1-CB 3.8Å; I171-S333 WeakPolarHBondContact O-CB 3.31Å; I171-I337 HydrophobicContact CG2-CD1 3.84Å
172	K	97.7	Very high	97.6	Very high	35 Å²	35	36.4 Å²	36.4	15%	0.152	17%	0.173	C	C	.	.	S	Bend	trans	-162	163.2	179.3	67.6	-162	-173.7	-159.9	0	108.6	D170 N174 N175 F176 T310 F313	D170-K172 PolarHBondContact O-N 3.09Å; D170-K172 IonicContact OD1-NZ 3.7Å; D170-K172 WeakPolarHBondContact OD2-CE 3.47Å; D170-K172 IonicContact OD2-NZ 3.55Å; D170-K172 PolarHBondContact OD2-NZ 3.05Å; K172-N174 HydrophobicContact CG-CB 4.21Å; K172-N174 PolarHBondContact O-N 2.93Å; K172-N174 VanDerWaalsContact O-N 3.16Å; K172-N175 HydrophobicContact CG-CB 4.24Å; K172-N175 PolarHBondContact O-N 3.4Å; K172-F176 PolarHBondContact O-N 2.82Å; K172-T310 HydrophobicContact CD-CG2 4.18Å; K172-T310 VanDerWaalsContact CD-OG1 3.25Å; K172-T310 WeakPolarHBondContact CD-OG1 3.28Å; K172-T310 PolarHBondContact NZ-OG1 3.03Å; K172-F313 HydrophobicContact CB-CD1 4.05Å; K172-F313 HydrophobicContact CB-CD2 4.06Å; K172-F313 HydrophobicContact CB-CE1 3.98Å; K172-F313 HydrophobicContact CB-CE2 3.99Å; K172-F313 HydrophobicContact CB-CG 4.09Å; K172-F313 HydrophobicContact CB-CZ 3.96Å
173	P	97.6	Very high	97.5	Very high	10 Å²	10	42.2 Å²	42.2	7%	0.065	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.8	-33.8	-176.8	-31.9	43.1	0	0	0	114.5	I135 N175 F176 I337 Y346	I135-P173 HydrophobicContact CB-CB 3.86Å; I135-P173 HydrophobicContact CG1-CB 3.77Å; I135-P173 HydrophobicContact CG2-CB 4.38Å; P173-N175 PolarHBondContact O-N 3.46Å; P173-F176 PolarHBondContact O-N 3.14Å; P173-I337 HydrophobicContact CG-CD1 4.38Å; P173-I337 HydrophobicContact CG-CG1 4.01Å; P173-I337 HydrophobicContact CG-CG2 4.19Å; P173-Y346 HydrophobicContact CB-CE2 4.19Å; P173-Y346 HydrophobicContact CG-CD2 4.24Å; P173-Y346 HydrophobicContact CG-CE2 3.49Å; P173-Y346 VanDerWaalsContact CG-CE2 3.49Å
174	N	96.1	Very high	97.5	Very high	107 Å²	107	39.4 Å²	39.4	57%	0.572	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-64	-24.5	176.1	-65.5	71.7	0	0	0	113.9	K172 Y346	K172-N174 HydrophobicContact CG-CB 4.21Å; K172-N174 PolarHBondContact O-N 2.93Å; K172-N174 VanDerWaalsContact O-N 3.16Å; N174-Y346 PolarHBondContact OD1-OH 3.48Å
175	N	98.1	Very high	97.6	Very high	11 Å²	11	38.8 Å²	38.8	6%	0.059	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-100.4	4.2	179.5	-70.9	-5.8	0	0	0	112.4	D170 K172 P173 L187 V188	D170-N175 PolarHBondContact O-ND2 3.35Å; D170-N175 PolarHBondContact OD2-ND2 3.29Å; D170-N175 VanDerWaalsContact OD2-ND2 3.14Å; K172-N175 HydrophobicContact CG-CB 4.24Å; K172-N175 PolarHBondContact O-N 3.4Å; P173-N175 PolarHBondContact O-N 3.46Å; N175-L187 WeakPolarHBondContact O-CA 3.44Å; N175-L187 WeakPolarHBondContact O-CD1 3.47Å; N175-V188 HydrophobicContact CB-CG2 4.31Å; N175-V188 WeakPolarHBondContact O-CG2 3.42Å; N175-V188 PolarHBondContact O-N 3.42Å
176	F	98.5	Very high	97.7	Very high	2 Å²	2	39 Å²	39	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	90.1	173.6	-169.8	-116.3	0	0	0	109.4	Y150 H153 L154 A157 K172 P173 Y185 A186 L187	Y150-F176 HydrophobicContact CD1-CD1 4.36Å; Y150-F176 HydrophobicContact CD1-CE1 4.28Å; Y150-F176 HydrophobicContact CD2-CD1 4.49Å; Y150-F176 HydrophobicContact CD2-CE1 4.36Å; Y150-F176 AromaticContact CE1-CD1 3.71Å; Y150-F176 HydrophobicContact CE1-CD1 3.71Å; Y150-F176 HydrophobicContact CE1-CE1 4.08Å; Y150-F176 AromaticContact CE2-CD1 3.85Å; Y150-F176 HydrophobicContact CE2-CD1 3.85Å; Y150-F176 HydrophobicContact CE2-CE1 4.16Å; Y150-F176 HydrophobicContact CG-CE1 4.43Å; Y150-F176 AromaticContact CZ-CD1 3.45Å; Y150-F176 VanDerWaalsContact CZ-CD1 3.45Å; Y150-F176 PolarHBondContact OH-O 3.28Å; H153-F176 HydrophobicContact CB-CZ 4.01Å; L154-F176 VanDerWaalsContact CA-CZ 3.41Å; L154-F176 HydrophobicContact CB-CD1 4.15Å; L154-F176 HydrophobicContact CB-CE1 3.74Å; L154-F176 HydrophobicContact CB-CE2 4.37Å; L154-F176 HydrophobicContact CB-CZ 3.86Å; L154-F176 HydrophobicContact CD1-CB 4.37Å; L154-F176 HydrophobicContact CD1-CD1 4.21Å; L154-F176 HydrophobicContact CD1-CD2 3.93Å; L154-F176 HydrophobicContact CD1-CE2 4.25Å; L154-F176 HydrophobicContact CD1-CG 3.92Å; L154-F176 VanDerWaalsContact N-CZ 3.27Å; A157-F176 HydrophobicContact CB-CE2 4.34Å; K172-F176 PolarHBondContact O-N 2.82Å; P173-F176 PolarHBondContact O-N 3.14Å; F176-Y185 AromaticContact CE1-CD1 3.72Å; F176-Y185 HydrophobicContact CE1-CD1 3.72Å; F176-Y185 HydrophobicContact CE1-CG 4.35Å; F176-Y185 AromaticContact CZ-CD1 3.87Å; F176-Y185 HydrophobicContact CZ-CD1 3.87Å; F176-Y185 HydrophobicContact CZ-CG 4.04Å; F176-A186 CarbonylContact C-O 3.6Å; F176-A186 WeakPolarHBondContact CA-O 3.38Å; F176-L187 HydrophobicContact CD2-CB 4.05Å; F176-L187 HydrophobicContact CD2-CD1 4.43Å; F176-L187 HydrophobicContact CE2-CB 4.49Å
177	L	98.4	Very high	97.7	Very high	21 Å²	21	39 Å²	39	11%	0.11	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	136.1	-177.2	-52.3	-172	0	0	0	109.6	M111 M130 H132 Y185 A186 V188	M111-L177 HydrophobicContact CE-CD1 4.18Å; M130-L177 HydrophobicContact CB-CD1 4.16Å; M130-L177 HydrophobicContact SD-CB 3.74Å; M130-L177 HydrophobicContact SD-CD1 4.29Å; H132-L177 HydrophobicContact CB-CB 4.12Å; L177-Y185 VanDerWaalsContact O-CA 3.29Å; L177-Y185 WeakPolarHBondContact O-CA 3.36Å; L177-A186 HydrophobicContact CB-CB 4.32Å; L177-A186 PolarHBondContact N-O 3.14Å; L177-A186 PolarHBondContact O-N 3.41Å; L177-V188 HydrophobicContact CD1-CG1 3.78Å; L177-V188 HydrophobicContact CD2-CG2 4.24Å; L177-V188 HydrophobicContact CG-CG1 3.89Å; L177-V188 HydrophobicContact CG-CG2 4.23Å
178	Y	98.2	Very high	97.8	Very high	3 Å²	3	39.9 Å²	39.9	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	119.4	179.6	172.3	-136.5	0	0	0	110.4	H132 Q133 I135 I138 L142 Y150 R180 Y185	H132-Y178 VanDerWaalsContact CA-O 3.29Å; H132-Y178 WeakPolarHBondContact CA-O 3.41Å; H132-Y178 WeakPolarHBondContact CB-O 3.44Å; Q133-Y178 PolarHBondContact N-O 3.19Å; Q133-Y178 PolarHBondContact OE1-O 3.06Å; I135-Y178 HydrophobicContact CD1-CD1 4.14Å; I138-Y178 HydrophobicContact CD1-CD1 3.79Å; I138-Y178 HydrophobicContact CD1-CE1 3.8Å; L142-Y178 HydrophobicContact CD2-CE1 4.08Å; Y150-Y178 AromaticContact CD2-CD1 3.79Å; Y150-Y178 HydrophobicContact CD2-CD1 3.79Å; Y150-Y178 HydrophobicContact CD2-CD2 4.35Å; Y150-Y178 HydrophobicContact CD2-CE1 4.3Å; Y150-Y178 AromaticContact CD2-CG 3.81Å; Y150-Y178 HydrophobicContact CD2-CG 3.81Å; Y150-Y178 AromaticContact CE2-CD1 4Å; Y150-Y178 HydrophobicContact CE2-CD1 4Å; Y150-Y178 AromaticContact CE2-CG 3.94Å; Y150-Y178 HydrophobicContact CE2-CG 3.94Å; Y178-R180 HydrophobicContact CE1-CB 3.92Å; Y178-R180 HydrophobicContact CE1-CG 4.26Å; Y178-R180 HydrophobicContact CE2-CB 4.43Å; Y178-Y185 AromaticContact CD2-CD1 3.63Å; Y178-Y185 HydrophobicContact CD2-CD1 3.63Å; Y178-Y185 AromaticContact CD2-CE1 3.21Å; Y178-Y185 HydrophobicContact CD2-CE1 3.21Å; Y178-Y185 AromaticContact CD2-CZ 3.87Å; Y178-Y185 HydrophobicContact CE2-CD1 4.27Å; Y178-Y185 AromaticContact CE2-CE1 3.41Å; Y178-Y185 HydrophobicContact CE2-CE1 3.41Å; Y178-Y185 VanDerWaalsContact CE2-CE1 3.41Å; Y178-Y185 AromaticContact CE2-CZ 3.65Å; Y178-Y185 HydrophobicContact CG-CD1 4.34Å; Y178-Y185 HydrophobicContact CG-CE1 4.1Å
179	N	97.9	Very high	97.7	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	104.3	167	-168	-52.4	0	0	0	109	M130 E131 K181 L182 R183 T184	M130-N179 HydrophobicContact CE-CB 4.47Å; E131-N179 VanDerWaalsContact O-CB 3.24Å; E131-N179 WeakPolarHBondContact O-CB 3.45Å; E131-N179 PolarHBondContact O-ND2 2.79Å; N179-K181 VanDerWaalsContact C-N 3.33Å; N179-K181 PolarHBondContact O-N 2.99Å; N179-K181 PolarHBondContact OD1-N 3.01Å; N179-K181 VanDerWaalsContact OD1-N 3.12Å; N179-L182 HydrophobicContact CB-CB 4.29Å; N179-L182 PolarHBondContact OD1-N 3.11Å; N179-R183 VanDerWaalsContact O-CA 3.26Å; N179-R183 WeakPolarHBondContact O-CA 3.33Å; N179-R183 PolarHBondContact O-N 3.49Å; N179-T184 WeakPolarHBondContact CB-OG1 3.29Å; N179-T184 PolarHBondContact N-O 2.75Å; N179-T184 PolarHBondContact O-N 3.02Å
180	R	96.4	Very high	97.7	Very high	73 Å²	73	41.3 Å²	41.3	28%	0.275	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-38	-179	-174.4	177.4	-172.8	173.5	10.5	113.1	S141 E146 Y178	S141-R180 PolarHBondContact O-NH2 3.11Å; S141-R180 PolarHBondContact OG-NH1 3.03Å; E146-R180 VanDerWaalsContact CD-NH2 3.32Å; E146-R180 IonicContact OE1-CZ 3.13Å; E146-R180 VanDerWaalsContact OE1-CZ 3.26Å; E146-R180 IonicContact OE1-NE 2.68Å; E146-R180 PolarHBondContact OE1-NE 3.42Å; E146-R180 IonicContact OE1-NH2 2.95Å; E146-R180 PolarHBondContact OE1-NH2 3Å; E146-R180 IonicContact OE2-CZ 3.07Å; E146-R180 IonicContact OE2-NE 3.12Å; E146-R180 IonicContact OE2-NH2 2.65Å; E146-R180 PolarHBondContact OE2-NH2 2.83Å; Y178-R180 HydrophobicContact CE1-CB 3.92Å; Y178-R180 HydrophobicContact CE1-CG 4.26Å; Y178-R180 HydrophobicContact CE2-CB 4.43Å
181	K	96.4	Very high	97.5	Very high	172 Å²	172	41.2 Å²	41.2	75%	0.748	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-46.8	-177.6	-65.5	179.7	-178.7	172.8	0	111.4	N179	N179-K181 VanDerWaalsContact C-N 3.33Å; N179-K181 PolarHBondContact O-N 2.99Å; N179-K181 PolarHBondContact OD1-N 3.01Å; N179-K181 VanDerWaalsContact OD1-N 3.12Å
182	L	97	Very high	97.4	Very high	122 Å²	122	42.2 Å²	42.2	64%	0.639	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-9.1	-177.9	-59.8	179.9	0	0	0	113	N179 T184	N179-L182 HydrophobicContact CB-CB 4.29Å; N179-L182 PolarHBondContact OD1-N 3.11Å; L182-T184 HydrophobicContact CB-CG2 4.08Å; L182-T184 PolarHBondContact O-N 2.91Å
183	R	96.3	Very high	97.3	Very high	162 Å²	162	41 Å²	41	61%	0.611	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	43.4	-173	-59.6	-175.8	177.6	177.3	-1.2	112.4	N179 Y185	N179-R183 VanDerWaalsContact O-CA 3.26Å; N179-R183 WeakPolarHBondContact O-CA 3.33Å; N179-R183 PolarHBondContact O-N 3.49Å; R183-Y185 WeakPolarHBondContact O-CE2 3Å
184	T	97.9	Very high	97.2	Very high	56 Å²	56	42.1 Å²	42.1	34%	0.344	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	149.1	178.6	51.5	0	0	0	0	110.4	M130 N179 L182	M130-T184 WeakPolarHBondContact CE-O 3.37Å; M130-T184 WeakPolarHBondContact CE-OG1 3.49Å; N179-T184 WeakPolarHBondContact CB-OG1 3.29Å; N179-T184 PolarHBondContact N-O 2.75Å; N179-T184 PolarHBondContact O-N 3.02Å; L182-T184 HydrophobicContact CB-CG2 4.08Å; L182-T184 PolarHBondContact O-N 2.91Å
185	Y	98.6	Very high	97.2	Very high	13 Å²	13	37.6 Å²	37.6	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.5	-173.3	-51.9	-93.8	0	0	0	111.3	N109 M130 Y150 H153 F176 L177 Y178 R183	N109-Y185 WeakPolarHBondContact CB-O 3.48Å; M130-Y185 VanDerWaalsContact CE-N 3.31Å; Y150-Y185 HydrophobicContact CD2-CD1 4.45Å; Y150-Y185 HydrophobicContact CD2-CE1 4.12Å; H153-Y185 HydrophobicContact CB-CD1 3.88Å; H153-Y185 HydrophobicContact CB-CD2 3.53Å; H153-Y185 HydrophobicContact CB-CE1 4.27Å; H153-Y185 HydrophobicContact CB-CE2 3.95Å; H153-Y185 HydrophobicContact CB-CG 3.49Å; H153-Y185 VanDerWaalsContact CB-CG 3.49Å; H153-Y185 AromaticContact CD2-CD2 3.61Å; H153-Y185 AromaticContact CD2-CE2 3.29Å; H153-Y185 WeakPolarHBondContact CD2-CE2 3.49Å; H153-Y185 AromaticContact CD2-CZ 3.89Å; H153-Y185 AromaticContact CE1-CD2 3.79Å; H153-Y185 AromaticContact CE1-CE2 3.92Å; H153-Y185 AromaticContact CG-CD2 3.2Å; H153-Y185 AromaticContact CG-CE2 3.43Å; H153-Y185 VanDerWaalsContact CG-CE2 3.43Å; H153-Y185 AromaticContact CG-CG 3.76Å; H153-Y185 AromaticContact ND1-CD2 3.32Å; H153-Y185 VanDerWaalsContact ND1-CD2 3.32Å; H153-Y185 WeakPolarHBondContact ND1-CD2 3.48Å; H153-Y185 AromaticContact ND1-CE2 3.81Å; H153-Y185 AromaticContact NE2-CD2 3.99Å; H153-Y185 AromaticContact NE2-CE2 3.66Å; F176-Y185 AromaticContact CE1-CD1 3.72Å; F176-Y185 HydrophobicContact CE1-CD1 3.72Å; F176-Y185 HydrophobicContact CE1-CG 4.35Å; F176-Y185 AromaticContact CZ-CD1 3.87Å; F176-Y185 HydrophobicContact CZ-CD1 3.87Å; F176-Y185 HydrophobicContact CZ-CG 4.04Å; L177-Y185 VanDerWaalsContact O-CA 3.29Å; L177-Y185 WeakPolarHBondContact O-CA 3.36Å; Y178-Y185 AromaticContact CD2-CD1 3.63Å; Y178-Y185 HydrophobicContact CD2-CD1 3.63Å; Y178-Y185 AromaticContact CD2-CE1 3.21Å; Y178-Y185 HydrophobicContact CD2-CE1 3.21Å; Y178-Y185 AromaticContact CD2-CZ 3.87Å; Y178-Y185 HydrophobicContact CE2-CD1 4.27Å; Y178-Y185 AromaticContact CE2-CE1 3.41Å; Y178-Y185 HydrophobicContact CE2-CE1 3.41Å; Y178-Y185 VanDerWaalsContact CE2-CE1 3.41Å; Y178-Y185 AromaticContact CE2-CZ 3.65Å; Y178-Y185 HydrophobicContact CG-CD1 4.34Å; Y178-Y185 HydrophobicContact CG-CE1 4.1Å; R183-Y185 WeakPolarHBondContact O-CE2 3Å
186	A	98.7	Very high	96.9	Very high	8 Å²	8	38.4 Å²	38.4	7%	0.066	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	122.4	173.6	0	0	0	0	0	112.7	N109 M111 M130 F176 L177	N109-A186 CarbonylContact O-C 3.59Å; N109-A186 WeakPolarHBondContact O-CA 3.31Å; M111-A186 HydrophobicContact CE-CB 3.86Å; M130-A186 HydrophobicContact SD-CB 3.61Å; F176-A186 CarbonylContact C-O 3.6Å; F176-A186 WeakPolarHBondContact CA-O 3.38Å; L177-A186 HydrophobicContact CB-CB 4.32Å; L177-A186 PolarHBondContact N-O 3.14Å; L177-A186 PolarHBondContact O-N 3.41Å
187	L	98.8	Very high	96.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127	166.2	-176.6	64.1	0	0	0	109.4	N109 M111 A157 L158 I161 I171 N175 F176	N109-L187 PolarHBondContact O-N 3.15Å; M111-L187 VanDerWaalsContact CB-O 3.27Å; M111-L187 WeakPolarHBondContact CB-O 3.48Å; M111-L187 PolarHBondContact N-O 2.76Å; A157-L187 HydrophobicContact CB-CB 3.96Å; A157-L187 HydrophobicContact CB-CD2 4.06Å; L158-L187 HydrophobicContact CD2-CD2 4.38Å; I161-L187 HydrophobicContact CD1-CD2 3.82Å; I161-L187 HydrophobicContact CG1-CD2 4.42Å; I161-L187 HydrophobicContact CG2-CD2 4.32Å; I171-L187 HydrophobicContact CD1-CD1 3.6Å; I171-L187 HydrophobicContact CD1-CD2 4.25Å; N175-L187 WeakPolarHBondContact O-CA 3.44Å; N175-L187 WeakPolarHBondContact O-CD1 3.47Å; F176-L187 HydrophobicContact CD2-CB 4.05Å; F176-L187 HydrophobicContact CD2-CD1 4.43Å; F176-L187 HydrophobicContact CE2-CB 4.49Å
188	V	98.4	Very high	96.1	Very high	21 Å²	21	48 Å²	48	13%	0.127	25%	0.253	C	S	.	.			trans	-127.7	168.4	-176	-62.1	0	0	0	0	111.2	M111 H168 N175 L177	M111-V188 HydrophobicContact CB-CB 4.49Å; M111-V188 HydrophobicContact CB-CG1 3.67Å; M111-V188 HydrophobicContact CE-CG1 3.99Å; M111-V188 HydrophobicContact CG-CG1 3.99Å; H168-V188 PolarHBondContact CE1-O 3.14Å; H168-V188 PolarHBondContact NE2-O 3.5Å; N175-V188 HydrophobicContact CB-CG2 4.31Å; N175-V188 WeakPolarHBondContact O-CG2 3.42Å; N175-V188 PolarHBondContact O-N 3.42Å; L177-V188 HydrophobicContact CD1-CG1 3.78Å; L177-V188 HydrophobicContact CD2-CG2 4.24Å; L177-V188 HydrophobicContact CG-CG1 3.89Å; L177-V188 HydrophobicContact CG-CG2 4.23Å
189	D	96.3	Very high	95.9	Very high	35 Å²	35	47.9 Å²	47.9	19%	0.187	25%	0.252	C	S	.	.			trans	69.2	76.8	170.8	-165.6	9.5	0	0	0	116	K83 H168 G191	K83-D189 VanDerWaalsContact NZ-CG 3.33Å; K83-D189 IonicContact NZ-OD1 3.02Å; K83-D189 PolarHBondContact NZ-OD1 3.07Å; H168-D189 PolarHBondContact CE1-O 3.36Å; H168-D189 PolarHBondContact NE2-O 3.16Å; D189-G191 PolarHBondContact O-N 3.27Å; D189-G191 PolarHBondContact OD1-N 2.8Å
190	F	97.4	Very high	95.7	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.018	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-83.4	10.9	172.5	-64.8	-87.4	0	0	0	113.4	E97 C100 L101 V110 I161 I166 H168 L192 A193	E97-F190 HydrophobicContact CG-CB 4.15Å; C100-F190 HydrophobicContact CB-CB 3.77Å; C100-F190 HydrophobicContact CB-CD1 3.81Å; C100-F190 HydrophobicContact CB-CD2 4.17Å; C100-F190 HydrophobicContact CB-CE1 4.48Å; C100-F190 HydrophobicContact CB-CG 3.63Å; L101-F190 HydrophobicContact CD2-CD2 3.65Å; L101-F190 HydrophobicContact CD2-CE2 3.86Å; L101-F190 HydrophobicContact CG-CD2 4.12Å; V110-F190 HydrophobicContact CG1-CE2 3.81Å; V110-F190 HydrophobicContact CG1-CZ 3.51Å; I161-F190 HydrophobicContact CD1-CE1 4.43Å; I161-F190 HydrophobicContact CG2-CE1 3.99Å; I161-F190 HydrophobicContact CG2-CZ 4.03Å; I166-F190 HydrophobicContact CG2-CD1 4.1Å; I166-F190 HydrophobicContact CG2-CE1 4.21Å; H168-F190 AromaticContact CD2-CE1 3.93Å; F190-L192 PolarHBondContact O-N 2.81Å; F190-A193 HydrophobicContact CB-CB 4.22Å; F190-A193 HydrophobicContact CD1-CB 4.31Å; F190-A193 VanDerWaalsContact O-CB 3.26Å; F190-A193 WeakPolarHBondContact O-CB 3.36Å; F190-A193 PolarHBondContact O-N 2.78Å
191	G	95.1	Very high	95.4	Very high	5 Å²	5	49.9 Å²	49.9	5%	0.052	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-63.7	-16.9	-175.5	0	0	0	0	0	113.8	R93 E97 D189	R93-G191 PolarHBondContact NE-O 3Å; R93-G191 PolarHBondContact NH2-O 2.8Å; E97-G191 VanDerWaalsContact OE2-CA 3.23Å; E97-G191 WeakPolarHBondContact OE2-CA 3.38Å; D189-G191 PolarHBondContact O-N 3.27Å; D189-G191 PolarHBondContact OD1-N 2.8Å
192	L	95.6	Very high	95.1	Very high	23 Å²	23	48.2 Å²	48.2	12%	0.12	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-108.7	3.7	175.4	-64.7	177.7	0	0	0	114	F62 R169 D170 F190 A308	F62-L192 HydrophobicContact CD2-CD2 4.08Å; F62-L192 HydrophobicContact CD2-CG 4.48Å; F62-L192 HydrophobicContact CE2-CD1 4.26Å; F62-L192 HydrophobicContact CE2-CD2 3.57Å; F62-L192 HydrophobicContact CE2-CG 4.24Å; F62-L192 HydrophobicContact CZ-CD2 4.03Å; R169-L192 VanDerWaalsContact CD-O 3.27Å; R169-L192 WeakPolarHBondContact CD-O 3.46Å; D170-L192 HydrophobicContact CB-CB 4.45Å; D170-L192 HydrophobicContact CB-CD1 3.86Å; F190-L192 PolarHBondContact O-N 2.81Å; L192-A308 HydrophobicContact CD2-CB 4.04Å
193	A	96.8	Very high	94.8	Very high	8 Å²	8	44.7 Å²	44.7	7%	0.066	24%	0.241	C	C	.	.			trans	-63.2	152.9	-173.1	0	0	0	0	0	113.1	I166 I167 F190 L204	I166-A193 HydrophobicContact CG2-CB 4Å; I167-A193 CarbonylContact O-C 3.49Å; I167-A193 VanDerWaalsContact O-CA 3.23Å; I167-A193 WeakPolarHBondContact O-CA 3.46Å; F190-A193 HydrophobicContact CB-CB 4.22Å; F190-A193 HydrophobicContact CD1-CB 4.31Å; F190-A193 VanDerWaalsContact O-CB 3.26Å; F190-A193 WeakPolarHBondContact O-CB 3.36Å; F190-A193 PolarHBondContact O-N 2.78Å; A193-L204 HydrophobicContact CB-CD2 4.31Å
194	Q	95.3	Very high	94.5	Very high	34 Å²	34	37 Å²	37	16%	0.159	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	156	173.2	-74.1	177.9	4.9	0	0	110.5	I167	I167-Q194 PolarHBondContact N-O 3.43Å; I167-Q194 PolarHBondContact O-N 3.44Å
195	G	94.6	Very high	93.7	Very high	13 Å²	13	38.5 Å²	38.5	13%	0.134	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	139.7	177	0	0	0	0	0	110.8
196	T	93.2	Very high	92.2	Very high	27 Å²	27	42.3 Å²	42.3	17%	0.166	24%	0.235	C	C	.	.			trans	-66	167.3	154.5	54.4	0	0	0	0	110.3	G165 I167 D198 S199 T327	G165-T196 WeakPolarHBondContact CA-OG1 3.27Å; G165-T196 PolarHBondContact O-N 2.9Å; G165-T196 PolarHBondContact O-OG1 3.41Å; I167-T196 HydrophobicContact CD1-CG2 4.06Å; I167-T196 HydrophobicContact CG1-CG2 3.85Å; T196-D198 VanDerWaalsContact CB-OD1 3.29Å; T196-D198 WeakPolarHBondContact CB-OD1 3.24Å; T196-D198 PolarHBondContact O-N 3.16Å; T196-D198 PolarHBondContact OG1-OD1 3.38Å; T196-D198 VanDerWaalsContact OG1-OD1 3.08Å; T196-S199 VanDerWaalsContact O-CB 3.31Å; T196-S199 WeakPolarHBondContact O-CB 3.33Å; T196-S199 PolarHBondContact O-N 2.93Å; T196-S199 VanDerWaalsContact O-N 3.13Å; T196-S199 PolarHBondContact OG1-N 3.29Å; T196-T327 HydrophobicContact CG2-CG2 4.01Å
197	A	89.2	Confident	90.5	Very high	104 Å²	104	43.5 Å²	43.5	86%	0.86	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-33.6	179.8	0	0	0	0	0	112.5
198	D	91	Very high	88.6	Confident	122 Å²	122	47.1 Å²	47.1	65%	0.652	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	14	179.8	59.3	-40.3	0	0	0	113.3	T196 Q200	T196-D198 VanDerWaalsContact CB-OD1 3.29Å; T196-D198 WeakPolarHBondContact CB-OD1 3.24Å; T196-D198 PolarHBondContact O-N 3.16Å; T196-D198 PolarHBondContact OG1-OD1 3.38Å; T196-D198 VanDerWaalsContact OG1-OD1 3.08Å; D198-Q200 PolarHBondContact O-N 2.83Å
199	S	93.9	Very high	86.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.281	C	S	.	.			trans	-54.2	139	-177.1	-173.5	0	0	0	0	112.8	F164 G165 T196 I201 K205	F164-S199 PolarHBondContact O-OG 2.85Å; G165-S199 WeakPolarHBondContact O-CB 3.12Å; G165-S199 PolarHBondContact O-OG 3.2Å; T196-S199 VanDerWaalsContact O-CB 3.31Å; T196-S199 WeakPolarHBondContact O-CB 3.33Å; T196-S199 PolarHBondContact O-N 2.93Å; T196-S199 VanDerWaalsContact O-N 3.13Å; T196-S199 PolarHBondContact OG1-N 3.29Å; S199-I201 VanDerWaalsContact C-N 3.25Å; S199-I201 PolarHBondContact OG-N 3.48Å; S199-K205 WeakPolarHBondContact O-CE 3.47Å; S199-K205 PolarHBondContact O-NZ 3.28Å
200	Q	93.3	Very high	84.1	Confident	118 Å²	118	51.8 Å²	51.8	55%	0.551	30%	0.299	S	S	*	.	S	Bend	trans	-82.9	-8	173.7	-58.3	-174	40.4	0	0	111.8	Q163 F164 D198	Q163-Q200 PolarHBondContact O-NE2 3.37Å; F164-Q200 HydrophobicContact CD1-CB 4.2Å; F164-Q200 PolarHBondContact O-N 3.28Å; D198-Q200 PolarHBondContact O-N 2.83Å
201	I	90.7	Very high	81.8	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.326	C	S	.	.			trans	-95.2	101.5	177.8	-48.4	-57.3	0	0	0	108.5	Q99 L103 F164 I166 S199 L203 L204	Q99-I201 HydrophobicContact CB-CG2 4.09Å; Q99-I201 HydrophobicContact CG-CG2 3.91Å; L103-I201 HydrophobicContact CB-CD1 3.97Å; L103-I201 HydrophobicContact CD1-CD1 3.84Å; L103-I201 HydrophobicContact CG-CD1 4.47Å; F164-I201 HydrophobicContact CD1-CD1 4.2Å; I166-I201 HydrophobicContact CD1-CD1 4.21Å; I166-I201 HydrophobicContact CD1-CG1 3.81Å; I166-I201 HydrophobicContact CG1-CG1 3.69Å; S199-I201 VanDerWaalsContact C-N 3.25Å; S199-I201 PolarHBondContact OG-N 3.48Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 2.62Å; I201-L204 HydrophobicContact CB-CB 4.2Å; I201-L204 HydrophobicContact CB-CD1 3.8Å; I201-L204 HydrophobicContact CB-CG 3.92Å; I201-L204 HydrophobicContact CG1-CD1 4.13Å; I201-L204 HydrophobicContact CG2-CB 4.24Å; I201-L204 HydrophobicContact CG2-CD1 3.92Å; I201-L204 HydrophobicContact CG2-CG 3.65Å; I201-L204 WeakPolarHBondContact O-CB 3.07Å; I201-L204 PolarHBondContact O-N 3.1Å; I201-L204 VanDerWaalsContact O-N 3.11Å
202	E	89.4	Confident	79.3	Confident	137 Å²	137	70 Å²	70	64%	0.64	37%	0.366	S	S	*	.	H	α-helix	trans	-55.2	-45.5	-173.6	-66.5	-179.3	166	0	0	112.8	L204 K205	E202-L204 PolarHBondContact O-N 3.38Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 2.71Å
203	L	90.9	Very high	76.3	Confident	48 Å²	48	73.6 Å²	73.6	25%	0.251	39%	0.389	S	S	.	.	H	α-helix	trans	-68.3	-19.2	-176.2	-64.3	172.9	0	0	0	113.1	A95 A96 Q99 I201 K205 L207	A95-L203 VanDerWaalsContact C-CD1 3.49Å; A95-L203 HydrophobicContact CB-CD1 3.56Å; A96-L203 HydrophobicContact CB-CB 3.8Å; Q99-L203 HydrophobicContact CB-CD1 4.29Å; Q99-L203 VanDerWaalsContact OE1-N 3.13Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 2.62Å; L203-K205 VanDerWaalsContact C-N 3.34Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å
204	L	89.2	Confident	73.3	Confident	2 Å²	2	78.8 Å²	78.8	1%	0.01	42%	0.422	C	S	.	.	H	α-helix	trans	-75.7	-22.9	173.2	-70.9	-175.1	0	0	0	112.7	A96 I166 A193 I201 E202 L207	A96-L204 HydrophobicContact CB-CD2 3.88Å; A96-L204 HydrophobicContact CB-CG 4.48Å; I166-L204 HydrophobicContact CB-CD1 4.5Å; I166-L204 HydrophobicContact CG1-CD1 4.04Å; I166-L204 HydrophobicContact CG2-CD1 4.3Å; A193-L204 HydrophobicContact CB-CD2 4.31Å; I201-L204 HydrophobicContact CB-CB 4.2Å; I201-L204 HydrophobicContact CB-CD1 3.8Å; I201-L204 HydrophobicContact CB-CG 3.92Å; I201-L204 HydrophobicContact CG1-CD1 4.13Å; I201-L204 HydrophobicContact CG2-CB 4.24Å; I201-L204 HydrophobicContact CG2-CD1 3.92Å; I201-L204 HydrophobicContact CG2-CG 3.65Å; I201-L204 WeakPolarHBondContact O-CB 3.07Å; I201-L204 PolarHBondContact O-N 3.1Å; I201-L204 VanDerWaalsContact O-N 3.11Å; E202-L204 PolarHBondContact O-N 3.38Å; L204-L207 HydrophobicContact CD2-CD1 4.13Å
205	K	81.9	Confident	70.6	Confident	87 Å²	87	86.8 Å²	86.8	38%	0.378	45%	0.451	S	S	.	.	H	α-helix	trans	-70.3	-43.3	175	-64.6	177.9	176.4	161.1	0	111	S199 E202 L203 L207 S208 G209	S199-K205 WeakPolarHBondContact O-CE 3.47Å; S199-K205 PolarHBondContact O-NZ 3.28Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 2.71Å; L203-K205 VanDerWaalsContact C-N 3.34Å; K205-L207 VanDerWaalsContact C-N 3.3Å; K205-L207 PolarHBondContact O-N 2.84Å; K205-S208 WeakPolarHBondContact O-CB 3.37Å; K205-S208 PolarHBondContact O-N 2.84Å; K205-S208 PolarHBondContact O-OG 3.07Å; K205-G209 PolarHBondContact O-N 2.79Å
206	D	66.2	Low	67.8	Low	92 Å²	92	91.7 Å²	91.7	49%	0.492	48%	0.48	S	S	.	.	H	α-helix	trans	-64.7	-34.8	-179.6	-68.7	-17.4	0	0	0	112.6	S208 G209 L210	D206-S208 PolarHBondContact O-N 2.88Å; D206-G209 PolarHBondContact O-N 3.5Å; D206-L210 WeakPolarHBondContact O-CB 3.5Å; D206-L210 WeakPolarHBondContact O-CG 3.33Å; D206-L210 PolarHBondContact O-N 3.21Å
207	L	63.7	Low	65	Low	33 Å²	33	95.3 Å²	95.3	17%	0.173	50%	0.502	C	S	.	.	H	α-helix	trans	-64.8	-27	174.5	-70	174.5	0	0	0	113	T92 A96 L203 L204 K205	T92-L207 HydrophobicContact CG2-CD2 3.87Å; T92-L207 HydrophobicContact CG2-CG 4.07Å; A96-L207 HydrophobicContact CB-CD1 3.87Å; L203-L207 WeakPolarHBondContact O-CG 3.45Å; L204-L207 HydrophobicContact CD2-CD1 4.13Å; K205-L207 VanDerWaalsContact C-N 3.3Å; K205-L207 PolarHBondContact O-N 2.84Å
208	S	59.7	Low	62.2	Low	77 Å²	77	100.8 Å²	100.8	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-76.2	-36.6	173.6	80.3	0	0	0	0	111.8	K205 D206	K205-S208 WeakPolarHBondContact O-CB 3.37Å; K205-S208 PolarHBondContact O-N 2.84Å; K205-S208 PolarHBondContact O-OG 3.07Å; D206-S208 PolarHBondContact O-N 2.88Å
209	G	51.9	Low	59.6	Low	43 Å²	43	98.6 Å²	98.6	44%	0.443	51%	0.513	S	S	.	.	H	α-helix	trans	-74.4	-39.6	179.8	0	0	0	0	0	114.4	K205 D206 R211 R212	K205-G209 PolarHBondContact O-N 2.79Å; D206-G209 PolarHBondContact O-N 3.5Å; G209-R211 PolarHBondContact O-N 2.91Å; G209-R211 VanDerWaalsContact O-N 3.09Å; G209-R212 PolarHBondContact O-N 2.77Å
210	L	47.3	Very low	56.9	Low	110 Å²	110	104.1 Å²	104.1	58%	0.576	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-65.4	-11.6	-179	-75.4	166.1	0	0	0	114.4	D206	D206-L210 WeakPolarHBondContact O-CB 3.5Å; D206-L210 WeakPolarHBondContact O-CG 3.33Å; D206-L210 PolarHBondContact O-N 3.21Å
211	R	49	Very low	53.9	Low	156 Å²	156	110 Å²	110	59%	0.589	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-95.5	2	-177.7	-70.3	-175.1	-178.9	-142.5	1.8	115	G209 V213	G209-R211 PolarHBondContact O-N 2.91Å; G209-R211 VanDerWaalsContact O-N 3.09Å; R211-V213 PolarHBondContact O-N 2.78Å
212	R	42.5	Very low	51.2	Low	235 Å²	235	115.4 Å²	115.4	89%	0.887	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-66.4	-8.2	169.4	-71.5	-173.3	177.8	-179.8	0.7	113.2	G209	G209-R212 PolarHBondContact O-N 2.77Å
213	V	33	Very low	48.6	Very low	100 Å²	100	116.2 Å²	116.2	61%	0.606	59%	0.593	S	S	*	*	S	Bend	trans	-99.4	124.4	171.9	-174	0	0	0	0	109.6	R211 R215	R211-V213 PolarHBondContact O-N 2.78Å; V213-R215 PolarHBondContact O-N 3.46Å
214	P	33.2	Very low	46	Very low	116 Å²	116	121.3 Å²	121.3	75%	0.753	62%	0.621	S	S	*	*			trans	-64.2	120	177.6	-14.3	27.1	0	0	0	110.3
215	R	38.9	Very low	43.1	Very low	202 Å²	202	125.9 Å²	125.9	76%	0.762	65%	0.652	S	S	*	*			trans	-112.6	136.3	165.1	-72.4	-173.1	179.6	178.1	0.9	109	V213 V217	V213-R215 PolarHBondContact O-N 3.46Å; R215-V217 PolarHBondContact O-N 3.1Å
216	P	35.4	Very low	40.6	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-64	129.4	169.4	26.1	-30.1	0	0	0	108.9
217	V	34.9	Very low	38.9	Very low	103 Å²	103	130 Å²	130	62%	0.624	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-84.6	129.3	176.8	176.7	0	0	0	0	107.8	R215 G219	R215-V217 PolarHBondContact O-N 3.1Å; V217-G219 PolarHBondContact O-N 3.21Å
218	F	30.4	Very low	37.3	Very low	219 Å²	219	134.3 Å²	134.3	96%	0.961	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	122.4	174.4	-107.5	-99	0	0	0	110.7
219	G	37.1	Very low	35.8	Very low	77 Å²	77	135 Å²	135	79%	0.794	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	128.4	-11.7	177.5	0	0	0	0	0	115.6	V217 R221	V217-G219 PolarHBondContact O-N 3.21Å; G219-R221 PolarHBondContact O-N 3.27Å
220	E	36.1	Very low	34.9	Very low	115 Å²	115	138.3 Å²	138.3	54%	0.537	75%	0.747	S	S	.	*			trans	-84.1	104.9	173	-71.7	178.8	174.5	0	0	110.3	N222	E220-N222 VanDerWaalsContact C-N 3.27Å; E220-N222 PolarHBondContact O-N 3.08Å
221	R	31.3	Very low	34	Very low	243 Å²	243	139.3 Å²	139.3	92%	0.917	76%	0.76	S	S	*	*			trans	-66.7	91.8	162.3	-74.6	-174	-163.7	169	5.1	107.9	G219 L223	G219-R221 PolarHBondContact O-N 3.27Å; R221-L223 PolarHBondContact O-N 3.12Å; R221-L223 VanDerWaalsContact O-N 3.14Å
222	N	33.8	Very low	33	Very low	112 Å²	112	138.5 Å²	138.5	60%	0.599	77%	0.773	S	S	*	*			trans	-74.8	95.4	167.1	-86.7	-63.4	0	0	0	108.8	E220	E220-N222 VanDerWaalsContact C-N 3.27Å; E220-N222 PolarHBondContact O-N 3.08Å
223	L	33.3	Very low	32.4	Very low	154 Å²	154	132.4 Å²	132.4	81%	0.806	77%	0.766	S	S	*	*			trans	-75.5	116.2	153.9	-70.1	167.1	0	0	0	105.7	R221	R221-L223 PolarHBondContact O-N 3.12Å; R221-L223 VanDerWaalsContact O-N 3.14Å
224	N	38.1	Very low	32.2	Very low	156 Å²	156	137.4 Å²	137.4	83%	0.834	78%	0.78	S	S	*	*			trans	101.9	77.9	-179.5	-48.7	-27.2	0	0	0	114.9
225	S	27.2	Very low	31.9	Very low	97 Å²	97	140.8 Å²	140.8	68%	0.678	79%	0.785	S	S	*	*			trans	-146.9	100.2	145.5	65.7	0	0	0	0	110.8
226	C	29.7	Very low	31.4	Very low	135 Å²	135	135.9 Å²	135.9	91%	0.912	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.6	119.3	156.9	-69.1	0	0	0	0	107.8
227	T	30.1	Very low	31.3	Very low	131 Å²	131	135.9 Å²	135.9	80%	0.804	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-80.6	132.1	171.5	29.7	0	0	0	0	110.3
228	P	30.5	Very low	30.8	Very low	123 Å²	123	139.2 Å²	139.2	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.4	134.2	162.4	16.1	-3	0	0	0	110.2
229	A	28.5	Very low	30.4	Very low	93 Å²	93	137.9 Å²	137.9	77%	0.769	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.7	148.2	178	0	0	0	0	0	112.4
230	P	33.1	Very low	29.8	Very low	112 Å²	112	139.8 Å²	139.8	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.3	152.5	179.2	30	-32	0	0	0	112.6
231	P	28.5	Very low	29.2	Very low	130 Å²	130	142.7 Å²	142.7	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79.7	128.8	179.8	32.1	-30.8	0	0	0	110.7
232	T	27.8	Very low	28.8	Very low	140 Å²	140	136 Å²	136	86%	0.859	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-81.6	130.4	175.9	41.7	0	0	0	0	111.3
233	S	30.2	Very low	28.5	Very low	106 Å²	106	138.5 Å²	138.5	74%	0.741	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.7	148.7	171.8	50.6	0	0	0	0	111.4
234	K	27.5	Very low	28	Very low	206 Å²	206	140.9 Å²	140.9	90%	0.896	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.3	128.3	-177	-59.8	171.4	178.7	178.5	0	111.3
235	H	28.6	Very low	27.5	Very low	187 Å²	187	137.9 Å²	137.9	87%	0.866	81%	0.808	S	S	*	*			trans	-125	136.4	152.7	-85.9	-80.7	0	0	0	109.4
236	A	27.5	Very low	27.4	Very low	98 Å²	98	143 Å²	143	81%	0.81	82%	0.818	S	S	*	*			trans	-83.4	166.9	-175.8	0	0	0	0	0	111.9
237	P	32.4	Very low	27.2	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	81%	0.809	S	S	*	*			trans	-103.6	162.3	-142.8	39.1	-34.9	0	0	0	114.4
238	L	24.4	Very low	27.1	Very low	174 Å²	174	144.7 Å²	144.7	91%	0.911	81%	0.81	S	S	*	*			trans	-149.4	141.1	151	-98.2	140.2	0	0	0	111.5
239	K	23	Very low	26.8	Very low	191 Å²	191	145.4 Å²	145.4	83%	0.83	80%	0.803	S	S	*	*			trans	-53.4	157.5	-170.3	-63.4	161.7	176.7	179.6	0	112.8
240	T	24.2	Very low	26.7	Very low	116 Å²	116	148 Å²	148	71%	0.712	80%	0.804	S	S	*	*				-178.3	136.5	77.2	-51.7	0	0	0	0	110.7
241	E	24.4	Very low	26.4	Very low	176 Å²	176	147.1 Å²	147.1	82%	0.822	81%	0.806	S	S	*	*			trans	42	118.7	149.2	-61.8	175.7	155.8	0	0	122
242	S	23.1	Very low	26.4	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	80%	0.801	S	S	*	*				80	120.8	92.8	-153.3	0	0	0	0	112.2
243	L	26.5	Very low	26.3	Very low	166 Å²	166	143.1 Å²	143.1	87%	0.869	79%	0.792	S	S	*	*				-172.3	155	79.7	-84.8	161.3	0	0	0	111.7
244	K	23.8	Very low	26.2	Very low	204 Å²	204	149.3 Å²	149.3	89%	0.887	80%	0.801	S	S	*	*			trans	-65.2	157.8	-177.8	-73.7	167.6	169.6	170.7	0	116.1
245	A	26.6	Very low	26.3	Very low	92 Å²	92	147.1 Å²	147.1	76%	0.76	79%	0.792	S	S	*	*				151.1	149.1	125.1	0	0	0	0	0	109.8
246	K	25.9	Very low	26.3	Very low	206 Å²	206	146 Å²	146	90%	0.896	79%	0.786	S	S	*	*			cis	-165.9	159.9	-0.2	-117.2	174.4	178.7	179.9	0	107
247	K	24.9	Very low	26.2	Very low	165 Å²	165	147.5 Å²	147.5	72%	0.717	79%	0.786	S	S	*	*			trans	-56.2	160	175.1	-78.5	178.4	151.7	-149.5	0	116.3	E249	K247-E249 IonicContact NZ-OE1 2.83Å; K247-E249 PolarHBondContact NZ-OE1 3.03Å
248	T	27.5	Very low	25.9	Very low	135 Å²	135	147 Å²	147	83%	0.828	79%	0.785	S	S	*	*				-174.9	115.6	122.2	30.8	0	0	0	0	107.5
249	E	25.3	Very low	26.2	Very low	138 Å²	138	144.7 Å²	144.7	65%	0.645	78%	0.784	S	S	*	*				49.9	117	82.4	-70.6	176.7	-153.7	0	0	112	K247	K247-E249 IonicContact NZ-OE1 2.83Å; K247-E249 PolarHBondContact NZ-OE1 3.03Å
250	D	26.1	Very low	26.4	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	79%	0.787	S	S	*	*				-160.1	143.6	66.7	-87.9	-41.6	0	0	0	112.3
251	A	26.5	Very low	26.7	Very low	94 Å²	94	149.8 Å²	149.8	78%	0.777	80%	0.797	S	S	*	*				59.9	137	89.2	0	0	0	0	0	114.3
252	A	28.1	Very low	27	Very low	91 Å²	91	145.9 Å²	145.9	75%	0.752	80%	0.795	S	S	*	*			cis	-160	139.3	12.6	0	0	0	0	0	107.6
253	S	26.1	Very low	27.3	Very low	95 Å²	95	149 Å²	149	66%	0.664	80%	0.802	S	S	*	*				83.1	116.2	102.7	-161.7	0	0	0	0	116.2
254	Y	28.9	Very low	27.4	Very low	236 Å²	236	147.8 Å²	147.8	93%	0.925	80%	0.802	S	S	*	*				-160.4	130.8	128.3	-105.6	-78.6	0	0	0	110.5
255	K	28.5	Very low	27.5	Very low	161 Å²	161	142.7 Å²	142.7	70%	0.7	79%	0.792	S	S	*	*			trans	-83.7	153.9	-174.1	-61.2	169.1	176.8	175.3	0	111
256	H	29.5	Very low	27.6	Very low	162 Å²	162	144.4 Å²	144.4	75%	0.75	79%	0.792	S	S	*	*				152.8	153.8	93.1	-101.6	-62	0	0	0	105.2
257	T	25.8	Very low	27.9	Very low	130 Å²	130	145.9 Å²	145.9	80%	0.798	79%	0.792	S	S	*	*			cis	-156.5	161.7	25.3	31.5	0	0	0	0	110.7
258	S	26.1	Very low	28	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	80%	0.796	S	S	*	*			trans	-74.7	160.6	-178	53.5	0	0	0	0	116.5
259	S	28.8	Very low	28.4	Very low	127 Å²	127	143.6 Å²	143.6	89%	0.888	80%	0.797	S	S	*	*			trans	-160.1	118.9	131	-73.9	0	0	0	0	111.5
260	N	28.4	Very low	28.6	Very low	167 Å²	167	142 Å²	142	89%	0.893	80%	0.802	S	S	*	*			trans	-79.8	146.5	174.5	-96.8	-24.4	0	0	0	111.8
261	R	31.1	Very low	28.8	Very low	247 Å²	247	140.1 Å²	140.1	93%	0.932	80%	0.8	S	S	*	*			trans	-161.1	111.5	132	-121.8	177.3	179.1	-179.6	-0.5	114.1
262	A	30.6	Very low	29.1	Very low	94 Å²	94	141.4 Å²	141.4	78%	0.777	80%	0.803	S	S	*	*			trans	37	132.6	138.8	0	0	0	0	0	122.9
263	L	28	Very low	29.7	Very low	166 Å²	166	145.1 Å²	145.1	87%	0.869	81%	0.805	S	S	*	*			trans	-64.3	150.1	169.5	-70.2	93.6	0	0	0	114.2
264	V	28.4	Very low	30	Very low	142 Å²	142	149.8 Å²	149.8	86%	0.861	81%	0.813	S	S	*	*			trans	-140.4	129.8	132.1	-178.9	0	0	0	0	109.2
265	S	26.6	Very low	30.3	Very low	96 Å²	96	144.1 Å²	144.1	67%	0.671	81%	0.806	S	S	*	*			trans	-84.4	130.5	177.5	179.3	0	0	0	0	110.6
266	V	29.4	Very low	30.8	Very low	128 Å²	128	145.5 Å²	145.5	78%	0.776	81%	0.814	S	S	*	*			trans	-132.8	110.7	157.5	179	0	0	0	0	107.7
267	R	30.6	Very low	31.5	Very low	237 Å²	237	148.7 Å²	148.7	89%	0.894	82%	0.82	S	S	*	*			trans	-74.5	122.5	166.9	-81.7	177	166.9	176.2	-3.8	108.7
268	T	27.7	Very low	32.4	Very low	130 Å²	130	145.9 Å²	145.9	80%	0.798	81%	0.81	S	S	*	*			trans	-140.4	130.3	143.3	42.1	0	0	0	0	109.5
269	S	37	Very low	33.3	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	81%	0.81	S	S	*	*			trans	-67.6	126.1	178.6	46.2	0	0	0	0	111.7
270	S	29.4	Very low	34.5	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	80%	0.799	S	S	*	*			trans	-149	119.3	154.9	61.9	0	0	0	0	109.8	S272	S270-S272 PolarHBondContact O-N 2.99Å
271	S	30.4	Very low	35.9	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	80%	0.798	S	S	*	*			trans	-48.9	116.7	178.2	57.7	0	0	0	0	111.8	Q273	S271-Q273 PolarHBondContact O-N 2.88Å
272	S	32.5	Very low	37.5	Very low	122 Å²	122	139.5 Å²	139.5	85%	0.853	79%	0.79	S	S	*	*			trans	-75.2	78.6	167.8	-59.2	0	0	0	0	109.7	S270 K274	S270-S272 PolarHBondContact O-N 2.99Å; S272-K274 PolarHBondContact O-N 3.42Å
273	Q	39.5	Very low	40	Very low	169 Å²	169	139.3 Å²	139.3	79%	0.79	78%	0.775	S	S	*	*			trans	-74.1	102.6	156.2	-72.5	-172.4	0.1	0	0	107	S271 P275	S271-Q273 PolarHBondContact O-N 2.88Å; Q273-P275 VanDerWaalsContact O-CD 3.32Å; Q273-P275 WeakPolarHBondContact O-CD 3.25Å
274	K	32.5	Very low	43.1	Very low	192 Å²	192	137.4 Å²	137.4	84%	0.835	77%	0.77	S	S	*	*			trans	-56.2	119.4	160.4	-88.2	177.8	174.9	174.9	0	106.7	S272 Q276	S272-K274 PolarHBondContact O-N 3.42Å; K274-Q276 PolarHBondContact O-N 3.37Å
275	P	34.7	Very low	46.2	Very low	118 Å²	118	131.7 Å²	131.7	77%	0.766	74%	0.737	S	S	*	*			trans	-65.9	114.4	169.6	26.3	-29.2	0	0	0	106.6	Q273 R277	Q273-P275 VanDerWaalsContact O-CD 3.32Å; Q273-P275 WeakPolarHBondContact O-CD 3.25Å; P275-R277 PolarHBondContact O-N 3.46Å
276	Q	40.8	Very low	49.6	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	74%	0.742	S	S	*	*			trans	-57.7	108.4	164.3	-76.2	-169.1	-24	0	0	106.6	K274 A278	K274-Q276 PolarHBondContact O-N 3.37Å; Q276-A278 VanDerWaalsContact C-N 3.33Å; Q276-A278 PolarHBondContact O-N 3.31Å
277	R	43.1	Very low	52.7	Low	229 Å²	229	129 Å²	129	86%	0.864	71%	0.711	S	S	*	*			trans	-67.1	96	176.2	-122.1	177.4	-178.5	177.3	0.6	107.3	P275	P275-R277 PolarHBondContact O-N 3.46Å
278	A	45.3	Very low	55.8	Low	71 Å²	71	125.5 Å²	125.5	59%	0.587	70%	0.7	S	S	*	*			trans	-53.5	140.3	164.5	0	0	0	0	0	108.4	Q276 Q280	Q276-A278 VanDerWaalsContact C-N 3.33Å; Q276-A278 PolarHBondContact O-N 3.31Å; A278-Q280 PolarHBondContact O-N 3.45Å
279	P	44.7	Very low	58.9	Low	114 Å²	114	124 Å²	124	74%	0.74	69%	0.686	S	S	*	*			trans	-64.5	107.5	178.6	26.3	-30.5	0	0	0	108.2	Q281	P279-Q281 VanDerWaalsContact C-N 3.3Å; P279-Q281 PolarHBondContact O-N 3.3Å
280	Q	53.9	Low	61.7	Low	140 Å²	140	120.5 Å²	120.5	65%	0.654	66%	0.659	S	S	*	*			trans	-68.4	89.8	177.6	-70.9	179.8	-35.1	0	0	108.9	A278 L283	A278-Q280 PolarHBondContact O-N 3.45Å; Q280-L283 HydrophobicContact CB-CD1 3.77Å; Q280-L283 HydrophobicContact CB-CG 4.22Å; Q280-L283 HydrophobicContact CG-CD1 4.33Å
281	Q	57.5	Low	64.8	Low	185 Å²	185	122.6 Å²	122.6	86%	0.864	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	126.9	170.2	-70.8	176.9	-8.3	0	0	108.6	P279	P279-Q281 VanDerWaalsContact C-N 3.3Å; P279-Q281 PolarHBondContact O-N 3.3Å
282	G	65.1	Low	67.9	Low	74 Å²	74	124.7 Å²	124.7	76%	0.763	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.9	16.3	162.5	0	0	0	0	0	118.7	T284	G282-T284 PolarHBondContact O-N 3.1Å
283	L	83.9	Confident	71	Confident	90 Å²	90	124.1 Å²	124.1	47%	0.471	65%	0.645	S	S	.	*			trans	-67.4	123	176.5	-72	170.4	0	0	0	113.1	Q280 V296 R300	Q280-L283 HydrophobicContact CB-CD1 3.77Å; Q280-L283 HydrophobicContact CB-CG 4.22Å; Q280-L283 HydrophobicContact CG-CD1 4.33Å; L283-V296 HydrophobicContact CB-CG1 3.92Å; L283-R300 PolarHBondContact O-NH2 2.88Å
284	T	91.8	Very high	73.7	Confident	126 Å²	126	118 Å²	118	77%	0.773	62%	0.62	S	S	*	*			trans	-87	168.1	170.2	60.4	0	0	0	0	111.3	G282	G282-T284 PolarHBondContact O-N 3.1Å
285	C	94.9	Very high	76.7	Confident	22 Å²	22	115.6 Å²	115.6	15%	0.149	62%	0.617	C	S	.	*			trans	-149.8	156.9	177.4	64.3	0	0	0	0	110.9	C287 V296 R300	C285-C287 PolarHBondContact O-N 3.3Å; C285-C287 VanDerWaalsContact O-N 3.11Å; C285-V296 HydrophobicContact CB-CB 4.06Å; C285-V296 HydrophobicContact CB-CG1 4.12Å; C285-R300 PolarHBondContact SG-NH2 3.28Å
286	N	96	Very high	79.6	Confident	147 Å²	147	112.8 Å²	112.8	79%	0.786	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	11.1	-178	-62.6	-21.6	0	0	0	114.8	Y288 R292	N286-Y288 VanDerWaalsContact C-N 3.34Å; N286-R292 PolarHBondContact O-NH2 2.91Å
287	C	96.4	Very high	82.1	Confident	20 Å²	20	105.2 Å²	105.2	14%	0.135	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-84	-7.9	173.6	-58.6	0	0	0	0	113.1	C285 L289 T290 R292	C285-C287 PolarHBondContact O-N 3.3Å; C285-C287 VanDerWaalsContact O-N 3.11Å; C287-L289 PolarHBondContact O-N 3.44Å; C287-T290 PolarHBondContact O-N 3.29Å; C287-T290 VanDerWaalsContact O-N 3.12Å; C287-T290 PolarHBondContact O-OG1 3.47Å; C287-R292 VanDerWaalsContact CB-O 3.32Å; C287-R292 WeakPolarHBondContact CB-O 3.35Å
288	Y	95.1	Very high	84.6	Confident	164 Å²	164	100 Å²	100	64%	0.643	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	125.8	-176	-178	-107.9	0	0	0	111	N286 T290 A380	N286-Y288 VanDerWaalsContact C-N 3.34Å; Y288-T290 PolarHBondContact O-N 2.99Å; Y288-A380 HydrophobicContact CD2-CB 4.47Å; Y288-A380 HydrophobicContact CE2-CB 3.55Å
289	L	92.7	Very high	87	Confident	99 Å²	99	100.6 Å²	100.6	52%	0.518	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	58.6	28.7	-175.1	-62.7	173.3	0	0	0	114.5	C287 A380 V382	C287-L289 PolarHBondContact O-N 3.44Å; L289-A380 HydrophobicContact CD2-CB 3.78Å; L289-V382 HydrophobicContact CD2-CG2 4.02Å
290	T	95	Very high	89.4	Confident	47 Å²	47	100.9 Å²	100.9	29%	0.288	55%	0.545	S	S	.	.	S	Bend	trans	-122.6	170.6	169.4	88	0	0	0	0	110.3	C287 Y288 R292	C287-T290 PolarHBondContact O-N 3.29Å; C287-T290 VanDerWaalsContact O-N 3.12Å; C287-T290 PolarHBondContact O-OG1 3.47Å; Y288-T290 PolarHBondContact O-N 2.99Å; T290-R292 PolarHBondContact O-N 2.92Å; T290-R292 WeakPolarHBondContact OG1-CB 3.42Å; T290-R292 PolarHBondContact OG1-N 3.33Å
291	D	94.4	Very high	91.3	Very high	151 Å²	151	104 Å²	104	81%	0.807	56%	0.557	S	S	*	*	S	Bend	trans	-81	9.7	173.8	64.3	-18.7	0	0	0	113.6
292	R	96.4	Very high	93	Very high	150 Å²	150	102.5 Å²	102.5	57%	0.566	55%	0.549	S	S	*	.			trans	-98	154.3	-171.7	-59	-173.5	-68.3	-159.4	-1	110.9	N286 C287 T290	N286-R292 PolarHBondContact O-NH2 2.91Å; C287-R292 VanDerWaalsContact CB-O 3.32Å; C287-R292 WeakPolarHBondContact CB-O 3.35Å; T290-R292 PolarHBondContact O-N 2.92Å; T290-R292 WeakPolarHBondContact OG1-CB 3.42Å; T290-R292 PolarHBondContact OG1-N 3.33Å
293	V	97	Very high	94.4	Very high	110 Å²	110	103.6 Å²	103.6	67%	0.667	54%	0.535	S	S	*	.			trans	-126.9	153.5	171.6	-63.1	0	0	0	0	110.4	L298	V293-L298 HydrophobicContact CB-CD1 4.35Å; V293-L298 HydrophobicContact CB-CG 4.42Å; V293-L298 HydrophobicContact CG2-CD1 4.41Å
294	C	96.3	Very high	94.8	Very high	39 Å²	39	104.9 Å²	104.9	26%	0.264	55%	0.546	S	S	.	.			trans	-146.5	167.3	174.2	71.7	0	0	0	0	110.7	V296 C297 L298	C294-V296 PolarHBondContact O-N 3.29Å; C294-V296 VanDerWaalsContact O-N 3.12Å; C294-C297 PolarHBondContact N-SG 2.93Å; C294-C297 PolarHBondContact O-N 2.83Å; C294-C297 PolarHBondContact O-SG 3.33Å; C294-L298 WeakPolarHBondContact O-CG 3.23Å; C294-L298 PolarHBondContact O-N 3.28Å; C294-L298 VanDerWaalsContact O-N 3.1Å
295	N	95.9	Very high	94.9	Very high	142 Å²	142	99.7 Å²	99.7	76%	0.759	52%	0.516	S	S	*	.	H	α-helix	trans	-59	-27.9	-179.9	-66.5	-23.2	0	0	0	113.1	A299	N295-A299 WeakPolarHBondContact O-CB 3.39Å; N295-A299 PolarHBondContact O-N 2.7Å; N295-A299 VanDerWaalsContact O-N 3.13Å
296	V	95.3	Very high	94.8	Very high	59 Å²	59	100 Å²	100	36%	0.358	52%	0.517	S	S	.	.	H	α-helix	trans	-67.6	-48.6	178.2	-178.8	0	0	0	0	111.4	L283 C285 C294 R300	L283-V296 HydrophobicContact CB-CG1 3.92Å; C285-V296 HydrophobicContact CB-CB 4.06Å; C285-V296 HydrophobicContact CB-CG1 4.12Å; C294-V296 PolarHBondContact O-N 3.29Å; C294-V296 VanDerWaalsContact O-N 3.12Å; V296-R300 WeakPolarHBondContact O-CG 3.29Å
297	C	94.4	Very high	94.7	Very high	31 Å²	31	98.1 Å²	98.1	21%	0.209	50%	0.499	C	S	.	.	H	α-helix	trans	-75.5	-34.7	-179	57.9	0	0	0	0	112.9	C294 A299 R300	C294-C297 PolarHBondContact N-SG 2.93Å; C294-C297 PolarHBondContact O-N 2.83Å; C294-C297 PolarHBondContact O-SG 3.33Å; C297-A299 VanDerWaalsContact C-N 3.34Å; C297-R300 WeakPolarHBondContact O-CB 3.32Å; C297-R300 PolarHBondContact O-N 3.13Å
298	L	95.5	Very high	94.5	Very high	118 Å²	118	98.7 Å²	98.7	62%	0.618	51%	0.505	S	S	*	.	H	α-helix	trans	-69.5	-29.4	178.3	-67.7	174.7	0	0	0	113.1	V293 C294 R300	V293-L298 HydrophobicContact CB-CD1 4.35Å; V293-L298 HydrophobicContact CB-CG 4.42Å; V293-L298 HydrophobicContact CG2-CD1 4.41Å; C294-L298 WeakPolarHBondContact O-CG 3.23Å; C294-L298 PolarHBondContact O-N 3.28Å; C294-L298 VanDerWaalsContact O-N 3.1Å; L298-R300 VanDerWaalsContact C-N 3.27Å; L298-R300 PolarHBondContact O-N 3.47Å
299	A	95.8	Very high	94.4	Very high	85 Å²	85	91.6 Å²	91.6	70%	0.702	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.2	178	0	0	0	0	0	114	N295 C297	N295-A299 WeakPolarHBondContact O-CB 3.39Å; N295-A299 PolarHBondContact O-N 2.7Å; N295-A299 VanDerWaalsContact O-N 3.13Å; C297-A299 VanDerWaalsContact C-N 3.34Å
300	R	93.6	Very high	94.5	Very high	119 Å²	119	88.7 Å²	88.7	45%	0.449	47%	0.469	S	S	.	.	S	Bend	trans	-69.1	144.2	-179.4	-68.6	177.5	-179.1	145.4	3.5	110.8	L283 C285 V296 C297 L298 Q302	L283-R300 PolarHBondContact O-NH2 2.88Å; C285-R300 PolarHBondContact SG-NH2 3.28Å; V296-R300 WeakPolarHBondContact O-CG 3.29Å; C297-R300 WeakPolarHBondContact O-CB 3.32Å; C297-R300 PolarHBondContact O-N 3.13Å; L298-R300 VanDerWaalsContact C-N 3.27Å; L298-R300 PolarHBondContact O-N 3.47Å; R300-Q302 PolarHBondContact O-N 2.9Å
301	K	94.4	Very high	94.5	Very high	207 Å²	207	89.9 Å²	89.9	90%	0.9	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-60.6	136.4	169.9	-66.7	-175.9	178.7	-178.4	0	109.4
302	Q	93.6	Very high	94.5	Very high	152 Å²	152	83 Å²	83	71%	0.71	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-65.3	139.5	175.7	-64.4	-172.2	6.2	0	0	110.6	R300 V304	R300-Q302 PolarHBondContact O-N 2.9Å; Q302-V304 PolarHBondContact O-N 3.08Å
303	Q	93.6	Very high	94.6	Very high	98 Å²	98	76.5 Å²	76.5	46%	0.458	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-73.7	126.9	174.9	-176	168.4	8.6	0	0	110.1	K321 K379	Q303-K321 PolarHBondContact NE2-O 3.17Å; Q303-K321 WeakPolarHBondContact O-CD 3.38Å; Q303-K379 VanDerWaalsContact CD-NZ 3.28Å
304	V	93	Very high	94.5	Very high	116 Å²	116	72.7 Å²	72.7	70%	0.703	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-93.1	130.7	173.2	-177.7	0	0	0	0	108.7	Q302	Q302-V304 PolarHBondContact O-N 3.08Å
305	A	93.5	Very high	94.5	Very high	17 Å²	17	70.8 Å²	70.8	14%	0.14	38%	0.379	C	S	.	.			trans	-146.4	152.5	173.7	0	0	0	0	0	110.1	R307 K321	A305-R307 PolarHBondContact O-N 2.92Å; A305-K321 VanDerWaalsContact CB-C 3.5Å; A305-K321 HydrophobicContact CB-CB 3.84Å; A305-K321 WeakPolarHBondContact CB-O 3.47Å
306	P	92.9	Very high	94.4	Very high	28 Å²	28	64.4 Å²	64.4	18%	0.182	35%	0.345	C	S	.	.			trans	-57.6	125.2	174.4	-25.3	36.1	0	0	0	111.8	R169 Q325	R169-P306 VanDerWaalsContact NH1-CB 3.31Å; R169-P306 PolarHBondContact NH2-O 3.27Å; P306-Q325 PolarHBondContact O-NE2 3.11Å; P306-Q325 PolarHBondContact O-OE1 3.29Å
307	R	93.9	Very high	94.3	Very high	108 Å²	108	62.1 Å²	62.1	41%	0.408	33%	0.331	S	S	.	.			trans	-132.6	8.3	179	69.4	178.2	-64.7	-89.8	-1.6	114.9	A305 R314 V318 D354	A305-R307 PolarHBondContact O-N 2.92Å; R307-R314 PolarHBondContact O-NE 3.41Å; R307-R314 VanDerWaalsContact O-NE 3.1Å; R307-V318 HydrophobicContact CB-CG1 4.42Å; R307-D354 IonicContact CZ-OD2 2.73Å; R307-D354 VanDerWaalsContact CZ-OD2 3.3Å; R307-D354 IonicContact NE-OD2 3.52Å; R307-D354 PolarHBondContact NE-OD2 3.49Å; R307-D354 VanDerWaalsContact NH2-CG 3.29Å; R307-D354 IonicContact NH2-OD1 3.86Å; R307-D354 PolarHBondContact NH2-OD1 2.98Å; R307-D354 VanDerWaalsContact NH2-OD1 3.07Å; R307-D354 IonicContact NH2-OD2 2.81Å; R307-D354 PolarHBondContact NH2-OD2 3.17Å
308	A	92.5	Very high	94.3	Very high	32 Å²	32	60.9 Å²	60.9	26%	0.264	32%	0.322	S	S	.	.			trans	-54	139.5	171.9	0	0	0	0	0	110.1	R169 L192	R169-A308 PolarHBondContact NH2-O 3.3Å; L192-A308 HydrophobicContact CD2-CB 4.04Å
309	G	93.5	Very high	94.3	Very high	15 Å²	15	55.5 Å²	55.5	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	137.3	176.2	-174.7	0	0	0	0	0	111.4	R169 D170 R314	R169-G309 VanDerWaalsContact O-CA 3.24Å; R169-G309 WeakPolarHBondContact O-CA 3.33Å; D170-G309 WeakPolarHBondContact OD1-CA 3.42Å; G309-R314 PolarHBondContact O-NH2 2.93Å
310	T	94.5	Very high	94.2	Very high	39 Å²	39	52.4 Å²	52.4	24%	0.239	27%	0.266	C	S	.	.			trans	-91.9	136.2	-178.6	-58.5	0	0	0	0	112.2	D170 K172 F313	D170-T310 WeakPolarHBondContact OD1-CB 3.37Å; D170-T310 PolarHBondContact OD1-N 2.97Å; D170-T310 PolarHBondContact OD1-OG1 3.38Å; K172-T310 HydrophobicContact CD-CG2 4.18Å; K172-T310 VanDerWaalsContact CD-OG1 3.25Å; K172-T310 WeakPolarHBondContact CD-OG1 3.28Å; K172-T310 PolarHBondContact NZ-OG1 3.03Å; T310-F313 HydrophobicContact CG2-CD2 4.05Å; T310-F313 HydrophobicContact CG2-CE2 4.39Å; T310-F313 PolarHBondContact O-N 3.01Å
311	P	94.3	Very high	94.4	Very high	72 Å²	72	50.5 Å²	50.5	47%	0.468	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	142.9	172.3	-24.9	34.4	0	0	0	112.3	F313	P311-F313 VanDerWaalsContact C-N 3.3Å; P311-F313 PolarHBondContact O-N 3.26Å
312	G	95.6	Very high	94.2	Very high	7 Å²	7	41 Å²	41	7%	0.072	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	-18.9	-177.1	0	0	0	0	0	115.3	F349	G312-F349 WeakPolarHBondContact O-CD2 3.43Å
313	F	97.1	Very high	94.1	Very high	12 Å²	12	36.8 Å²	36.8	5%	0.053	21%	0.207	C	C	.	.	S	Bend	trans	-106.2	-8.3	178.4	-64.6	-87.1	0	0	0	114.1	K172 T310 P311 S333 V336 I337 Y346	K172-F313 HydrophobicContact CB-CD1 4.05Å; K172-F313 HydrophobicContact CB-CD2 4.06Å; K172-F313 HydrophobicContact CB-CE1 3.98Å; K172-F313 HydrophobicContact CB-CE2 3.99Å; K172-F313 HydrophobicContact CB-CG 4.09Å; K172-F313 HydrophobicContact CB-CZ 3.96Å; T310-F313 HydrophobicContact CG2-CD2 4.05Å; T310-F313 HydrophobicContact CG2-CE2 4.39Å; T310-F313 PolarHBondContact O-N 3.01Å; P311-F313 VanDerWaalsContact C-N 3.3Å; P311-F313 PolarHBondContact O-N 3.26Å; F313-S333 PolarHBondContact O-OG 3.3Å; F313-V336 HydrophobicContact CD1-CB 4.11Å; F313-V336 HydrophobicContact CD1-CG1 3.83Å; F313-V336 HydrophobicContact CE1-CB 4.46Å; F313-V336 HydrophobicContact CE1-CG1 3.89Å; F313-I337 HydrophobicContact CD1-CG1 4.46Å; F313-I337 HydrophobicContact CE1-CG1 4.04Å; F313-Y346 AromaticContact CZ-CE2 3.92Å; F313-Y346 HydrophobicContact CZ-CE2 3.92Å
314	R	96.4	Very high	93.8	Very high	30 Å²	30	38.9 Å²	38.9	11%	0.113	22%	0.221	C	C	.	.			trans	-72.7	137.7	-177.3	-64.8	-177.1	-171.4	114.3	11.7	111.5	R307 G309 V318 L319 W332 D354	R307-R314 PolarHBondContact O-NE 3.41Å; R307-R314 VanDerWaalsContact O-NE 3.1Å; G309-R314 PolarHBondContact O-NH2 2.93Å; R314-V318 HydrophobicContact CB-CB 4.21Å; R314-V318 HydrophobicContact CB-CG1 4.18Å; R314-V318 HydrophobicContact CG-CG1 4.2Å; R314-L319 HydrophobicContact CB-CD2 3.67Å; R314-L319 HydrophobicContact CB-CG 4.12Å; R314-L319 HydrophobicContact CG-CD2 4.47Å; R314-W332 PolarHBondContact O-NE1 3.08Å; R314-D354 IonicContact CZ-OD1 2.66Å; R314-D354 IonicContact NH1-OD1 3.26Å; R314-D354 PolarHBondContact NH1-OD1 2.98Å
315	A	95.3	Very high	93.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.			trans	-72.2	155.7	175.6	0	0	0	0	0	112.8	E317 V318 L319 I329 W332	A315-E317 VanDerWaalsContact C-N 3.27Å; A315-E317 HydrophobicContact CB-CG 4.43Å; A315-E317 VanDerWaalsContact CB-OE2 3.23Å; A315-E317 WeakPolarHBondContact CB-OE2 3.18Å; A315-E317 PolarHBondContact O-N 3.24Å; A315-V318 HydrophobicContact CB-CG2 4.3Å; A315-V318 WeakPolarHBondContact O-CA 3.08Å; A315-V318 WeakPolarHBondContact O-CB 2.9Å; A315-V318 PolarHBondContact O-N 3.12Å; A315-L319 WeakPolarHBondContact O-CG 3.18Å; A315-L319 PolarHBondContact O-N 2.98Å; A315-L319 VanDerWaalsContact O-N 3.09Å; A315-I329 HydrophobicContact CB-CB 4.14Å; A315-I329 HydrophobicContact CB-CG2 4.13Å; A315-W332 VanDerWaalsContact CA-CD1 3.4Å; A315-W332 HydrophobicContact CB-CB 3.68Å; A315-W332 HydrophobicContact CB-CD2 4.07Å; A315-W332 HydrophobicContact CB-CG 3.53Å
316	P	94.3	Very high	93.5	Very high	7 Å²	7	35.2 Å²	35.2	5%	0.045	20%	0.202	C	C	.	.	H	α-helix	trans	-53.3	-38.7	-178.9	-27.6	35.4	0	0	0	114.3	V318 L319 T320 W332 L358 I361	P316-V318 VanDerWaalsContact C-N 3.28Å; P316-V318 PolarHBondContact O-N 3.41Å; P316-L319 PolarHBondContact O-N 3.46Å; P316-T320 WeakPolarHBondContact O-CB 3.26Å; P316-T320 WeakPolarHBondContact O-CG2 3.49Å; P316-T320 PolarHBondContact O-N 2.99Å; P316-T320 PolarHBondContact O-OG1 2.93Å; P316-W332 HydrophobicContact CG-CE3 4.26Å; P316-W332 HydrophobicContact CG-CH2 3.76Å; P316-W332 HydrophobicContact CG-CZ2 4.15Å; P316-W332 HydrophobicContact CG-CZ3 3.8Å; P316-L358 HydrophobicContact CB-CD1 4.2Å; P316-I361 HydrophobicContact CG-CD1 4.4Å; P316-I361 HydrophobicContact CG-CG2 4.46Å
317	E	92.3	Very high	93.5	Very high	12 Å²	12	35.7 Å²	35.7	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-29.3	176.2	66	-87.9	-150.4	0	0	112.6	A315 T320 K321 C322 I329 F377	A315-E317 VanDerWaalsContact C-N 3.27Å; A315-E317 HydrophobicContact CB-CG 4.43Å; A315-E317 VanDerWaalsContact CB-OE2 3.23Å; A315-E317 WeakPolarHBondContact CB-OE2 3.18Å; A315-E317 PolarHBondContact O-N 3.24Å; E317-T320 WeakPolarHBondContact CA-OG1 3.26Å; E317-K321 PolarHBondContact O-N 2.99Å; E317-C322 HydrophobicContact CB-CB 3.81Å; E317-C322 WeakPolarHBondContact O-CA 3.49Å; E317-C322 WeakPolarHBondContact O-CB 3.4Å; E317-C322 PolarHBondContact O-N 3.23Å; E317-I329 HydrophobicContact CG-CG2 4.05Å; E317-I329 WeakPolarHBondContact OE1-CG2 3.45Å; E317-F377 HydrophobicContact CB-CD2 4.14Å; E317-F377 HydrophobicContact CB-CE1 4.44Å; E317-F377 HydrophobicContact CB-CE2 3.85Å; E317-F377 HydrophobicContact CB-CZ 3.95Å
318	V	95.5	Very high	93.5	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.024	19%	0.193	C	C	.	.	H	α-helix	trans	-73.1	-47.1	172.7	-176.7	0	0	0	0	109.8	R307 R314 A315 P316 T320 K321 I329	R307-V318 HydrophobicContact CB-CG1 4.42Å; R314-V318 HydrophobicContact CB-CB 4.21Å; R314-V318 HydrophobicContact CB-CG1 4.18Å; R314-V318 HydrophobicContact CG-CG1 4.2Å; A315-V318 HydrophobicContact CB-CG2 4.3Å; A315-V318 WeakPolarHBondContact O-CA 3.08Å; A315-V318 WeakPolarHBondContact O-CB 2.9Å; A315-V318 PolarHBondContact O-N 3.12Å; P316-V318 VanDerWaalsContact C-N 3.28Å; P316-V318 PolarHBondContact O-N 3.41Å; V318-T320 VanDerWaalsContact C-N 3.3Å; V318-T320 PolarHBondContact O-N 2.69Å; V318-K321 PolarHBondContact O-N 3.28Å; V318-K321 VanDerWaalsContact O-N 3.1Å; V318-I329 HydrophobicContact CG2-CB 4.21Å; V318-I329 HydrophobicContact CG2-CD1 4.31Å; V318-I329 HydrophobicContact CG2-CG2 3.75Å
319	L	95.6	Very high	93.7	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-36.4	-177.9	-60.9	177.3	0	0	0	112.6	R314 A315 P316 K321 D354 A357 L358 I361	R314-L319 HydrophobicContact CB-CD2 3.67Å; R314-L319 HydrophobicContact CB-CG 4.12Å; R314-L319 HydrophobicContact CG-CD2 4.47Å; A315-L319 WeakPolarHBondContact O-CG 3.18Å; A315-L319 PolarHBondContact O-N 2.98Å; A315-L319 VanDerWaalsContact O-N 3.09Å; P316-L319 PolarHBondContact O-N 3.46Å; L319-K321 VanDerWaalsContact C-N 3.29Å; L319-K321 PolarHBondContact O-N 3.21Å; L319-D354 HydrophobicContact CB-CB 4.4Å; L319-D354 HydrophobicContact CD2-CB 3.78Å; L319-A357 HydrophobicContact CD1-CB 3.86Å; L319-A357 HydrophobicContact CD2-CB 4Å; L319-L358 HydrophobicContact CD1-CB 4.14Å; L319-I361 HydrophobicContact CD1-CD1 3.59Å
320	T	94.1	Very high	93.9	Very high	21 Å²	21	29.6 Å²	29.6	13%	0.129	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	8.6	178.4	56.3	0	0	0	0	113.5	P316 E317 V318 L358 F377 K379 V381	P316-T320 WeakPolarHBondContact O-CB 3.26Å; P316-T320 WeakPolarHBondContact O-CG2 3.49Å; P316-T320 PolarHBondContact O-N 2.99Å; P316-T320 PolarHBondContact O-OG1 2.93Å; E317-T320 WeakPolarHBondContact CA-OG1 3.26Å; V318-T320 VanDerWaalsContact C-N 3.3Å; V318-T320 PolarHBondContact O-N 2.69Å; T320-L358 HydrophobicContact CG2-CD1 4.41Å; T320-L358 HydrophobicContact CG2-CD2 3.72Å; T320-F377 WeakPolarHBondContact OG1-CE2 3.5Å; T320-K379 WeakPolarHBondContact O-CD 3.49Å; T320-K379 WeakPolarHBondContact O-CE 3.4Å; T320-K379 PolarHBondContact O-NZ 3.39Å; T320-V381 HydrophobicContact CG2-CG2 4.13Å
321	K	95.9	Very high	93.9	Very high	78 Å²	78	28.5 Å²	28.5	34%	0.339	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	43.5	175.3	-51.2	177.7	-174.2	-77.3	0	113.5	Q303 A305 E317 V318 L319 K379	Q303-K321 PolarHBondContact NE2-O 3.17Å; Q303-K321 WeakPolarHBondContact O-CD 3.38Å; A305-K321 VanDerWaalsContact CB-C 3.5Å; A305-K321 HydrophobicContact CB-CB 3.84Å; A305-K321 WeakPolarHBondContact CB-O 3.47Å; E317-K321 PolarHBondContact O-N 2.99Å; V318-K321 PolarHBondContact O-N 3.28Å; V318-K321 VanDerWaalsContact O-N 3.1Å; L319-K321 VanDerWaalsContact C-N 3.29Å; L319-K321 PolarHBondContact O-N 3.21Å; K321-K379 VanDerWaalsContact C-NZ 3.29Å; K321-K379 WeakPolarHBondContact O-CE 3.23Å; K321-K379 PolarHBondContact O-NZ 3.09Å
322	C	90.9	Very high	94	Very high	8 Å²	8	25.6 Å²	25.6	5%	0.054	15%	0.148	C	C	.	.			trans	-65.3	126.4	168.4	-172.6	0	0	0	0	109.5	E317 N324 Q325 F377	E317-C322 HydrophobicContact CB-CB 3.81Å; E317-C322 WeakPolarHBondContact O-CA 3.49Å; E317-C322 WeakPolarHBondContact O-CB 3.4Å; E317-C322 PolarHBondContact O-N 3.23Å; C322-N324 PolarHBondContact SG-O 3.06Å; C322-N324 VanDerWaalsContact SG-O 3.36Å; C322-Q325 WeakPolarHBondContact O-CG 3.29Å; C322-Q325 PolarHBondContact O-NE2 2.69Å; C322-F377 HydrophobicContact CB-CD2 4.08Å
323	P	90.7	Very high	94.1	Very high	63 Å²	63	25.6 Å²	25.6	41%	0.409	15%	0.146	S	C	.	.	S	Bend	trans	-74.6	-29.4	-179.1	29.3	-33	0	0	0	112.2
324	N	88.8	Confident	94.2	Very high	142 Å²	142	25 Å²	25	76%	0.759	14%	0.144	S	C	*	.			trans	-99.1	93.9	-176.9	-59.1	-23.6	0	0	0	108.5	C322	C322-N324 PolarHBondContact SG-O 3.06Å; C322-N324 VanDerWaalsContact SG-O 3.36Å
325	Q	88.9	Confident	94.2	Very high	26 Å²	26	23.8 Å²	23.8	12%	0.121	14%	0.141	C	C	.	.			trans	-108.7	142.4	178.6	-65	168.2	16.4	0	0	109.1	R169 P306 C322 I329	R169-Q325 VanDerWaalsContact CZ-OE1 3.29Å; P306-Q325 PolarHBondContact O-NE2 3.11Å; P306-Q325 PolarHBondContact O-OE1 3.29Å; C322-Q325 WeakPolarHBondContact O-CG 3.29Å; C322-Q325 PolarHBondContact O-NE2 2.69Å; Q325-I329 HydrophobicContact CB-CG2 4.35Å
326	G	89.9	Confident	94.3	Very high	31 Å²	31	24.1 Å²	24.1	32%	0.32	14%	0.142	S	C	.	.			trans	-122.5	-172	177.4	0	0	0	0	0	112.2	A328 I329	G326-A328 PolarHBondContact O-N 3.41Å; G326-A328 VanDerWaalsContact O-N 3.11Å; G326-I329 WeakPolarHBondContact O-CG1 3.41Å; G326-I329 PolarHBondContact O-N 3.39Å
327	T	94.8	Very high	94.4	Very high	38 Å²	38	23.8 Å²	23.8	23%	0.233	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-19.1	177	52.2	0	0	0	0	113.7	H162 I167 T196 I329 D330	H162-T327 HydrophobicContact CB-CG2 4.06Å; H162-T327 VanDerWaalsContact CD2-CG2 3.49Å; H162-T327 WeakPolarHBondContact CD2-CG2 3.33Å; H162-T327 PolarHBondContact CE1-O 3.43Å; I167-T327 HydrophobicContact CG1-CG2 4Å; T196-T327 HydrophobicContact CG2-CG2 4.01Å; T327-I329 PolarHBondContact O-N 2.91Å; T327-I329 VanDerWaalsContact O-N 3.11Å; T327-D330 WeakPolarHBondContact O-CB 3.26Å; T327-D330 PolarHBondContact O-N 3.09Å
328	A	93.5	Very high	94.7	Very high	22 Å²	22	23.3 Å²	23.3	18%	0.182	14%	0.138	C	C	.	.	H	α-helix	trans	-50.8	-31.4	173.1	0	0	0	0	0	114	G326 D330 V331 W332 T460	G326-A328 PolarHBondContact O-N 3.41Å; G326-A328 VanDerWaalsContact O-N 3.11Å; A328-D330 VanDerWaalsContact C-N 3.29Å; A328-D330 PolarHBondContact O-N 2.94Å; A328-V331 PolarHBondContact O-N 3.08Å; A328-W332 PolarHBondContact O-N 3.14Å; A328-T460 HydrophobicContact CB-CG2 3.74Å
329	I	95.2	Very high	94.7	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-67.2	-31.9	179.3	73.5	-179.2	0	0	0	112	I167 R169 A315 E317 V318 Q325 G326 T327 W332 S333	I167-I329 HydrophobicContact CG2-CD1 3.57Å; I167-I329 HydrophobicContact CG2-CG1 3.71Å; R169-I329 HydrophobicContact CG-CD1 4.14Å; A315-I329 HydrophobicContact CB-CB 4.14Å; A315-I329 HydrophobicContact CB-CG2 4.13Å; E317-I329 HydrophobicContact CG-CG2 4.05Å; E317-I329 WeakPolarHBondContact OE1-CG2 3.45Å; V318-I329 HydrophobicContact CG2-CB 4.21Å; V318-I329 HydrophobicContact CG2-CD1 4.31Å; V318-I329 HydrophobicContact CG2-CG2 3.75Å; Q325-I329 HydrophobicContact CB-CG2 4.35Å; G326-I329 WeakPolarHBondContact O-CG1 3.41Å; G326-I329 PolarHBondContact O-N 3.39Å; T327-I329 PolarHBondContact O-N 2.91Å; T327-I329 VanDerWaalsContact O-N 3.11Å; I329-W332 WeakPolarHBondContact O-CB 3.36Å; I329-W332 PolarHBondContact O-N 3.12Å; I329-S333 PolarHBondContact O-N 2.91Å; I329-S333 VanDerWaalsContact O-N 3.14Å; I329-S333 PolarHBondContact O-OG 3.45Å; I329-S333 VanDerWaalsContact O-OG 3.07Å
330	D	97.9	Very high	94.7	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.9	-35.5	177.3	-65.8	-25.2	0	0	0	110.6	L158 H162 H168 R169 I171 T327 A328 S333 A334	L158-D330 HydrophobicContact CD2-CB 4.09Å; H162-D330 IonicContact CD2-OD2 2.68Å; H162-D330 IonicContact NE2-OD2 2.77Å; H162-D330 PolarHBondContact NE2-OD2 2.78Å; H168-D330 PolarHBondContact N-OD1 2.91Å; H168-D330 PolarHBondContact N-OD2 3.43Å; R169-D330 PolarHBondContact N-OD1 3.14Å; I171-D330 HydrophobicContact CG1-CB 3.8Å; T327-D330 WeakPolarHBondContact O-CB 3.26Å; T327-D330 PolarHBondContact O-N 3.09Å; A328-D330 VanDerWaalsContact C-N 3.29Å; A328-D330 PolarHBondContact O-N 2.94Å; D330-S333 WeakPolarHBondContact O-CB 3.45Å; D330-S333 PolarHBondContact O-N 3.49Å; D330-A334 PolarHBondContact O-N 2.79Å
331	V	96	Very high	94.9	Very high	16 Å²	16	23.1 Å²	23.1	10%	0.097	14%	0.136	C	C	.	.	H	α-helix	trans	-67.3	-40.3	176.1	-175.7	0	0	0	0	110.8	A328 S333 A334 G335 T460 Q464 I467	A328-V331 PolarHBondContact O-N 3.08Å; V331-S333 VanDerWaalsContact C-N 3.34Å; V331-S333 PolarHBondContact O-N 3.36Å; V331-A334 PolarHBondContact O-N 3.28Å; V331-G335 PolarHBondContact O-N 3.19Å; V331-T460 HydrophobicContact CB-CG2 4.34Å; V331-T460 HydrophobicContact CG1-CG2 4.47Å; V331-Q464 HydrophobicContact CG1-CG 3.68Å; V331-I467 HydrophobicContact CG1-CD1 4.27Å
332	W	96.1	Very high	94.8	Very high	11 Å²	11	21.4 Å²	21.4	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-56.3	-49.9	170.7	173.4	-83.4	0	0	0	111.1	R314 A315 P316 A328 I329 A334 G335 V336 I361 L463	R314-W332 PolarHBondContact O-NE1 3.08Å; A315-W332 VanDerWaalsContact CA-CD1 3.4Å; A315-W332 HydrophobicContact CB-CB 3.68Å; A315-W332 HydrophobicContact CB-CD2 4.07Å; A315-W332 HydrophobicContact CB-CG 3.53Å; P316-W332 HydrophobicContact CG-CE3 4.26Å; P316-W332 HydrophobicContact CG-CH2 3.76Å; P316-W332 HydrophobicContact CG-CZ2 4.15Å; P316-W332 HydrophobicContact CG-CZ3 3.8Å; A328-W332 PolarHBondContact O-N 3.14Å; I329-W332 WeakPolarHBondContact O-CB 3.36Å; I329-W332 PolarHBondContact O-N 3.12Å; W332-A334 VanDerWaalsContact C-N 3.31Å; W332-A334 PolarHBondContact O-N 2.8Å; W332-G335 CarbonylContact O-C 3.59Å; W332-G335 WeakPolarHBondContact O-CA 3.45Å; W332-G335 PolarHBondContact O-N 2.74Å; W332-V336 PolarHBondContact O-N 3.38Å; W332-I361 HydrophobicContact CH2-CD1 4.26Å; W332-I361 HydrophobicContact CH2-CG1 4.4Å; W332-I361 HydrophobicContact CH2-CG2 3.66Å; W332-I361 HydrophobicContact CZ2-CD1 3.54Å; W332-I361 HydrophobicContact CZ2-CG1 3.84Å; W332-I361 HydrophobicContact CZ2-CG2 3.99Å; W332-L463 HydrophobicContact CD2-CD1 4Å; W332-L463 HydrophobicContact CE3-CD1 3.16Å; W332-L463 HydrophobicContact CH2-CD1 3.98Å; W332-L463 HydrophobicContact CZ3-CD1 3.16Å
333	S	97.9	Very high	94.9	Very high	6 Å²	6	21 Å²	21	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-60.8	-38.6	179	-59	0	0	0	0	112.5	I171 F313 I329 D330 V331 G335 V336 I337	I171-S333 WeakPolarHBondContact O-CB 3.31Å; F313-S333 PolarHBondContact O-OG 3.3Å; I329-S333 PolarHBondContact O-N 2.91Å; I329-S333 VanDerWaalsContact O-N 3.14Å; I329-S333 PolarHBondContact O-OG 3.45Å; I329-S333 VanDerWaalsContact O-OG 3.07Å; D330-S333 WeakPolarHBondContact O-CB 3.45Å; D330-S333 PolarHBondContact O-N 3.49Å; V331-S333 VanDerWaalsContact C-N 3.34Å; V331-S333 PolarHBondContact O-N 3.36Å; S333-G335 VanDerWaalsContact C-N 3.31Å; S333-G335 PolarHBondContact O-N 3.13Å; S333-V336 WeakPolarHBondContact O-CB 3.44Å; S333-V336 PolarHBondContact O-N 3.44Å; S333-I337 WeakPolarHBondContact O-CG1 3.32Å; S333-I337 PolarHBondContact O-N 3.4Å
334	A	98.1	Very high	95.2	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-37.6	171.6	0	0	0	0	0	112.5	L154 L158 D330 V331 W332 V336 I337 L338	L154-A334 HydrophobicContact CD2-CB 3.7Å; L154-A334 HydrophobicContact CG-CB 4.33Å; L158-A334 HydrophobicContact CD1-CB 3.86Å; D330-A334 PolarHBondContact O-N 2.79Å; V331-A334 PolarHBondContact O-N 3.28Å; W332-A334 VanDerWaalsContact C-N 3.31Å; W332-A334 PolarHBondContact O-N 2.8Å; A334-V336 VanDerWaalsContact C-N 3.35Å; A334-I337 WeakPolarHBondContact O-CB 3.09Å; A334-I337 PolarHBondContact O-N 2.85Å; A334-L338 PolarHBondContact O-N 3.32Å
335	G	96.1	Very high	95.5	Very high	4 Å²	4	18 Å²	18	4%	0.041	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-37.7	171.9	0	0	0	0	0	113.1	V331 W332 S333 I337 L338 L339	V331-G335 PolarHBondContact O-N 3.19Å; W332-G335 CarbonylContact O-C 3.59Å; W332-G335 WeakPolarHBondContact O-CA 3.45Å; W332-G335 PolarHBondContact O-N 2.74Å; S333-G335 VanDerWaalsContact C-N 3.31Å; S333-G335 PolarHBondContact O-N 3.13Å; G335-I337 VanDerWaalsContact C-N 3.33Å; G335-L338 PolarHBondContact O-N 3.31Å; G335-L339 WeakPolarHBondContact O-CB 3.31Å; G335-L339 PolarHBondContact O-N 2.92Å
336	V	97.1	Very high	95.8	Very high	6 Å²	6	19.5 Å²	19.5	4%	0.036	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-39.2	172.5	178.1	0	0	0	0	111.1	F313 W332 S333 A334 L339 S340 F349	F313-V336 HydrophobicContact CD1-CB 4.11Å; F313-V336 HydrophobicContact CD1-CG1 3.83Å; F313-V336 HydrophobicContact CE1-CB 4.46Å; F313-V336 HydrophobicContact CE1-CG1 3.89Å; W332-V336 PolarHBondContact O-N 3.38Å; S333-V336 WeakPolarHBondContact O-CB 3.44Å; S333-V336 PolarHBondContact O-N 3.44Å; A334-V336 VanDerWaalsContact C-N 3.35Å; V336-L339 PolarHBondContact O-N 3.35Å; V336-S340 PolarHBondContact O-N 3.46Å; V336-F349 HydrophobicContact CG1-CD2 4.11Å; V336-F349 HydrophobicContact CG1-CE2 4.45Å; V336-F349 HydrophobicContact CG2-CD2 4.42Å; V336-F349 HydrophobicContact CG2-CE2 4.23Å
337	I	97.9	Very high	96.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-48.4	174.4	-62.6	171.8	0	0	0	110.5	Y150 I151 L154 I171 P173 F313 S333 A334 G335 L339 S340 L341	Y150-I337 HydrophobicContact CE1-CG2 3.77Å; I151-I337 HydrophobicContact CD1-CG2 4.3Å; L154-I337 HydrophobicContact CD2-CD1 3.87Å; I171-I337 HydrophobicContact CG2-CD1 3.84Å; P173-I337 HydrophobicContact CG-CD1 4.38Å; P173-I337 HydrophobicContact CG-CG1 4.01Å; P173-I337 HydrophobicContact CG-CG2 4.19Å; F313-I337 HydrophobicContact CD1-CG1 4.46Å; F313-I337 HydrophobicContact CE1-CG1 4.04Å; S333-I337 WeakPolarHBondContact O-CG1 3.32Å; S333-I337 PolarHBondContact O-N 3.4Å; A334-I337 WeakPolarHBondContact O-CB 3.09Å; A334-I337 PolarHBondContact O-N 2.85Å; G335-I337 VanDerWaalsContact C-N 3.33Å; I337-L339 VanDerWaalsContact C-N 3.31Å; I337-L339 PolarHBondContact O-N 2.89Å; I337-S340 WeakPolarHBondContact O-CB 3.02Å; I337-S340 PolarHBondContact O-N 3.05Å; I337-L341 HydrophobicContact CG2-CD1 4.1Å; I337-L341 HydrophobicContact CG2-CG 4.35Å; I337-L341 WeakPolarHBondContact O-CG 3.37Å; I337-L341 PolarHBondContact O-N 3.4Å
338	L	97.3	Very high	96.1	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-57.1	-45.7	176	174.7	62.6	0	0	0	111.1	V147 I151 A334 G335 S340 L341 L342 I467 F470	V147-L338 HydrophobicContact CG1-CD1 4.14Å; I151-L338 HydrophobicContact CD1-CB 3.85Å; I151-L338 HydrophobicContact CD1-CD1 4.43Å; I151-L338 HydrophobicContact CG1-CB 4.27Å; I151-L338 HydrophobicContact CG1-CD1 3.91Å; A334-L338 PolarHBondContact O-N 3.32Å; G335-L338 PolarHBondContact O-N 3.31Å; L338-S340 VanDerWaalsContact C-N 3.31Å; L338-S340 PolarHBondContact O-N 2.86Å; L338-L341 PolarHBondContact O-N 3.5Å; L338-L341 VanDerWaalsContact O-N 3.13Å; L338-L342 HydrophobicContact CD1-CD1 3.77Å; L338-L342 HydrophobicContact CD1-CD2 4.22Å; L338-L342 HydrophobicContact CD1-CG 3.77Å; L338-L342 HydrophobicContact CG-CD1 3.93Å; L338-L342 HydrophobicContact CG-CG 4.25Å; L338-L342 WeakPolarHBondContact O-CG 3.35Å; L338-L342 PolarHBondContact O-N 2.9Å; L338-I467 HydrophobicContact CD2-CG1 3.9Å; L338-F470 HydrophobicContact CD1-CD1 3.74Å; L338-F470 HydrophobicContact CD1-CD2 4.42Å; L338-F470 HydrophobicContact CD1-CE1 3.72Å; L338-F470 HydrophobicContact CD1-CE2 4.39Å; L338-F470 HydrophobicContact CD1-CG 4.12Å; L338-F470 HydrophobicContact CD1-CZ 4.07Å; L338-F470 HydrophobicContact CD2-CB 4.27Å; L338-F470 HydrophobicContact CD2-CD1 4.32Å; L338-F470 HydrophobicContact CD2-CG 4.24Å
339	L	95.4	Very high	96.2	Very high	24 Å²	24	21.1 Å²	21.1	13%	0.126	11%	0.109	C	C	.	.	H	α-helix	trans	-56.8	-45.1	177.1	-179.2	60.7	0	0	0	111.5	G335 V336 I337 L342 S343 F348 F349	G335-L339 WeakPolarHBondContact O-CB 3.31Å; G335-L339 PolarHBondContact O-N 2.92Å; V336-L339 PolarHBondContact O-N 3.35Å; I337-L339 VanDerWaalsContact C-N 3.31Å; I337-L339 PolarHBondContact O-N 2.89Å; L339-L342 PolarHBondContact O-N 2.87Å; L339-S343 WeakPolarHBondContact O-CB 3.41Å; L339-S343 PolarHBondContact O-N 3.48Å; L339-S343 PolarHBondContact O-OG 3.47Å; L339-S343 VanDerWaalsContact O-OG 3.07Å; L339-F348 HydrophobicContact CD1-CD2 4.39Å; L339-F348 HydrophobicContact CD1-CE2 3.86Å; L339-F348 HydrophobicContact CD1-CZ 4.04Å; L339-F348 HydrophobicContact CD2-CD1 3.57Å; L339-F348 HydrophobicContact CD2-CD2 4.02Å; L339-F348 HydrophobicContact CD2-CE1 3.47Å; L339-F348 VanDerWaalsContact CD2-CE1 3.47Å; L339-F348 HydrophobicContact CD2-CE2 3.92Å; L339-F348 HydrophobicContact CD2-CG 3.86Å; L339-F348 HydrophobicContact CD2-CZ 3.65Å; L339-F348 HydrophobicContact CG-CD1 4.16Å; L339-F348 HydrophobicContact CG-CD2 3.66Å; L339-F348 HydrophobicContact CG-CE1 4.12Å; L339-F348 HydrophobicContact CG-CE2 3.6Å; L339-F348 HydrophobicContact CG-CG 3.95Å; L339-F348 HydrophobicContact CG-CZ 3.85Å; L339-F349 HydrophobicContact CD2-CE2 4.23Å; L339-F349 HydrophobicContact CD2-CZ 4.25Å
340	S	97.3	Very high	96.2	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.007	14%	0.144	C	C	.	.	H	α-helix	trans	-58.2	-48.2	173.5	-87.9	0	0	0	0	112.8	I139 V336 I337 L338 L342 S343 G344 R345 F348	I139-S340 VanDerWaalsContact CD1-O 3.31Å; I139-S340 WeakPolarHBondContact CD1-O 3.3Å; V336-S340 PolarHBondContact O-N 3.46Å; I337-S340 WeakPolarHBondContact O-CB 3.02Å; I337-S340 PolarHBondContact O-N 3.05Å; L338-S340 VanDerWaalsContact C-N 3.31Å; L338-S340 PolarHBondContact O-N 2.86Å; S340-L342 PolarHBondContact O-N 3.36Å; S340-S343 PolarHBondContact O-OG 3.2Å; S340-G344 WeakPolarHBondContact O-CA 3.4Å; S340-G344 PolarHBondContact O-N 2.89Å; S340-R345 VanDerWaalsContact CA-O 3.24Å; S340-R345 WeakPolarHBondContact CA-O 3.47Å; S340-R345 WeakPolarHBondContact CB-O 3.49Å; S340-R345 PolarHBondContact O-N 3.47Å; S340-R345 VanDerWaalsContact O-N 3.13Å; S340-R345 PolarHBondContact OG-O 3.18Å; S340-F348 WeakPolarHBondContact OG-CB 3.34Å
341	L	96.3	Very high	96	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-40.6	-178.4	-66	175.1	0	0	0	111.9	I135 I139 L142 V147 Y150 I151 I337 L338	I135-L341 HydrophobicContact CG2-CD2 4.04Å; I139-L341 HydrophobicContact CD1-CD2 4.44Å; I139-L341 HydrophobicContact CG1-CD2 4.2Å; L142-L341 HydrophobicContact CD1-CD2 3.7Å; V147-L341 HydrophobicContact CG1-CB 3.84Å; V147-L341 HydrophobicContact CG1-CD1 4.03Å; V147-L341 HydrophobicContact CG2-CB 4.11Å; Y150-L341 HydrophobicContact CD1-CD1 3.74Å; Y150-L341 HydrophobicContact CE1-CD1 4.17Å; Y150-L341 HydrophobicContact CG-CD1 4.31Å; I151-L341 HydrophobicContact CD1-CD1 4.03Å; I151-L341 HydrophobicContact CG1-CD1 4.15Å; I337-L341 HydrophobicContact CG2-CD1 4.1Å; I337-L341 HydrophobicContact CG2-CG 4.35Å; I337-L341 WeakPolarHBondContact O-CG 3.37Å; I337-L341 PolarHBondContact O-N 3.4Å; L338-L341 PolarHBondContact O-N 3.5Å; L338-L341 VanDerWaalsContact O-N 3.13Å
342	L	94	Very high	95.8	Very high	43 Å²	43	34.3 Å²	34.3	23%	0.225	18%	0.181	C	C	.	.	H	α-helix	trans	-74.8	-38.5	179.5	-64.7	-177.3	0	0	0	113.3	V147 L338 L339 S340 G344 C396 R400 F470	V147-L342 HydrophobicContact CG1-CD2 4.13Å; L338-L342 HydrophobicContact CD1-CD1 3.77Å; L338-L342 HydrophobicContact CD1-CD2 4.22Å; L338-L342 HydrophobicContact CD1-CG 3.77Å; L338-L342 HydrophobicContact CG-CD1 3.93Å; L338-L342 HydrophobicContact CG-CG 4.25Å; L338-L342 WeakPolarHBondContact O-CG 3.35Å; L338-L342 PolarHBondContact O-N 2.9Å; L339-L342 PolarHBondContact O-N 2.87Å; S340-L342 PolarHBondContact O-N 3.36Å; L342-G344 VanDerWaalsContact C-N 3.29Å; L342-C396 HydrophobicContact CB-CB 4.04Å; L342-R400 WeakPolarHBondContact O-CD 3.16Å; L342-F470 HydrophobicContact CD1-CD2 3.9Å; L342-F470 HydrophobicContact CD1-CE2 3.79Å; L342-F470 HydrophobicContact CD2-CD2 4.22Å; L342-F470 HydrophobicContact CD2-CE2 3.26Å; L342-F470 HydrophobicContact CD2-CZ 3.51Å; L342-F470 HydrophobicContact CG-CE2 4.1Å; L342-F470 HydrophobicContact CG-CZ 4.47Å
343	S	94.8	Very high	95.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-82	-11.8	178.6	77.1	0	0	0	0	112.9	L339 S340 R345 F348 L399 R400	L339-S343 WeakPolarHBondContact O-CB 3.41Å; L339-S343 PolarHBondContact O-N 3.48Å; L339-S343 PolarHBondContact O-OG 3.47Å; L339-S343 VanDerWaalsContact O-OG 3.07Å; S340-S343 PolarHBondContact O-OG 3.2Å; S343-R345 PolarHBondContact O-N 2.91Å; S343-R345 WeakPolarHBondContact OG-CB 3.4Å; S343-R345 WeakPolarHBondContact OG-CG 3.17Å; S343-R345 PolarHBondContact OG-N 2.93Å; S343-R345 VanDerWaalsContact OG-N 3.16Å; S343-F348 WeakPolarHBondContact OG-CD2 3.19Å; S343-L399 CarbonylContact O-C 3.32Å; S343-L399 VanDerWaalsContact O-C 3.32Å; S343-R400 WeakPolarHBondContact O-CA 3.39Å; S343-R400 PolarHBondContact O-N 2.96Å
344	G	95.2	Very high	95.7	Very high	25 Å²	25	37.7 Å²	37.7	26%	0.258	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.2	22.5	-169.5	0	0	0	0	0	113.6	S340 L342	S340-G344 WeakPolarHBondContact O-CA 3.4Å; S340-G344 PolarHBondContact O-N 2.89Å; L342-G344 VanDerWaalsContact C-N 3.29Å
345	R	95.1	Very high	95.5	Very high	116 Å²	116	43.3 Å²	43.3	44%	0.438	23%	0.229	S	C	.	.			trans	-117.2	122	-176	-54.8	-57.1	179.5	87.3	-1.5	111	S340 S343 F348 L399	S340-R345 VanDerWaalsContact CA-O 3.24Å; S340-R345 WeakPolarHBondContact CA-O 3.47Å; S340-R345 WeakPolarHBondContact CB-O 3.49Å; S340-R345 PolarHBondContact O-N 3.47Å; S340-R345 VanDerWaalsContact O-N 3.13Å; S340-R345 PolarHBondContact OG-O 3.18Å; S343-R345 PolarHBondContact O-N 2.91Å; S343-R345 WeakPolarHBondContact OG-CB 3.4Å; S343-R345 WeakPolarHBondContact OG-CG 3.17Å; S343-R345 PolarHBondContact OG-N 2.93Å; S343-R345 VanDerWaalsContact OG-N 3.16Å; R345-F348 HydrophobicContact CB-CD2 4.22Å; R345-L399 HydrophobicContact CG-CB 4.19Å; R345-L399 HydrophobicContact CG-CD1 4.42Å; R345-L399 VanDerWaalsContact CZ-O 3.29Å; R345-L399 PolarHBondContact NE-O 3.31Å; R345-L399 PolarHBondContact NH2-O 2.64Å
346	Y	95.6	Very high	95.5	Very high	57 Å²	57	46.4 Å²	46.4	22%	0.224	24%	0.244	C	C	.	.	S	Bend	trans	-142.3	130.6	176.9	-176.5	-100.7	0	0	0	111.6	V136 P173 N174 F313	V136-Y346 HydrophobicContact CB-CD1 3.92Å; V136-Y346 HydrophobicContact CB-CE1 4.33Å; V136-Y346 HydrophobicContact CG2-CD1 4.2Å; P173-Y346 HydrophobicContact CB-CE2 4.19Å; P173-Y346 HydrophobicContact CG-CD2 4.24Å; P173-Y346 HydrophobicContact CG-CE2 3.49Å; P173-Y346 VanDerWaalsContact CG-CE2 3.49Å; N174-Y346 PolarHBondContact OD1-OH 3.48Å; F313-Y346 AromaticContact CZ-CE2 3.92Å; F313-Y346 HydrophobicContact CZ-CE2 3.92Å
347	P	96	Very high	95.4	Very high	71 Å²	71	46.4 Å²	46.4	46%	0.461	25%	0.245	S	C	.	.	S	Bend	cis	-63.9	143.9	-13	29.4	-35.2	0	0	0	111.3
348	F	96	Very high	95.3	Very high	35 Å²	35	46.9 Å²	46.9	15%	0.154	25%	0.247	C	C	.	.	S	Bend	trans	-70.9	-52.2	177.9	-170.1	-83.6	0	0	0	111.6	L339 S340 S343 R345 I364 L395 L399	L339-F348 HydrophobicContact CD1-CD2 4.39Å; L339-F348 HydrophobicContact CD1-CE2 3.86Å; L339-F348 HydrophobicContact CD1-CZ 4.04Å; L339-F348 HydrophobicContact CD2-CD1 3.57Å; L339-F348 HydrophobicContact CD2-CD2 4.02Å; L339-F348 HydrophobicContact CD2-CE1 3.47Å; L339-F348 VanDerWaalsContact CD2-CE1 3.47Å; L339-F348 HydrophobicContact CD2-CE2 3.92Å; L339-F348 HydrophobicContact CD2-CG 3.86Å; L339-F348 HydrophobicContact CD2-CZ 3.65Å; L339-F348 HydrophobicContact CG-CD1 4.16Å; L339-F348 HydrophobicContact CG-CD2 3.66Å; L339-F348 HydrophobicContact CG-CE1 4.12Å; L339-F348 HydrophobicContact CG-CE2 3.6Å; L339-F348 HydrophobicContact CG-CG 3.95Å; L339-F348 HydrophobicContact CG-CZ 3.85Å; S340-F348 WeakPolarHBondContact OG-CB 3.34Å; S343-F348 WeakPolarHBondContact OG-CD2 3.19Å; R345-F348 HydrophobicContact CB-CD2 4.22Å; F348-I364 HydrophobicContact CE1-CG1 4.2Å; F348-L395 HydrophobicContact CZ-CD2 4.32Å; F348-L399 HydrophobicContact CE2-CD1 3.78Å; F348-L399 HydrophobicContact CZ-CD1 4.15Å
349	F	95.6	Very high	95.2	Very high	19 Å²	19	49.1 Å²	49.1	8%	0.083	27%	0.265	C	S	.	.			trans	-96.2	126.4	174.4	-64.1	-62.4	0	0	0	110.1	G312 V336 L339 Q360 I361 I364	G312-F349 WeakPolarHBondContact O-CD2 3.43Å; V336-F349 HydrophobicContact CG1-CD2 4.11Å; V336-F349 HydrophobicContact CG1-CE2 4.45Å; V336-F349 HydrophobicContact CG2-CD2 4.42Å; V336-F349 HydrophobicContact CG2-CE2 4.23Å; L339-F349 HydrophobicContact CD2-CE2 4.23Å; L339-F349 HydrophobicContact CD2-CZ 4.25Å; F349-Q360 HydrophobicContact CD1-CB 3.65Å; F349-Q360 HydrophobicContact CE1-CB 3.98Å; F349-I361 HydrophobicContact CE1-CG1 4.38Å; F349-I361 HydrophobicContact CE2-CG1 4.36Å; F349-I361 HydrophobicContact CZ-CG1 4.09Å; F349-I364 HydrophobicContact CE1-CG1 4.23Å; F349-I364 HydrophobicContact CZ-CG1 4.46Å
350	K	94.9	Very high	95.2	Very high	175 Å²	175	50.4 Å²	50.4	76%	0.761	27%	0.271	S	S	*	.			trans	-123.7	90.5	177.2	-168.7	176.6	-176.9	179.4	0	108.5	Q360	K350-Q360 PolarHBondContact O-NE2 2.72Å
351	A	92.4	Very high	95	Very high	15 Å²	15	50.6 Å²	50.6	12%	0.124	27%	0.272	C	S	.	.			trans	-121.8	138	-175.8	0	0	0	0	0	111	I356 A357	A351-I356 HydrophobicContact CB-CB 4.17Å; A351-I356 HydrophobicContact CB-CG2 3.77Å; A351-A357 HydrophobicContact CB-CB 3.67Å
352	S	93.5	Very high	94.8	Very high	108 Å²	108	50.9 Å²	50.9	76%	0.755	27%	0.273	S	S	*	.	S	Bend	trans	-81.1	-23	176.1	47.2	0	0	0	0	113.3	I356	S352-I356 WeakPolarHBondContact OG-CD1 3.42Å
353	D	95.2	Very high	94.9	Very high	71 Å²	71	51.6 Å²	51.6	38%	0.38	28%	0.28	S	S	.	.	S	Bend	trans	-145.6	172.2	179	66.1	75.3	0	0	0	112.3	L355 I356 A357	D353-L355 PolarHBondContact O-N 3.35Å; D353-L355 PolarHBondContact OD1-N 3.18Å; D353-I356 PolarHBondContact OD1-N 2.99Å; D353-I356 WeakPolarHBondContact OD2-CD1 3.49Å; D353-I356 VanDerWaalsContact OD2-CG1 3.31Å; D353-I356 WeakPolarHBondContact OD2-CG1 3.2Å; D353-A357 PolarHBondContact O-N 2.93Å; D353-A357 VanDerWaalsContact O-N 3.08Å
354	D	95.5	Very high	94.8	Very high	17 Å²	17	52.3 Å²	52.3	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-30.5	-172.1	-67	-22.7	0	0	0	112.8	R307 R314 L319 L358	R307-D354 IonicContact CZ-OD2 2.73Å; R307-D354 VanDerWaalsContact CZ-OD2 3.3Å; R307-D354 IonicContact NE-OD2 3.52Å; R307-D354 PolarHBondContact NE-OD2 3.49Å; R307-D354 VanDerWaalsContact NH2-CG 3.29Å; R307-D354 IonicContact NH2-OD1 3.86Å; R307-D354 PolarHBondContact NH2-OD1 2.98Å; R307-D354 VanDerWaalsContact NH2-OD1 3.07Å; R307-D354 IonicContact NH2-OD2 2.81Å; R307-D354 PolarHBondContact NH2-OD2 3.17Å; R314-D354 IonicContact CZ-OD1 2.66Å; R314-D354 IonicContact NH1-OD1 3.26Å; R314-D354 PolarHBondContact NH1-OD1 2.98Å; L319-D354 HydrophobicContact CB-CB 4.4Å; L319-D354 HydrophobicContact CD2-CB 3.78Å; D354-L358 PolarHBondContact O-N 3.28Å
355	L	94.7	Very high	94.6	Very high	119 Å²	119	52.2 Å²	52.2	62%	0.623	28%	0.275	S	S	*	.	H	α-helix	trans	-82	-33.4	-179.8	-66.7	-177.1	0	0	0	111.8	D353 A357 L358 A359	D353-L355 PolarHBondContact O-N 3.35Å; D353-L355 PolarHBondContact OD1-N 3.18Å; L355-A357 VanDerWaalsContact C-N 3.31Å; L355-L358 HydrophobicContact CD2-CD2 4.4Å; L355-L358 PolarHBondContact O-N 2.87Å; L355-A359 WeakPolarHBondContact O-CB 3.45Å; L355-A359 PolarHBondContact O-N 3.27Å
356	I	96.7	Very high	94.4	Very high	69 Å²	69	46.7 Å²	46.7	35%	0.354	25%	0.254	S	S	.	.	H	α-helix	trans	-62.9	-41.3	168.6	-68	-179.7	0	0	0	110.2	A351 S352 D353 L358 A359 Q360	A351-I356 HydrophobicContact CB-CB 4.17Å; A351-I356 HydrophobicContact CB-CG2 3.77Å; S352-I356 WeakPolarHBondContact OG-CD1 3.42Å; D353-I356 PolarHBondContact OD1-N 2.99Å; D353-I356 WeakPolarHBondContact OD2-CD1 3.49Å; D353-I356 VanDerWaalsContact OD2-CG1 3.31Å; D353-I356 WeakPolarHBondContact OD2-CG1 3.2Å; I356-L358 VanDerWaalsContact C-N 3.32Å; I356-L358 PolarHBondContact O-N 2.92Å; I356-A359 PolarHBondContact O-N 3.05Å; I356-Q360 WeakPolarHBondContact O-CG 3.47Å; I356-Q360 PolarHBondContact O-N 3.32Å
357	A	94.6	Very high	94.3	Very high	7 Å²	7	44.1 Å²	44.1	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-43.4	174.2	0	0	0	0	0	111.4	L319 A351 D353 L355 Q360 I361	L319-A357 HydrophobicContact CD1-CB 3.86Å; L319-A357 HydrophobicContact CD2-CB 4Å; A351-A357 HydrophobicContact CB-CB 3.67Å; D353-A357 PolarHBondContact O-N 2.93Å; D353-A357 VanDerWaalsContact O-N 3.08Å; L355-A357 VanDerWaalsContact C-N 3.31Å; A357-Q360 PolarHBondContact O-N 3.44Å; A357-I361 WeakPolarHBondContact O-CG1 3.34Å; A357-I361 PolarHBondContact O-N 3.2Å
358	L	94.6	Very high	94.2	Very high	10 Å²	10	49.4 Å²	49.4	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-43	176.6	-175.3	65.3	0	0	0	111.7	P316 L319 T320 D354 L355 I356 Q360 I361 M362 T370 V381	P316-L358 HydrophobicContact CB-CD1 4.2Å; L319-L358 HydrophobicContact CD1-CB 4.14Å; T320-L358 HydrophobicContact CG2-CD1 4.41Å; T320-L358 HydrophobicContact CG2-CD2 3.72Å; D354-L358 PolarHBondContact O-N 3.28Å; L355-L358 HydrophobicContact CD2-CD2 4.4Å; L355-L358 PolarHBondContact O-N 2.87Å; I356-L358 VanDerWaalsContact C-N 3.32Å; I356-L358 PolarHBondContact O-N 2.92Å; L358-Q360 PolarHBondContact O-N 3.47Å; L358-I361 WeakPolarHBondContact O-CB 3.44Å; L358-I361 PolarHBondContact O-N 3.12Å; L358-M362 HydrophobicContact CG-SD 4.21Å; L358-M362 VanDerWaalsContact O-CG 3.28Å; L358-M362 WeakPolarHBondContact O-CG 2.9Å; L358-M362 PolarHBondContact O-N 3.45Å; L358-T370 HydrophobicContact CD1-CG2 3.96Å; L358-V381 HydrophobicContact CD2-CG1 4.4Å
359	A	95.5	Very high	94	Very high	48 Å²	48	50.1 Å²	50.1	40%	0.397	26%	0.259	S	S	.	.	H	α-helix	trans	-61.1	-43.1	176.3	0	0	0	0	0	111.8	L355 I356 I361 M362 T363	L355-A359 WeakPolarHBondContact O-CB 3.45Å; L355-A359 PolarHBondContact O-N 3.27Å; I356-A359 PolarHBondContact O-N 3.05Å; A359-I361 VanDerWaalsContact C-N 3.32Å; A359-I361 PolarHBondContact O-N 3.15Å; A359-M362 WeakPolarHBondContact O-CB 3.16Å; A359-M362 PolarHBondContact O-N 3.36Å; A359-M362 VanDerWaalsContact O-N 3.16Å; A359-T363 WeakPolarHBondContact O-CG2 3.36Å; A359-T363 PolarHBondContact O-N 2.88Å
360	Q	94.9	Very high	93.7	Very high	52 Å²	52	49.4 Å²	49.4	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-38.4	174.8	-68.8	176.5	0	0	0	111.9	F349 K350 I356 A357 L358 M362 T363	F349-Q360 HydrophobicContact CD1-CB 3.65Å; F349-Q360 HydrophobicContact CE1-CB 3.98Å; K350-Q360 PolarHBondContact O-NE2 2.72Å; I356-Q360 WeakPolarHBondContact O-CG 3.47Å; I356-Q360 PolarHBondContact O-N 3.32Å; A357-Q360 PolarHBondContact O-N 3.44Å; L358-Q360 PolarHBondContact O-N 3.47Å; Q360-M362 VanDerWaalsContact C-N 3.35Å; Q360-M362 PolarHBondContact O-N 2.95Å; Q360-T363 PolarHBondContact O-N 2.73Å; Q360-T363 PolarHBondContact O-OG1 3.44Å
361	I	93.5	Very high	93.5	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-46.2	173	-69	165.2	0	0	0	110.3	P316 L319 W332 F349 A357 L358 A359 T363 I364 R365	P316-I361 HydrophobicContact CG-CD1 4.4Å; P316-I361 HydrophobicContact CG-CG2 4.46Å; L319-I361 HydrophobicContact CD1-CD1 3.59Å; W332-I361 HydrophobicContact CH2-CD1 4.26Å; W332-I361 HydrophobicContact CH2-CG1 4.4Å; W332-I361 HydrophobicContact CH2-CG2 3.66Å; W332-I361 HydrophobicContact CZ2-CD1 3.54Å; W332-I361 HydrophobicContact CZ2-CG1 3.84Å; W332-I361 HydrophobicContact CZ2-CG2 3.99Å; F349-I361 HydrophobicContact CE1-CG1 4.38Å; F349-I361 HydrophobicContact CE2-CG1 4.36Å; F349-I361 HydrophobicContact CZ-CG1 4.09Å; A357-I361 WeakPolarHBondContact O-CG1 3.34Å; A357-I361 PolarHBondContact O-N 3.2Å; L358-I361 WeakPolarHBondContact O-CB 3.44Å; L358-I361 PolarHBondContact O-N 3.12Å; A359-I361 VanDerWaalsContact C-N 3.32Å; A359-I361 PolarHBondContact O-N 3.15Å; I361-T363 VanDerWaalsContact C-N 3.26Å; I361-T363 PolarHBondContact O-N 3.04Å; I361-I364 PolarHBondContact O-N 3.19Å; I361-R365 HydrophobicContact CG2-CB 4.45Å; I361-R365 HydrophobicContact CG2-CG 4.15Å; I361-R365 PolarHBondContact O-N 2.87Å
362	M	93.5	Very high	93.4	Very high	7 Å²	7	48.4 Å²	48.4	3%	0.034	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-31.5	178.6	-66.7	170.5	77.6	0	0	112.6	L358 A359 Q360 I364 G366 S367 T370 I371 V381 C383 L387	L358-M362 HydrophobicContact CG-SD 4.21Å; L358-M362 VanDerWaalsContact O-CG 3.28Å; L358-M362 WeakPolarHBondContact O-CG 2.9Å; L358-M362 PolarHBondContact O-N 3.45Å; A359-M362 WeakPolarHBondContact O-CB 3.16Å; A359-M362 PolarHBondContact O-N 3.36Å; A359-M362 VanDerWaalsContact O-N 3.16Å; Q360-M362 VanDerWaalsContact C-N 3.35Å; Q360-M362 PolarHBondContact O-N 2.95Å; M362-I364 PolarHBondContact O-N 3.41Å; M362-G366 CarbonylContact O-C 3.6Å; M362-G366 VanDerWaalsContact O-CA 3.22Å; M362-G366 WeakPolarHBondContact O-CA 3.41Å; M362-G366 PolarHBondContact O-N 2.87Å; M362-S367 VanDerWaalsContact CE-CB 3.43Å; M362-T370 HydrophobicContact CG-CG2 3.73Å; M362-T370 HydrophobicContact SD-CG2 4.41Å; M362-I371 HydrophobicContact CE-CD1 4.28Å; M362-I371 HydrophobicContact CE-CG1 4.24Å; M362-V381 HydrophobicContact CE-CG1 4.39Å; M362-V381 HydrophobicContact SD-CG1 4.44Å; M362-C383 HydrophobicContact CE-CB 3.66Å; M362-L387 HydrophobicContact CB-CD1 3.94Å
363	T	95	Very high	93	Very high	58 Å²	58	43.5 Å²	43.5	36%	0.356	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-22.5	174.8	61.7	0	0	0	0	113.8	A359 Q360 I361 L387 Q390	A359-T363 WeakPolarHBondContact O-CG2 3.36Å; A359-T363 PolarHBondContact O-N 2.88Å; Q360-T363 PolarHBondContact O-N 2.73Å; Q360-T363 PolarHBondContact O-OG1 3.44Å; I361-T363 VanDerWaalsContact C-N 3.26Å; I361-T363 PolarHBondContact O-N 3.04Å; T363-L387 HydrophobicContact CG2-CD1 3.81Å; T363-Q390 PolarHBondContact O-NE2 3.48Å
364	I	92.8	Very high	92.7	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.072	20%	0.202	C	C	.	.	H	α-helix	trans	-100.9	-49	-179.5	-55.9	-48.9	0	0	0	110.7	F348 F349 I361 M362 Q390 L392 L395	F348-I364 HydrophobicContact CE1-CG1 4.2Å; F349-I364 HydrophobicContact CE1-CG1 4.23Å; F349-I364 HydrophobicContact CZ-CG1 4.46Å; I361-I364 PolarHBondContact O-N 3.19Å; M362-I364 PolarHBondContact O-N 3.41Å; I364-Q390 PolarHBondContact O-N 2.96Å; I364-L392 HydrophobicContact CG2-CD2 3.67Å; I364-L395 HydrophobicContact CD1-CD2 3.8Å; I364-L395 HydrophobicContact CG1-CD2 4.43Å; I364-L395 HydrophobicContact CG2-CD2 3.67Å
365	R	91	Very high	92.4	Very high	23 Å²	23	46.6 Å²	46.6	9%	0.087	23%	0.228	C	C	.	.	H	α-helix	trans	-85.7	-13.1	-174.2	-63.5	-52.3	-56.5	148.8	-6.2	114.2	I361	I361-R365 HydrophobicContact CG2-CB 4.45Å; I361-R365 HydrophobicContact CG2-CG 4.15Å; I361-R365 PolarHBondContact O-N 2.87Å
366	G	91.8	Very high	92.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.			trans	89.8	141	-173.4	0	0	0	0	0	111.8	M362 E369 T370 L387	M362-G366 CarbonylContact O-C 3.6Å; M362-G366 VanDerWaalsContact O-CA 3.22Å; M362-G366 WeakPolarHBondContact O-CA 3.41Å; M362-G366 PolarHBondContact O-N 2.87Å; G366-E369 VanDerWaalsContact C-OE2 3.32Å; G366-E369 VanDerWaalsContact CA-OE2 3.26Å; G366-E369 WeakPolarHBondContact CA-OE2 3.17Å; G366-T370 WeakPolarHBondContact O-CB 3.36Å; G366-T370 PolarHBondContact O-N 2.69Å; G366-T370 PolarHBondContact O-OG1 2.79Å; G366-L387 WeakPolarHBondContact CA-O 3.49Å
367	S	92.9	Very high	91.4	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-70.2	-40.7	-178.3	59.4	0	0	0	0	112.3	M362 T370 I371 E386 L387	M362-S367 VanDerWaalsContact CE-CB 3.43Å; S367-T370 PolarHBondContact O-N 2.95Å; S367-I371 WeakPolarHBondContact O-CB 3.43Å; S367-I371 WeakPolarHBondContact O-CD1 3.36Å; S367-I371 WeakPolarHBondContact O-CG1 3.28Å; S367-I371 PolarHBondContact O-N 2.98Å; S367-E386 WeakPolarHBondContact OG-CA 3.18Å; S367-L387 PolarHBondContact N-O 3.21Å; S367-L387 PolarHBondContact OG-N 3.46Å; S367-L387 PolarHBondContact OG-O 3.46Å; S367-L387 VanDerWaalsContact OG-O 3.13Å
368	R	93	Very high	91.1	Very high	183 Å²	183	46.1 Å²	46.1	69%	0.691	24%	0.243	S	C	*	.	H	α-helix	trans	-64.1	-44	-179	-176.8	178.1	175.2	-176.5	-1.6	111.4	I371 Q372	R368-I371 PolarHBondContact O-N 2.88Å; R368-Q372 VanDerWaalsContact O-CB 3.26Å; R368-Q372 WeakPolarHBondContact O-CB 3.49Å; R368-Q372 PolarHBondContact O-N 3.31Å
369	E	91.6	Very high	91	Very high	50 Å²	50	46.9 Å²	46.9	23%	0.234	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-49.8	176.9	-66.4	79.3	178.5	0	0	110.6	G366 I371 Q372 A373	G366-E369 VanDerWaalsContact C-OE2 3.32Å; G366-E369 VanDerWaalsContact CA-OE2 3.26Å; G366-E369 WeakPolarHBondContact CA-OE2 3.17Å; E369-I371 PolarHBondContact O-N 3.08Å; E369-Q372 PolarHBondContact O-N 3.35Å; E369-A373 WeakPolarHBondContact O-CB 3.35Å; E369-A373 PolarHBondContact O-N 3.16Å
370	T	89.2	Confident	90.9	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.018	25%	0.248	C	C	.	.	H	α-helix	trans	-62.5	-42.6	-179.6	-53.6	0	0	0	0	111.5	L358 M362 G366 S367 A373 A374	L358-T370 HydrophobicContact CD1-CG2 3.96Å; M362-T370 HydrophobicContact CG-CG2 3.73Å; M362-T370 HydrophobicContact SD-CG2 4.41Å; G366-T370 WeakPolarHBondContact O-CB 3.36Å; G366-T370 PolarHBondContact O-N 2.69Å; G366-T370 PolarHBondContact O-OG1 2.79Å; S367-T370 PolarHBondContact O-N 2.95Å; T370-A373 PolarHBondContact O-N 3.42Å; T370-A374 VanDerWaalsContact O-CB 3.26Å; T370-A374 WeakPolarHBondContact O-CB 3.23Å; T370-A374 PolarHBondContact O-N 2.75Å
371	I	91.4	Very high	90.9	Very high	53 Å²	53	45.6 Å²	45.6	27%	0.272	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-43.7	176.8	-68.8	164.9	0	0	0	110.7	M362 S367 R368 E369 A373 A374 K375 V381 C383	M362-I371 HydrophobicContact CE-CD1 4.28Å; M362-I371 HydrophobicContact CE-CG1 4.24Å; S367-I371 WeakPolarHBondContact O-CB 3.43Å; S367-I371 WeakPolarHBondContact O-CD1 3.36Å; S367-I371 WeakPolarHBondContact O-CG1 3.28Å; S367-I371 PolarHBondContact O-N 2.98Å; R368-I371 PolarHBondContact O-N 2.88Å; E369-I371 PolarHBondContact O-N 3.08Å; I371-A373 VanDerWaalsContact C-N 3.34Å; I371-A373 PolarHBondContact O-N 3.29Å; I371-A374 PolarHBondContact O-N 3.23Å; I371-K375 PolarHBondContact O-N 3.39Å; I371-K375 VanDerWaalsContact O-N 3.08Å; I371-V381 HydrophobicContact CG1-CB 4.01Å; I371-V381 HydrophobicContact CG1-CG1 4.02Å; I371-C383 HydrophobicContact CD1-CB 4.33Å
372	Q	90.4	Very high	90.9	Very high	117 Å²	117	49 Å²	49	55%	0.547	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-41.8	178.9	-179.4	57.5	46.6	0	0	111.4	R368 E369 K375	R368-Q372 VanDerWaalsContact O-CB 3.26Å; R368-Q372 WeakPolarHBondContact O-CB 3.49Å; R368-Q372 PolarHBondContact O-N 3.31Å; E369-Q372 PolarHBondContact O-N 3.35Å; Q372-K375 WeakPolarHBondContact O-CB 3.05Å
373	A	84.9	Confident	91	Very high	5 Å²	5	50.9 Å²	50.9	4%	0.041	28%	0.276	C	S	.	.	H	α-helix	trans	-67.3	-45.2	175.5	0	0	0	0	0	111.7	E369 T370 I371 K375 T376 F377 H457 D459	E369-A373 WeakPolarHBondContact O-CB 3.35Å; E369-A373 PolarHBondContact O-N 3.16Å; T370-A373 PolarHBondContact O-N 3.42Å; I371-A373 VanDerWaalsContact C-N 3.34Å; I371-A373 PolarHBondContact O-N 3.29Å; A373-K375 PolarHBondContact O-N 3.4Å; A373-K375 VanDerWaalsContact O-N 3.17Å; A373-T376 WeakPolarHBondContact O-CB 3.46Å; A373-T376 PolarHBondContact O-N 3.38Å; A373-T376 PolarHBondContact O-OG1 2.86Å; A373-F377 WeakPolarHBondContact O-CD1 3.48Å; A373-F377 VanDerWaalsContact O-CE1 3.26Å; A373-F377 WeakPolarHBondContact O-CE1 3.37Å; A373-H457 PolarHBondContact O-NE2 3.21Å; A373-D459 HydrophobicContact CB-CB 4.18Å; A373-D459 WeakPolarHBondContact CB-OD2 3.47Å
374	A	89.3	Confident	91	Very high	3 Å²	3	54.4 Å²	54.4	3%	0.025	30%	0.304	C	S	.	.	H	α-helix	trans	-50.1	-41.3	175	0	0	0	0	0	113.4	T370 I371 T376 F377 G378 K379 V381	T370-A374 VanDerWaalsContact O-CB 3.26Å; T370-A374 WeakPolarHBondContact O-CB 3.23Å; T370-A374 PolarHBondContact O-N 2.75Å; I371-A374 PolarHBondContact O-N 3.23Å; A374-T376 PolarHBondContact O-N 3.05Å; A374-F377 VanDerWaalsContact CA-CZ 3.42Å; A374-F377 HydrophobicContact CB-CE1 4.37Å; A374-F377 HydrophobicContact CB-CZ 4.04Å; A374-F377 PolarHBondContact O-N 3.07Å; A374-G378 PolarHBondContact O-N 2.87Å; A374-K379 CarbonylContact C-O 3.59Å; A374-K379 HydrophobicContact CB-CB 4.14Å; A374-K379 PolarHBondContact O-N 3.43Å; A374-V381 HydrophobicContact CB-CB 4.46Å; A374-V381 HydrophobicContact CB-CG2 3.75Å
375	K	89.3	Confident	91.1	Very high	149 Å²	149	62.2 Å²	62.2	65%	0.648	33%	0.332	S	S	*	.	H	α-helix	trans	-59.4	-34.4	177.8	-168.6	177.1	178.7	-179.2	0	112.7	I371 Q372 A373 F377 G378 K379	I371-K375 PolarHBondContact O-N 3.39Å; I371-K375 VanDerWaalsContact O-N 3.08Å; Q372-K375 WeakPolarHBondContact O-CB 3.05Å; A373-K375 PolarHBondContact O-N 3.4Å; A373-K375 VanDerWaalsContact O-N 3.17Å; K375-F377 VanDerWaalsContact C-N 3.27Å; K375-F377 PolarHBondContact O-N 3.13Å; K375-G378 PolarHBondContact O-N 2.65Å; K375-G378 VanDerWaalsContact O-N 3.14Å; K375-K379 WeakPolarHBondContact CA-O 3.26Å; K375-K379 PolarHBondContact N-O 2.91Å
376	T	87.3	Confident	91.3	Very high	78 Å²	78	67.6 Å²	67.6	48%	0.479	36%	0.359	S	S	.	.	H	α-helix	trans	-68.9	-23.2	-176.7	72	0	0	0	0	113.7	A373 A374 H457 P458	A373-T376 WeakPolarHBondContact O-CB 3.46Å; A373-T376 PolarHBondContact O-N 3.38Å; A373-T376 PolarHBondContact O-OG1 2.86Å; A374-T376 PolarHBondContact O-N 3.05Å; T376-H457 PolarHBondContact OG1-CD2 2.81Å; T376-H457 PolarHBondContact OG1-NE2 3.48Å; T376-H457 VanDerWaalsContact OG1-NE2 3.13Å; T376-P458 HydrophobicContact CG2-CG 4.31Å
377	F	82.4	Confident	91.4	Very high	39 Å²	39	68.8 Å²	68.8	17%	0.171	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	25.2	173.2	57	-88.1	0	0	0	112.8	E317 T320 C322 A373 A374 K375 K379 H457	E317-F377 HydrophobicContact CB-CD2 4.14Å; E317-F377 HydrophobicContact CB-CE1 4.44Å; E317-F377 HydrophobicContact CB-CE2 3.85Å; E317-F377 HydrophobicContact CB-CZ 3.95Å; T320-F377 WeakPolarHBondContact OG1-CE2 3.5Å; C322-F377 HydrophobicContact CB-CD2 4.08Å; A373-F377 WeakPolarHBondContact O-CD1 3.48Å; A373-F377 VanDerWaalsContact O-CE1 3.26Å; A373-F377 WeakPolarHBondContact O-CE1 3.37Å; A374-F377 VanDerWaalsContact CA-CZ 3.42Å; A374-F377 HydrophobicContact CB-CE1 4.37Å; A374-F377 HydrophobicContact CB-CZ 4.04Å; A374-F377 PolarHBondContact O-N 3.07Å; K375-F377 VanDerWaalsContact C-N 3.27Å; K375-F377 PolarHBondContact O-N 3.13Å; F377-K379 HydrophobicContact CD2-CB 4.12Å; F377-K379 HydrophobicContact CD2-CG 3.52Å; F377-K379 HydrophobicContact CE2-CB 3.88Å; F377-K379 HydrophobicContact CE2-CG 3.5Å; F377-H457 AromaticContact CD1-CD2 3.58Å; F377-H457 AromaticContact CD1-CE1 3.78Å; F377-H457 AromaticContact CD1-NE2 2.9Å; F377-H457 WeakPolarHBondContact CD1-NE2 3.25Å; F377-H457 AromaticContact CE1-CE1 3.47Å; F377-H457 VanDerWaalsContact CE1-CE1 3.47Å; F377-H457 WeakPolarHBondContact CE1-CE1 3.32Å; F377-H457 AromaticContact CE1-NE2 3.08Å; F377-H457 WeakPolarHBondContact CE1-NE2 3.46Å
378	G	89.3	Confident	91.5	Very high	68 Å²	68	73.5 Å²	73.5	70%	0.701	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	27.6	169.3	0	0	0	0	0	114.6	A374 K375	A374-G378 PolarHBondContact O-N 2.87Å; K375-G378 PolarHBondContact O-N 2.65Å; K375-G378 VanDerWaalsContact O-N 3.14Å
379	K	92.2	Very high	91.4	Very high	27 Å²	27	70.5 Å²	70.5	12%	0.117	38%	0.384	C	S	.	.			trans	-113.5	128	176.2	-61.5	-63.3	178.9	158.5	0	111.5	Q303 T320 K321 A374 K375 F377	Q303-K379 VanDerWaalsContact CD-NZ 3.28Å; T320-K379 WeakPolarHBondContact O-CD 3.49Å; T320-K379 WeakPolarHBondContact O-CE 3.4Å; T320-K379 PolarHBondContact O-NZ 3.39Å; K321-K379 VanDerWaalsContact C-NZ 3.29Å; K321-K379 WeakPolarHBondContact O-CE 3.23Å; K321-K379 PolarHBondContact O-NZ 3.09Å; A374-K379 CarbonylContact C-O 3.59Å; A374-K379 HydrophobicContact CB-CB 4.14Å; A374-K379 PolarHBondContact O-N 3.43Å; K375-K379 WeakPolarHBondContact CA-O 3.26Å; K375-K379 PolarHBondContact N-O 2.91Å; F377-K379 HydrophobicContact CD2-CB 4.12Å; F377-K379 HydrophobicContact CD2-CG 3.52Å; F377-K379 HydrophobicContact CE2-CB 3.88Å; F377-K379 HydrophobicContact CE2-CG 3.5Å
380	A	94.3	Very high	91.2	Very high	52 Å²	52	71.5 Å²	71.5	43%	0.43	39%	0.389	S	S	.	.			trans	-94.8	114.5	171.5	0	0	0	0	0	108.8	Y288 L289	Y288-A380 HydrophobicContact CD2-CB 4.47Å; Y288-A380 HydrophobicContact CE2-CB 3.55Å; L289-A380 HydrophobicContact CD2-CB 3.78Å
381	V	93.8	Very high	91.3	Very high	20 Å²	20	75.8 Å²	75.8	12%	0.121	41%	0.411	C	S	.	.			trans	-113	133.3	176.6	178	0	0	0	0	107.9	T320 L358 M362 I371 A374	T320-V381 HydrophobicContact CG2-CG2 4.13Å; L358-V381 HydrophobicContact CD2-CG1 4.4Å; M362-V381 HydrophobicContact CE-CG1 4.39Å; M362-V381 HydrophobicContact SD-CG1 4.44Å; I371-V381 HydrophobicContact CG1-CB 4.01Å; I371-V381 HydrophobicContact CG1-CG1 4.02Å; A374-V381 HydrophobicContact CB-CB 4.46Å; A374-V381 HydrophobicContact CB-CG2 3.75Å
382	V	94.8	Very high	91	Very high	78 Å²	78	74.4 Å²	74.4	47%	0.473	40%	0.404	S	S	.	.			trans	-119.3	131	175.6	-179.4	0	0	0	0	107.6	L289	L289-V382 HydrophobicContact CD2-CG2 4.02Å
383	C	94.5	Very high	90.8	Very high	45 Å²	45	74.9 Å²	74.9	30%	0.304	40%	0.401	S	S	.	.			trans	-116.6	130.7	173.2	-155.6	0	0	0	0	108.2	M362 I371 R385	M362-C383 HydrophobicContact CE-CB 3.66Å; I371-C383 HydrophobicContact CD1-CB 4.33Å; C383-R385 PolarHBondContact O-N 3.25Å; C383-R385 PolarHBondContact SG-O 2.76Å
384	S	94.6	Very high	91	Very high	133 Å²	133	78.6 Å²	78.6	93%	0.93	42%	0.423	S	S	*	.	S	Bend	trans	-67.4	-22	-179.8	53.2	0	0	0	0	113.2
385	R	94.7	Very high	91	Very high	178 Å²	178	79.4 Å²	79.4	67%	0.672	43%	0.427	S	S	*	.	S	Bend	trans	-134.1	134.4	177.8	-173.7	176.7	67.5	-178.1	0.9	109.4	C383 L387	C383-R385 PolarHBondContact O-N 3.25Å; C383-R385 PolarHBondContact SG-O 2.76Å; R385-L387 PolarHBondContact O-N 2.87Å
386	E	96.2	Very high	91.1	Very high	136 Å²	136	72.9 Å²	72.9	64%	0.636	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-67.5	124.2	170.2	-171.3	168.2	-177.2	0	0	109.8	S367	S367-E386 WeakPolarHBondContact OG-CA 3.18Å
387	L	93.4	Very high	91.2	Very high	24 Å²	24	72.4 Å²	72.4	13%	0.126	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-102.8	122.6	172.8	-55.7	174.3	0	0	0	108.2	M362 T363 G366 S367 R385	M362-L387 HydrophobicContact CB-CD1 3.94Å; T363-L387 HydrophobicContact CG2-CD1 3.81Å; G366-L387 WeakPolarHBondContact CA-O 3.49Å; S367-L387 PolarHBondContact N-O 3.21Å; S367-L387 PolarHBondContact OG-N 3.46Å; S367-L387 PolarHBondContact OG-O 3.46Å; S367-L387 VanDerWaalsContact OG-O 3.13Å; R385-L387 PolarHBondContact O-N 2.87Å
388	P	94.4	Very high	91.7	Very high	102 Å²	102	74.2 Å²	74.2	66%	0.662	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-71.7	151.4	178.6	30	-34.5	0	0	0	111
389	R	90.9	Very high	91.8	Very high	121 Å²	121	73 Å²	73	46%	0.457	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.1	138.1	171.6	174.9	176	169.2	175.6	-1.8	110.3
390	Q	88.9	Confident	91.7	Very high	71 Å²	71	75.8 Å²	75.8	33%	0.332	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-92	149.1	172.1	-59.2	-166	28.1	0	0	111.5	T363 I364	T363-Q390 PolarHBondContact O-NE2 3.48Å; I364-Q390 PolarHBondContact O-N 2.96Å
391	D	89.8	Confident	91.3	Very high	93 Å²	93	76.4 Å²	76.4	50%	0.497	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-74.4	124.1	164.3	-177.9	-95.5	0	0	0	109.8	R393 T394 L395	D391-R393 WeakPolarHBondContact OD1-CA 3.5Å; D391-R393 VanDerWaalsContact OD1-CB 3.3Å; D391-R393 WeakPolarHBondContact OD1-CB 3.47Å; D391-R393 PolarHBondContact OD1-N 3.04Å; D391-T394 PolarHBondContact OD1-N 3.31Å; D391-T394 PolarHBondContact OD1-OG1 2.93Å; D391-L395 WeakPolarHBondContact O-CB 3.4Å; D391-L395 PolarHBondContact O-N 2.83Å
392	L	86.8	Confident	90	Very high	24 Å²	24	81.3 Å²	81.3	13%	0.126	43%	0.427	C	S	.	.	H	α-helix	trans	-73.7	-28.6	-172.7	-68.7	179	0	0	0	112.6	I364 L395 C396 L466	I364-L392 HydrophobicContact CG2-CD2 3.67Å; L392-L395 HydrophobicContact CD2-CD2 4.32Å; L392-C396 VanDerWaalsContact O-CB 3.28Å; L392-C396 WeakPolarHBondContact O-CB 3.22Å; L392-C396 PolarHBondContact O-N 3.49Å; L392-C396 PolarHBondContact O-SG 3.07Å; L392-L466 HydrophobicContact CD1-CD1 3.86Å; L392-L466 HydrophobicContact CD1-CD2 3.41Å; L392-L466 VanDerWaalsContact CD1-CD2 3.41Å; L392-L466 HydrophobicContact CD1-CG 4.22Å
393	R	86.1	Confident	87.8	Confident	127 Å²	127	88.2 Å²	88.2	48%	0.479	44%	0.444	S	S	.	.	H	α-helix	trans	-67.6	-57	175.9	170.6	-172.6	-67.9	-80.2	5.4	109.1	D391 L395 C396 E397	D391-R393 WeakPolarHBondContact OD1-CA 3.5Å; D391-R393 VanDerWaalsContact OD1-CB 3.3Å; D391-R393 WeakPolarHBondContact OD1-CB 3.47Å; D391-R393 PolarHBondContact OD1-N 3.04Å; R393-L395 VanDerWaalsContact C-N 3.27Å; R393-L395 PolarHBondContact O-N 3.16Å; R393-C396 PolarHBondContact O-N 3.48Å; R393-C396 VanDerWaalsContact O-N 3.15Å; R393-E397 VanDerWaalsContact CG-CD 3.42Å; R393-E397 HydrophobicContact CG-CG 4.32Å; R393-E397 WeakPolarHBondContact CG-OE1 3.46Å; R393-E397 IonicContact NH1-OE1 3.86Å; R393-E397 PolarHBondContact NH1-OE1 2.95Å; R393-E397 VanDerWaalsContact NH1-OE1 3.12Å; R393-E397 WeakPolarHBondContact O-CB 3.26Å; R393-E397 WeakPolarHBondContact O-CG 3.34Å; R393-E397 PolarHBondContact O-N 3.46Å
394	T	88.2	Confident	85.3	Confident	82 Å²	82	90.9 Å²	90.9	50%	0.503	46%	0.463	S	S	.	.	H	α-helix	trans	-56.5	-43.2	179.9	-55.9	0	0	0	0	111.2	D391 T398	D391-T394 PolarHBondContact OD1-N 3.31Å; D391-T394 PolarHBondContact OD1-OG1 2.93Å; T394-T398 WeakPolarHBondContact O-CB 3.42Å; T394-T398 PolarHBondContact O-N 3.13Å; T394-T398 PolarHBondContact O-OG1 2.91Å
395	L	89.3	Confident	82.6	Confident	21 Å²	21	90.9 Å²	90.9	11%	0.11	46%	0.464	C	S	.	.	H	α-helix	trans	-59.2	-52.7	176	174.1	61.3	0	0	0	112	F348 I364 D391 L392 R393 L399	F348-L395 HydrophobicContact CZ-CD2 4.32Å; I364-L395 HydrophobicContact CD1-CD2 3.8Å; I364-L395 HydrophobicContact CG1-CD2 4.43Å; I364-L395 HydrophobicContact CG2-CD2 3.67Å; D391-L395 WeakPolarHBondContact O-CB 3.4Å; D391-L395 PolarHBondContact O-N 2.83Å; L392-L395 HydrophobicContact CD2-CD2 4.32Å; R393-L395 VanDerWaalsContact C-N 3.27Å; R393-L395 PolarHBondContact O-N 3.16Å; L395-L399 HydrophobicContact CD1-CD1 3.51Å; L395-L399 HydrophobicContact CD1-CG 3.93Å; L395-L399 HydrophobicContact CG-CD1 3.95Å; L395-L399 WeakPolarHBondContact O-CB 3.47Å; L395-L399 VanDerWaalsContact O-CG 3.24Å; L395-L399 WeakPolarHBondContact O-CG 3.32Å; L395-L399 PolarHBondContact O-N 3.43Å
396	C	91.4	Very high	80.2	Confident	11 Å²	11	85.9 Å²	85.9	7%	0.074	46%	0.46	C	S	.	.	H	α-helix	trans	-64.2	-47.8	-177.5	-74.5	0	0	0	0	111.9	L342 L392 R393 T398 L399 R400	L342-C396 HydrophobicContact CB-CB 4.04Å; L392-C396 VanDerWaalsContact O-CB 3.28Å; L392-C396 WeakPolarHBondContact O-CB 3.22Å; L392-C396 PolarHBondContact O-N 3.49Å; L392-C396 PolarHBondContact O-SG 3.07Å; R393-C396 PolarHBondContact O-N 3.48Å; R393-C396 VanDerWaalsContact O-N 3.15Å; C396-T398 VanDerWaalsContact C-N 3.34Å; C396-T398 PolarHBondContact O-N 3.2Å; C396-L399 PolarHBondContact O-N 2.82Å; C396-R400 VanDerWaalsContact O-CB 3.27Å; C396-R400 WeakPolarHBondContact O-CB 3.41Å; C396-R400 PolarHBondContact O-N 2.85Å
397	E	89.8	Confident	77.3	Confident	69 Å²	69	86.6 Å²	86.6	32%	0.322	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-44	179.3	-71.2	170.3	179.3	0	0	111	R393 R400 G401 Q402	R393-E397 VanDerWaalsContact CG-CD 3.42Å; R393-E397 HydrophobicContact CG-CG 4.32Å; R393-E397 WeakPolarHBondContact CG-OE1 3.46Å; R393-E397 IonicContact NH1-OE1 3.86Å; R393-E397 PolarHBondContact NH1-OE1 2.95Å; R393-E397 VanDerWaalsContact NH1-OE1 3.12Å; R393-E397 WeakPolarHBondContact O-CB 3.26Å; R393-E397 WeakPolarHBondContact O-CG 3.34Å; R393-E397 PolarHBondContact O-N 3.46Å; E397-R400 PolarHBondContact O-N 3.11Å; E397-G401 PolarHBondContact O-N 2.84Å; E397-G401 VanDerWaalsContact O-N 3.16Å; E397-Q402 PolarHBondContact O-N 3.33Å
398	T	91.8	Very high	74.7	Confident	77 Å²	77	91.1 Å²	91.1	47%	0.472	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-47.2	175.8	-60.5	0	0	0	0	111.7	T394 C396 R400 G401	T394-T398 WeakPolarHBondContact O-CB 3.42Å; T394-T398 PolarHBondContact O-N 3.13Å; T394-T398 PolarHBondContact O-OG1 2.91Å; C396-T398 VanDerWaalsContact C-N 3.34Å; C396-T398 PolarHBondContact O-N 3.2Å; T398-R400 VanDerWaalsContact C-N 3.34Å; T398-R400 PolarHBondContact O-N 3.5Å; T398-G401 PolarHBondContact O-N 3.16Å
399	L	93	Very high	71.9	Confident	41 Å²	41	92.3 Å²	92.3	22%	0.215	50%	0.502	C	S	.	.	H	α-helix	trans	-69.4	-32	-178.9	-71.3	176	0	0	0	112.9	S343 R345 F348 L395 C396 G401	S343-L399 CarbonylContact O-C 3.32Å; S343-L399 VanDerWaalsContact O-C 3.32Å; R345-L399 HydrophobicContact CG-CB 4.19Å; R345-L399 HydrophobicContact CG-CD1 4.42Å; R345-L399 VanDerWaalsContact CZ-O 3.29Å; R345-L399 PolarHBondContact NE-O 3.31Å; R345-L399 PolarHBondContact NH2-O 2.64Å; F348-L399 HydrophobicContact CE2-CD1 3.78Å; F348-L399 HydrophobicContact CZ-CD1 4.15Å; L395-L399 HydrophobicContact CD1-CD1 3.51Å; L395-L399 HydrophobicContact CD1-CG 3.93Å; L395-L399 HydrophobicContact CG-CD1 3.95Å; L395-L399 WeakPolarHBondContact O-CB 3.47Å; L395-L399 VanDerWaalsContact O-CG 3.24Å; L395-L399 WeakPolarHBondContact O-CG 3.32Å; L395-L399 PolarHBondContact O-N 3.43Å; C396-L399 PolarHBondContact O-N 2.82Å; L399-G401 PolarHBondContact O-N 3.28Å
400	R	90.1	Very high	69.1	Low	86 Å²	86	94.2 Å²	94.2	33%	0.325	52%	0.518	S	S	.	.	H	α-helix	trans	-76.8	-12.9	178.1	-152.8	-177.3	-154.5	-108.6	-3	112.7	L142 L342 S343 C396 E397 T398	L142-R400 PolarHBondContact O-NH2 2.95Å; L342-R400 WeakPolarHBondContact O-CD 3.16Å; S343-R400 WeakPolarHBondContact O-CA 3.39Å; S343-R400 PolarHBondContact O-N 2.96Å; C396-R400 VanDerWaalsContact O-CB 3.27Å; C396-R400 WeakPolarHBondContact O-CB 3.41Å; C396-R400 PolarHBondContact O-N 2.85Å; E397-R400 PolarHBondContact O-N 3.11Å; T398-R400 VanDerWaalsContact C-N 3.34Å; T398-R400 PolarHBondContact O-N 3.5Å
401	G	84.6	Confident	66.5	Low	65 Å²	65	97.1 Å²	97.1	67%	0.67	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	17.8	-179.7	0	0	0	0	0	113.9	E397 T398 L399 R403	E397-G401 PolarHBondContact O-N 2.84Å; E397-G401 VanDerWaalsContact O-N 3.16Å; T398-G401 PolarHBondContact O-N 3.16Å; L399-G401 PolarHBondContact O-N 3.28Å; G401-R403 PolarHBondContact O-N 3.31Å
402	Q	66.1	Low	64.1	Low	124 Å²	124	98.3 Å²	98.3	58%	0.579	55%	0.554	S	S	*	*			trans	-91.8	80.3	171.4	-67	-160.8	-38.2	0	0	109	E397	E397-Q402 PolarHBondContact O-N 3.33Å
403	R	49	Very low	61.6	Low	222 Å²	222	106.4 Å²	106.4	84%	0.838	59%	0.591	S	S	*	*			trans	-82.5	120.7	155.9	-83.1	-173.4	174.9	-174.3	-2.4	107.4	G401 S405	G401-R403 PolarHBondContact O-N 3.31Å; R403-S405 PolarHBondContact O-N 3.19Å
404	S	43	Very low	59.1	Low	101 Å²	101	105.2 Å²	105.2	71%	0.706	61%	0.608	S	S	*	*			trans	-53.5	130	163.1	24.6	0	0	0	0	109.1	A406	S404-A406 PolarHBondContact O-N 2.81Å
405	S	37.3	Very low	56.3	Low	134 Å²	134	105.4 Å²	105.4	94%	0.937	63%	0.626	S	S	*	*	S	Bend	trans	-71.8	48	170.2	175.8	0	0	0	0	111.4	R403	R403-S405 PolarHBondContact O-N 3.19Å
406	A	43.3	Very low	53.3	Low	72 Å²	72	107.9 Å²	107.9	60%	0.595	66%	0.657	S	S	*	*			trans	-136.4	69	179.2	0	0	0	0	0	108.4	S404	S404-A406 PolarHBondContact O-N 2.81Å
407	D	37.1	Very low	50.3	Low	152 Å²	152	116.1 Å²	116.1	81%	0.813	69%	0.694	S	S	*	*			trans	179.1	65.5	151.5	-92.9	-18.2	0	0	0	108.1
408	V	38.5	Very low	47.3	Very low	118 Å²	118	118.8 Å²	118.8	72%	0.715	72%	0.716	S	S	*	*			trans	-128.4	72.3	153.5	-172.5	0	0	0	0	105.8	M410	V408-M410 HydrophobicContact CG1-CE 4.36Å; V408-M410 HydrophobicContact CG1-CG 4.36Å; V408-M410 PolarHBondContact O-N 3.35Å
409	T	34.8	Very low	44.2	Very low	128 Å²	128	120.7 Å²	120.7	79%	0.785	73%	0.732	S	S	*	*			trans	-66.3	97.1	154.4	38	0	0	0	0	106.8	V411	T409-V411 PolarHBondContact O-N 3.21Å
410	M	32.5	Very low	41.1	Very low	160 Å²	160	123.1 Å²	123.1	79%	0.788	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-48	118.7	161.9	-67.9	-102.7	170.9	0	0	108.4	V408 P412	V408-M410 HydrophobicContact CG1-CE 4.36Å; V408-M410 HydrophobicContact CG1-CG 4.36Å; V408-M410 PolarHBondContact O-N 3.35Å; M410-P412 WeakPolarHBondContact O-CD 3.31Å
411	V	34.6	Very low	38.2	Very low	133 Å²	133	122.9 Å²	122.9	81%	0.806	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-74.3	122.8	164.5	-177.9	0	0	0	0	106.6	T409	T409-V411 PolarHBondContact O-N 3.21Å
412	P	38.3	Very low	35.5	Very low	118 Å²	118	130.5 Å²	130.5	77%	0.766	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-82.1	125.5	165.6	5.5	12.7	0	0	0	108.9	M410	M410-P412 WeakPolarHBondContact O-CD 3.31Å
413	E	35.8	Very low	33.7	Very low	194 Å²	194	134.3 Å²	134.3	91%	0.907	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71	127	159.9	-74.2	-174.4	146.6	0	0	109.8
414	A	33	Very low	32.7	Very low	102 Å²	102	130.4 Å²	130.4	84%	0.843	79%	0.787	S	S	*	*			trans	-161.7	129.8	146.1	0	0	0	0	0	108.8
415	G	28.7	Very low	32	Very low	86 Å²	86	131.2 Å²	131.2	89%	0.887	79%	0.788	S	S	*	*			trans	-82	-174.1	-175	0	0	0	0	0	115.6
416	G	26.5	Very low	31.5	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	78%	0.779	S	S	*	*			trans	116.7	106	160.2	0	0	0	0	0	116.8
417	E	28.3	Very low	30.7	Very low	184 Å²	184	136 Å²	136	86%	0.86	79%	0.788	S	S	*	*			trans	75.9	111.8	139.7	-62.8	-176.6	168.4	0	0	123
418	T	27.5	Very low	30.2	Very low	125 Å²	125	136.3 Å²	136.3	77%	0.767	79%	0.79	S	S	*	*			trans	27.4	118.6	132.8	58.1	0	0	0	0	121
419	S	27	Very low	29.7	Very low	117 Å²	117	139.1 Å²	139.1	82%	0.818	80%	0.795	S	S	*	*				152	145.4	101.7	62.5	0	0	0	0	114.1
420	A	28.1	Very low	29.4	Very low	91 Å²	91	139.3 Å²	139.3	75%	0.752	80%	0.796	S	S	*	*			trans	68.7	105.5	149.1	0	0	0	0	0	122.2
421	A	27.9	Very low	29.5	Very low	81 Å²	81	137 Å²	137	67%	0.669	79%	0.793	S	S	*	*				92.9	123.6	110.3	0	0	0	0	0	121.4
422	R	28.6	Very low	29.2	Very low	225 Å²	225	137 Å²	137	85%	0.849	79%	0.793	S	S	*	*			trans	76.3	144.9	144.6	-66.9	167.6	-176.7	-162.7	2.7	116.3
423	R	28.3	Very low	28.6	Very low	205 Å²	205	142.7 Å²	142.7	77%	0.774	80%	0.8	S	S	*	*			cis	179.1	141.7	-14.1	-116.2	-176.8	-166.7	-178.6	2.7	103.4
424	N	27.1	Very low	28.1	Very low	139 Å²	139	145.3 Å²	145.3	74%	0.743	80%	0.801	S	S	*	*			trans	54.3	142.8	145.9	-71.5	11.2	0	0	0	118.4
425	T	28.6	Very low	28	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.724	80%	0.8	S	S	*	*			cis	-175.7	130.7	29.1	12.3	0	0	0	0	103.7
426	D	26.3	Very low	27.9	Very low	141 Å²	141	150.3 Å²	150.3	75%	0.754	80%	0.801	S	S	*	*				67.5	130	90.1	-122.4	10	0	0	0	116
427	Q	27.3	Very low	27.9	Very low	167 Å²	167	150.4 Å²	150.4	78%	0.78	80%	0.802	S	S	*	*			trans	84.1	112.8	162.3	-54.1	-177.1	14.5	0	0	117.6
428	D	26.5	Very low	27.9	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	80%	0.799	S	S	*	*				88.8	150.9	65.6	-152	10.6	0	0	0	112.3
429	E	27.6	Very low	28.2	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	81%	0.805	S	S	*	*			trans	103.1	107.8	173.6	-52.5	-152.1	146.1	0	0	119.2
430	T	29.4	Very low	28.2	Very low	132 Å²	132	153 Å²	153	81%	0.81	81%	0.807	S	S	*	*			trans	-77.9	151.2	148.4	17.9	0	0	0	0	109
431	P	35	Very low	28.1	Very low	112 Å²	112	155.6 Å²	155.6	73%	0.727	81%	0.808	S	S	*	*				-150.5	139.8	104.7	32.7	-13.1	0	0	0	116.6
432	T	28.1	Very low	28.1	Very low	131 Å²	131	157.7 Å²	157.7	80%	0.804	81%	0.813	S	S	*	*			trans	24.1	114.4	132.7	-16.1	0	0	0	0	120.1
433	R	26	Very low	28.4	Very low	239 Å²	239	155.6 Å²	155.6	90%	0.902	81%	0.813	S	S	*	*				-176.1	129.9	128.4	-112.4	174.3	176.1	-176.6	-0.8	112.9
434	W	25.3	Very low	28.4	Very low	248 Å²	248	156.1 Å²	156.1	94%	0.939	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.3	135.1	166.9	-73.5	49.9	0	0	0	109.4
435	P	29.2	Very low	28.5	Very low	125 Å²	125	153 Å²	153	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.1	144.3	166.5	-0.2	19.4	0	0	0	112.2
436	N	27.5	Very low	28.5	Very low	169 Å²	169	156 Å²	156	90%	0.904	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-81.3	142.5	173.8	-75.2	-40.3	0	0	0	112.5
437	G	26.5	Very low	28.9	Very low	75 Å²	75	156.1 Å²	156.1	77%	0.773	82%	0.82	S	S	*	*			trans	88.7	150.5	151.6	0	0	0	0	0	117.4
438	P	28.9	Very low	29.1	Very low	124 Å²	124	152.5 Å²	152.5	81%	0.805	81%	0.812	S	S	*	*			cis	-129.1	160.7	35	36.3	-19.4	0	0	0	117
439	Q	32.3	Very low	29.5	Very low	191 Å²	191	151.2 Å²	151.2	89%	0.893	80%	0.804	S	S	*	*			trans	-59.9	136.9	164.7	-82.9	165.5	-57.4	0	0	111.7
440	L	27.6	Very low	29.6	Very low	166 Å²	166	148.7 Å²	148.7	87%	0.869	80%	0.8	S	S	*	*			trans	-140.7	116.2	154	-114.8	105.1	0	0	0	109.9
441	D	26.5	Very low	30	Very low	145 Å²	145	146.4 Å²	146.4	78%	0.775	79%	0.786	S	S	*	*			trans	-68.2	135.9	162.4	-81	-42.7	0	0	0	110.1
442	T	27.2	Very low	29.9	Very low	125 Å²	125	144.7 Å²	144.7	77%	0.767	79%	0.789	S	S	*	*				167.7	121.4	115.9	36.1	0	0	0	0	111.8
443	H	34.3	Very low	30.3	Very low	181 Å²	181	142.5 Å²	142.5	84%	0.838	78%	0.779	S	S	*	*			trans	34.3	107.8	150	-74.4	-80.9	0	0	0	119.8
444	K	29.1	Very low	31	Very low	216 Å²	216	142.5 Å²	142.5	94%	0.939	78%	0.779	S	S	*	*			trans	-165.8	116.3	144.1	-105.3	160.2	-168.9	-177.1	0	111.8
445	G	30.1	Very low	31.8	Very low	72 Å²	72	139.4 Å²	139.4	74%	0.742	78%	0.775	S	S	*	*			trans	68.4	66	154.1	0	0	0	0	0	117.6	F447	G445-F447 PolarHBondContact O-N 3.03Å; G445-F447 VanDerWaalsContact O-N 3.14Å
446	E	28.4	Very low	32.5	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	76%	0.755	S	S	*	*			trans	-64.2	112.4	164.9	-72.7	-176.2	154.4	0	0	110.4	P448	E446-P448 VanDerWaalsContact C-CD 3.43Å; E446-P448 VanDerWaalsContact O-CD 3.23Å; E446-P448 WeakPolarHBondContact O-CD 3.24Å
447	F	34.4	Very low	33.6	Very low	143 Å²	143	130 Å²	130	63%	0.627	72%	0.719	S	S	*	*			trans	-97.6	88.5	152.4	-83.6	-87	0	0	0	107.9	G445 L449	G445-F447 PolarHBondContact O-N 3.03Å; G445-F447 VanDerWaalsContact O-N 3.14Å; F447-L449 VanDerWaalsContact C-N 3.32Å; F447-L449 PolarHBondContact O-N 2.93Å
448	P	31.2	Very low	34.2	Very low	92 Å²	92	128.9 Å²	128.9	60%	0.597	70%	0.698	S	S	*	*			trans	-78.2	92.6	168.7	31.8	-27.2	0	0	0	106.9	E446 V450	E446-P448 VanDerWaalsContact C-CD 3.43Å; E446-P448 VanDerWaalsContact O-CD 3.23Å; E446-P448 WeakPolarHBondContact O-CD 3.24Å; P448-V450 HydrophobicContact CB-CG2 3.95Å; P448-V450 PolarHBondContact O-N 3.04Å
449	L	35.6	Very low	34.6	Very low	130 Å²	130	123.8 Å²	123.8	68%	0.681	66%	0.664	S	S	*	*			trans	-74.8	60.6	149.2	-92.3	160.2	0	0	0	107.7	F447 V451	F447-L449 VanDerWaalsContact C-N 3.32Å; F447-L449 PolarHBondContact O-N 2.93Å; L449-V451 HydrophobicContact CD2-CG2 4.37Å; L449-V451 PolarHBondContact O-N 2.95Å; L449-V451 VanDerWaalsContact O-N 3.09Å
450	V	30.1	Very low	35	Very low	124 Å²	124	114.8 Å²	114.8	75%	0.752	62%	0.622	S	S	*	*			trans	-79.8	87.6	162.7	179.8	0	0	0	0	105.4	P448 G452	P448-V450 HydrophobicContact CB-CG2 3.95Å; P448-V450 PolarHBondContact O-N 3.04Å; V450-G452 VanDerWaalsContact C-N 3.34Å; V450-G452 PolarHBondContact O-N 3.44Å
451	V	35.8	Very low	35.6	Very low	84 Å²	84	111.6 Å²	111.6	51%	0.509	60%	0.603	S	S	.	*			trans	-69.6	100.6	164.5	-177.5	0	0	0	0	106	L449 S453	L449-V451 HydrophobicContact CD2-CG2 4.37Å; L449-V451 PolarHBondContact O-N 2.95Å; L449-V451 VanDerWaalsContact O-N 3.09Å; V451-S453 PolarHBondContact O-N 3.26Å
452	G	34.9	Very low	36.5	Very low	76 Å²	76	110 Å²	110	78%	0.784	59%	0.586	S	S	*	*			trans	-66.2	81.7	163.7	0	0	0	0	0	109.7	V450	V450-G452 VanDerWaalsContact C-N 3.34Å; V450-G452 PolarHBondContact O-N 3.44Å
453	S	34.7	Very low	37.5	Very low	86 Å²	86	104.9 Å²	104.9	60%	0.601	55%	0.553	S	S	*	*	S	Bend	trans	-165	135.6	153.4	-149.6	0	0	0	0	110	V451 H455	V451-S453 PolarHBondContact O-N 3.26Å; S453-H455 PolarHBondContact O-N 2.86Å
454	R	41.7	Very low	38	Very low	238 Å²	238	99.4 Å²	99.4	90%	0.898	53%	0.528	S	S	*	.	S	Bend	trans	-62.1	129	-170.5	-67	174.5	179.6	-178.9	-0.9	110.6
455	H	41.2	Very low	38.8	Very low	184 Å²	184	94.2 Å²	94.2	85%	0.852	51%	0.507	S	S	*	.			trans	86.4	72	172.1	-52.3	-10.3	0	0	0	116.4	S453	S453-H455 PolarHBondContact O-N 2.86Å
456	V	45.6	Very low	39.9	Very low	67 Å²	67	93.4 Å²	93.4	41%	0.406	49%	0.486	S	S	.	.			trans	-74.7	134	156.6	-178.9	0	0	0	0	108.7
457	H	50.5	Low	41.2	Very low	28 Å²	28	85.1 Å²	85.1	13%	0.13	45%	0.447	C	S	.	.			trans	-80.6	140	-169.4	-174.4	-95.8	0	0	0	112.7	A373 T376 F377 D459 T460 Q461	A373-H457 PolarHBondContact O-NE2 3.21Å; T376-H457 PolarHBondContact OG1-CD2 2.81Å; T376-H457 PolarHBondContact OG1-NE2 3.48Å; T376-H457 VanDerWaalsContact OG1-NE2 3.13Å; F377-H457 AromaticContact CD1-CD2 3.58Å; F377-H457 AromaticContact CD1-CE1 3.78Å; F377-H457 AromaticContact CD1-NE2 2.9Å; F377-H457 WeakPolarHBondContact CD1-NE2 3.25Å; F377-H457 AromaticContact CE1-CE1 3.47Å; F377-H457 VanDerWaalsContact CE1-CE1 3.47Å; F377-H457 WeakPolarHBondContact CE1-CE1 3.32Å; F377-H457 AromaticContact CE1-NE2 3.08Å; F377-H457 WeakPolarHBondContact CE1-NE2 3.46Å; H457-D459 PolarHBondContact O-N 3.13Å; H457-T460 WeakPolarHBondContact O-CB 3.43Å; H457-T460 PolarHBondContact O-N 2.85Å; H457-T460 VanDerWaalsContact O-N 3.1Å; H457-Q461 PolarHBondContact O-N 3.34Å
458	P	39.4	Very low	41.6	Very low	53 Å²	53	83.4 Å²	83.4	34%	0.344	44%	0.44	S	S	.	.	H	α-helix	trans	-63.9	-35.9	-166.8	-22.4	32.5	0	0	0	115.5	T376 Q461 R462	T376-P458 HydrophobicContact CG2-CG 4.31Å; P458-Q461 WeakPolarHBondContact O-CB 3.43Å; P458-Q461 PolarHBondContact O-N 2.82Å; P458-R462 PolarHBondContact O-N 3.48Å; P458-R462 VanDerWaalsContact O-N 3.08Å
459	D	36.9	Very low	42	Very low	17 Å²	17	84.7 Å²	84.7	9%	0.091	43%	0.434	C	S	.	.	H	α-helix	trans	-77.5	-27.7	177.4	-82.5	-8.7	0	0	0	112.4	A373 H457 L463	A373-D459 HydrophobicContact CB-CB 4.18Å; A373-D459 WeakPolarHBondContact CB-OD2 3.47Å; H457-D459 PolarHBondContact O-N 3.13Å; D459-L463 PolarHBondContact O-N 3.48Å; D459-L463 VanDerWaalsContact O-N 3.13Å
460	T	40.8	Very low	42.4	Very low	2 Å²	2	79.6 Å²	79.6	1%	0.012	41%	0.406	C	S	.	.	H	α-helix	trans	-69.4	-39	169.6	-46.6	0	0	0	0	109.8	A328 V331 H457 R462 L463 Q464	A328-T460 HydrophobicContact CB-CG2 3.74Å; V331-T460 HydrophobicContact CB-CG2 4.34Å; V331-T460 HydrophobicContact CG1-CG2 4.47Å; H457-T460 WeakPolarHBondContact O-CB 3.43Å; H457-T460 PolarHBondContact O-N 2.85Å; H457-T460 VanDerWaalsContact O-N 3.1Å; T460-R462 PolarHBondContact O-N 2.98Å; T460-L463 PolarHBondContact O-N 2.81Å; T460-Q464 HydrophobicContact CG2-CG 4.46Å; T460-Q464 VanDerWaalsContact O-CB 3.3Å; T460-Q464 WeakPolarHBondContact O-CB 3.28Å; T460-Q464 WeakPolarHBondContact O-CG 3.21Å; T460-Q464 PolarHBondContact O-N 2.67Å
461	Q	39	Very low	42.9	Very low	98 Å²	98	76 Å²	76	46%	0.458	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-40.7	175.5	-167.4	172.5	4.1	0	0	111.7	H457 P458 Q464 E465	H457-Q461 PolarHBondContact O-N 3.34Å; P458-Q461 WeakPolarHBondContact O-CB 3.43Å; P458-Q461 PolarHBondContact O-N 2.82Å; Q461-Q464 CarbonylContact O-C 3.37Å; Q461-Q464 WeakPolarHBondContact O-CB 3.26Å; Q461-Q464 PolarHBondContact O-N 3.24Å; Q461-E465 WeakPolarHBondContact O-CB 3.24Å; Q461-E465 VanDerWaalsContact O-CG 3.26Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 2.85Å
462	R	46.6	Very low	42.8	Very low	112 Å²	112	77.2 Å²	77.2	42%	0.423	38%	0.382	S	S	.	.	H	α-helix	trans	-70.9	-30.3	175.9	-73.4	175.5	173.1	-177.6	-2.2	114.5	P458 T460 E465 L466	P458-R462 PolarHBondContact O-N 3.48Å; P458-R462 VanDerWaalsContact O-N 3.08Å; T460-R462 PolarHBondContact O-N 2.98Å; R462-E465 WeakPolarHBondContact O-CB 3.39Å; R462-L466 PolarHBondContact O-N 3.15Å
463	L	48.3	Very low	43	Very low	17 Å²	17	77.7 Å²	77.7	9%	0.089	36%	0.363	C	S	.	.	H	α-helix	trans	-77.9	-33.6	171.7	-90.7	158.2	0	0	0	111.9	W332 D459 T460 E465 L466 I467	W332-L463 HydrophobicContact CD2-CD1 4Å; W332-L463 HydrophobicContact CE3-CD1 3.16Å; W332-L463 HydrophobicContact CH2-CD1 3.98Å; W332-L463 HydrophobicContact CZ3-CD1 3.16Å; D459-L463 PolarHBondContact O-N 3.48Å; D459-L463 VanDerWaalsContact O-N 3.13Å; T460-L463 PolarHBondContact O-N 2.81Å; L463-E465 VanDerWaalsContact C-N 3.31Å; L463-L466 HydrophobicContact CD2-CD2 4.01Å; L463-L466 PolarHBondContact O-N 3.07Å; L463-I467 WeakPolarHBondContact O-CB 3.37Å; L463-I467 WeakPolarHBondContact O-CG1 2.97Å; L463-I467 PolarHBondContact O-N 3.01Å
464	Q	44.6	Very low	43.1	Very low	67 Å²	67	74.7 Å²	74.7	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-42.3	166.6	-75.7	167.8	-12.4	0	0	110.2	V331 T460 Q461 I467 F468	V331-Q464 HydrophobicContact CG1-CG 3.68Å; T460-Q464 HydrophobicContact CG2-CG 4.46Å; T460-Q464 VanDerWaalsContact O-CB 3.3Å; T460-Q464 WeakPolarHBondContact O-CB 3.28Å; T460-Q464 WeakPolarHBondContact O-CG 3.21Å; T460-Q464 PolarHBondContact O-N 2.67Å; Q461-Q464 CarbonylContact O-C 3.37Å; Q461-Q464 WeakPolarHBondContact O-CB 3.26Å; Q461-Q464 PolarHBondContact O-N 3.24Å; Q464-I467 PolarHBondContact O-N 3.12Å; Q464-F468 WeakPolarHBondContact O-CA 3.36Å; Q464-F468 WeakPolarHBondContact O-CB 3.22Å; Q464-F468 PolarHBondContact O-N 3.21Å
465	E	45.5	Very low	42.9	Very low	106 Å²	106	67 Å²	67	50%	0.495	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-40.3	172.2	-74.7	163.2	-166.6	0	0	112	Q461 R462 L463 F468 Y469	Q461-E465 WeakPolarHBondContact O-CB 3.24Å; Q461-E465 VanDerWaalsContact O-CG 3.26Å; Q461-E465 WeakPolarHBondContact O-CG 3.48Å; Q461-E465 PolarHBondContact O-N 2.85Å; R462-E465 WeakPolarHBondContact O-CB 3.39Å; L463-E465 VanDerWaalsContact C-N 3.31Å; E465-F468 PolarHBondContact O-N 3.01Å; E465-Y469 WeakPolarHBondContact O-CA 3.27Å; E465-Y469 WeakPolarHBondContact O-CB 3.19Å; E465-Y469 PolarHBondContact O-N 3.29Å
466	L	52.1	Low	42.9	Very low	55 Å²	55	65 Å²	65	29%	0.288	32%	0.322	S	S	.	.	H	α-helix	trans	-65	-45.3	174.7	-177.5	74.5	0	0	0	112	L392 R462 L463 F468 F470	L392-L466 HydrophobicContact CD1-CD1 3.86Å; L392-L466 HydrophobicContact CD1-CD2 3.41Å; L392-L466 VanDerWaalsContact CD1-CD2 3.41Å; L392-L466 HydrophobicContact CD1-CG 4.22Å; R462-L466 PolarHBondContact O-N 3.15Å; L463-L466 HydrophobicContact CD2-CD2 4.01Å; L463-L466 PolarHBondContact O-N 3.07Å; L466-F468 VanDerWaalsContact C-N 3.34Å; L466-F470 WeakPolarHBondContact O-CB 3.45Å; L466-F470 PolarHBondContact O-N 2.99Å
467	I	55.4	Low	42.6	Very low	8 Å²	8	64.9 Å²	64.9	4%	0.041	33%	0.328	C	S	.	.	H	α-helix	trans	-63.7	-43.8	177.2	-72.5	167.6	0	0	0	109.8	I151 L155 V331 L338 L463 Q464 F470 I471	I151-I467 HydrophobicContact CG2-CG2 4.42Å; L155-I467 HydrophobicContact CD1-CG2 3.42Å; L155-I467 VanDerWaalsContact CD1-CG2 3.42Å; L155-I467 HydrophobicContact CD2-CG2 4.3Å; L155-I467 HydrophobicContact CG-CG2 4.42Å; V331-I467 HydrophobicContact CG1-CD1 4.27Å; L338-I467 HydrophobicContact CD2-CG1 3.9Å; L463-I467 WeakPolarHBondContact O-CB 3.37Å; L463-I467 WeakPolarHBondContact O-CG1 2.97Å; L463-I467 PolarHBondContact O-N 3.01Å; Q464-I467 PolarHBondContact O-N 3.12Å; I467-F470 PolarHBondContact O-N 3.16Å; I467-I471 HydrophobicContact CG2-CD1 3.69Å; I467-I471 WeakPolarHBondContact O-CB 3.35Å; I467-I471 WeakPolarHBondContact O-CD1 3.45Å; I467-I471 WeakPolarHBondContact O-CG1 3.12Å; I467-I471 PolarHBondContact O-N 2.9Å
468	F	43.3	Very low	41.8	Very low	107 Å²	107	66.6 Å²	66.6	47%	0.469	35%	0.353	S	S	.	.	H	α-helix	trans	-68	-44.9	179.3	-170.3	-105.3	0	0	0	111.4	Q464 E465 L466 F470 I471 Q472	Q464-F468 WeakPolarHBondContact O-CA 3.36Å; Q464-F468 WeakPolarHBondContact O-CB 3.22Å; Q464-F468 PolarHBondContact O-N 3.21Å; E465-F468 PolarHBondContact O-N 3.01Å; L466-F468 VanDerWaalsContact C-N 3.34Å; F468-F470 VanDerWaalsContact C-N 3.33Å; F468-F470 PolarHBondContact O-N 3.39Å; F468-I471 PolarHBondContact O-N 3.02Å; F468-Q472 VanDerWaalsContact O-CB 3.23Å; F468-Q472 WeakPolarHBondContact O-CB 3.42Å; F468-Q472 PolarHBondContact O-N 2.69Å
469	Y	39.2	Very low	41.6	Very low	120 Å²	120	71 Å²	71	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-59.5	-44	173.1	-176.2	-86	0	0	0	111.2	E465 I471 Q472 F473	E465-Y469 WeakPolarHBondContact O-CA 3.27Å; E465-Y469 WeakPolarHBondContact O-CB 3.19Å; E465-Y469 PolarHBondContact O-N 3.29Å; Y469-I471 VanDerWaalsContact C-N 3.35Å; Y469-I471 PolarHBondContact O-N 3.35Å; Y469-Q472 PolarHBondContact O-N 3.41Å; Y469-F473 HydrophobicContact CD2-CB 4.24Å; Y469-F473 AromaticContact CD2-CD2 3.77Å; Y469-F473 HydrophobicContact CD2-CD2 3.77Å; Y469-F473 HydrophobicContact CD2-CG 4.36Å; Y469-F473 HydrophobicContact CE1-CB 4.34Å; Y469-F473 HydrophobicContact CE2-CB 4.06Å; Y469-F473 HydrophobicContact CE2-CD2 4.16Å; Y469-F473 HydrophobicContact CE2-CG 4.34Å; Y469-F473 HydrophobicContact CG-CB 4.48Å; Y469-F473 HydrophobicContact CG-CD2 4.31Å; Y469-F473 CarbonylContact O-C 3.6Å; Y469-F473 WeakPolarHBondContact O-CA 3.3Å; Y469-F473 WeakPolarHBondContact O-CB 3.16Å; Y469-F473 PolarHBondContact O-N 2.99Å
470	F	44.3	Very low	41.4	Very low	23 Å²	23	78.8 Å²	78.8	10%	0.101	41%	0.409	C	S	.	.	H	α-helix	trans	-64.2	-37.3	176.8	-175.3	-94.2	0	0	0	113	Y144 V147 L338 L342 L466 I467 F468	Y144-F470 HydrophobicContact CD2-CE2 4.23Å; Y144-F470 HydrophobicContact CD2-CZ 4.01Å; Y144-F470 HydrophobicContact CE2-CD2 4.31Å; Y144-F470 HydrophobicContact CE2-CE1 4.31Å; Y144-F470 AromaticContact CE2-CE2 3.31Å; Y144-F470 HydrophobicContact CE2-CE2 3.31Å; Y144-F470 AromaticContact CE2-CZ 3.29Å; Y144-F470 HydrophobicContact CE2-CZ 3.29Å; Y144-F470 AromaticContact CZ-CE2 3.91Å; Y144-F470 AromaticContact CZ-CZ 3.72Å; Y144-F470 PolarHBondContact OH-O 3.3Å; Y144-F470 VanDerWaalsContact OH-O 3.08Å; V147-F470 HydrophobicContact CG1-CE1 4.02Å; V147-F470 HydrophobicContact CG1-CZ 3.88Å; L338-F470 HydrophobicContact CD1-CD1 3.74Å; L338-F470 HydrophobicContact CD1-CD2 4.42Å; L338-F470 HydrophobicContact CD1-CE1 3.72Å; L338-F470 HydrophobicContact CD1-CE2 4.39Å; L338-F470 HydrophobicContact CD1-CG 4.12Å; L338-F470 HydrophobicContact CD1-CZ 4.07Å; L338-F470 HydrophobicContact CD2-CB 4.27Å; L338-F470 HydrophobicContact CD2-CD1 4.32Å; L338-F470 HydrophobicContact CD2-CG 4.24Å; L342-F470 HydrophobicContact CD1-CD2 3.9Å; L342-F470 HydrophobicContact CD1-CE2 3.79Å; L342-F470 HydrophobicContact CD2-CD2 4.22Å; L342-F470 HydrophobicContact CD2-CE2 3.26Å; L342-F470 HydrophobicContact CD2-CZ 3.51Å; L342-F470 HydrophobicContact CG-CE2 4.1Å; L342-F470 HydrophobicContact CG-CZ 4.47Å; L466-F470 WeakPolarHBondContact O-CB 3.45Å; L466-F470 PolarHBondContact O-N 2.99Å; I467-F470 PolarHBondContact O-N 3.16Å; F468-F470 VanDerWaalsContact C-N 3.33Å; F468-F470 PolarHBondContact O-N 3.39Å
471	I	41.9	Very low	40.9	Very low	49 Å²	49	86.3 Å²	86.3	25%	0.251	45%	0.449	S	S	.	.	H	α-helix	trans	-75.9	-35	179.7	-71.5	166.2	0	0	0	111.9	I151 L155 I467 F468 Y469	I151-I471 HydrophobicContact CG2-CD1 4.23Å; L155-I471 HydrophobicContact CD1-CD1 3.25Å; I467-I471 HydrophobicContact CG2-CD1 3.69Å; I467-I471 WeakPolarHBondContact O-CB 3.35Å; I467-I471 WeakPolarHBondContact O-CD1 3.45Å; I467-I471 WeakPolarHBondContact O-CG1 3.12Å; I467-I471 PolarHBondContact O-N 2.9Å; F468-I471 PolarHBondContact O-N 3.02Å; Y469-I471 VanDerWaalsContact C-N 3.35Å; Y469-I471 PolarHBondContact O-N 3.35Å
472	Q	33.9	Very low	40.4	Very low	108 Å²	108	85.5 Å²	85.5	51%	0.505	47%	0.467	S	S	.	.	H	α-helix	trans	-95.9	-32.8	-172.7	-168.5	174.5	5.6	0	0	113.8	F468 Y469	F468-Q472 VanDerWaalsContact O-CB 3.23Å; F468-Q472 WeakPolarHBondContact O-CB 3.42Å; F468-Q472 PolarHBondContact O-N 2.69Å; Y469-Q472 PolarHBondContact O-N 3.41Å
473	F	39.1	Very low	39.8	Very low	87 Å²	87	89.5 Å²	89.5	38%	0.382	49%	0.487	S	S	.	.	S	Bend	trans	-129.4	41	-169.4	-55.1	-74	0	0	0	112.4	Y469 A477	Y469-F473 HydrophobicContact CD2-CB 4.24Å; Y469-F473 AromaticContact CD2-CD2 3.77Å; Y469-F473 HydrophobicContact CD2-CD2 3.77Å; Y469-F473 HydrophobicContact CD2-CG 4.36Å; Y469-F473 HydrophobicContact CE1-CB 4.34Å; Y469-F473 HydrophobicContact CE2-CB 4.06Å; Y469-F473 HydrophobicContact CE2-CD2 4.16Å; Y469-F473 HydrophobicContact CE2-CG 4.34Å; Y469-F473 HydrophobicContact CG-CB 4.48Å; Y469-F473 HydrophobicContact CG-CD2 4.31Å; Y469-F473 CarbonylContact O-C 3.6Å; Y469-F473 WeakPolarHBondContact O-CA 3.3Å; Y469-F473 WeakPolarHBondContact O-CB 3.16Å; Y469-F473 PolarHBondContact O-N 2.99Å; F473-A477 HydrophobicContact CB-CB 3.77Å; F473-A477 HydrophobicContact CD1-CB 4.26Å; F473-A477 HydrophobicContact CG-CB 4.5Å
474	G	36.2	Very low	38.9	Very low	23 Å²	23	101.3 Å²	101.3	24%	0.237	55%	0.545	C	S	.	.			trans	-47.1	165.7	167.8	0	0	0	0	0	113.2	Y144 D476 A477	Y144-G474 WeakPolarHBondContact OH-CA 3.44Å; G474-D476 PolarHBondContact O-N 2.86Å; G474-A477 PolarHBondContact O-N 3.25Å
475	P	38.1	Very low	38.6	Very low	76 Å²	76	103.1 Å²	103.1	49%	0.494	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.9	-7.7	-150.4	22.7	-33.9	0	0	0	117.5	Y144 A477	Y144-P475 HydrophobicContact CD2-CG 4.43Å; Y144-P475 HydrophobicContact CE1-CG 4.48Å; Y144-P475 HydrophobicContact CE2-CG 4.29Å; P475-A477 VanDerWaalsContact C-N 3.32Å
476	D	40.9	Very low	38.2	Very low	143 Å²	143	102.9 Å²	102.9	77%	0.765	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-1.4	172	-63.4	-32.8	0	0	0	114.5	G474 G478	G474-D476 PolarHBondContact O-N 2.86Å; D476-G478 PolarHBondContact O-N 2.98Å
477	A	38.5	Very low	37.4	Very low	63 Å²	63	105.6 Å²	105.6	52%	0.521	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	13.2	173	0	0	0	0	0	114.5	F473 G474 P475	F473-A477 HydrophobicContact CB-CB 3.77Å; F473-A477 HydrophobicContact CD1-CB 4.26Å; F473-A477 HydrophobicContact CG-CB 4.5Å; G474-A477 PolarHBondContact O-N 3.25Å; P475-A477 VanDerWaalsContact C-N 3.32Å
478	G	34.5	Very low	36.4	Very low	65 Å²	65	111.3 Å²	111.3	67%	0.67	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	12.2	-179.6	0	0	0	0	0	115.5	D476	D476-G478 PolarHBondContact O-N 2.98Å
479	L	34.3	Very low	36	Very low	144 Å²	144	111.6 Å²	111.6	75%	0.754	62%	0.615	S	S	*	*	S	Bend	trans	-122.6	70.6	171	-94.7	97.1	0	0	0	110.6
480	Q	32.2	Very low	35.7	Very low	182 Å²	182	111 Å²	111	85%	0.85	63%	0.625	S	S	*	*			trans	-173.8	91.3	148.7	-105	164.7	55.4	0	0	108.2
481	D	31.1	Very low	35.1	Very low	160 Å²	160	117.3 Å²	117.3	86%	0.856	66%	0.662	S	S	*	*				-172.5	72.9	127.3	-91	-20.7	0	0	0	109.3
482	G	29.1	Very low	34.6	Very low	80 Å²	80	122.5 Å²	122.5	83%	0.825	69%	0.694	S	S	*	*			trans	-105.7	89.7	150.7	0	0	0	0	0	107.6
483	K	32.3	Very low	34.7	Very low	196 Å²	196	123.8 Å²	123.8	85%	0.852	71%	0.71	S	S	*	*			trans	-124.1	76.6	162.9	-91.6	-169.9	177.9	177.9	0	109.1
484	M	29.7	Very low	34.3	Very low	266 Å²	266	127.1 Å²	127.1	100%	1.31	74%	0.739	S	S	*	*			trans	160.5	0	136	-93.1	-166.6	-166.6	0	0	108.9

Retrieved 484 of 484 residues in 125.1 ms (Link to these results)

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