A0A077Z6Z0_TRITR Loading...

Nicotinic acetylcholine receptor alpha subunit

AlphaFold DB , UniProt , Accession A0A077Z6Z0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 578 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	40.5	Very low	38.1	Very low	241 Å²	241	167.2 Å²	167.2	100%	1.187	88%	0.877	S	S	*	*				0	-1.3	0	-88.4	176.6	130.1	0	0	113.3
2	S	35.4	Very low	38.1	Very low	116 Å²	116	170.3 Å²	170.3	81%	0.811	87%	0.871	S	S	*	*			trans	-47.4	149.8	141.6	-24.5	0	0	0	0	112.2
3	A	36.7	Very low	38.1	Very low	97 Å²	97	169.1 Å²	169.1	80%	0.802	88%	0.875	S	S	*	*	S	Bend	trans	96.9	3.9	162.2	0	0	0	0	0	121.1
4	L	38.1	Very low	37.9	Very low	163 Å²	163	162.5 Å²	162.5	85%	0.853	87%	0.87	S	S	*	*			trans	-131	88.5	170.2	-88.8	97	0	0	0	112.3
5	R	35.8	Very low	37.8	Very low	253 Å²	253	158.3 Å²	158.3	96%	0.955	87%	0.867	S	S	*	*			trans	-172.4	34.8	153.1	-103.5	169.2	-162	-148.3	5.8	112.1
6	L	39.6	Very low	37.8	Very low	170 Å²	170	160.8 Å²	160.8	89%	0.89	87%	0.873	S	S	*	*			trans	-98.3	15.4	177.6	-105.3	158.6	0	0	0	113.3
7	F	38.5	Very low	37.7	Very low	212 Å²	212	160.4 Å²	160.4	93%	0.93	87%	0.87	S	S	*	*	S	Bend	trans	-133.2	107.8	173.8	-98.4	-95.9	0	0	0	108.8
8	G	37.6	Very low	37.4	Very low	67 Å²	67	160.6 Å²	160.6	69%	0.691	87%	0.869	S	S	*	*	S	Bend	trans	119.2	73.7	171.2	0	0	0	0	0	114
9	L	35.2	Very low	37.3	Very low	152 Å²	152	160.4 Å²	160.4	80%	0.796	87%	0.865	S	S	*	*			trans	-174	66	134.4	-113.8	113.5	0	0	0	108.7	Y12	L9-Y12 HydrophobicContact CD2-CD2 4.23Å
10	F	38.7	Very low	37.2	Very low	215 Å²	215	160.2 Å²	160.2	94%	0.943	86%	0.859	S	S	*	*			trans	-104.1	28.3	171.8	-120.8	-82.1	0	0	0	111.4
11	I	42.6	Very low	37.1	Very low	153 Å²	153	161.5 Å²	161.5	79%	0.785	86%	0.859	S	S	*	*			trans	-122.8	-2.8	-172.8	-68.3	-174.2	0	0	0	114.5
12	Y	38.3	Very low	37	Very low	205 Å²	205	158 Å²	158	80%	0.804	84%	0.84	S	S	*	*	S	Bend	trans	-102.9	19.3	-175.6	-99.4	-82	0	0	0	117	L9	L9-Y12 HydrophobicContact CD2-CD2 4.23Å
13	V	38.3	Very low	37	Very low	154 Å²	154	159.9 Å²	159.9	93%	0.933	84%	0.841	S	S	*	*	S	Bend	trans	-122.6	88.4	172.2	-176.2	0	0	0	0	108.7
14	G	35.4	Very low	37	Very low	77 Å²	77	162.7 Å²	162.7	79%	0.794	84%	0.841	S	S	*	*	S	Bend	trans	153.9	54.8	176.7	0	0	0	0	0	114.8
15	A	36.6	Very low	36.8	Very low	100 Å²	100	158.1 Å²	158.1	83%	0.826	83%	0.833	S	S	*	*			trans	-179.4	78.6	160.4	0	0	0	0	0	110.5
16	M	37.1	Very low	36.9	Very low	197 Å²	197	150.9 Å²	150.9	97%	0.97	82%	0.821	S	S	*	*			trans	-147.7	42.7	160.1	-144.9	177.3	-173	0	0	111.3
17	L	36.8	Very low	36.5	Very low	155 Å²	155	150.7 Å²	150.7	81%	0.812	82%	0.821	S	S	*	*	S	Bend	trans	-139.2	119.2	168.7	-102.6	147.4	0	0	0	105.3
18	L	32	Very low	36.3	Very low	164 Å²	164	144.3 Å²	144.3	86%	0.859	80%	0.802	S	S	*	*			trans	76.6	73.3	167.7	-52	173.9	0	0	0	118.1
19	I	36.3	Very low	36.4	Very low	156 Å²	156	150.9 Å²	150.9	80%	0.8	81%	0.812	S	S	*	*			trans	-152.6	128.5	151.1	-61.6	-174.1	0	0	0	104.1
20	Q	34.3	Very low	36.7	Very low	157 Å²	157	151.3 Å²	151.3	73%	0.734	81%	0.808	S	S	*	*			cis	-164.8	136.7	-5.1	-175	148.4	-54.5	0	0	105.1	E22	Q20-E22 PolarHBondContact O-N 3.39Å; Q20-E22 VanDerWaalsContact O-N 3.15Å
21	E	34.4	Very low	36.6	Very low	187 Å²	187	145.4 Å²	145.4	87%	0.874	79%	0.792	S	S	*	*			trans	-63.4	103.7	164.3	-157.5	156.3	-179.3	0	0	106
22	E	39.5	Very low	36.3	Very low	169 Å²	169	146.9 Å²	146.9	79%	0.79	79%	0.793	S	S	*	*			trans	-87.8	108.9	167	-97.7	-163.4	159.6	0	0	108.5	Q20 I24	Q20-E22 PolarHBondContact O-N 3.39Å; Q20-E22 VanDerWaalsContact O-N 3.15Å; E22-I24 PolarHBondContact O-N 3.45Å
23	D	35.2	Very low	36.6	Very low	155 Å²	155	140 Å²	140	83%	0.829	78%	0.779	S	S	*	*			trans	-52.2	111	163.5	-79	-51.9	0	0	0	110.9
24	I	36.8	Very low	36.8	Very low	155 Å²	155	135.9 Å²	135.9	80%	0.795	76%	0.761	S	S	*	*			trans	-110.5	75.7	154	-57.6	176.4	0	0	0	106.9	E22	E22-I24 PolarHBondContact O-N 3.45Å
25	G	33.9	Very low	37.1	Very low	67 Å²	67	135.3 Å²	135.3	69%	0.691	75%	0.749	S	S	*	*			trans	-98.8	89.3	162	0	0	0	0	0	109.1
26	S	37.2	Very low	37.7	Very low	101 Å²	101	132.6 Å²	132.6	71%	0.706	73%	0.727	S	S	*	*	S	Bend	trans	-176.1	106.2	158.7	-72.6	0	0	0	0	108.9
27	D	32.6	Very low	38.5	Very low	166 Å²	166	125.3 Å²	125.3	89%	0.888	70%	0.697	S	S	*	*			trans	53	84.2	154.9	-55.9	-22.7	0	0	0	118.8
28	C	33.4	Very low	40.1	Very low	78 Å²	78	123.7 Å²	123.7	53%	0.527	69%	0.69	S	S	.	*			trans	-146.5	115.8	154.3	-141.4	0	0	0	0	111.1	F30 C31	C28-F30 HydrophobicContact CB-CB 4.34Å; C28-F30 PolarHBondContact O-N 3.4Å; C28-C31 PolarHBondContact O-N 3.45Å
29	F	40.7	Very low	42.6	Very low	205 Å²	205	123 Å²	123	90%	0.899	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.8	-15.5	169.5	-145.9	-99.4	0	0	0	112.9
30	F	40.8	Very low	45	Very low	162 Å²	162	117.3 Å²	117.3	71%	0.711	65%	0.653	S	S	*	*	H	α-helix	trans	-70.2	-23.9	174.4	-85.4	-88.5	0	0	0	115.8	C28 F32 A33 A34	C28-F30 HydrophobicContact CB-CB 4.34Å; C28-F30 PolarHBondContact O-N 3.4Å; F30-F32 PolarHBondContact O-N 3.25Å; F30-A33 PolarHBondContact O-N 3.21Å; F30-A34 PolarHBondContact O-N 3.19Å
31	C	36.9	Very low	47.4	Very low	90 Å²	90	110.8 Å²	110.8	61%	0.608	63%	0.626	S	S	*	*	H	α-helix	trans	-70.4	-31	-179.4	-76.7	0	0	0	0	113.1	C28 A33 A34 A35	C28-C31 PolarHBondContact O-N 3.45Å; C31-A33 VanDerWaalsContact C-N 3.3Å; C31-A33 PolarHBondContact O-N 3.35Å; C31-A34 PolarHBondContact O-N 3.45Å; C31-A35 WeakPolarHBondContact O-CB 3.21Å; C31-A35 PolarHBondContact O-N 3.45Å
32	F	35.2	Very low	50	Low	184 Å²	184	108.3 Å²	108.3	81%	0.807	61%	0.612	S	S	*	*	H	α-helix	trans	-65.6	-34.5	173.2	-99.8	-84.1	0	0	0	112.1	F30 A36	F30-F32 PolarHBondContact O-N 3.25Å; F32-A36 VanDerWaalsContact O-CB 3.26Å; F32-A36 WeakPolarHBondContact O-CB 3.19Å; F32-A36 PolarHBondContact O-N 3.35Å
33	A	45.4	Very low	52.4	Low	62 Å²	62	106 Å²	106	51%	0.512	60%	0.596	S	S	.	*	H	α-helix	trans	-70.6	-37.8	176	0	0	0	0	0	112.2	F30 C31 A37	F30-A33 PolarHBondContact O-N 3.21Å; C31-A33 VanDerWaalsContact C-N 3.3Å; C31-A33 PolarHBondContact O-N 3.35Å; A33-A37 VanDerWaalsContact O-CB 3.3Å; A33-A37 WeakPolarHBondContact O-CB 3.27Å; A33-A37 PolarHBondContact O-N 2.94Å
34	A	43.5	Very low	55.1	Low	66 Å²	66	98.6 Å²	98.6	55%	0.545	56%	0.557	S	S	.	*	H	α-helix	trans	-70.8	-39.3	177.3	0	0	0	0	0	112.7	F30 C31 A37 N38	F30-A34 PolarHBondContact O-N 3.19Å; C31-A34 PolarHBondContact O-N 3.45Å; A34-A37 PolarHBondContact O-N 3.34Å; A34-N38 PolarHBondContact O-N 3.38Å
35	A	41.2	Very low	57.6	Low	65 Å²	65	93.4 Å²	93.4	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-65.2	-43.3	174	0	0	0	0	0	111.6	C31 A37 N38 E39	C31-A35 WeakPolarHBondContact O-CB 3.21Å; C31-A35 PolarHBondContact O-N 3.45Å; A35-A37 PolarHBondContact O-N 3.37Å; A35-N38 PolarHBondContact O-N 3.26Å; A35-E39 PolarHBondContact O-N 3.13Å
36	A	49.1	Very low	60.3	Low	44 Å²	44	94.7 Å²	94.7	36%	0.364	52%	0.521	S	S	.	.	H	α-helix	trans	-66.7	-33.9	175.2	0	0	0	0	0	112.9	F32 N38 E39 N40	F32-A36 VanDerWaalsContact O-CB 3.26Å; F32-A36 WeakPolarHBondContact O-CB 3.19Å; F32-A36 PolarHBondContact O-N 3.35Å; A36-N38 VanDerWaalsContact C-N 3.26Å; A36-N38 PolarHBondContact O-N 3.44Å; A36-E39 PolarHBondContact O-N 3.14Å; A36-N40 PolarHBondContact O-N 3.25Å; A36-N40 VanDerWaalsContact O-N 3.12Å; A36-N40 PolarHBondContact O-ND2 3.1Å
37	A	53.7	Low	62.9	Low	43 Å²	43	93.7 Å²	93.7	36%	0.355	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-35.9	175.1	0	0	0	0	0	111.7	A33 A34 A35 A41	A33-A37 VanDerWaalsContact O-CB 3.3Å; A33-A37 WeakPolarHBondContact O-CB 3.27Å; A33-A37 PolarHBondContact O-N 2.94Å; A34-A37 PolarHBondContact O-N 3.34Å; A35-A37 PolarHBondContact O-N 3.37Å; A37-A41 WeakPolarHBondContact O-CB 3.19Å; A37-A41 PolarHBondContact O-N 3.37Å; A37-A41 VanDerWaalsContact O-N 3.1Å
38	N	70.8	Confident	65.7	Low	122 Å²	122	86.9 Å²	86.9	65%	0.652	47%	0.471	S	S	*	.	H	α-helix	trans	-70.4	-39.3	178.6	-160.4	11.3	0	0	0	112.3	A34 A35 A36 A41 K42	A34-N38 PolarHBondContact O-N 3.38Å; A35-N38 PolarHBondContact O-N 3.26Å; A36-N38 VanDerWaalsContact C-N 3.26Å; A36-N38 PolarHBondContact O-N 3.44Å; N38-A41 PolarHBondContact O-N 2.99Å; N38-K42 PolarHBondContact O-N 3.04Å; N38-K42 VanDerWaalsContact O-N 3.09Å
39	E	83.3	Confident	68.4	Low	150 Å²	150	85.1 Å²	85.1	70%	0.701	46%	0.457	S	S	*	.	H	α-helix	trans	-67.4	-41.3	176.9	-168.3	174.2	-169	0	0	112.2	A35 A36 A41 K42 R43	A35-E39 PolarHBondContact O-N 3.13Å; A36-E39 PolarHBondContact O-N 3.14Å; E39-A41 PolarHBondContact O-N 2.98Å; E39-K42 PolarHBondContact O-N 2.97Å; E39-R43 PolarHBondContact O-N 3.46Å
40	N	86.6	Confident	70.6	Confident	36 Å²	36	82.1 Å²	82.1	19%	0.193	45%	0.447	C	S	.	.	H	α-helix	trans	-63.7	-39.8	175.9	-75.2	-58.4	0	0	0	112.5	A36 R43 L44	A36-N40 PolarHBondContact O-N 3.25Å; A36-N40 VanDerWaalsContact O-N 3.12Å; A36-N40 PolarHBondContact O-ND2 3.1Å; N40-R43 PolarHBondContact O-N 3.25Å; N40-L44 WeakPolarHBondContact O-CB 3.02Å; N40-L44 PolarHBondContact O-N 2.89Å
41	A	86.1	Confident	72.8	Confident	19 Å²	19	81 Å²	81	16%	0.157	45%	0.449	C	S	.	.	H	α-helix	trans	-65.5	-40.1	176.7	0	0	0	0	0	111.9	A37 N38 E39 L44 I45 V138 L141	A37-A41 WeakPolarHBondContact O-CB 3.19Å; A37-A41 PolarHBondContact O-N 3.37Å; A37-A41 VanDerWaalsContact O-N 3.1Å; N38-A41 PolarHBondContact O-N 2.99Å; E39-A41 PolarHBondContact O-N 2.98Å; A41-L44 PolarHBondContact O-N 2.94Å; A41-I45 WeakPolarHBondContact O-CG1 3.36Å; A41-I45 PolarHBondContact O-N 3.34Å; A41-V138 HydrophobicContact CB-CG2 4.4Å; A41-L141 HydrophobicContact CB-CD1 4.18Å
42	K	88.7	Confident	75.5	Confident	135 Å²	135	78.1 Å²	78.1	59%	0.587	43%	0.425	S	S	*	.	H	α-helix	trans	-63.2	-49.1	174.9	-174.3	-179.5	177.3	-175.6	0	111.7	N38 E39 L44 I45 D46	N38-K42 PolarHBondContact O-N 3.04Å; N38-K42 VanDerWaalsContact O-N 3.09Å; E39-K42 PolarHBondContact O-N 2.97Å; K42-L44 VanDerWaalsContact C-N 3.28Å; K42-L44 PolarHBondContact O-N 3.48Å; K42-I45 WeakPolarHBondContact O-CB 3.34Å; K42-I45 PolarHBondContact O-N 3.02Å; K42-I45 VanDerWaalsContact O-N 3.14Å; K42-D46 PolarHBondContact O-N 2.9Å; K42-D46 VanDerWaalsContact O-N 3.09Å
43	R	90.2	Very high	78.2	Confident	120 Å²	120	73.7 Å²	73.7	45%	0.453	41%	0.41	S	S	.	.	H	α-helix	trans	-56.5	-43.4	176.4	-170.7	-179.4	73.8	-167.2	0.6	111.7	E39 N40 I45 D46 D47 Q134	E39-R43 PolarHBondContact O-N 3.46Å; N40-R43 PolarHBondContact O-N 3.25Å; R43-I45 PolarHBondContact O-N 3.4Å; R43-D46 PolarHBondContact O-N 3.5Å; R43-D47 WeakPolarHBondContact O-CB 3.04Å; R43-D47 VanDerWaalsContact O-CG 3.3Å; R43-D47 PolarHBondContact O-N 3.2Å; R43-Q134 PolarHBondContact NH2-O 3.38Å
44	L	91.3	Very high	80.4	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-43.3	176.9	177.2	62.3	0	0	0	112.5	N40 A41 K42 D46 D47 L48 W130 Y135 V138 L141	N40-L44 WeakPolarHBondContact O-CB 3.02Å; N40-L44 PolarHBondContact O-N 2.89Å; A41-L44 PolarHBondContact O-N 2.94Å; K42-L44 VanDerWaalsContact C-N 3.28Å; K42-L44 PolarHBondContact O-N 3.48Å; L44-D46 VanDerWaalsContact C-N 3.35Å; L44-D47 PolarHBondContact O-N 3.15Å; L44-L48 HydrophobicContact CD1-CD1 3.74Å; L44-L48 HydrophobicContact CD1-CG 3.85Å; L44-L48 HydrophobicContact CG-CD1 3.89Å; L44-L48 HydrophobicContact CG-CG 4.37Å; L44-L48 WeakPolarHBondContact O-CB 3.46Å; L44-L48 VanDerWaalsContact O-CG 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.15Å; L44-L48 PolarHBondContact O-N 3.16Å; L44-W130 HydrophobicContact CD1-CB 3.78Å; L44-W130 HydrophobicContact CD1-CD2 4.09Å; L44-W130 HydrophobicContact CD1-CG 3.67Å; L44-W130 HydrophobicContact CD2-CD2 3.92Å; L44-W130 HydrophobicContact CD2-CG 4.04Å; L44-W130 HydrophobicContact CD2-CZ2 4.11Å; L44-W130 HydrophobicContact CG-CG 4.49Å; L44-Y135 HydrophobicContact CB-CD1 3.59Å; L44-Y135 HydrophobicContact CB-CE1 3.99Å; L44-Y135 HydrophobicContact CB-CG 4.07Å; L44-Y135 HydrophobicContact CD1-CD1 3.8Å; L44-Y135 HydrophobicContact CD1-CD2 3.75Å; L44-Y135 HydrophobicContact CD1-CE1 3.73Å; L44-Y135 HydrophobicContact CD1-CE2 3.69Å; L44-Y135 HydrophobicContact CD1-CG 3.8Å; L44-Y135 HydrophobicContact CD2-CG 4.47Å; L44-Y135 HydrophobicContact CG-CD1 4.23Å; L44-Y135 HydrophobicContact CG-CE1 4.47Å; L44-Y135 HydrophobicContact CG-CG 4.33Å; L44-V138 HydrophobicContact CD2-CB 4.45Å; L44-V138 HydrophobicContact CD2-CG1 4Å; L44-L141 HydrophobicContact CD2-CD1 4.46Å; L44-L141 HydrophobicContact CD2-CD2 4.08Å; L44-L141 HydrophobicContact CG-CD2 4.19Å
45	I	90.2	Very high	82.6	Confident	47 Å²	47	79.5 Å²	79.5	24%	0.241	42%	0.417	C	S	.	.	H	α-helix	trans	-59.6	-48.5	176.6	-69.6	164.1	0	0	0	110.2	A41 K42 R43 L48 L49 L141 V143	A41-I45 WeakPolarHBondContact O-CG1 3.36Å; A41-I45 PolarHBondContact O-N 3.34Å; K42-I45 WeakPolarHBondContact O-CB 3.34Å; K42-I45 PolarHBondContact O-N 3.02Å; K42-I45 VanDerWaalsContact O-N 3.14Å; R43-I45 PolarHBondContact O-N 3.4Å; I45-L48 PolarHBondContact O-N 2.87Å; I45-L49 HydrophobicContact CG2-CD1 3.66Å; I45-L49 HydrophobicContact CG2-CG 4.35Å; I45-L49 WeakPolarHBondContact O-CB 3.31Å; I45-L49 WeakPolarHBondContact O-CG 3.43Å; I45-L49 PolarHBondContact O-N 3.24Å; I45-L141 HydrophobicContact CD1-CD1 3.95Å; I45-L141 HydrophobicContact CD1-CG 4.47Å; I45-L141 HydrophobicContact CG1-CD1 3.75Å; I45-L141 HydrophobicContact CG1-CD2 3.65Å; I45-L141 HydrophobicContact CG1-CG 4Å; I45-V143 HydrophobicContact CG1-CG2 4.33Å
46	D	90.4	Very high	84.9	Confident	94 Å²	94	83.6 Å²	83.6	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-62.4	-45.1	-178.4	-67.2	-25.4	0	0	0	111	K42 R43 L44 L49 M50	K42-D46 PolarHBondContact O-N 2.9Å; K42-D46 VanDerWaalsContact O-N 3.09Å; R43-D46 PolarHBondContact O-N 3.5Å; L44-D46 VanDerWaalsContact C-N 3.35Å; D46-L49 PolarHBondContact O-N 3.35Å; D46-M50 WeakPolarHBondContact O-CB 3.23Å; D46-M50 PolarHBondContact O-N 3.48Å
47	D	91	Very high	87	Confident	79 Å²	79	82.8 Å²	82.8	42%	0.422	41%	0.406	S	S	.	.	H	α-helix	trans	-63.9	-42.2	178.8	-72.3	-21	0	0	0	112.4	R43 L44 Y135	R43-D47 WeakPolarHBondContact O-CB 3.04Å; R43-D47 VanDerWaalsContact O-CG 3.3Å; R43-D47 PolarHBondContact O-N 3.2Å; L44-D47 PolarHBondContact O-N 3.15Å; D47-Y135 WeakPolarHBondContact OD2-CE1 3.3Å; D47-Y135 PolarHBondContact OD2-OH 3.4Å
48	L	90.7	Very high	88.9	Confident	24 Å²	24	80.9 Å²	80.9	13%	0.126	39%	0.39	C	S	.	.	H	α-helix	trans	-69.9	-39.3	179.1	-73.9	176.2	0	0	0	112.3	L44 I45 L128 W130 L141	L44-L48 HydrophobicContact CD1-CD1 3.74Å; L44-L48 HydrophobicContact CD1-CG 3.85Å; L44-L48 HydrophobicContact CG-CD1 3.89Å; L44-L48 HydrophobicContact CG-CG 4.37Å; L44-L48 WeakPolarHBondContact O-CB 3.46Å; L44-L48 VanDerWaalsContact O-CG 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.15Å; L44-L48 PolarHBondContact O-N 3.16Å; I45-L48 PolarHBondContact O-N 2.87Å; L48-L128 HydrophobicContact CB-CD2 4.43Å; L48-W130 HydrophobicContact CD1-CD2 4.43Å; L48-W130 HydrophobicContact CD1-CE3 3.78Å; L48-W130 HydrophobicContact CD1-CZ3 4.14Å; L48-L141 HydrophobicContact CD1-CD2 4.18Å
49	L	89.9	Confident	89.9	Confident	41 Å²	41	76.5 Å²	76.5	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-89.4	-18.5	-172.4	-64.5	-178.6	0	0	0	114.2	I45 D46 N51 Y52 V143 M147 I148	I45-L49 HydrophobicContact CG2-CD1 3.66Å; I45-L49 HydrophobicContact CG2-CG 4.35Å; I45-L49 WeakPolarHBondContact O-CB 3.31Å; I45-L49 WeakPolarHBondContact O-CG 3.43Å; I45-L49 PolarHBondContact O-N 3.24Å; D46-L49 PolarHBondContact O-N 3.35Å; L49-N51 PolarHBondContact O-N 3.47Å; L49-N51 VanDerWaalsContact O-N 3.08Å; L49-Y52 HydrophobicContact CD2-CD1 4.48Å; L49-Y52 HydrophobicContact CD2-CG 4.4Å; L49-Y52 PolarHBondContact O-N 2.57Å; L49-Y52 VanDerWaalsContact O-N 3.09Å; L49-V143 HydrophobicContact CD1-CG1 4.29Å; L49-M147 HydrophobicContact CD1-CB 4.21Å; L49-M147 HydrophobicContact CD1-SD 4.01Å; L49-I148 HydrophobicContact CD2-CG2 4.32Å
50	M	88.4	Confident	90.2	Very high	141 Å²	141	77 Å²	77	70%	0.695	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-37.8	-175	-175.3	175.7	61.7	0	0	114.1	D46	D46-M50 WeakPolarHBondContact O-CB 3.23Å; D46-M50 PolarHBondContact O-N 3.48Å
51	N	86.7	Confident	90.4	Very high	140 Å²	140	79.8 Å²	79.8	75%	0.749	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	18.4	178.8	-78.3	-35.4	0	0	0	113.2	L49	L49-N51 PolarHBondContact O-N 3.47Å; L49-N51 VanDerWaalsContact O-N 3.08Å
52	Y	93	Very high	90.5	Very high	29 Å²	29	83.2 Å²	83.2	11%	0.114	40%	0.403	C	S	.	.			trans	-84.1	120.8	-179.6	-171.9	-87.7	0	0	0	110.6	L49 K54 D125 K127 L128 I148 W149	L49-Y52 HydrophobicContact CD2-CD1 4.48Å; L49-Y52 HydrophobicContact CD2-CG 4.4Å; L49-Y52 PolarHBondContact O-N 2.57Å; L49-Y52 VanDerWaalsContact O-N 3.09Å; Y52-K54 HydrophobicContact CD1-CB 4.44Å; Y52-K54 HydrophobicContact CE1-CB 4.12Å; Y52-D125 WeakPolarHBondContact CE2-OD2 3.42Å; Y52-D125 PolarHBondContact OH-OD2 2.93Å; Y52-K127 HydrophobicContact CD2-CB 3.95Å; Y52-K127 HydrophobicContact CD2-CD 4.26Å; Y52-K127 HydrophobicContact CE2-CB 3.89Å; Y52-K127 HydrophobicContact CE2-CD 4.25Å; Y52-L128 HydrophobicContact CD2-CD2 3.78Å; Y52-L128 HydrophobicContact CD2-CG 4.31Å; Y52-L128 HydrophobicContact CE2-CD1 4.15Å; Y52-L128 HydrophobicContact CE2-CD2 3.76Å; Y52-L128 HydrophobicContact CE2-CG 3.8Å; Y52-I148 HydrophobicContact CE1-CB 4.3Å; Y52-W149 HydrophobicContact CE1-CB 4.46Å; Y52-W149 VanDerWaalsContact OH-CB 3.27Å; Y52-W149 WeakPolarHBondContact OH-CB 3.36Å; Y52-W149 PolarHBondContact OH-N 3.42Å
53	N	92.3	Very high	90.5	Very high	91 Å²	91	85.9 Å²	85.9	49%	0.487	42%	0.415	S	S	.	.			trans	-100.9	105.2	174.7	-175	-13.9	0	0	0	110.2	L55 R56	N53-L55 PolarHBondContact O-N 2.87Å; N53-L55 VanDerWaalsContact O-N 3.16Å; N53-L55 WeakPolarHBondContact OD1-CB 3.38Å; N53-L55 PolarHBondContact OD1-N 3.18Å; N53-R56 PolarHBondContact O-N 3.34Å
54	K	91.2	Very high	90.6	Very high	107 Å²	107	83.2 Å²	83.2	47%	0.465	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.5	-179	70.9	-179.7	-172.3	-179.4	0	115.8	Y52 R56 E146 W149	Y52-K54 HydrophobicContact CD1-CB 4.44Å; Y52-K54 HydrophobicContact CE1-CB 4.12Å; K54-R56 VanDerWaalsContact C-N 3.35Å; K54-E146 VanDerWaalsContact CD-O 3.3Å; K54-E146 WeakPolarHBondContact CD-O 3.48Å; K54-E146 PolarHBondContact NZ-O 3.37Å; K54-W149 WeakPolarHBondContact O-CA 3.44Å; K54-W149 WeakPolarHBondContact O-CB 3.48Å
55	L	89.7	Confident	90.7	Very high	143 Å²	143	86.6 Å²	86.6	75%	0.749	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.2	179	-59.4	178.1	0	0	0	112.9	N53	N53-L55 PolarHBondContact O-N 2.87Å; N53-L55 VanDerWaalsContact O-N 3.16Å; N53-L55 WeakPolarHBondContact OD1-CB 3.38Å; N53-L55 PolarHBondContact OD1-N 3.18Å
56	R	90.6	Very high	90.9	Very high	150 Å²	150	84.8 Å²	84.8	57%	0.566	42%	0.421	S	S	*	.	S	Bend	trans	-105.3	130.1	-175.7	-164.8	-179.8	-170	-167	0.6	110.8	N53 K54	N53-R56 PolarHBondContact O-N 3.34Å; K54-R56 VanDerWaalsContact C-N 3.35Å
57	R	92.5	Very high	91.1	Very high	27 Å²	27	83 Å²	83	10%	0.102	41%	0.413	C	S	.	.			trans	-54.4	138.4	173.7	-70	-166.7	-63.8	131.7	8.1	111.1	V59 P62 D64 W149 Y214 H218	R57-V59 HydrophobicContact CB-CG2 4.24Å; R57-V59 PolarHBondContact O-N 3.28Å; R57-P62 PolarHBondContact NH2-O 2.95Å; R57-D64 PolarHBondContact NH1-O 3.33Å; R57-D64 VanDerWaalsContact NH1-O 3.09Å; R57-W149 HydrophobicContact CG-CZ2 3.87Å; R57-Y214 HydrophobicContact CG-CE1 3.99Å; R57-Y214 HydrophobicContact CG-CE2 4.42Å; R57-Y214 WeakPolarHBondContact CG-OH 3.48Å; R57-H218 PolarHBondContact NH1-O 2.94Å
58	P	92.7	Very high	91.3	Very high	3 Å²	3	79.2 Å²	79.2	2%	0.019	39%	0.393	C	S	.	.	S	Bend	trans	-81.9	50.8	-173.9	34.9	-39.8	0	0	0	114.2	L66 D125 N126 W149	P58-L66 HydrophobicContact CG-CD1 4.1Å; P58-L66 HydrophobicContact CG-CD2 4.06Å; P58-D125 HydrophobicContact CB-CB 3.84Å; P58-D125 WeakPolarHBondContact CB-OD1 3.48Å; P58-D125 WeakPolarHBondContact CB-OD2 3.29Å; P58-D125 HydrophobicContact CG-CB 4.28Å; P58-N126 PolarHBondContact O-ND2 3.35Å; P58-W149 HydrophobicContact CG-CD2 4.32Å; P58-W149 HydrophobicContact CG-CE3 3.86Å; P58-W149 HydrophobicContact CG-CZ3 4.26Å
59	V	92.2	Very high	91.5	Very high	30 Å²	30	82.4 Å²	82.4	18%	0.182	41%	0.406	C	S	.	.			trans	-106.6	147.4	180	-67.3	0	0	0	0	111.4	R57 N61 D64 L66	R57-V59 HydrophobicContact CB-CG2 4.24Å; R57-V59 PolarHBondContact O-N 3.28Å; V59-N61 VanDerWaalsContact CG2-O 3.24Å; V59-N61 WeakPolarHBondContact CG2-O 3.5Å; V59-D64 HydrophobicContact CB-CB 4.22Å; V59-D64 HydrophobicContact CG1-CB 4.36Å; V59-L66 HydrophobicContact CG1-CB 4.08Å; V59-L66 HydrophobicContact CG1-CD1 4.41Å
60	K	89.1	Confident	91.8	Very high	160 Å²	160	80.5 Å²	80.5	70%	0.696	40%	0.396	S	S	*	.	S	Bend	trans	-68.9	-52	177.3	-71.2	-179.3	-177.9	177.5	0	110.5	N126	K60-N126 HydrophobicContact CG-CB 4.37Å
61	N	91.4	Very high	92	Very high	96 Å²	96	76.4 Å²	76.4	51%	0.513	37%	0.374	S	S	.	.	S	Bend	trans	-104.1	141.7	171.7	-55.6	-48.1	0	0	0	110.4	V59 K63 D64	V59-N61 VanDerWaalsContact CG2-O 3.24Å; V59-N61 WeakPolarHBondContact CG2-O 3.5Å; N61-K63 PolarHBondContact O-N 3.41Å; N61-D64 WeakPolarHBondContact CB-OD2 3.36Å; N61-D64 PolarHBondContact N-OD2 3.02Å; N61-D64 PolarHBondContact ND2-OD2 3.07Å; N61-D64 WeakPolarHBondContact O-CB 3.4Å; N61-D64 PolarHBondContact O-N 3.15Å
62	P	87.8	Confident	92.4	Very high	90 Å²	90	69.8 Å²	69.8	58%	0.584	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-22	177.4	-25.5	34.4	0	0	0	114.9	R57	R57-P62 PolarHBondContact NH2-O 2.95Å
63	K	88.7	Confident	92.4	Very high	192 Å²	192	71.7 Å²	71.7	84%	0.835	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-11.6	178.4	-63.3	-171.8	178.7	-178.6	0	113.6	N61	N61-K63 PolarHBondContact O-N 3.41Å
64	D	93.2	Very high	92.5	Very high	64 Å²	64	67.4 Å²	67.4	34%	0.342	32%	0.323	S	S	.	.	S	Bend	trans	-73.3	141.2	-179.4	-57.5	-22.3	0	0	0	109.5	R57 V59 N61	R57-D64 PolarHBondContact NH1-O 3.33Å; R57-D64 VanDerWaalsContact NH1-O 3.09Å; V59-D64 HydrophobicContact CB-CB 4.22Å; V59-D64 HydrophobicContact CG1-CB 4.36Å; N61-D64 WeakPolarHBondContact CB-OD2 3.36Å; N61-D64 PolarHBondContact N-OD2 3.02Å; N61-D64 PolarHBondContact ND2-OD2 3.07Å; N61-D64 WeakPolarHBondContact O-CB 3.4Å; N61-D64 PolarHBondContact O-N 3.15Å
65	V	92.5	Very high	92.5	Very high	71 Å²	71	63.3 Å²	63.3	43%	0.43	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-82.6	132.2	175.5	-170.1	0	0	0	0	108.2	D220	V65-D220 HydrophobicContact CG1-CB 3.69Å
66	L	94.5	Very high	92.6	Very high	9 Å²	9	60.2 Å²	60.2	5%	0.047	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118.4	172.8	-178.1	72.2	0	0	0	109.2	P58 V59 V68 W149 H218 V219 D220	P58-L66 HydrophobicContact CG-CD1 4.1Å; P58-L66 HydrophobicContact CG-CD2 4.06Å; V59-L66 HydrophobicContact CG1-CB 4.08Å; V59-L66 HydrophobicContact CG1-CD1 4.41Å; L66-V68 HydrophobicContact CD2-CG2 4.01Å; L66-V68 HydrophobicContact CG-CG2 4.17Å; L66-W149 HydrophobicContact CD2-CE3 4.29Å; L66-W149 HydrophobicContact CD2-CH2 3.2Å; L66-W149 HydrophobicContact CD2-CZ2 4.1Å; L66-W149 HydrophobicContact CD2-CZ3 3.32Å; L66-H218 PolarHBondContact N-O 3.33Å; L66-V219 WeakPolarHBondContact O-CA 3.23Å; L66-D220 PolarHBondContact O-N 3.41Å
67	T	94.8	Very high	92.5	Very high	56 Å²	56	53.6 Å²	53.6	34%	0.344	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	122	171.8	-54.2	0	0	0	0	109.9	K69 D220 Q222	T67-K69 HydrophobicContact CG2-CG 4.5Å; T67-D220 WeakPolarHBondContact CA-O 3.3Å; T67-Q222 HydrophobicContact CG2-CB 4.39Å; T67-Q222 HydrophobicContact CG2-CG 3.97Å
68	V	95.5	Very high	92.1	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	116.6	174.1	176.8	0	0	0	0	107.7	L66 L70 W123 P151 V219 D220 L221 Q222	L66-V68 HydrophobicContact CD2-CG2 4.01Å; L66-V68 HydrophobicContact CG-CG2 4.17Å; V68-L70 HydrophobicContact CG1-CD2 4.16Å; V68-W123 HydrophobicContact CG2-CB 4.1Å; V68-P151 HydrophobicContact CG1-CB 4.39Å; V68-P151 HydrophobicContact CG1-CG 4.11Å; V68-P151 HydrophobicContact CG2-CB 4.2Å; V68-V219 HydrophobicContact CB-CG1 4.28Å; V68-V219 HydrophobicContact CG2-CG1 3.87Å; V68-D220 PolarHBondContact N-O 3.27Å; V68-L221 HydrophobicContact CB-CD2 3.89Å; V68-L221 HydrophobicContact CG1-CD2 4.09Å; V68-L221 WeakPolarHBondContact O-CA 3.48Å; V68-Q222 PolarHBondContact O-N 2.88Å
69	K	95.5	Very high	91.3	Very high	91 Å²	91	58.1 Å²	58.1	40%	0.396	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.6	176.7	-60.8	-178	178.4	178.9	0	109.9	T67 Q121 E122 Q222 M224	T67-K69 HydrophobicContact CG2-CG 4.5Å; K69-Q121 CarbonylContact O-C 3.56Å; K69-Q121 WeakPolarHBondContact O-CA 3.34Å; K69-E122 HydrophobicContact CB-CB 4.33Å; K69-E122 PolarHBondContact N-O 2.84Å; K69-E122 PolarHBondContact O-N 3.3Å; K69-Q222 CarbonylContact C-O 3.45Å; K69-Q222 VanDerWaalsContact CA-O 3.23Å; K69-Q222 WeakPolarHBondContact CA-O 3.47Å; K69-Q222 HydrophobicContact CG-CB 4.49Å; K69-M224 HydrophobicContact CB-CE 4.05Å; K69-M224 HydrophobicContact CB-CG 3.65Å; K69-M224 WeakPolarHBondContact O-CE 3.29Å
70	L	94.8	Very high	90.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.1	178.7	-62.7	-179.1	0	0	0	111	V68 L119 K120 Q121 I153 L221 Q222 H223 M224 I290	V68-L70 HydrophobicContact CG1-CD2 4.16Å; L70-L119 HydrophobicContact CD2-CD1 4.44Å; L70-K120 CarbonylContact C-O 3.48Å; L70-K120 WeakPolarHBondContact CA-O 3.48Å; L70-Q121 HydrophobicContact CD2-CB 4.1Å; L70-Q121 HydrophobicContact CD2-CG 3.66Å; L70-I153 HydrophobicContact CD1-CG2 3.99Å; L70-I153 HydrophobicContact CD2-CG1 4.34Å; L70-L221 HydrophobicContact CD1-CD1 4.5Å; L70-L221 HydrophobicContact CD1-CD2 3.97Å; L70-L221 HydrophobicContact CG-CD2 4.34Å; L70-Q222 PolarHBondContact N-O 3.47Å; L70-H223 CarbonylContact O-C 3.49Å; L70-H223 WeakPolarHBondContact O-CA 3.43Å; L70-M224 PolarHBondContact O-N 3.26Å; L70-I290 HydrophobicContact CB-CD1 4.25Å; L70-I290 HydrophobicContact CD1-CD1 4.24Å
71	K	94.1	Very high	88.7	Confident	56 Å²	56	51.2 Å²	51.2	24%	0.243	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	136.6	168	-173.3	169.6	178.1	171.3	0	109.1	K120 M224	K71-K120 HydrophobicContact CB-CB 4.3Å; K71-K120 PolarHBondContact N-O 2.92Å; K71-K120 WeakPolarHBondContact O-CB 3.08Å; K71-K120 PolarHBondContact O-N 3.33Å; K71-M224 HydrophobicContact CB-CB 3.96Å; K71-M224 HydrophobicContact CB-CE 4.47Å; K71-M224 HydrophobicContact CB-CG 3.88Å; K71-M224 HydrophobicContact CB-SD 3.51Å; K71-M224 VanDerWaalsContact CB-SD 3.51Å; K71-M224 HydrophobicContact CD-CB 4.23Å; K71-M224 HydrophobicContact CD-SD 4.43Å
72	L	94.1	Very high	86.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.7	176.2	-160.4	71.4	0	0	0	109.3	V117 L119 L207 F209 I251 D252 Y292	L72-V117 HydrophobicContact CD1-CB 3.86Å; L72-V117 HydrophobicContact CD1-CG1 4.33Å; L72-V117 HydrophobicContact CD1-CG2 3.78Å; L72-V117 HydrophobicContact CD2-CG1 4.23Å; L72-V117 HydrophobicContact CG-CB 4.16Å; L72-V117 HydrophobicContact CG-CG1 4.26Å; L72-L119 HydrophobicContact CD1-CD1 4.16Å; L72-L207 HydrophobicContact CD2-CD1 3.85Å; L72-F209 HydrophobicContact CD1-CE2 3.95Å; L72-F209 HydrophobicContact CD1-CZ 4.17Å; L72-F209 HydrophobicContact CD2-CE2 4.41Å; L72-I251 HydrophobicContact CD2-CD1 4.3Å; L72-I251 HydrophobicContact CD2-CG1 4.35Å; L72-I251 WeakPolarHBondContact O-CA 3.38Å; L72-D252 PolarHBondContact O-N 3.07Å; L72-Y292 HydrophobicContact CB-CD1 4Å; L72-Y292 HydrophobicContact CB-CD2 4.36Å; L72-Y292 HydrophobicContact CB-CE1 3.76Å; L72-Y292 HydrophobicContact CB-CE2 4.13Å; L72-Y292 HydrophobicContact CB-CG 4.29Å; L72-Y292 HydrophobicContact CD2-CD1 4.36Å; L72-Y292 HydrophobicContact CD2-CD2 4.12Å; L72-Y292 HydrophobicContact CD2-CG 3.97Å
73	R	93.9	Very high	84.2	Confident	69 Å²	69	54 Å²	54	26%	0.26	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.4	165.9	-177.1	-176.6	-65.4	172.8	4.6	109.3	V117 W118 D252 D255	R73-V117 CarbonylContact O-C 3.59Å; R73-V117 WeakPolarHBondContact O-CA 3.06Å; R73-V117 WeakPolarHBondContact O-CB 3.38Å; R73-W118 HydrophobicContact CB-CB 4.24Å; R73-W118 PolarHBondContact N-O 3.5Å; R73-W118 PolarHBondContact O-N 2.92Å; R73-D252 WeakPolarHBondContact CA-O 3.34Å; R73-D252 HydrophobicContact CB-CB 3.98Å; R73-D252 HydrophobicContact CG-CB 4.02Å; R73-D252 WeakPolarHBondContact CG-O 3.27Å; R73-D252 IonicContact CZ-OD2 3.65Å; R73-D252 IonicContact NE-OD2 3.84Å; R73-D252 PolarHBondContact NE-OD2 3.21Å; R73-D252 IonicContact NH2-OD2 3.78Å; R73-D252 PolarHBondContact NH2-OD2 3.36Å; R73-D255 VanDerWaalsContact CD-OD2 3.28Å; R73-D255 WeakPolarHBondContact CD-OD2 3.5Å; R73-D255 IonicContact CZ-OD2 3.84Å; R73-D255 IonicContact NE-OD2 3.64Å; R73-D255 IonicContact NH1-OD2 2.7Å; R73-D255 PolarHBondContact NH1-OD2 3.47Å
74	L	93.7	Very high	81.7	Confident	1 Å²	1	52 Å²	52	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.1	-179.7	179.3	68.5	0	0	0	109.8	I77 T115 V117 I251 D252 L253 Y256 I264	L74-I77 HydrophobicContact CD1-CG1 4.42Å; L74-I77 HydrophobicContact CD2-CD1 4.42Å; L74-I77 HydrophobicContact CD2-CG1 4.13Å; L74-T115 HydrophobicContact CD1-CG2 4.15Å; L74-V117 HydrophobicContact CD1-CG1 3.72Å; L74-I251 HydrophobicContact CB-CG2 3.63Å; L74-D252 PolarHBondContact N-O 3.42Å; L74-L253 HydrophobicContact CB-CD2 3.99Å; L74-L253 HydrophobicContact CD2-CD2 3.91Å; L74-L253 HydrophobicContact CG-CD2 4.47Å; L74-Y256 HydrophobicContact CD2-CD2 3.85Å; L74-Y256 HydrophobicContact CD2-CE2 3.78Å; L74-Y256 HydrophobicContact CG-CD2 3.84Å; L74-Y256 HydrophobicContact CG-CE2 4.08Å; L74-I264 HydrophobicContact CD2-CD1 3.92Å
75	S	91.8	Very high	79	Confident	21 Å²	21	58 Å²	58	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-48.2	176.7	-50.4	0	0	0	0	111.1	S116 W118 Y256 Y257	S75-S116 PolarHBondContact N-O 3.5Å; S75-W118 PolarHBondContact OG-NE1 3.16Å; S75-Y256 WeakPolarHBondContact O-CA 3.27Å; S75-Y257 PolarHBondContact O-N 2.81Å
76	Q	91.2	Very high	76.1	Confident	79 Å²	79	60.7 Å²	60.7	37%	0.369	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	151.8	179	58.9	177.4	14.9	0	0	111.5	I78 S116	Q76-I78 HydrophobicContact CG-CG1 3.99Å; Q76-S116 PolarHBondContact N-O 2.77Å; Q76-S116 PolarHBondContact O-N 2.77Å
77	I	89.4	Confident	73.1	Confident	11 Å²	11	65.7 Å²	65.7	6%	0.056	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	111.4	165.1	-59.1	170.9	0	0	0	106.1	L74 T115 Y256 I264 L296	L74-I77 HydrophobicContact CD1-CG1 4.42Å; L74-I77 HydrophobicContact CD2-CD1 4.42Å; L74-I77 HydrophobicContact CD2-CG1 4.13Å; I77-T115 HydrophobicContact CG1-CG2 4.44Å; I77-Y256 HydrophobicContact CD1-CE2 4.5Å; I77-Y256 HydrophobicContact CG1-CE2 4.22Å; I77-I264 HydrophobicContact CD1-CD1 4.11Å; I77-I264 HydrophobicContact CD1-CG1 4.12Å; I77-L296 HydrophobicContact CD1-CD1 4.43Å; I77-L296 HydrophobicContact CD1-CD2 3.57Å
78	I	83.8	Confident	70.2	Confident	77 Å²	77	72.3 Å²	72.3	40%	0.395	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-52.5	-172.4	-65.8	171.9	0	0	0	109.8	Q76 T114 I186	Q76-I78 HydrophobicContact CG-CG1 3.99Å; I78-T114 HydrophobicContact CB-CG2 4.02Å; I78-T114 HydrophobicContact CD1-CG2 4.03Å; I78-T114 HydrophobicContact CG2-CG2 4.37Å; I78-T114 PolarHBondContact N-O 2.9Å; I78-I186 HydrophobicContact CD1-CG2 4.19Å
79	D	74.6	Confident	67.2	Low	48 Å²	48	76.3 Å²	76.3	26%	0.257	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	146.7	-177.1	-168.9	19.6	0	0	0	111.1	R82 T114	D79-R82 PolarHBondContact OD1-N 3.44Å; D79-R82 VanDerWaalsContact OD1-N 3.16Å; D79-R82 PolarHBondContact OD2-N 2.9Å; D79-T114 PolarHBondContact N-O 3.18Å; D79-T114 PolarHBondContact O-N 2.99Å
80	L	68.8	Low	64.3	Low	2 Å²	2	77.3 Å²	77.3	1%	0.01	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	88.7	174.5	-160.3	141.3	0	0	0	106.2	M113 I193 Q203 W262 L296	L80-M113 HydrophobicContact CD1-CB 4.13Å; L80-M113 HydrophobicContact CD1-CG 3.89Å; L80-M113 HydrophobicContact CD1-SD 4.14Å; L80-M113 HydrophobicContact CG-CB 4.47Å; L80-I193 HydrophobicContact CD2-CD1 3.49Å; L80-I193 VanDerWaalsContact CD2-CD1 3.49Å; L80-I193 HydrophobicContact CG-CD1 4.3Å; L80-Q203 HydrophobicContact CD2-CG 4.33Å; L80-W262 HydrophobicContact CB-CZ2 4.33Å; L80-W262 HydrophobicContact CD2-CH2 3.8Å; L80-W262 HydrophobicContact CD2-CZ2 3.4Å; L80-W262 HydrophobicContact CG-CZ2 4.39Å; L80-L296 HydrophobicContact CD1-CD1 3.38Å
81	V	58.5	Low	61.6	Low	42 Å²	42	83.3 Å²	83.3	26%	0.255	44%	0.44	S	S	.	.	S	Bend	trans	56.7	76.5	-176.1	-170.2	0	0	0	0	113.7	I193	V81-I193 HydrophobicContact CG2-CD1 4.33Å; V81-I193 HydrophobicContact CG2-CG1 3.72Å
82	R	49.1	Very low	58.8	Low	120 Å²	120	92.4 Å²	92.4	45%	0.453	47%	0.473	S	S	.	.			trans	-146.5	89.3	144	-90.2	-171.2	-174.9	-171.5	4.8	110.9	D79 F84 Y303	D79-R82 PolarHBondContact OD1-N 3.44Å; D79-R82 VanDerWaalsContact OD1-N 3.16Å; D79-R82 PolarHBondContact OD2-N 2.9Å; R82-F84 PolarHBondContact O-N 3.31Å; R82-Y303 PolarHBondContact NH2-OH 3.42Å
83	L	35.6	Very low	56.3	Low	125 Å²	125	96.7 Å²	96.7	65%	0.654	51%	0.508	S	S	*	.			trans	-76	74.8	160.1	-73.9	170.8	0	0	0	109.8
84	F	35.9	Very low	53.8	Low	151 Å²	151	99.5 Å²	99.5	66%	0.662	54%	0.535	S	S	*	.			trans	-127.8	63	157.6	-102.8	-80.3	0	0	0	108.2	R82 N86	R82-F84 PolarHBondContact O-N 3.31Å; F84-N86 PolarHBondContact O-N 2.83Å
85	E	36.4	Very low	51.2	Low	189 Å²	189	104.5 Å²	104.5	88%	0.883	58%	0.576	S	S	*	*			trans	-78.1	103.5	148.3	-103.4	-177.1	171	0	0	106.9	S87	E85-S87 PolarHBondContact O-N 3.04Å
86	N	31.2	Very low	49	Very low	127 Å²	127	112.3 Å²	112.3	68%	0.679	61%	0.608	S	S	*	*			trans	-46.9	102.1	161.4	-75.5	-36.6	0	0	0	109.5	F84 F88	F84-N86 PolarHBondContact O-N 2.83Å; N86-F88 HydrophobicContact CB-CB 4Å; N86-F88 PolarHBondContact O-N 3.31Å
87	S	32.4	Very low	46.8	Very low	115 Å²	115	116.1 Å²	116.1	80%	0.804	63%	0.63	S	S	*	*			trans	-72	39.7	150.7	48.7	0	0	0	0	110.7	E85 A89	E85-S87 PolarHBondContact O-N 3.04Å; S87-A89 PolarHBondContact O-N 3.44Å
88	F	34.5	Very low	44.6	Very low	194 Å²	194	127.1 Å²	127.1	85%	0.851	67%	0.671	S	S	*	*			trans	-79.6	57.8	167.5	-151	-89.9	0	0	0	109	N86	N86-F88 HydrophobicContact CB-CB 4Å; N86-F88 PolarHBondContact O-N 3.31Å
89	A	32.6	Very low	42.5	Very low	84 Å²	84	129.1 Å²	129.1	69%	0.694	69%	0.689	S	S	*	*	S	Bend	trans	-154.1	108.1	166.4	0	0	0	0	0	108	S87	S87-A89 PolarHBondContact O-N 3.44Å
90	S	33.4	Very low	41	Very low	113 Å²	113	131.8 Å²	131.8	79%	0.79	72%	0.717	S	S	*	*	S	Bend	trans	71.7	108.4	175.2	-152.9	0	0	0	0	114.2
91	T	37.8	Very low	39.5	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	76%	0.758	S	S	*	*				-176.1	135.4	56.5	-43.3	0	0	0	0	108	A93	T91-A93 PolarHBondContact O-N 2.05Å
92	R	35.3	Very low	38.4	Very low	248 Å²	248	139.5 Å²	139.5	94%	0.936	78%	0.778	S	S	*	*			trans	-54.2	119.5	165.6	-84.9	172.2	178.9	156.7	1.4	110.5
93	A	41.6	Very low	37.8	Very low	89 Å²	89	140.2 Å²	140.2	74%	0.736	80%	0.796	S	S	*	*			trans	-163.6	135.8	148.4	0	0	0	0	0	110.2	T91	T91-A93 PolarHBondContact O-N 2.05Å
94	P	42.5	Very low	37.7	Very low	129 Å²	129	143 Å²	143	84%	0.838	81%	0.805	S	S	*	*			trans	-74.2	141.1	178.8	31.2	-33	0	0	0	111.4	F96	P94-F96 PolarHBondContact O-N 2.94Å
95	A	40	Very low	37.6	Very low	105 Å²	105	142.4 Å²	142.4	87%	0.868	81%	0.808	S	S	*	*			trans	-76.9	96.2	-180	0	0	0	0	0	111.5
96	F	44.1	Very low	37.3	Very low	186 Å²	186	140 Å²	140	82%	0.816	80%	0.797	S	S	*	*			trans	-155.7	127.3	157.7	-145.7	-105.9	0	0	0	106.8	P94	P94-F96 PolarHBondContact O-N 2.94Å
97	L	45.2	Very low	37.4	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	80%	0.797	S	S	*	*			trans	83.6	78.5	178.5	-52.6	152	0	0	0	116.9
98	R	42.5	Very low	37.5	Very low	242 Å²	242	141.5 Å²	141.5	91%	0.913	79%	0.787	S	S	*	*			trans	-138.1	127.8	140.8	-76.5	-165	176.1	179.9	-1.6	110.9
99	P	40	Very low	38.3	Very low	119 Å²	119	136 Å²	136	77%	0.773	76%	0.763	S	S	*	*			trans	-77.1	150.1	179.8	31.5	-30.2	0	0	0	111.2	T101	P99-T101 PolarHBondContact O-N 3.25Å; P99-T101 VanDerWaalsContact O-N 3.11Å
100	A	43.6	Very low	39.5	Very low	103 Å²	103	133.7 Å²	133.7	85%	0.851	74%	0.739	S	S	*	*	S	Bend	trans	-73.2	92.9	-174.6	0	0	0	0	0	112.4
101	T	38.2	Very low	41.3	Very low	140 Å²	140	131 Å²	131	86%	0.859	71%	0.714	S	S	*	*			trans	-140.6	88	157.4	53.4	0	0	0	0	108.8	P99	P99-T101 PolarHBondContact O-N 3.25Å; P99-T101 VanDerWaalsContact O-N 3.11Å
102	G	34.8	Very low	43.5	Very low	66 Å²	66	126.7 Å²	126.7	68%	0.68	69%	0.686	S	S	*	*			trans	-175.6	106.9	174.2	0	0	0	0	0	108.6	Q104	G102-Q104 PolarHBondContact O-N 3.04Å
103	V	37.2	Very low	46.1	Very low	136 Å²	136	114.9 Å²	114.9	82%	0.824	64%	0.641	S	S	*	*			trans	-65.9	79.1	164.6	178.1	0	0	0	0	106.6	L105	V103-L105 HydrophobicContact CG1-CD1 4.31Å; V103-L105 HydrophobicContact CG1-CG 3.99Å; V103-L105 PolarHBondContact O-N 3.28Å
104	Q	32.2	Very low	48.3	Very low	182 Å²	182	111.6 Å²	111.6	85%	0.85	61%	0.612	S	S	*	*			trans	-82.2	85.7	158.3	-159.2	103.3	-0.8	0	0	104	G102 Q106	G102-Q104 PolarHBondContact O-N 3.04Å; Q104-Q106 PolarHBondContact O-N 3.12Å; Q104-Q106 VanDerWaalsContact O-N 3.1Å
105	L	33.7	Very low	50.6	Low	140 Å²	140	105.5 Å²	105.5	73%	0.733	57%	0.572	S	S	*	*			trans	-49.9	122.7	164.8	-88.2	155.3	0	0	0	106.3	V103 H107	V103-L105 HydrophobicContact CG1-CD1 4.31Å; V103-L105 HydrophobicContact CG1-CG 3.99Å; V103-L105 PolarHBondContact O-N 3.28Å; L105-H107 PolarHBondContact O-N 3.49Å
106	Q	30.2	Very low	53.1	Low	138 Å²	138	101.6 Å²	101.6	65%	0.645	54%	0.539	S	S	*	.			trans	-50.7	112.3	174.6	-61.9	168	-73.9	0	0	107.5	Q104 E108	Q104-Q106 PolarHBondContact O-N 3.12Å; Q104-Q106 VanDerWaalsContact O-N 3.1Å; Q106-E108 HydrophobicContact CB-CB 3.72Å; Q106-E108 HydrophobicContact CB-CG 3.83Å; Q106-E108 VanDerWaalsContact CD-CD 3.5Å; Q106-E108 HydrophobicContact CG-CG 4.42Å; Q106-E108 VanDerWaalsContact NE2-CD 3.26Å; Q106-E108 PolarHBondContact NE2-OE1 2.68Å; Q106-E108 PolarHBondContact O-N 2.82Å
107	H	34.5	Very low	55.4	Low	144 Å²	144	92.8 Å²	92.8	67%	0.667	50%	0.5	S	S	*	.			trans	-74.1	70.6	152.4	-85	-70.7	0	0	0	106	L105 K109 D110	L105-H107 PolarHBondContact O-N 3.49Å; H107-K109 PolarHBondContact O-N 3.16Å; H107-K109 VanDerWaalsContact O-N 3.09Å; H107-D110 VanDerWaalsContact CA-OD1 3.27Å; H107-D110 WeakPolarHBondContact CA-OD1 3.44Å; H107-D110 WeakPolarHBondContact CB-OD2 3.32Å; H107-D110 IonicContact CE1-OD2 2.73Å; H107-D110 IonicContact CG-OD1 3.64Å; H107-D110 IonicContact CG-OD2 2.75Å; H107-D110 IonicContact ND1-OD1 3.75Å; H107-D110 PolarHBondContact ND1-OD1 2.85Å; H107-D110 IonicContact ND1-OD2 3.16Å; H107-D110 PolarHBondContact ND1-OD2 2.89Å
108	E	33.2	Very low	57.7	Low	129 Å²	129	89.9 Å²	89.9	60%	0.603	48%	0.478	S	S	*	.			trans	-73.6	89.6	-175.8	-132.2	179.1	-171	0	0	107.2	Q106 D110	Q106-E108 HydrophobicContact CB-CB 3.72Å; Q106-E108 HydrophobicContact CB-CG 3.83Å; Q106-E108 VanDerWaalsContact CD-CD 3.5Å; Q106-E108 HydrophobicContact CG-CG 4.42Å; Q106-E108 VanDerWaalsContact NE2-CD 3.26Å; Q106-E108 PolarHBondContact NE2-OE1 2.68Å; Q106-E108 PolarHBondContact O-N 2.82Å; E108-D110 PolarHBondContact N-OD1 3.25Å; E108-D110 PolarHBondContact O-N 3.38Å
109	K	52	Low	60	Low	79 Å²	79	78.3 Å²	78.3	34%	0.343	43%	0.434	S	S	.	.	S	Bend	trans	51.1	54.7	167.5	-66.6	171.5	148.8	-167.5	0	112.9	H107 Q111 T350 I353 P354 A355	H107-K109 PolarHBondContact O-N 3.16Å; H107-K109 VanDerWaalsContact O-N 3.09Å; K109-Q111 PolarHBondContact O-N 3.22Å; K109-T350 PolarHBondContact NZ-O 3.01Å; K109-I353 PolarHBondContact NZ-O 3.14Å; K109-P354 HydrophobicContact CB-CB 4.13Å; K109-P354 HydrophobicContact CD-CB 4.31Å; K109-A355 HydrophobicContact CD-CB 3.84Å; K109-A355 VanDerWaalsContact NZ-N 3.12Å
110	D	57.3	Low	62.6	Low	36 Å²	36	74.4 Å²	74.4	19%	0.193	41%	0.405	C	S	.	.			trans	-58.7	124.1	-162.3	-57.6	-23.3	0	0	0	113.8	H107 E108 I112	H107-D110 VanDerWaalsContact CA-OD1 3.27Å; H107-D110 WeakPolarHBondContact CA-OD1 3.44Å; H107-D110 WeakPolarHBondContact CB-OD2 3.32Å; H107-D110 IonicContact CE1-OD2 2.73Å; H107-D110 IonicContact CG-OD1 3.64Å; H107-D110 IonicContact CG-OD2 2.75Å; H107-D110 IonicContact ND1-OD1 3.75Å; H107-D110 PolarHBondContact ND1-OD1 2.85Å; H107-D110 IonicContact ND1-OD2 3.16Å; H107-D110 PolarHBondContact ND1-OD2 2.89Å; E108-D110 PolarHBondContact N-OD1 3.25Å; E108-D110 PolarHBondContact O-N 3.38Å; D110-I112 HydrophobicContact CB-CB 4.46Å; D110-I112 HydrophobicContact CB-CD1 3.43Å; D110-I112 VanDerWaalsContact CB-CD1 3.43Å; D110-I112 HydrophobicContact CB-CG1 3.71Å; D110-I112 PolarHBondContact O-N 2.87Å
111	Q	72.6	Confident	65.1	Low	57 Å²	57	69.5 Å²	69.5	27%	0.266	37%	0.365	S	S	.	.			trans	-70.8	65.2	172.9	-68.6	176.4	-31.5	0	0	111	K109 C191	K109-Q111 PolarHBondContact O-N 3.22Å; Q111-C191 CarbonylContact C-O 3.55Å; Q111-C191 WeakPolarHBondContact CB-O 3.37Å; Q111-C191 PolarHBondContact O-N 2.89Å
112	I	83.4	Confident	67.8	Low	34 Å²	34	64.1 Å²	64.1	17%	0.174	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.9	-173.5	-61.2	173.1	0	0	0	109.9	D110 A159 K188 S189	D110-I112 HydrophobicContact CB-CB 4.46Å; D110-I112 HydrophobicContact CB-CD1 3.43Å; D110-I112 VanDerWaalsContact CB-CD1 3.43Å; D110-I112 HydrophobicContact CB-CG1 3.71Å; D110-I112 PolarHBondContact O-N 2.87Å; I112-A159 HydrophobicContact CD1-CB 3.66Å; I112-A159 HydrophobicContact CG1-CB 3.62Å; I112-A159 HydrophobicContact CG2-CB 4.23Å; I112-K188 HydrophobicContact CG2-CB 3.85Å; I112-K188 HydrophobicContact CG2-CG 4.44Å; I112-S189 WeakPolarHBondContact CA-O 3.45Å
113	M	88.6	Confident	70.7	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.7	166.5	174.9	-175.7	80.6	0	0	109.2	L80 T115 K188 S189 C191 C205 L207 I294	L80-M113 HydrophobicContact CD1-CB 4.13Å; L80-M113 HydrophobicContact CD1-CG 3.89Å; L80-M113 HydrophobicContact CD1-SD 4.14Å; L80-M113 HydrophobicContact CG-CB 4.47Å; M113-T115 HydrophobicContact CE-CG2 3.57Å; M113-T115 HydrophobicContact CG-CG2 3.89Å; M113-T115 HydrophobicContact SD-CG2 3.86Å; M113-K188 CarbonylContact O-C 3.46Å; M113-K188 WeakPolarHBondContact O-CA 3.41Å; M113-S189 VanDerWaalsContact CE-OG 3.29Å; M113-S189 WeakPolarHBondContact CE-OG 3.48Å; M113-S189 PolarHBondContact N-O 3.09Å; M113-S189 PolarHBondContact O-N 2.87Å; M113-S189 PolarHBondContact O-OG 3.1Å; M113-C191 HydrophobicContact CB-CB 4.13Å; M113-C205 HydrophobicContact CE-CB 3.98Å; M113-C205 HydrophobicContact SD-CB 3.41Å; M113-C205 WeakPolarHBondContact SD-CB 3.34Å; M113-L207 HydrophobicContact CE-CD1 4.18Å; M113-L207 HydrophobicContact CE-CD2 4.22Å; M113-L207 HydrophobicContact CE-CG 3.98Å; M113-I294 HydrophobicContact CE-CD1 4.02Å; M113-I294 HydrophobicContact SD-CD1 4.38Å
114	T	88.8	Confident	73.5	Confident	20 Å²	20	58.7 Å²	58.7	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.8	175	-55.8	0	0	0	0	110	I78 D79 I186 Y187 K188	I78-T114 HydrophobicContact CB-CG2 4.02Å; I78-T114 HydrophobicContact CD1-CG2 4.03Å; I78-T114 HydrophobicContact CG2-CG2 4.37Å; I78-T114 PolarHBondContact N-O 2.9Å; D79-T114 PolarHBondContact N-O 3.18Å; D79-T114 PolarHBondContact O-N 2.99Å; T114-I186 HydrophobicContact CG2-CG2 3.63Å; T114-Y187 WeakPolarHBondContact CA-O 3.45Å; T114-K188 HydrophobicContact CG2-CG 4.27Å
115	T	91.2	Very high	76.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.1	179.6	53.2	0	0	0	0	111.3	L74 I77 M113 I186 Y187	L74-T115 HydrophobicContact CD1-CG2 4.15Å; I77-T115 HydrophobicContact CG1-CG2 4.44Å; M113-T115 HydrophobicContact CE-CG2 3.57Å; M113-T115 HydrophobicContact CG-CG2 3.89Å; M113-T115 HydrophobicContact SD-CG2 3.86Å; T115-I186 CarbonylContact O-C 3.58Å; T115-I186 WeakPolarHBondContact O-CA 3.47Å; T115-Y187 PolarHBondContact N-O 2.59Å; T115-Y187 PolarHBondContact O-N 3.46Å
116	S	91.5	Very high	79.2	Confident	24 Å²	24	46.7 Å²	46.7	17%	0.168	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.8	167.3	178.6	0	0	0	0	108.5	S75 Q76	S75-S116 PolarHBondContact N-O 3.5Å; Q76-S116 PolarHBondContact N-O 2.77Å; Q76-S116 PolarHBondContact O-N 2.77Å
117	V	92.6	Very high	82.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	154.4	-175.6	-56.6	0	0	0	0	110.9	L72 R73 L74 A185 Y187	L72-V117 HydrophobicContact CD1-CB 3.86Å; L72-V117 HydrophobicContact CD1-CG1 4.33Å; L72-V117 HydrophobicContact CD1-CG2 3.78Å; L72-V117 HydrophobicContact CD2-CG1 4.23Å; L72-V117 HydrophobicContact CG-CB 4.16Å; L72-V117 HydrophobicContact CG-CG1 4.26Å; R73-V117 CarbonylContact O-C 3.59Å; R73-V117 WeakPolarHBondContact O-CA 3.06Å; R73-V117 WeakPolarHBondContact O-CB 3.38Å; L74-V117 HydrophobicContact CD1-CG1 3.72Å; V117-A185 PolarHBondContact N-O 3.2Å; V117-A185 PolarHBondContact O-N 3.15Å; V117-Y187 HydrophobicContact CG2-CD2 3.3Å; V117-Y187 HydrophobicContact CG2-CE2 3.5Å
118	W	92.8	Very high	84.9	Confident	98 Å²	98	38.4 Å²	38.4	37%	0.371	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.1	164.6	-59.2	80	0	0	0	108	R73 S75 K120 P184	R73-W118 HydrophobicContact CB-CB 4.24Å; R73-W118 PolarHBondContact N-O 3.5Å; R73-W118 PolarHBondContact O-N 2.92Å; S75-W118 PolarHBondContact OG-NE1 3.16Å; W118-K120 PolarHBondContact O-N 3.09Å; W118-P184 HydrophobicContact CD2-CB 3.97Å; W118-P184 HydrophobicContact CE3-CB 3.8Å; W118-P184 HydrophobicContact CE3-CG 4.23Å; W118-P184 HydrophobicContact CH2-CB 3.88Å; W118-P184 HydrophobicContact CH2-CG 4.02Å; W118-P184 HydrophobicContact CZ2-CB 4.05Å; W118-P184 HydrophobicContact CZ3-CB 3.76Å; W118-P184 HydrophobicContact CZ3-CG 3.79Å
119	L	92.5	Very high	87.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	98.7	177	179	62.1	0	0	0	108.4	L70 L72 Q121 I153 P183 F209	L70-L119 HydrophobicContact CD2-CD1 4.44Å; L72-L119 HydrophobicContact CD1-CD1 4.16Å; L119-Q121 HydrophobicContact CD2-CG 4.42Å; L119-Q121 HydrophobicContact CG-CG 3.97Å; L119-I153 HydrophobicContact CD2-CG2 4.26Å; L119-P183 PolarHBondContact N-O 2.89Å; L119-P183 VanDerWaalsContact N-O 3.1Å; L119-P183 VanDerWaalsContact O-CD 3.22Å; L119-P183 WeakPolarHBondContact O-CD 3.49Å; L119-F209 HydrophobicContact CD2-CD1 4.39Å; L119-F209 HydrophobicContact CD2-CE1 4.22Å
120	K	94.1	Very high	89.7	Confident	36 Å²	36	33.2 Å²	33.2	16%	0.157	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.8	177.8	175.2	178	-178.6	127.3	0	109.9	L70 K71 W118 E122 E182 M224	L70-K120 CarbonylContact C-O 3.48Å; L70-K120 WeakPolarHBondContact CA-O 3.48Å; K71-K120 HydrophobicContact CB-CB 4.3Å; K71-K120 PolarHBondContact N-O 2.92Å; K71-K120 WeakPolarHBondContact O-CB 3.08Å; K71-K120 PolarHBondContact O-N 3.33Å; W118-K120 PolarHBondContact O-N 3.09Å; K120-E122 WeakPolarHBondContact CE-OE1 3.45Å; K120-E122 IonicContact NZ-OE1 2.78Å; K120-E182 HydrophobicContact CB-CG 3.9Å; K120-E182 HydrophobicContact CD-CG 4.41Å; K120-E182 WeakPolarHBondContact CD-OE1 3.47Å; K120-E182 WeakPolarHBondContact CE-OE1 3.45Å; K120-E182 HydrophobicContact CG-CG 3.74Å; K120-E182 VanDerWaalsContact CG-OE1 3.29Å; K120-E182 WeakPolarHBondContact CG-OE1 3.48Å; K120-E182 IonicContact NZ-OE1 2.73Å; K120-E182 PolarHBondContact NZ-OE1 2.91Å; K120-M224 HydrophobicContact CB-CE 4.41Å; K120-M224 HydrophobicContact CB-SD 4.47Å; K120-M224 HydrophobicContact CD-CE 4.25Å; K120-M224 HydrophobicContact CD-SD 3.6Å; K120-M224 VanDerWaalsContact CD-SD 3.6Å; K120-M224 VanDerWaalsContact CE-SD 3.55Å; K120-M224 HydrophobicContact CG-CE 3.62Å; K120-M224 HydrophobicContact CG-SD 3.63Å; K120-M224 WeakPolarHBondContact O-CE 3.21Å
121	Q	94.8	Very high	91.5	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	134.4	-177	-47.5	-174.1	37.7	0	0	109.4	K69 L70 L119 W123 P151 R180 W181	K69-Q121 CarbonylContact O-C 3.56Å; K69-Q121 WeakPolarHBondContact O-CA 3.34Å; L70-Q121 HydrophobicContact CD2-CB 4.1Å; L70-Q121 HydrophobicContact CD2-CG 3.66Å; L119-Q121 HydrophobicContact CD2-CG 4.42Å; L119-Q121 HydrophobicContact CG-CG 3.97Å; Q121-W123 HydrophobicContact CB-CE3 4.31Å; Q121-W123 HydrophobicContact CB-CZ3 3.97Å; Q121-P151 VanDerWaalsContact OE1-CG 3.29Å; Q121-R180 WeakPolarHBondContact O-CA 3.48Å; Q121-W181 PolarHBondContact N-O 3.26Å; Q121-W181 PolarHBondContact O-N 2.9Å
122	E	96.1	Very high	92.4	Very high	27 Å²	27	33.1 Å²	33.1	13%	0.126	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.2	176.2	-75.7	173.8	-174.6	0	0	110.7	K69 K120 L178 V179 R180 M224	K69-E122 HydrophobicContact CB-CB 4.33Å; K69-E122 PolarHBondContact N-O 2.84Å; K69-E122 PolarHBondContact O-N 3.3Å; K120-E122 WeakPolarHBondContact CE-OE1 3.45Å; K120-E122 IonicContact NZ-OE1 2.78Å; E122-L178 HydrophobicContact CB-CD1 4.27Å; E122-V179 VanDerWaalsContact CA-O 3.3Å; E122-V179 WeakPolarHBondContact CA-O 3.43Å; E122-R180 HydrophobicContact CG-CB 3.99Å; E122-R180 HydrophobicContact CG-CG 4.17Å; E122-R180 IonicContact OE1-CZ 2.73Å; E122-R180 IonicContact OE1-NE 2.77Å; E122-R180 PolarHBondContact OE1-NE 3.12Å; E122-R180 IonicContact OE1-NH2 3.83Å; E122-R180 PolarHBondContact OE1-NH2 3.36Å; E122-M224 HydrophobicContact CB-CE 3.66Å; E122-M224 HydrophobicContact CG-CE 3.59Å; E122-M224 HydrophobicContact CG-SD 4.47Å
123	W	95.8	Very high	92.8	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.011	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.5	173.3	68	94.4	0	0	0	110.5	V68 Q121 I148 W149 L150 P151 V179 W181	V68-W123 HydrophobicContact CG2-CB 4.1Å; Q121-W123 HydrophobicContact CB-CE3 4.31Å; Q121-W123 HydrophobicContact CB-CZ3 3.97Å; W123-I148 HydrophobicContact CZ2-CD1 4.35Å; W123-W149 HydrophobicContact CG-CZ3 4.35Å; W123-W149 VanDerWaalsContact CZ2-O 3.25Å; W123-W149 WeakPolarHBondContact CZ2-O 3.23Å; W123-W149 AromaticContact NE1-CE3 3.78Å; W123-W149 AromaticContact NE1-CZ3 3.99Å; W123-L150 HydrophobicContact CH2-CD2 3.74Å; W123-L150 HydrophobicContact CZ2-CD2 4.06Å; W123-P151 HydrophobicContact CE3-CG 4.23Å; W123-P151 HydrophobicContact CZ3-CG 4.25Å; W123-V179 HydrophobicContact CD2-CB 4.01Å; W123-V179 HydrophobicContact CD2-CG1 4.25Å; W123-V179 HydrophobicContact CE3-CG1 4.48Å; W123-V179 HydrophobicContact CG-CB 4.43Å; W123-V179 HydrophobicContact CH2-CB 4.39Å; W123-V179 HydrophobicContact CH2-CG1 3.58Å; W123-V179 HydrophobicContact CZ2-CB 3.86Å; W123-V179 HydrophobicContact CZ2-CG1 3.27Å; W123-V179 HydrophobicContact CZ3-CG1 4.18Å; W123-V179 PolarHBondContact N-O 3.13Å; W123-V179 PolarHBondContact O-N 3.23Å; W123-W181 HydrophobicContact CH2-CB 3.93Å; W123-W181 HydrophobicContact CZ3-CB 3.94Å
124	M	95.4	Very high	92.9	Very high	85 Å²	85	46.3 Å²	46.3	42%	0.419	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.5	176.2	-64.4	-61.4	-61.5	0	0	110	D176 L178	M124-D176 VanDerWaalsContact CE-O 3.23Å; M124-D176 WeakPolarHBondContact CE-O 3.23Å; M124-L178 HydrophobicContact CE-CB 4.41Å; M124-L178 HydrophobicContact SD-CB 3.72Å; M124-L178 HydrophobicContact SD-CD1 3.76Å; M124-L178 HydrophobicContact SD-CG 4.36Å
125	D	95.1	Very high	92.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	22%	0.22	C	C	.	.			trans	-114.2	107.5	173	-168.5	-26	0	0	0	111.5	Y52 P58 K127 L128 G177 V179	Y52-D125 WeakPolarHBondContact CE2-OD2 3.42Å; Y52-D125 PolarHBondContact OH-OD2 2.93Å; P58-D125 HydrophobicContact CB-CB 3.84Å; P58-D125 WeakPolarHBondContact CB-OD1 3.48Å; P58-D125 WeakPolarHBondContact CB-OD2 3.29Å; P58-D125 HydrophobicContact CG-CB 4.28Å; D125-K127 PolarHBondContact O-N 3.45Å; D125-K127 VanDerWaalsContact O-N 3.17Å; D125-K127 WeakPolarHBondContact OD1-CB 3.42Å; D125-K127 PolarHBondContact OD1-N 3.43Å; D125-L128 HydrophobicContact CB-CB 4.2Å; D125-L128 HydrophobicContact CB-CD1 4Å; D125-L128 HydrophobicContact CB-CG 4.13Å; D125-L128 PolarHBondContact O-N 2.87Å; D125-L128 VanDerWaalsContact O-N 3.14Å; D125-L128 WeakPolarHBondContact OD2-CD1 3.46Å; D125-G177 PolarHBondContact N-O 2.94Å; D125-V179 HydrophobicContact CB-CG2 3.85Å
126	N	91.2	Very high	92.7	Very high	68 Å²	68	49.5 Å²	49.5	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.7	-178.7	-68.5	-61.3	0	0	0	114.1	P58 K60	P58-N126 PolarHBondContact O-ND2 3.35Å; K60-N126 HydrophobicContact CG-CB 4.37Å
127	K	90.6	Very high	92.6	Very high	107 Å²	107	50.5 Å²	50.5	47%	0.465	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-15.9	177.4	-70.6	174.7	164.3	-75.9	0	112.6	Y52 D125	Y52-K127 HydrophobicContact CD2-CB 3.95Å; Y52-K127 HydrophobicContact CD2-CD 4.26Å; Y52-K127 HydrophobicContact CE2-CB 3.89Å; Y52-K127 HydrophobicContact CE2-CD 4.25Å; D125-K127 PolarHBondContact O-N 3.45Å; D125-K127 VanDerWaalsContact O-N 3.17Å; D125-K127 WeakPolarHBondContact OD1-CB 3.42Å; D125-K127 PolarHBondContact OD1-N 3.43Å
128	L	92.7	Very high	92.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.267	C	S	.	.	S	Bend	trans	-105.1	44.5	-177.7	-59.1	177.7	0	0	0	111.3	L48 Y52 D125 W130 I148 L173 G177 V179	L48-L128 HydrophobicContact CB-CD2 4.43Å; Y52-L128 HydrophobicContact CD2-CD2 3.78Å; Y52-L128 HydrophobicContact CD2-CG 4.31Å; Y52-L128 HydrophobicContact CE2-CD1 4.15Å; Y52-L128 HydrophobicContact CE2-CD2 3.76Å; Y52-L128 HydrophobicContact CE2-CG 3.8Å; D125-L128 HydrophobicContact CB-CB 4.2Å; D125-L128 HydrophobicContact CB-CD1 4Å; D125-L128 HydrophobicContact CB-CG 4.13Å; D125-L128 PolarHBondContact O-N 2.87Å; D125-L128 VanDerWaalsContact O-N 3.14Å; D125-L128 WeakPolarHBondContact OD2-CD1 3.46Å; L128-W130 WeakPolarHBondContact O-CZ3 3.3Å; L128-I148 HydrophobicContact CD1-CB 4.49Å; L128-I148 HydrophobicContact CD1-CG2 4.02Å; L128-L173 HydrophobicContact CD1-CD1 4.16Å; L128-L173 HydrophobicContact CD1-CD2 3.84Å; L128-G177 WeakPolarHBondContact O-CA 3.31Å; L128-V179 HydrophobicContact CD1-CG2 4.14Å
129	I	93.5	Very high	92.4	Very high	85 Å²	85	55.1 Å²	55.1	44%	0.436	28%	0.28	S	S	.	.			trans	-109.2	136.3	178.8	-60.1	176.3	0	0	0	108.5
130	W	93.4	Very high	92.4	Very high	15 Å²	15	57.8 Å²	57.8	6%	0.057	30%	0.296	C	S	.	.			trans	-144.8	158.9	174.7	68	95.4	0	0	0	111.3	L44 L48 L128 P132 Y135 V138 L141 L173 H174 H175	L44-W130 HydrophobicContact CD1-CB 3.78Å; L44-W130 HydrophobicContact CD1-CD2 4.09Å; L44-W130 HydrophobicContact CD1-CG 3.67Å; L44-W130 HydrophobicContact CD2-CD2 3.92Å; L44-W130 HydrophobicContact CD2-CG 4.04Å; L44-W130 HydrophobicContact CD2-CZ2 4.11Å; L44-W130 HydrophobicContact CG-CG 4.49Å; L48-W130 HydrophobicContact CD1-CD2 4.43Å; L48-W130 HydrophobicContact CD1-CE3 3.78Å; L48-W130 HydrophobicContact CD1-CZ3 4.14Å; L128-W130 WeakPolarHBondContact O-CZ3 3.3Å; W130-P132 WeakPolarHBondContact O-CD 3.21Å; W130-Y135 HydrophobicContact CB-CD2 4.33Å; W130-Y135 HydrophobicContact CB-CE2 4.1Å; W130-V138 PolarHBondContact NE1-O 3.47Å; W130-L141 HydrophobicContact CH2-CB 4.03Å; W130-L141 HydrophobicContact CZ2-CB 4.21Å; W130-L173 HydrophobicContact CH2-CB 4.01Å; W130-L173 HydrophobicContact CZ3-CB 4.21Å; W130-H174 WeakPolarHBondContact CH2-O 3.44Å; W130-H174 WeakPolarHBondContact CZ3-O 3.44Å; W130-H175 HydrophobicContact CD2-CB 3.99Å; W130-H175 HydrophobicContact CG-CB 4.41Å; W130-H175 HydrophobicContact CH2-CB 4.37Å; W130-H175 VanDerWaalsContact CZ2-CA 3.5Å; W130-H175 HydrophobicContact CZ2-CB 3.76Å; W130-H175 PolarHBondContact N-O 3.23Å
131	D	94.3	Very high	92.3	Very high	70 Å²	70	56.4 Å²	56.4	37%	0.374	29%	0.291	S	S	.	.			trans	-88.5	116.4	170.8	-178.3	2	0	0	0	109.4	K133 Q134	D131-K133 PolarHBondContact O-N 3.27Å; D131-K133 WeakPolarHBondContact OD1-CB 3.5Å; D131-K133 PolarHBondContact OD1-N 3.1Å; D131-Q134 HydrophobicContact CB-CG 4.24Å; D131-Q134 PolarHBondContact O-N 2.89Å
132	P	92.7	Very high	92.2	Very high	20 Å²	20	63.4 Å²	63.4	13%	0.13	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-53.1	-28.9	177.8	-27.6	35.8	0	0	0	113.5	W130 Q134 Y135 G137 R139 H175	W130-P132 WeakPolarHBondContact O-CD 3.21Å; P132-Q134 VanDerWaalsContact C-N 3.27Å; P132-Q134 PolarHBondContact O-N 3.21Å; P132-Y135 PolarHBondContact O-N 3.02Å; P132-G137 WeakPolarHBondContact O-CA 3.35Å; P132-G137 PolarHBondContact O-N 3.22Å; P132-R139 HydrophobicContact CB-CG 4.14Å; P132-R139 HydrophobicContact CG-CG 4.1Å; P132-H175 HydrophobicContact CG-CB 3.77Å
133	K	91.1	Very high	92	Very high	187 Å²	187	62.2 Å²	62.2	81%	0.813	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-65.1	-28.6	-179.4	-64.1	179.9	-179.1	178.6	0	113.3	D131	D131-K133 PolarHBondContact O-N 3.27Å; D131-K133 WeakPolarHBondContact OD1-CB 3.5Å; D131-K133 PolarHBondContact OD1-N 3.1Å
134	Q	90.4	Very high	91.8	Very high	125 Å²	125	64.6 Å²	64.6	58%	0.584	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-81	-19.7	-178.6	-64.8	-179.1	6.1	0	0	113.2	R43 D131 P132	R43-Q134 PolarHBondContact NH2-O 3.38Å; D131-Q134 HydrophobicContact CB-CG 4.24Å; D131-Q134 PolarHBondContact O-N 2.89Å; P132-Q134 VanDerWaalsContact C-N 3.27Å; P132-Q134 PolarHBondContact O-N 3.21Å
135	Y	89.8	Confident	91.6	Very high	32 Å²	32	60.6 Å²	60.6	13%	0.125	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-122.3	44.1	-173	-60.3	-88.2	0	0	0	111.7	L44 D47 W130 P132 G137 V138	L44-Y135 HydrophobicContact CB-CD1 3.59Å; L44-Y135 HydrophobicContact CB-CE1 3.99Å; L44-Y135 HydrophobicContact CB-CG 4.07Å; L44-Y135 HydrophobicContact CD1-CD1 3.8Å; L44-Y135 HydrophobicContact CD1-CD2 3.75Å; L44-Y135 HydrophobicContact CD1-CE1 3.73Å; L44-Y135 HydrophobicContact CD1-CE2 3.69Å; L44-Y135 HydrophobicContact CD1-CG 3.8Å; L44-Y135 HydrophobicContact CD2-CG 4.47Å; L44-Y135 HydrophobicContact CG-CD1 4.23Å; L44-Y135 HydrophobicContact CG-CE1 4.47Å; L44-Y135 HydrophobicContact CG-CG 4.33Å; D47-Y135 WeakPolarHBondContact OD2-CE1 3.3Å; D47-Y135 PolarHBondContact OD2-OH 3.4Å; W130-Y135 HydrophobicContact CB-CD2 4.33Å; W130-Y135 HydrophobicContact CB-CE2 4.1Å; P132-Y135 PolarHBondContact O-N 3.02Å; Y135-G137 VanDerWaalsContact C-N 3.27Å; Y135-G137 PolarHBondContact O-N 2.78Å; Y135-V138 VanDerWaalsContact O-CG2 3.25Å; Y135-V138 WeakPolarHBondContact O-CG2 3.24Å; Y135-V138 PolarHBondContact O-N 2.88Å
136	G	85.2	Confident	91.3	Very high	55 Å²	55	65.8 Å²	65.8	57%	0.567	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	22	173	0	0	0	0	0	115.3
137	G	89.8	Confident	91.2	Very high	44 Å²	44	67.1 Å²	67.1	45%	0.454	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	9	179.3	0	0	0	0	0	115.1	P132 Y135 R139	P132-G137 WeakPolarHBondContact O-CA 3.35Å; P132-G137 PolarHBondContact O-N 3.22Å; Y135-G137 VanDerWaalsContact C-N 3.27Å; Y135-G137 PolarHBondContact O-N 2.78Å; G137-R139 PolarHBondContact O-N 3.38Å; G137-R139 VanDerWaalsContact O-N 3.15Å
138	V	89.3	Confident	91.4	Very high	22 Å²	22	62.3 Å²	62.3	13%	0.133	32%	0.317	C	S	.	.			trans	-63.7	113.4	178.6	176.6	0	0	0	0	110.2	A41 L44 W130 Y135	A41-V138 HydrophobicContact CB-CG2 4.4Å; L44-V138 HydrophobicContact CD2-CB 4.45Å; L44-V138 HydrophobicContact CD2-CG1 4Å; W130-V138 PolarHBondContact NE1-O 3.47Å; Y135-V138 VanDerWaalsContact O-CG2 3.25Å; Y135-V138 WeakPolarHBondContact O-CG2 3.24Å; Y135-V138 PolarHBondContact O-N 2.88Å
139	R	91.9	Very high	91.5	Very high	174 Å²	174	62.6 Å²	62.6	66%	0.657	32%	0.318	S	S	*	.			trans	-101	-25.4	178.5	-66.8	-173.5	-174.3	-169.9	1.1	114.2	P132 G137 H175	P132-R139 HydrophobicContact CB-CG 4.14Å; P132-R139 HydrophobicContact CG-CG 4.1Å; G137-R139 PolarHBondContact O-N 3.38Å; G137-R139 VanDerWaalsContact O-N 3.15Å; R139-H175 PolarHBondContact O-N 3.39Å
140	V	93.1	Very high	91.4	Very high	55 Å²	55	60.9 Å²	60.9	33%	0.333	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	136.7	-177.5	-179.3	0	0	0	0	108.1	Y142 L173	V140-Y142 HydrophobicContact CG1-CE2 4.13Å; V140-L173 CarbonylContact C-O 3.53Å; V140-L173 VanDerWaalsContact CA-O 3.31Å; V140-L173 WeakPolarHBondContact CA-O 3.39Å
141	L	91.7	Very high	91.4	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.6	-177.7	-173.5	72.1	0	0	0	109.8	A41 L44 I45 L48 W130 V143 L173	A41-L141 HydrophobicContact CB-CD1 4.18Å; L44-L141 HydrophobicContact CD2-CD1 4.46Å; L44-L141 HydrophobicContact CD2-CD2 4.08Å; L44-L141 HydrophobicContact CG-CD2 4.19Å; I45-L141 HydrophobicContact CD1-CD1 3.95Å; I45-L141 HydrophobicContact CD1-CG 4.47Å; I45-L141 HydrophobicContact CG1-CD1 3.75Å; I45-L141 HydrophobicContact CG1-CD2 3.65Å; I45-L141 HydrophobicContact CG1-CG 4Å; L48-L141 HydrophobicContact CD1-CD2 4.18Å; W130-L141 HydrophobicContact CH2-CB 4.03Å; W130-L141 HydrophobicContact CZ2-CB 4.21Å; L141-V143 HydrophobicContact CD2-CG2 3.79Å; L141-V143 HydrophobicContact CG-CG2 3.85Å; L141-L173 HydrophobicContact CB-CB 4.32Å; L141-L173 HydrophobicContact CD2-CD1 4.37Å; L141-L173 PolarHBondContact N-O 2.91Å; L141-L173 PolarHBondContact O-N 3.26Å
142	Y	92.3	Very high	91.2	Very high	148 Å²	148	59.1 Å²	59.1	58%	0.58	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	111.3	179.9	-65	-93.6	0	0	0	109.9	V140 A171 T172	V140-Y142 HydrophobicContact CG1-CE2 4.13Å; Y142-A171 WeakPolarHBondContact CA-O 3.48Å; Y142-T172 HydrophobicContact CD1-CG2 3.56Å; Y142-T172 HydrophobicContact CE1-CG2 3.22Å
143	V	91.8	Very high	91.1	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.012	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.5	-174.9	-178.3	0	0	0	0	109.8	I45 L49 L141 A145 M147 I148 K170 A171 L173	I45-V143 HydrophobicContact CG1-CG2 4.33Å; L49-V143 HydrophobicContact CD1-CG1 4.29Å; L141-V143 HydrophobicContact CD2-CG2 3.79Å; L141-V143 HydrophobicContact CG-CG2 3.85Å; V143-A145 PolarHBondContact O-N 2.97Å; V143-M147 HydrophobicContact CG1-CB 4.25Å; V143-M147 HydrophobicContact CG1-SD 4.37Å; V143-I148 HydrophobicContact CG1-CG2 4.32Å; V143-K170 CarbonylContact O-C 3.54Å; V143-K170 WeakPolarHBondContact O-CA 2.82Å; V143-A171 PolarHBondContact N-O 3.26Å; V143-A171 PolarHBondContact O-N 3.43Å; V143-L173 HydrophobicContact CB-CD1 4.02Å; V143-L173 HydrophobicContact CG2-CD1 3.53Å; V143-L173 HydrophobicContact CG2-CG 4.3Å
144	P	92.4	Very high	91.1	Very high	52 Å²	52	51 Å²	51	34%	0.338	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	128.4	171.3	-25.4	35.5	0	0	0	111.6	E146 M147	P144-E146 PolarHBondContact O-N 3.06Å; P144-E146 VanDerWaalsContact O-N 3.1Å; P144-M147 HydrophobicContact CB-CE 4.28Å; P144-M147 HydrophobicContact CB-CG 4.37Å; P144-M147 HydrophobicContact CB-SD 4.37Å; P144-M147 HydrophobicContact CG-CE 3.98Å; P144-M147 HydrophobicContact CG-SD 4.19Å; P144-M147 PolarHBondContact O-N 3.43Å; P144-M147 VanDerWaalsContact O-N 3.13Å
145	A	91	Very high	91.2	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.008	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.2	-27.5	-173.7	0	0	0	0	0	113.5	V143 M147 I148 L150 T169 W181	V143-A145 PolarHBondContact O-N 2.97Å; A145-M147 PolarHBondContact O-N 2.92Å; A145-I148 VanDerWaalsContact O-CG1 3.3Å; A145-I148 WeakPolarHBondContact O-CG1 3.4Å; A145-I148 PolarHBondContact O-N 3.09Å; A145-L150 HydrophobicContact CB-CD1 3.98Å; A145-L150 HydrophobicContact CB-CD2 4.02Å; A145-L150 WeakPolarHBondContact O-CD1 3.46Å; A145-T169 VanDerWaalsContact CB-O 3.26Å; A145-T169 WeakPolarHBondContact CB-O 3.36Å; A145-T169 PolarHBondContact N-O 3.24Å; A145-W181 HydrophobicContact CB-CD2 4.48Å; A145-W181 HydrophobicContact CB-CZ2 4.15Å
146	E	88.7	Confident	91.2	Very high	111 Å²	111	46.3 Å²	46.3	52%	0.519	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-67.7	-15.5	-179.5	-62	173.2	-161.8	0	0	114.7	K54 P144 T168	K54-E146 VanDerWaalsContact CD-O 3.3Å; K54-E146 WeakPolarHBondContact CD-O 3.48Å; K54-E146 PolarHBondContact NZ-O 3.37Å; P144-E146 PolarHBondContact O-N 3.06Å; P144-E146 VanDerWaalsContact O-N 3.1Å; E146-T168 HydrophobicContact CG-CG2 4.14Å; E146-T168 WeakPolarHBondContact OE1-CB 3.4Å; E146-T168 WeakPolarHBondContact OE1-CG2 3.32Å; E146-T168 PolarHBondContact OE1-OG1 3.44Å
147	M	90.6	Very high	91.5	Very high	96 Å²	96	44.6 Å²	44.6	47%	0.473	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-89.2	-18.5	-180	-62.3	-177.5	-177.1	0	0	112.9	L49 V143 P144 A145	L49-M147 HydrophobicContact CD1-CB 4.21Å; L49-M147 HydrophobicContact CD1-SD 4.01Å; V143-M147 HydrophobicContact CG1-CB 4.25Å; V143-M147 HydrophobicContact CG1-SD 4.37Å; P144-M147 HydrophobicContact CB-CE 4.28Å; P144-M147 HydrophobicContact CB-CG 4.37Å; P144-M147 HydrophobicContact CB-SD 4.37Å; P144-M147 HydrophobicContact CG-CE 3.98Å; P144-M147 HydrophobicContact CG-SD 4.19Å; P144-M147 PolarHBondContact O-N 3.43Å; P144-M147 VanDerWaalsContact O-N 3.13Å; A145-M147 PolarHBondContact O-N 2.92Å
148	I	93.4	Very high	91.5	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	21%	0.205	C	C	.	.	S	Bend	trans	-109.8	166.8	-177.6	61.2	172.7	0	0	0	111.1	L49 Y52 W123 L128 V143 A145 L150 A171 L173 V179	L49-I148 HydrophobicContact CD2-CG2 4.32Å; Y52-I148 HydrophobicContact CE1-CB 4.3Å; W123-I148 HydrophobicContact CZ2-CD1 4.35Å; L128-I148 HydrophobicContact CD1-CB 4.49Å; L128-I148 HydrophobicContact CD1-CG2 4.02Å; V143-I148 HydrophobicContact CG1-CG2 4.32Å; A145-I148 VanDerWaalsContact O-CG1 3.3Å; A145-I148 WeakPolarHBondContact O-CG1 3.4Å; A145-I148 PolarHBondContact O-N 3.09Å; I148-L150 HydrophobicContact CD1-CD2 4.33Å; I148-L150 HydrophobicContact CG1-CD2 4.09Å; I148-A171 HydrophobicContact CD1-CB 3.68Å; I148-L173 HydrophobicContact CD1-CD2 4.1Å; I148-V179 HydrophobicContact CD1-CG1 3.89Å
149	W	94.5	Very high	91.2	Very high	7 Å²	7	43.6 Å²	43.6	3%	0.027	21%	0.21	C	C	.	.			trans	-69	132.6	171.5	178.4	90.4	0	0	0	109.1	Y52 K54 R57 P58 L66 W123 P151 Y214	Y52-W149 HydrophobicContact CE1-CB 4.46Å; Y52-W149 VanDerWaalsContact OH-CB 3.27Å; Y52-W149 WeakPolarHBondContact OH-CB 3.36Å; Y52-W149 PolarHBondContact OH-N 3.42Å; K54-W149 WeakPolarHBondContact O-CA 3.44Å; K54-W149 WeakPolarHBondContact O-CB 3.48Å; R57-W149 HydrophobicContact CG-CZ2 3.87Å; P58-W149 HydrophobicContact CG-CD2 4.32Å; P58-W149 HydrophobicContact CG-CE3 3.86Å; P58-W149 HydrophobicContact CG-CZ3 4.26Å; L66-W149 HydrophobicContact CD2-CE3 4.29Å; L66-W149 HydrophobicContact CD2-CH2 3.2Å; L66-W149 HydrophobicContact CD2-CZ2 4.1Å; L66-W149 HydrophobicContact CD2-CZ3 3.32Å; W123-W149 HydrophobicContact CG-CZ3 4.35Å; W123-W149 VanDerWaalsContact CZ2-O 3.25Å; W123-W149 WeakPolarHBondContact CZ2-O 3.23Å; W123-W149 AromaticContact NE1-CE3 3.78Å; W123-W149 AromaticContact NE1-CZ3 3.99Å; W149-P151 HydrophobicContact CH2-CB 3.66Å; W149-P151 HydrophobicContact CH2-CG 4.45Å; W149-P151 HydrophobicContact CZ2-CB 4.45Å; W149-P151 HydrophobicContact CZ3-CB 4.01Å; W149-P151 HydrophobicContact CZ3-CG 4.31Å; W149-Y214 HydrophobicContact CZ2-CE2 4.05Å
150	L	92.6	Very high	90.4	Very high	50 Å²	50	36.8 Å²	36.8	26%	0.262	19%	0.191	S	C	.	.			trans	-120.6	139	176	-59.8	173.9	0	0	0	109.1	W123 A145 I148 W181	W123-L150 HydrophobicContact CH2-CD2 3.74Å; W123-L150 HydrophobicContact CZ2-CD2 4.06Å; A145-L150 HydrophobicContact CB-CD1 3.98Å; A145-L150 HydrophobicContact CB-CD2 4.02Å; A145-L150 WeakPolarHBondContact O-CD1 3.46Å; I148-L150 HydrophobicContact CD1-CD2 4.33Å; I148-L150 HydrophobicContact CG1-CD2 4.09Å; L150-W181 HydrophobicContact CD1-CH2 4.01Å; L150-W181 HydrophobicContact CD1-CZ2 4.32Å; L150-W181 HydrophobicContact CD1-CZ3 4.24Å; L150-W181 HydrophobicContact CD2-CD2 4.16Å; L150-W181 HydrophobicContact CD2-CE3 3.98Å; L150-W181 HydrophobicContact CD2-CZ3 4.23Å
151	P	92.6	Very high	89.1	Confident	8 Å²	8	40 Å²	40	5%	0.052	22%	0.216	C	C	.	.			trans	-67.6	140.3	169.9	30.4	-34.7	0	0	0	110.1	V68 Q121 W123 W149 I153	V68-P151 HydrophobicContact CG1-CB 4.39Å; V68-P151 HydrophobicContact CG1-CG 4.11Å; V68-P151 HydrophobicContact CG2-CB 4.2Å; Q121-P151 VanDerWaalsContact OE1-CG 3.29Å; W123-P151 HydrophobicContact CE3-CG 4.23Å; W123-P151 HydrophobicContact CZ3-CG 4.25Å; W149-P151 HydrophobicContact CH2-CB 3.66Å; W149-P151 HydrophobicContact CH2-CG 4.45Å; W149-P151 HydrophobicContact CZ2-CB 4.45Å; W149-P151 HydrophobicContact CZ3-CB 4.01Å; W149-P151 HydrophobicContact CZ3-CG 4.31Å; P151-I153 HydrophobicContact CB-CD1 4.1Å; P151-I153 HydrophobicContact CB-CG1 3.96Å; P151-I153 HydrophobicContact CG-CG1 4.1Å; P151-I153 PolarHBondContact O-N 3.34Å
152	D	90	Very high	88.2	Confident	40 Å²	40	44.6 Å²	44.6	21%	0.214	24%	0.241	C	C	.	.			trans	-82.4	54.9	-178.1	64.8	-25.5	0	0	0	112.1	V154 S211 W212 T213 Y214	D152-V154 PolarHBondContact O-N 3.13Å; D152-S211 WeakPolarHBondContact O-CA 3.29Å; D152-S211 WeakPolarHBondContact OD1-CB 3.48Å; D152-S211 PolarHBondContact OD1-OG 3.45Å; D152-S211 PolarHBondContact OD2-OG 3.42Å; D152-W212 PolarHBondContact O-N 3.03Å; D152-W212 VanDerWaalsContact O-N 3.14Å; D152-W212 PolarHBondContact OD2-N 3.29Å; D152-T213 WeakPolarHBondContact OD2-CB 3.49Å; D152-T213 PolarHBondContact OD2-N 3.46Å; D152-T213 PolarHBondContact OD2-OG1 2.88Å; D152-Y214 VanDerWaalsContact OD1-CD2 3.3Å; D152-Y214 WeakPolarHBondContact OD1-CD2 3.49Å
153	I	91.7	Very high	86.8	Confident	12 Å²	12	43.8 Å²	43.8	6%	0.062	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	115.3	179.9	-50.6	-54.7	0	0	0	109.5	L70 L119 P151 F209 L221	L70-I153 HydrophobicContact CD1-CG2 3.99Å; L70-I153 HydrophobicContact CD2-CG1 4.34Å; L119-I153 HydrophobicContact CD2-CG2 4.26Å; P151-I153 HydrophobicContact CB-CD1 4.1Å; P151-I153 HydrophobicContact CB-CG1 3.96Å; P151-I153 HydrophobicContact CG-CG1 4.1Å; P151-I153 PolarHBondContact O-N 3.34Å; I153-F209 HydrophobicContact CG2-CB 4.09Å; I153-F209 HydrophobicContact CG2-CD1 4.13Å; I153-L221 HydrophobicContact CD1-CD1 4.18Å; I153-L221 HydrophobicContact CD1-CD2 3.47Å; I153-L221 VanDerWaalsContact CD1-CD2 3.47Å; I153-L221 HydrophobicContact CD1-CG 4.46Å
154	V	91	Very high	85.4	Confident	25 Å²	25	49.6 Å²	49.6	15%	0.152	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	156.8	-178.1	-62.9	0	0	0	0	111.1	D152 Y156 F209 G210 W212	D152-V154 PolarHBondContact O-N 3.13Å; V154-Y156 HydrophobicContact CG2-CD1 3.87Å; V154-Y156 HydrophobicContact CG2-CE1 3.8Å; V154-F209 WeakPolarHBondContact O-CA 3.21Å; V154-G210 PolarHBondContact N-O 2.92Å; V154-G210 PolarHBondContact O-N 3.21Å; V154-G210 VanDerWaalsContact O-N 3.1Å; V154-W212 HydrophobicContact CG1-CB 4.47Å; V154-W212 HydrophobicContact CG2-CB 3.85Å; V154-W212 HydrophobicContact CG2-CD2 4.44Å; V154-W212 HydrophobicContact CG2-CE3 3.89Å; V154-W212 HydrophobicContact CG2-CG 4.48Å
155	L	91.7	Very high	84.2	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.1	171.6	-177.7	71	0	0	0	109.5	N157 N158 Y187 L207 F209	L155-N157 VanDerWaalsContact CD1-OD1 3.27Å; L155-N157 WeakPolarHBondContact CD1-OD1 3.15Å; L155-N158 HydrophobicContact CB-CB 4.39Å; L155-N158 HydrophobicContact CD2-CB 4.14Å; L155-N158 HydrophobicContact CG-CB 4.34Å; L155-N158 WeakPolarHBondContact O-CB 3.19Å; L155-Y187 HydrophobicContact CB-CD1 4.21Å; L155-Y187 HydrophobicContact CB-CE1 4.32Å; L155-Y187 HydrophobicContact CD2-CD1 3.84Å; L155-Y187 HydrophobicContact CD2-CG 4.03Å; L155-L207 HydrophobicContact CD1-CB 4.01Å; L155-L207 HydrophobicContact CD1-CD2 3.84Å; L155-L207 HydrophobicContact CD2-CD2 4.05Å; L155-F209 HydrophobicContact CB-CD1 4.46Å; L155-F209 HydrophobicContact CB-CE1 4.18Å; L155-F209 HydrophobicContact CD1-CD1 4.48Å; L155-F209 HydrophobicContact CD1-CE1 4.22Å; L155-F209 HydrophobicContact CD1-CE2 4.31Å; L155-F209 HydrophobicContact CD1-CZ 4.14Å
156	Y	90.6	Very high	82.9	Confident	54 Å²	54	53.2 Å²	53.2	21%	0.212	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-36.4	-177.6	-70.2	-14.1	0	0	0	113.3	V154 N158 K208 S211 W212 D289	V154-Y156 HydrophobicContact CG2-CD1 3.87Å; V154-Y156 HydrophobicContact CG2-CE1 3.8Å; Y156-N158 VanDerWaalsContact C-N 3.29Å; Y156-N158 PolarHBondContact O-N 2.95Å; Y156-K208 HydrophobicContact CD2-CD 3.89Å; Y156-K208 HydrophobicContact CD2-CG 3.99Å; Y156-K208 PolarHBondContact N-O 3.43Å; Y156-S211 PolarHBondContact OH-O 3.47Å; Y156-W212 HydrophobicContact CD1-CE3 4.26Å; Y156-W212 HydrophobicContact CD1-CZ3 4.39Å; Y156-W212 HydrophobicContact CE1-CE3 4.02Å; Y156-W212 HydrophobicContact CE1-CZ3 4.48Å; Y156-D289 HydrophobicContact CE2-CB 4.24Å
157	N	90.9	Very high	82.1	Confident	19 Å²	19	52.4 Å²	52.4	10%	0.102	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	36.2	-179.9	67.5	-45.4	0	0	0	112.7	L155 S189 M190 H206 K208	L155-N157 VanDerWaalsContact CD1-OD1 3.27Å; L155-N157 WeakPolarHBondContact CD1-OD1 3.15Å; N157-S189 CarbonylContact O-C 3.6Å; N157-S189 WeakPolarHBondContact O-CA 3.35Å; N157-M190 PolarHBondContact ND2-O 2.74Å; N157-M190 PolarHBondContact O-N 3.24Å; N157-H206 PolarHBondContact ND2-O 3.23Å; N157-K208 PolarHBondContact OD1-N 3.14Å
158	N	88.8	Confident	81.4	Confident	14 Å²	14	51.5 Å²	51.5	8%	0.075	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-70.7	127.7	176.9	-172.6	22.4	0	0	0	111	L155 Y156 A160 N162 Y163 K188	L155-N158 HydrophobicContact CB-CB 4.39Å; L155-N158 HydrophobicContact CD2-CB 4.14Å; L155-N158 HydrophobicContact CG-CB 4.34Å; L155-N158 WeakPolarHBondContact O-CB 3.19Å; Y156-N158 VanDerWaalsContact C-N 3.29Å; Y156-N158 PolarHBondContact O-N 2.95Å; N158-A160 PolarHBondContact ND2-O 3.44Å; N158-A160 VanDerWaalsContact ND2-O 3.11Å; N158-A160 PolarHBondContact OD1-N 3.22Å; N158-N162 PolarHBondContact ND2-O 3.09Å; N158-Y163 HydrophobicContact CB-CD1 4.09Å; N158-Y163 HydrophobicContact CB-CE1 4.06Å; N158-K188 CarbonylContact C-O 3.51Å; N158-K188 WeakPolarHBondContact CA-O 3.39Å; N158-K188 PolarHBondContact OD1-O 2.97Å
159	A	83	Confident	81.2	Confident	30 Å²	30	53 Å²	53	25%	0.248	30%	0.299	C	S	.	.			trans	-89.5	-16.3	176	0	0	0	0	0	113	I112 K188 M190	I112-A159 HydrophobicContact CD1-CB 3.66Å; I112-A159 HydrophobicContact CG1-CB 3.62Å; I112-A159 HydrophobicContact CG2-CB 4.23Å; A159-K188 PolarHBondContact N-O 2.92Å; A159-M190 HydrophobicContact CB-CE 4.35Å; A159-M190 HydrophobicContact CB-CG 3.7Å
160	A	76.5	Confident	81.2	Confident	32 Å²	32	59.1 Å²	59.1	26%	0.264	33%	0.326	S	S	.	.	S	Bend	trans	-86.4	150.9	177.4	0	0	0	0	0	111.5	N158 N162 K188	N158-A160 PolarHBondContact ND2-O 3.44Å; N158-A160 VanDerWaalsContact ND2-O 3.11Å; N158-A160 PolarHBondContact OD1-N 3.22Å; A160-N162 PolarHBondContact O-N 2.92Å; A160-K188 HydrophobicContact CB-CB 4.24Å; A160-K188 HydrophobicContact CB-CD 4.24Å
161	S	65.1	Low	81.3	Confident	121 Å²	121	56.8 Å²	56.8	85%	0.846	31%	0.314	S	S	*	.	S	Bend	trans	-66.5	-19.5	177.6	58.7	0	0	0	0	114.1
162	N	72.1	Confident	81.4	Confident	105 Å²	105	57.7 Å²	57.7	56%	0.561	32%	0.319	S	S	*	.			trans	-101.9	119.8	-178.3	-156.9	-1	0	0	0	110.6	N158 A160 N164	N158-N162 PolarHBondContact ND2-O 3.09Å; A160-N162 PolarHBondContact O-N 2.92Å; N162-N164 PolarHBondContact OD1-N 3.41Å
163	Y	63.8	Low	81.6	Confident	131 Å²	131	55.9 Å²	55.9	51%	0.514	31%	0.31	S	S	.	.			trans	-92.1	-14.4	179.8	-60.3	-86.6	0	0	0	112.9	N158	N158-Y163 HydrophobicContact CB-CD1 4.09Å; N158-Y163 HydrophobicContact CB-CE1 4.06Å
164	N	62.3	Low	81.8	Confident	125 Å²	125	57.6 Å²	57.6	67%	0.668	32%	0.317	S	S	*	.	S	Bend	trans	-85.2	142.5	-174.8	-70.2	-5.1	0	0	0	111.5	N162 S166	N162-N164 PolarHBondContact OD1-N 3.41Å; N164-S166 PolarHBondContact O-N 3.16Å
165	I	66.2	Low	82	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.185	33%	0.325	C	S	.	.			trans	-59.4	122.1	171.3	-59.6	175.3	0	0	0	107.9	I167 W181 P183 A185	I165-I167 VanDerWaalsContact C-N 3.25Å; I165-I167 WeakPolarHBondContact CG2-O 3.22Å; I165-I167 PolarHBondContact O-N 3.43Å; I165-W181 HydrophobicContact CD1-CH2 3.73Å; I165-W181 HydrophobicContact CD1-CZ2 4.39Å; I165-W181 HydrophobicContact CD1-CZ3 4.28Å; I165-P183 HydrophobicContact CD1-CB 4.06Å; I165-P183 HydrophobicContact CD1-CG 3.68Å; I165-P183 HydrophobicContact CG2-CB 3.77Å; I165-A185 HydrophobicContact CG2-CB 4.47Å
166	S	63.9	Low	82.1	Confident	92 Å²	92	63.1 Å²	63.1	64%	0.643	34%	0.344	S	S	*	.	S	Bend	trans	-70.1	-19.6	-172.6	52.1	0	0	0	0	114.1	N164	N164-S166 PolarHBondContact O-N 3.16Å
167	I	72	Confident	82.3	Confident	94 Å²	94	60.6 Å²	60.6	48%	0.482	33%	0.334	S	S	.	.	S	Bend	trans	-129.3	111.4	-176.5	-56.7	173.8	0	0	0	108.8	I165 T169	I165-I167 VanDerWaalsContact C-N 3.25Å; I165-I167 WeakPolarHBondContact CG2-O 3.22Å; I165-I167 PolarHBondContact O-N 3.43Å; I167-T169 HydrophobicContact CG2-CG2 4.33Å; I167-T169 PolarHBondContact O-N 2.94Å
168	T	76.4	Confident	82.5	Confident	78 Å²	78	61.5 Å²	61.5	48%	0.479	34%	0.339	S	S	.	.			trans	-81.5	113.2	171.8	48.1	0	0	0	0	109.5	E146	E146-T168 HydrophobicContact CG-CG2 4.14Å; E146-T168 WeakPolarHBondContact OE1-CB 3.4Å; E146-T168 WeakPolarHBondContact OE1-CG2 3.32Å; E146-T168 PolarHBondContact OE1-OG1 3.44Å
169	T	90.2	Very high	82.9	Confident	36 Å²	36	60.8 Å²	60.8	22%	0.221	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-92	167.4	174.9	55.9	0	0	0	0	111.2	A145 I167 W181 P184	A145-T169 VanDerWaalsContact CB-O 3.26Å; A145-T169 WeakPolarHBondContact CB-O 3.36Å; A145-T169 PolarHBondContact N-O 3.24Å; I167-T169 HydrophobicContact CG2-CG2 4.33Å; I167-T169 PolarHBondContact O-N 2.94Å; T169-W181 PolarHBondContact OG1-NE1 3.47Å; T169-P184 VanDerWaalsContact CG2-CD 3.45Å; T169-P184 HydrophobicContact CG2-CG 4.26Å
170	K	93	Very high	83.5	Confident	136 Å²	136	63 Å²	63	59%	0.591	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	140.1	170.1	-63.1	-177.8	-177.9	-179.9	0	109.8	V143	V143-K170 CarbonylContact O-C 3.54Å; V143-K170 WeakPolarHBondContact O-CA 2.82Å
171	A	94.3	Very high	84.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	146.2	168.8	0	0	0	0	0	110.2	Y142 V143 I148 V179 W181	Y142-A171 WeakPolarHBondContact CA-O 3.48Å; V143-A171 PolarHBondContact N-O 3.26Å; V143-A171 PolarHBondContact O-N 3.43Å; I148-A171 HydrophobicContact CD1-CB 3.68Å; A171-V179 HydrophobicContact CB-CG1 4.33Å; A171-W181 HydrophobicContact CB-CB 4.22Å; A171-W181 HydrophobicContact CB-CG 4.35Å
172	T	95	Very high	85.7	Confident	27 Å²	27	59.1 Å²	59.1	17%	0.166	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.9	171.7	44.1	0	0	0	0	109.3	Y142 R180	Y142-T172 HydrophobicContact CD1-CG2 3.56Å; Y142-T172 HydrophobicContact CE1-CG2 3.22Å; T172-R180 PolarHBondContact N-O 3.01Å; T172-R180 PolarHBondContact O-N 3.17Å; T172-R180 VanDerWaalsContact OG1-CB 3.26Å; T172-R180 WeakPolarHBondContact OG1-CB 3.49Å; T172-R180 PolarHBondContact OG1-O 3.05Å
173	L	95.4	Very high	86.7	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.016	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.3	173.7	-53.7	-179.7	0	0	0	108.8	L128 W130 V140 L141 V143 I148 V179	L128-L173 HydrophobicContact CD1-CD1 4.16Å; L128-L173 HydrophobicContact CD1-CD2 3.84Å; W130-L173 HydrophobicContact CH2-CB 4.01Å; W130-L173 HydrophobicContact CZ3-CB 4.21Å; V140-L173 CarbonylContact C-O 3.53Å; V140-L173 VanDerWaalsContact CA-O 3.31Å; V140-L173 WeakPolarHBondContact CA-O 3.39Å; L141-L173 HydrophobicContact CB-CB 4.32Å; L141-L173 HydrophobicContact CD2-CD1 4.37Å; L141-L173 PolarHBondContact N-O 2.91Å; L141-L173 PolarHBondContact O-N 3.26Å; V143-L173 HydrophobicContact CB-CD1 4.02Å; V143-L173 HydrophobicContact CG2-CD1 3.53Å; V143-L173 HydrophobicContact CG2-CG 4.3Å; I148-L173 HydrophobicContact CD1-CD2 4.1Å; L173-V179 HydrophobicContact CD2-CB 4.08Å; L173-V179 HydrophobicContact CD2-CG1 3.7Å; L173-V179 HydrophobicContact CD2-CG2 3.57Å
174	H	95.8	Very high	88	Confident	47 Å²	47	49.2 Å²	49.2	22%	0.218	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	151.6	170.7	-68.6	-97.7	0	0	0	110.3	W130 D176 G177 L178	W130-H174 WeakPolarHBondContact CH2-O 3.44Å; W130-H174 WeakPolarHBondContact CZ3-O 3.44Å; H174-D176 WeakPolarHBondContact CB-OD1 3.47Å; H174-D176 PolarHBondContact O-N 3.11Å; H174-D176 VanDerWaalsContact O-N 3.1Å; H174-G177 PolarHBondContact O-N 3.3Å; H174-L178 HydrophobicContact CB-CB 4.09Å; H174-L178 PolarHBondContact N-O 3.06Å
175	H	94.4	Very high	89.2	Confident	68 Å²	68	43.5 Å²	43.5	32%	0.315	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20	-175	72.5	82.7	0	0	0	114.9	W130 P132 R139 G177	W130-H175 HydrophobicContact CD2-CB 3.99Å; W130-H175 HydrophobicContact CG-CB 4.41Å; W130-H175 HydrophobicContact CH2-CB 4.37Å; W130-H175 VanDerWaalsContact CZ2-CA 3.5Å; W130-H175 HydrophobicContact CZ2-CB 3.76Å; W130-H175 PolarHBondContact N-O 3.23Å; P132-H175 HydrophobicContact CG-CB 3.77Å; R139-H175 PolarHBondContact O-N 3.39Å; H175-G177 VanDerWaalsContact C-N 3.26Å
176	D	94.9	Very high	90.3	Very high	77 Å²	77	46.7 Å²	46.7	41%	0.412	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-2.7	176.2	60.8	-7.6	0	0	0	113.3	M124 H174 L178	M124-D176 VanDerWaalsContact CE-O 3.23Å; M124-D176 WeakPolarHBondContact CE-O 3.23Å; H174-D176 WeakPolarHBondContact CB-OD1 3.47Å; H174-D176 PolarHBondContact O-N 3.11Å; H174-D176 VanDerWaalsContact O-N 3.1Å; D176-L178 WeakPolarHBondContact OD1-CB 3.29Å; D176-L178 PolarHBondContact OD1-N 2.95Å
177	G	93.5	Very high	91.5	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.01	22%	0.216	C	C	.	.	S	Bend	trans	91.7	2.6	-176.6	0	0	0	0	0	113.9	D125 L128 H174 H175 V179	D125-G177 PolarHBondContact N-O 2.94Å; L128-G177 WeakPolarHBondContact O-CA 3.31Å; H174-G177 PolarHBondContact O-N 3.3Å; H175-G177 VanDerWaalsContact C-N 3.26Å; G177-V179 PolarHBondContact O-N 3.47Å
178	L	96.4	Very high	92.3	Very high	38 Å²	38	43.3 Å²	43.3	20%	0.199	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.3	173.5	177.9	69.2	0	0	0	109.8	E122 M124 H174 D176	E122-L178 HydrophobicContact CB-CD1 4.27Å; M124-L178 HydrophobicContact CE-CB 4.41Å; M124-L178 HydrophobicContact SD-CB 3.72Å; M124-L178 HydrophobicContact SD-CD1 3.76Å; M124-L178 HydrophobicContact SD-CG 4.36Å; H174-L178 HydrophobicContact CB-CB 4.09Å; H174-L178 PolarHBondContact N-O 3.06Å; D176-L178 WeakPolarHBondContact OD1-CB 3.29Å; D176-L178 PolarHBondContact OD1-N 2.95Å
179	V	96.5	Very high	93	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	124.6	173	-175.1	0	0	0	0	108.5	E122 W123 D125 L128 I148 A171 L173 G177	E122-V179 VanDerWaalsContact CA-O 3.3Å; E122-V179 WeakPolarHBondContact CA-O 3.43Å; W123-V179 HydrophobicContact CD2-CB 4.01Å; W123-V179 HydrophobicContact CD2-CG1 4.25Å; W123-V179 HydrophobicContact CE3-CG1 4.48Å; W123-V179 HydrophobicContact CG-CB 4.43Å; W123-V179 HydrophobicContact CH2-CB 4.39Å; W123-V179 HydrophobicContact CH2-CG1 3.58Å; W123-V179 HydrophobicContact CZ2-CB 3.86Å; W123-V179 HydrophobicContact CZ2-CG1 3.27Å; W123-V179 HydrophobicContact CZ3-CG1 4.18Å; W123-V179 PolarHBondContact N-O 3.13Å; W123-V179 PolarHBondContact O-N 3.23Å; D125-V179 HydrophobicContact CB-CG2 3.85Å; L128-V179 HydrophobicContact CD1-CG2 4.14Å; I148-V179 HydrophobicContact CD1-CG1 3.89Å; A171-V179 HydrophobicContact CB-CG1 4.33Å; L173-V179 HydrophobicContact CD2-CB 4.08Å; L173-V179 HydrophobicContact CD2-CG1 3.7Å; L173-V179 HydrophobicContact CD2-CG2 3.57Å; G177-V179 PolarHBondContact O-N 3.47Å
180	R	95.9	Very high	92.9	Very high	77 Å²	77	42.5 Å²	42.5	29%	0.291	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.4	172.4	168.8	-172.7	-73.1	160.9	2.7	109.3	Q121 E122 T172 E182	Q121-R180 WeakPolarHBondContact O-CA 3.48Å; E122-R180 HydrophobicContact CG-CB 3.99Å; E122-R180 HydrophobicContact CG-CG 4.17Å; E122-R180 IonicContact OE1-CZ 2.73Å; E122-R180 IonicContact OE1-NE 2.77Å; E122-R180 PolarHBondContact OE1-NE 3.12Å; E122-R180 IonicContact OE1-NH2 3.83Å; E122-R180 PolarHBondContact OE1-NH2 3.36Å; T172-R180 PolarHBondContact N-O 3.01Å; T172-R180 PolarHBondContact O-N 3.17Å; T172-R180 VanDerWaalsContact OG1-CB 3.26Å; T172-R180 WeakPolarHBondContact OG1-CB 3.49Å; T172-R180 PolarHBondContact OG1-O 3.05Å; R180-E182 VanDerWaalsContact CD-OE1 3.29Å; R180-E182 WeakPolarHBondContact CD-OE1 3.28Å; R180-E182 HydrophobicContact CG-CG 4.09Å; R180-E182 IonicContact NE-OE1 3.73Å
181	W	94.7	Very high	92.7	Very high	16 Å²	16	36.1 Å²	36.1	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	126	179.3	-175.5	46.9	0	0	0	110.1	Q121 W123 A145 L150 I165 T169 A171 P183	Q121-W181 PolarHBondContact N-O 3.26Å; Q121-W181 PolarHBondContact O-N 2.9Å; W123-W181 HydrophobicContact CH2-CB 3.93Å; W123-W181 HydrophobicContact CZ3-CB 3.94Å; A145-W181 HydrophobicContact CB-CD2 4.48Å; A145-W181 HydrophobicContact CB-CZ2 4.15Å; L150-W181 HydrophobicContact CD1-CH2 4.01Å; L150-W181 HydrophobicContact CD1-CZ2 4.32Å; L150-W181 HydrophobicContact CD1-CZ3 4.24Å; L150-W181 HydrophobicContact CD2-CD2 4.16Å; L150-W181 HydrophobicContact CD2-CE3 3.98Å; L150-W181 HydrophobicContact CD2-CZ3 4.23Å; I165-W181 HydrophobicContact CD1-CH2 3.73Å; I165-W181 HydrophobicContact CD1-CZ2 4.39Å; I165-W181 HydrophobicContact CD1-CZ3 4.28Å; T169-W181 PolarHBondContact OG1-NE1 3.47Å; A171-W181 HydrophobicContact CB-CB 4.22Å; A171-W181 HydrophobicContact CB-CG 4.35Å; W181-P183 VanDerWaalsContact C-CD 3.48Å; W181-P183 HydrophobicContact CD2-CG 3.96Å; W181-P183 HydrophobicContact CE3-CG 4.13Å; W181-P183 HydrophobicContact CH2-CB 4.49Å; W181-P183 HydrophobicContact CH2-CG 3.95Å; W181-P183 HydrophobicContact CZ2-CB 3.9Å; W181-P183 HydrophobicContact CZ2-CG 3.72Å; W181-P183 HydrophobicContact CZ3-CG 4.14Å
182	E	92.9	Very high	92.2	Very high	55 Å²	55	43.5 Å²	43.5	26%	0.257	21%	0.207	S	C	.	.			trans	-130.5	70.4	-173.5	-53.3	-170.8	179.9	0	0	110.3	K120 R180	K120-E182 HydrophobicContact CB-CG 3.9Å; K120-E182 HydrophobicContact CD-CG 4.41Å; K120-E182 WeakPolarHBondContact CD-OE1 3.47Å; K120-E182 WeakPolarHBondContact CE-OE1 3.45Å; K120-E182 HydrophobicContact CG-CG 3.74Å; K120-E182 VanDerWaalsContact CG-OE1 3.29Å; K120-E182 WeakPolarHBondContact CG-OE1 3.48Å; K120-E182 IonicContact NZ-OE1 2.73Å; K120-E182 PolarHBondContact NZ-OE1 2.91Å; R180-E182 VanDerWaalsContact CD-OE1 3.29Å; R180-E182 WeakPolarHBondContact CD-OE1 3.28Å; R180-E182 HydrophobicContact CG-CG 4.09Å; R180-E182 IonicContact NE-OE1 3.73Å
183	P	92.3	Very high	91.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.204	C	C	.	.			trans	-70	135.4	176	25.3	-35.3	0	0	0	112.3	L119 I165 W181	L119-P183 PolarHBondContact N-O 2.89Å; L119-P183 VanDerWaalsContact N-O 3.1Å; L119-P183 VanDerWaalsContact O-CD 3.22Å; L119-P183 WeakPolarHBondContact O-CD 3.49Å; I165-P183 HydrophobicContact CD1-CB 4.06Å; I165-P183 HydrophobicContact CD1-CG 3.68Å; I165-P183 HydrophobicContact CG2-CB 3.77Å; W181-P183 VanDerWaalsContact C-CD 3.48Å; W181-P183 HydrophobicContact CD2-CG 3.96Å; W181-P183 HydrophobicContact CE3-CG 4.13Å; W181-P183 HydrophobicContact CH2-CB 4.49Å; W181-P183 HydrophobicContact CH2-CG 3.95Å; W181-P183 HydrophobicContact CZ2-CB 3.9Å; W181-P183 HydrophobicContact CZ2-CG 3.72Å; W181-P183 HydrophobicContact CZ3-CG 4.14Å
184	P	91.5	Very high	90.9	Very high	27 Å²	27	46.5 Å²	46.5	18%	0.175	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	135.4	164.8	31.2	-30.4	0	0	0	109.6	W118 T169	W118-P184 HydrophobicContact CD2-CB 3.97Å; W118-P184 HydrophobicContact CE3-CB 3.8Å; W118-P184 HydrophobicContact CE3-CG 4.23Å; W118-P184 HydrophobicContact CH2-CB 3.88Å; W118-P184 HydrophobicContact CH2-CG 4.02Å; W118-P184 HydrophobicContact CZ2-CB 4.05Å; W118-P184 HydrophobicContact CZ3-CB 3.76Å; W118-P184 HydrophobicContact CZ3-CG 3.79Å; T169-P184 VanDerWaalsContact CG2-CD 3.45Å; T169-P184 HydrophobicContact CG2-CG 4.26Å
185	A	88.3	Confident	90.3	Very high	6 Å²	6	44.4 Å²	44.4	5%	0.05	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146.5	177.4	0	0	0	0	0	111.1	V117 I165 Y187	V117-A185 PolarHBondContact N-O 3.2Å; V117-A185 PolarHBondContact O-N 3.15Å; I165-A185 HydrophobicContact CG2-CB 4.47Å; A185-Y187 HydrophobicContact CB-CD2 4.08Å; A185-Y187 HydrophobicContact CB-CE1 4.15Å; A185-Y187 HydrophobicContact CB-CE2 3.54Å
186	I	88.8	Confident	89.8	Confident	103 Å²	103	43.9 Å²	43.9	53%	0.528	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	105.3	166.7	-60.3	173.9	0	0	0	106.7	I78 T114 T115	I78-I186 HydrophobicContact CD1-CG2 4.19Å; T114-I186 HydrophobicContact CG2-CG2 3.63Å; T115-I186 CarbonylContact O-C 3.58Å; T115-I186 WeakPolarHBondContact O-CA 3.47Å
187	Y	89.6	Confident	89.4	Confident	16 Å²	16	42.6 Å²	42.6	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.4	177.8	-71.2	-60.6	0	0	0	110.8	T114 T115 V117 L155 A185 F209	T114-Y187 WeakPolarHBondContact CA-O 3.45Å; T115-Y187 PolarHBondContact N-O 2.59Å; T115-Y187 PolarHBondContact O-N 3.46Å; V117-Y187 HydrophobicContact CG2-CD2 3.3Å; V117-Y187 HydrophobicContact CG2-CE2 3.5Å; L155-Y187 HydrophobicContact CB-CD1 4.21Å; L155-Y187 HydrophobicContact CB-CE1 4.32Å; L155-Y187 HydrophobicContact CD2-CD1 3.84Å; L155-Y187 HydrophobicContact CD2-CG 4.03Å; A185-Y187 HydrophobicContact CB-CD2 4.08Å; A185-Y187 HydrophobicContact CB-CE1 4.15Å; A185-Y187 HydrophobicContact CB-CE2 3.54Å; Y187-F209 HydrophobicContact CD2-CE1 4.26Å; Y187-F209 AromaticContact CD2-CZ 3.78Å; Y187-F209 HydrophobicContact CD2-CZ 3.78Å; Y187-F209 HydrophobicContact CE1-CE1 4.18Å; Y187-F209 AromaticContact CE2-CE1 3.65Å; Y187-F209 HydrophobicContact CE2-CE1 3.65Å; Y187-F209 AromaticContact CE2-CZ 3.49Å; Y187-F209 HydrophobicContact CE2-CZ 3.49Å; Y187-F209 VanDerWaalsContact CE2-CZ 3.49Å; Y187-F209 HydrophobicContact CG-CZ 4.48Å; Y187-F209 AromaticContact CZ-CE1 3.61Å; Y187-F209 AromaticContact CZ-CZ 3.96Å
188	K	88.7	Confident	88.9	Confident	98 Å²	98	43 Å²	43	43%	0.426	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	98.9	170.6	-64.5	-168.8	-179	-174	0	108.2	I112 M113 T114 N158 A159 A160	I112-K188 HydrophobicContact CG2-CB 3.85Å; I112-K188 HydrophobicContact CG2-CG 4.44Å; M113-K188 CarbonylContact O-C 3.46Å; M113-K188 WeakPolarHBondContact O-CA 3.41Å; T114-K188 HydrophobicContact CG2-CG 4.27Å; N158-K188 CarbonylContact C-O 3.51Å; N158-K188 WeakPolarHBondContact CA-O 3.39Å; N158-K188 PolarHBondContact OD1-O 2.97Å; A159-K188 PolarHBondContact N-O 2.92Å; A160-K188 HydrophobicContact CB-CB 4.24Å; A160-K188 HydrophobicContact CB-CD 4.24Å
189	S	90.3	Very high	88.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	142.8	-179.8	56.5	0	0	0	0	111.8	I112 M113 N157 C191	I112-S189 WeakPolarHBondContact CA-O 3.45Å; M113-S189 VanDerWaalsContact CE-OG 3.29Å; M113-S189 WeakPolarHBondContact CE-OG 3.48Å; M113-S189 PolarHBondContact N-O 3.09Å; M113-S189 PolarHBondContact O-N 2.87Å; M113-S189 PolarHBondContact O-OG 3.1Å; N157-S189 CarbonylContact O-C 3.6Å; N157-S189 WeakPolarHBondContact O-CA 3.35Å; S189-C191 PolarHBondContact O-N 3.24Å
190	M	88.2	Confident	87.9	Confident	98 Å²	98	42.9 Å²	42.9	48%	0.483	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	120.7	167.5	-62.4	-178.6	-174.1	0	0	109.2	N157 A159	N157-M190 PolarHBondContact ND2-O 2.74Å; N157-M190 PolarHBondContact O-N 3.24Å; A159-M190 HydrophobicContact CB-CE 4.35Å; A159-M190 HydrophobicContact CB-CG 3.7Å
191	C	89.1	Confident	87.5	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.014	19%	0.187	C	C	.	.			trans	-136.8	113.5	176.7	179	0	0	0	0	109.9	Q111 M113 S189 I193 C205	Q111-C191 CarbonylContact C-O 3.55Å; Q111-C191 WeakPolarHBondContact CB-O 3.37Å; Q111-C191 PolarHBondContact O-N 2.89Å; M113-C191 HydrophobicContact CB-CB 4.13Å; S189-C191 PolarHBondContact O-N 3.24Å; C191-I193 PolarHBondContact O-N 3.35Å; C191-C205 HydrophobicContact CB-CB 3.78Å; C191-C205 WeakPolarHBondContact CB-SG 3.12Å; C191-C205 WeakPolarHBondContact SG-CA 3.36Å; C191-C205 WeakPolarHBondContact SG-CB 3.48Å; C191-C205 CovalentContact SG-SG 2.03Å; C191-C205 PolarHBondContact SG-SG 3.45Å
192	F	83.3	Confident	87.2	Confident	154 Å²	154	42 Å²	42	68%	0.675	20%	0.2	S	C	*	.			trans	-71	118.9	178.4	-63.8	-73.7	0	0	0	110.7
193	I	81.3	Confident	87	Confident	19 Å²	19	39.5 Å²	39.5	10%	0.097	19%	0.188	C	C	.	.			trans	-85.5	124.7	-179.6	-56.6	-50.3	0	0	0	110.1	L80 V81 C191 V195 Q203	L80-I193 HydrophobicContact CD2-CD1 3.49Å; L80-I193 VanDerWaalsContact CD2-CD1 3.49Å; L80-I193 HydrophobicContact CG-CD1 4.3Å; V81-I193 HydrophobicContact CG2-CD1 4.33Å; V81-I193 HydrophobicContact CG2-CG1 3.72Å; C191-I193 PolarHBondContact O-N 3.35Å; I193-V195 HydrophobicContact CG2-CG1 4.03Å; I193-Q203 HydrophobicContact CD1-CG 4.41Å
194	N	81.9	Confident	87	Confident	75 Å²	75	43.3 Å²	43.3	40%	0.401	21%	0.212	S	C	.	.			trans	-87.2	109.4	169.9	-173.6	-6.5	0	0	0	110.1	E196 Q203	N194-E196 VanDerWaalsContact OD1-CB 3.31Å; N194-E196 WeakPolarHBondContact OD1-CB 3.47Å; N194-E196 PolarHBondContact OD1-N 3.19Å; N194-Q203 PolarHBondContact O-NE2 2.78Å
195	V	83.5	Confident	87.1	Confident	3 Å²	3	42 Å²	42	2%	0.018	20%	0.203	C	C	.	.			trans	-90.5	-1.7	-178.2	-59.9	0	0	0	0	114.2	I193 W197 F198 P354 T356 V359 P361	I193-V195 HydrophobicContact CG2-CG1 4.03Å; V195-W197 PolarHBondContact O-N 3.15Å; V195-W197 VanDerWaalsContact O-N 3.09Å; V195-F198 WeakPolarHBondContact O-CB 3.45Å; V195-F198 PolarHBondContact O-N 3.29Å; V195-F198 VanDerWaalsContact O-N 3.15Å; V195-P354 HydrophobicContact CG1-CG 3.8Å; V195-T356 WeakPolarHBondContact CG2-OG1 3.47Å; V195-V359 HydrophobicContact CG2-CG2 3.88Å; V195-P361 HydrophobicContact CB-CB 4.47Å; V195-P361 VanDerWaalsContact O-CA 3.29Å; V195-P361 WeakPolarHBondContact O-CA 3.17Å; V195-P361 WeakPolarHBondContact O-CB 3.32Å
196	E	84.6	Confident	87.4	Confident	57 Å²	57	44.6 Å²	44.6	27%	0.266	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.8	-171.7	-175.3	176	-167.6	0	0	113	N194 V359 P361 L362	N194-E196 VanDerWaalsContact OD1-CB 3.31Å; N194-E196 WeakPolarHBondContact OD1-CB 3.47Å; N194-E196 PolarHBondContact OD1-N 3.19Å; E196-V359 HydrophobicContact CB-CG2 4.11Å; E196-P361 CarbonylContact O-C 3.56Å; E196-L362 PolarHBondContact O-N 3.26Å
197	W	86.5	Confident	87.6	Confident	49 Å²	49	39.7 Å²	39.7	19%	0.186	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106	8.5	-174.7	-57.7	109.1	0	0	0	114.2	V195 F200 L362 R552 P554	V195-W197 PolarHBondContact O-N 3.15Å; V195-W197 VanDerWaalsContact O-N 3.09Å; W197-F200 CarbonylContact O-C 3.49Å; W197-F200 VanDerWaalsContact O-C 3.27Å; W197-F200 VanDerWaalsContact O-CA 3.25Å; W197-F200 WeakPolarHBondContact O-CA 3.18Å; W197-F200 VanDerWaalsContact O-CB 3.29Å; W197-F200 WeakPolarHBondContact O-CB 3.45Å; W197-F200 PolarHBondContact O-N 3.02Å; W197-L362 HydrophobicContact CE3-CB 4.48Å; W197-L362 HydrophobicContact CE3-CD1 4.16Å; W197-L362 HydrophobicContact CE3-CD2 4.26Å; W197-L362 HydrophobicContact CZ3-CD1 3.95Å; W197-R552 HydrophobicContact CH2-CB 4.49Å; W197-R552 HydrophobicContact CH2-CG 3.77Å; W197-R552 VanDerWaalsContact CH2-O 3.32Å; W197-R552 WeakPolarHBondContact CH2-O 3.44Å; W197-R552 HydrophobicContact CZ3-CB 4.09Å; W197-R552 HydrophobicContact CZ3-CG 3.86Å; W197-R552 WeakPolarHBondContact CZ3-O 3.5Å; W197-P554 HydrophobicContact CD2-CG 3.99Å; W197-P554 VanDerWaalsContact CE3-CD 3.49Å; W197-P554 HydrophobicContact CG-CG 4.09Å
198	F	83.7	Confident	87.8	Confident	10 Å²	10	40.4 Å²	40.4	4%	0.044	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	133.5	-179.1	-178.9	-86.5	0	0	0	112.1	V195 Y303 I352 I353 P361 I363	V195-F198 WeakPolarHBondContact O-CB 3.45Å; V195-F198 PolarHBondContact O-N 3.29Å; V195-F198 VanDerWaalsContact O-N 3.15Å; F198-Y303 HydrophobicContact CE1-CD1 4.34Å; F198-Y303 AromaticContact CZ-CD1 3.92Å; F198-Y303 HydrophobicContact CZ-CD1 3.92Å; F198-Y303 AromaticContact CZ-CE1 3.72Å; F198-Y303 HydrophobicContact CZ-CE1 3.72Å; F198-Y303 HydrophobicContact CZ-CG 4.42Å; F198-I352 HydrophobicContact CZ-CG2 4.1Å; F198-I353 HydrophobicContact CD1-CD1 3.84Å; F198-I353 HydrophobicContact CD1-CG1 4.19Å; F198-I353 HydrophobicContact CE1-CD1 4.04Å; F198-I353 HydrophobicContact CE1-CG1 4.02Å; F198-P361 HydrophobicContact CB-CB 4.29Å; F198-I363 HydrophobicContact CD1-CG2 3.76Å; F198-I363 HydrophobicContact CE1-CG2 4.35Å
199	P	85.1	Confident	88.1	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.1	10.6	5.2	38.2	-38.4	0	0	0	115.1	D201 Y303	P199-D201 VanDerWaalsContact C-N 3.26Å; P199-D201 VanDerWaalsContact C-OD1 3.25Å; P199-D201 PolarHBondContact O-N 3.13Å; P199-Y303 HydrophobicContact CB-CD2 3.88Å; P199-Y303 HydrophobicContact CB-CG 3.81Å
200	F	85.8	Confident	88.3	Confident	32 Å²	32	35.8 Å²	35.8	14%	0.14	17%	0.172	C	C	.	.	S	Bend	trans	-95.7	36.3	-179.7	-68.1	-69	0	0	0	110.5	W197 P300 I308 A553 S555	W197-F200 CarbonylContact O-C 3.49Å; W197-F200 VanDerWaalsContact O-C 3.27Å; W197-F200 VanDerWaalsContact O-CA 3.25Å; W197-F200 WeakPolarHBondContact O-CA 3.18Å; W197-F200 VanDerWaalsContact O-CB 3.29Å; W197-F200 WeakPolarHBondContact O-CB 3.45Å; W197-F200 PolarHBondContact O-N 3.02Å; F200-P300 HydrophobicContact CD1-CB 3.78Å; F200-P300 HydrophobicContact CD1-CG 3.96Å; F200-P300 HydrophobicContact CE1-CB 3.62Å; F200-P300 HydrophobicContact CE1-CG 3.75Å; F200-P300 HydrophobicContact CZ-CB 4.33Å; F200-I308 HydrophobicContact CE2-CD1 3.89Å; F200-I308 HydrophobicContact CZ-CD1 4.26Å; F200-A553 HydrophobicContact CB-CB 4.05Å; F200-A553 HydrophobicContact CD2-CB 4.15Å; F200-A553 HydrophobicContact CG-CB 4.19Å; F200-S555 WeakPolarHBondContact CB-OG 3.36Å; F200-S555 PolarHBondContact O-OG 2.85Å
201	D	86.5	Confident	88.5	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.011	15%	0.151	C	C	.	.			trans	-94	150.6	-171	56.8	-55.5	0	0	0	113.9	P199 Q203 R298	P199-D201 VanDerWaalsContact C-N 3.26Å; P199-D201 VanDerWaalsContact C-OD1 3.25Å; P199-D201 PolarHBondContact O-N 3.13Å; D201-Q203 PolarHBondContact OD2-NE2 3.06Å; D201-R298 PolarHBondContact O-N 3Å; D201-R298 WeakPolarHBondContact OD1-CD 3.28Å; D201-R298 IonicContact OD1-CZ 3.25Å; D201-R298 IonicContact OD1-NE 2.94Å; D201-R298 PolarHBondContact OD1-NE 2.72Å; D201-R298 IonicContact OD1-NH2 3.52Å; D201-R298 IonicContact OD2-CZ 3.35Å; D201-R298 IonicContact OD2-NE 3.1Å; D201-R298 PolarHBondContact OD2-NE 3.15Å; D201-R298 IonicContact OD2-NH2 2.74Å; D201-R298 PolarHBondContact OD2-NH2 3.31Å
202	E	89.2	Confident	88.4	Confident	72 Å²	72	39.5 Å²	39.5	34%	0.336	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.2	168.4	-70.6	174.3	-148.4	0	0	109.2	L265 L296 R297 R560	E202-L265 HydrophobicContact CG-CD1 4.45Å; E202-L296 CarbonylContact C-O 3.27Å; E202-L296 VanDerWaalsContact CA-O 3.3Å; E202-L296 WeakPolarHBondContact CA-O 3.14Å; E202-R297 HydrophobicContact CG-CG 4.46Å; E202-R560 IonicContact OE1-NH2 3.9Å; E202-R560 PolarHBondContact OE1-NH2 3.46Å; E202-R560 IonicContact OE2-CZ 2.72Å; E202-R560 IonicContact OE2-NH1 3.79Å; E202-R560 IonicContact OE2-NH2 2.78Å; E202-R560 PolarHBondContact OE2-NH2 2.94Å
203	Q	89.7	Confident	88.7	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.8	-178.8	-55	-57.4	-23.7	0	0	110.1	L80 I193 N194 D201 W262 L296	L80-Q203 HydrophobicContact CD2-CG 4.33Å; I193-Q203 HydrophobicContact CD1-CG 4.41Å; N194-Q203 PolarHBondContact O-NE2 2.78Å; D201-Q203 PolarHBondContact OD2-NE2 3.06Å; Q203-W262 HydrophobicContact CB-CZ3 4.36Å; Q203-W262 HydrophobicContact CG-CH2 3.58Å; Q203-W262 HydrophobicContact CG-CZ3 3.7Å; Q203-L296 HydrophobicContact CB-CB 4.44Å; Q203-L296 PolarHBondContact N-O 3.28Å; Q203-L296 PolarHBondContact O-N 2.88Å
204	T	91.8	Very high	89.1	Confident	81 Å²	81	38.1 Å²	38.1	50%	0.497	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	95.8	175.8	-61.4	0	0	0	0	108.6	Y293 N295	T204-Y293 HydrophobicContact CG2-CD1 4.11Å; T204-N295 WeakPolarHBondContact CG2-OD1 3.38Å; T204-N295 PolarHBondContact OG1-OD1 3.16Å
205	C	93.6	Very high	89.5	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	151.8	176.1	-63.9	0	0	0	0	110.8	M113 C191 Y293 I294	M113-C205 HydrophobicContact CE-CB 3.98Å; M113-C205 HydrophobicContact SD-CB 3.41Å; M113-C205 WeakPolarHBondContact SD-CB 3.34Å; C191-C205 HydrophobicContact CB-CB 3.78Å; C191-C205 WeakPolarHBondContact CB-SG 3.12Å; C191-C205 WeakPolarHBondContact SG-CA 3.36Å; C191-C205 WeakPolarHBondContact SG-CB 3.48Å; C191-C205 CovalentContact SG-SG 2.03Å; C191-C205 PolarHBondContact SG-SG 3.45Å; C205-Y293 CarbonylContact O-C 3.58Å; C205-Y293 WeakPolarHBondContact O-CA 3.34Å; C205-I294 PolarHBondContact N-O 3.13Å; C205-I294 PolarHBondContact O-N 3.46Å
206	H	93.9	Very high	89.8	Confident	60 Å²	60	37.9 Å²	37.9	28%	0.278	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	148.5	179.1	60.8	-88	0	0	0	112.4	N157 T291 Y292 Y293	N157-H206 PolarHBondContact ND2-O 3.23Å; H206-T291 HydrophobicContact CB-CG2 3.76Å; H206-Y292 CarbonylContact C-O 3.6Å; H206-Y292 WeakPolarHBondContact CA-O 3.27Å; H206-Y293 HydrophobicContact CB-CD1 3.71Å; H206-Y293 HydrophobicContact CB-CE1 3.86Å; H206-Y293 HydrophobicContact CB-CG 4.27Å
207	L	93.8	Very high	90	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	111	173.8	-69.1	160.4	0	0	0	107.9	L72 M113 L155 F209 T291 Y292 I294	L72-L207 HydrophobicContact CD2-CD1 3.85Å; M113-L207 HydrophobicContact CE-CD1 4.18Å; M113-L207 HydrophobicContact CE-CD2 4.22Å; M113-L207 HydrophobicContact CE-CG 3.98Å; L155-L207 HydrophobicContact CD1-CB 4.01Å; L155-L207 HydrophobicContact CD1-CD2 3.84Å; L155-L207 HydrophobicContact CD2-CD2 4.05Å; L207-F209 HydrophobicContact CB-CD2 4.38Å; L207-F209 HydrophobicContact CB-CE2 3.82Å; L207-T291 WeakPolarHBondContact O-CA 3.35Å; L207-Y292 PolarHBondContact N-O 2.93Å; L207-Y292 PolarHBondContact O-N 3.29Å; L207-I294 HydrophobicContact CD1-CD1 4.3Å
208	K	93.9	Very high	90.3	Very high	31 Å²	31	40.7 Å²	40.7	14%	0.135	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	99.7	-174.7	-172.5	179.2	-172.3	-167.5	0	110.8	Y156 N157 Y276 D289 T291	Y156-K208 HydrophobicContact CD2-CD 3.89Å; Y156-K208 HydrophobicContact CD2-CG 3.99Å; Y156-K208 PolarHBondContact N-O 3.43Å; N157-K208 PolarHBondContact OD1-N 3.14Å; K208-Y276 PolarHBondContact NZ-OH 3.2Å; K208-D289 WeakPolarHBondContact CE-OD2 3.48Å; K208-D289 HydrophobicContact CG-CB 4.23Å; K208-D289 IonicContact NZ-OD2 3.82Å; K208-T291 HydrophobicContact CB-CG2 4.44Å
209	F	94.6	Very high	90.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.4	177.7	-69.1	-81.1	0	0	0	111.4	L72 L119 I153 V154 L155 Y187 L207 D289 I290 Y292	L72-F209 HydrophobicContact CD1-CE2 3.95Å; L72-F209 HydrophobicContact CD1-CZ 4.17Å; L72-F209 HydrophobicContact CD2-CE2 4.41Å; L119-F209 HydrophobicContact CD2-CD1 4.39Å; L119-F209 HydrophobicContact CD2-CE1 4.22Å; I153-F209 HydrophobicContact CG2-CB 4.09Å; I153-F209 HydrophobicContact CG2-CD1 4.13Å; V154-F209 WeakPolarHBondContact O-CA 3.21Å; L155-F209 HydrophobicContact CB-CD1 4.46Å; L155-F209 HydrophobicContact CB-CE1 4.18Å; L155-F209 HydrophobicContact CD1-CD1 4.48Å; L155-F209 HydrophobicContact CD1-CE1 4.22Å; L155-F209 HydrophobicContact CD1-CE2 4.31Å; L155-F209 HydrophobicContact CD1-CZ 4.14Å; Y187-F209 HydrophobicContact CD2-CE1 4.26Å; Y187-F209 AromaticContact CD2-CZ 3.78Å; Y187-F209 HydrophobicContact CD2-CZ 3.78Å; Y187-F209 HydrophobicContact CE1-CE1 4.18Å; Y187-F209 AromaticContact CE2-CE1 3.65Å; Y187-F209 HydrophobicContact CE2-CE1 3.65Å; Y187-F209 AromaticContact CE2-CZ 3.49Å; Y187-F209 HydrophobicContact CE2-CZ 3.49Å; Y187-F209 VanDerWaalsContact CE2-CZ 3.49Å; Y187-F209 HydrophobicContact CG-CZ 4.48Å; Y187-F209 AromaticContact CZ-CE1 3.61Å; Y187-F209 AromaticContact CZ-CZ 3.96Å; L207-F209 HydrophobicContact CB-CD2 4.38Å; L207-F209 HydrophobicContact CB-CE2 3.82Å; F209-D289 CarbonylContact O-C 3.49Å; F209-D289 VanDerWaalsContact O-CA 3.24Å; F209-D289 WeakPolarHBondContact O-CA 3.46Å; F209-D289 WeakPolarHBondContact O-CB 3.39Å; F209-I290 PolarHBondContact N-O 2.65Å; F209-I290 PolarHBondContact O-N 2.97Å; F209-Y292 AromaticContact CD2-CD2 3.72Å; F209-Y292 HydrophobicContact CD2-CD2 3.72Å; F209-Y292 AromaticContact CD2-CE2 3.79Å; F209-Y292 HydrophobicContact CD2-CE2 3.79Å; F209-Y292 HydrophobicContact CE2-CD2 4.08Å; F209-Y292 HydrophobicContact CE2-CE2 4.32Å
210	G	93.4	Very high	91.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	165.5	174.2	0	0	0	0	0	111	V154	V154-G210 PolarHBondContact N-O 2.92Å; V154-G210 PolarHBondContact O-N 3.21Å; V154-G210 VanDerWaalsContact O-N 3.1Å
211	S	92.6	Very high	91.5	Very high	4 Å²	4	40 Å²	40	3%	0.028	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	137.5	168.5	171.8	0	0	0	0	109.4	D152 Y156 T213 Y214	D152-S211 WeakPolarHBondContact O-CA 3.29Å; D152-S211 WeakPolarHBondContact OD1-CB 3.48Å; D152-S211 PolarHBondContact OD1-OG 3.45Å; D152-S211 PolarHBondContact OD2-OG 3.42Å; Y156-S211 PolarHBondContact OH-O 3.47Å; S211-T213 PolarHBondContact OG-N 2.83Å; S211-Y214 VanDerWaalsContact OG-CB 3.31Å; S211-Y214 WeakPolarHBondContact OG-CB 3.34Å; S211-Y214 PolarHBondContact OG-N 2.64Å
212	W	88.2	Confident	91.8	Very high	175 Å²	175	43.4 Å²	43.4	66%	0.663	21%	0.206	S	C	*	.	S	Bend	trans	-74	-39.3	176.6	-172.1	-110.5	0	0	0	112.4	D152 V154 Y156	D152-W212 PolarHBondContact O-N 3.03Å; D152-W212 VanDerWaalsContact O-N 3.14Å; D152-W212 PolarHBondContact OD2-N 3.29Å; V154-W212 HydrophobicContact CG1-CB 4.47Å; V154-W212 HydrophobicContact CG2-CB 3.85Å; V154-W212 HydrophobicContact CG2-CD2 4.44Å; V154-W212 HydrophobicContact CG2-CE3 3.89Å; V154-W212 HydrophobicContact CG2-CG 4.48Å; Y156-W212 HydrophobicContact CD1-CE3 4.26Å; Y156-W212 HydrophobicContact CD1-CZ3 4.39Å; Y156-W212 HydrophobicContact CE1-CE3 4.02Å; Y156-W212 HydrophobicContact CE1-CZ3 4.48Å
213	T	88.8	Confident	92	Very high	88 Å²	88	40.9 Å²	40.9	54%	0.54	19%	0.194	S	C	.	.	S	Bend	trans	-108.2	-31.4	-168	-41.3	0	0	0	0	112.9	D152 S211	D152-T213 WeakPolarHBondContact OD2-CB 3.49Å; D152-T213 PolarHBondContact OD2-N 3.46Å; D152-T213 PolarHBondContact OD2-OG1 2.88Å; S211-T213 PolarHBondContact OG-N 2.83Å
214	Y	90.3	Very high	92.2	Very high	55 Å²	55	42.3 Å²	42.3	22%	0.216	20%	0.201	C	C	.	.			trans	-94.4	136.6	-172.3	-61.3	-64.9	0	0	0	112.8	R57 W149 D152 S211 H218 V219	R57-Y214 HydrophobicContact CG-CE1 3.99Å; R57-Y214 HydrophobicContact CG-CE2 4.42Å; R57-Y214 WeakPolarHBondContact CG-OH 3.48Å; W149-Y214 HydrophobicContact CZ2-CE2 4.05Å; D152-Y214 VanDerWaalsContact OD1-CD2 3.3Å; D152-Y214 WeakPolarHBondContact OD1-CD2 3.49Å; S211-Y214 VanDerWaalsContact OG-CB 3.31Å; S211-Y214 WeakPolarHBondContact OG-CB 3.34Å; S211-Y214 PolarHBondContact OG-N 2.64Å; Y214-H218 HydrophobicContact CD1-CB 3.71Å; Y214-H218 HydrophobicContact CG-CB 4.19Å; Y214-V219 HydrophobicContact CD1-CG2 4.43Å; Y214-V219 HydrophobicContact CD2-CG2 3.68Å; Y214-V219 HydrophobicContact CE2-CG2 4.46Å; Y214-V219 HydrophobicContact CG-CB 4.47Å; Y214-V219 HydrophobicContact CG-CG2 3.65Å
215	T	90.8	Very high	92	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	19%	0.189	C	C	.	.			trans	-89.8	174.5	171.1	58.2	0	0	0	0	111.5	E217 H218 V219 F283 F287	T215-E217 PolarHBondContact O-N 3.29Å; T215-E217 VanDerWaalsContact O-N 3.1Å; T215-H218 PolarHBondContact O-N 3.16Å; T215-H218 PolarHBondContact OG1-ND1 3.17Å; T215-V219 PolarHBondContact O-N 3.01Å; T215-F283 HydrophobicContact CG2-CB 4.17Å; T215-F283 HydrophobicContact CG2-CD1 3.95Å; T215-F283 HydrophobicContact CG2-CG 4.2Å; T215-F287 HydrophobicContact CG2-CD1 4.25Å; T215-F287 HydrophobicContact CG2-CD2 4.36Å; T215-F287 HydrophobicContact CG2-CE1 3.8Å; T215-F287 HydrophobicContact CG2-CE2 3.93Å; T215-F287 HydrophobicContact CG2-CZ 3.64Å
216	E	89.6	Confident	91.5	Very high	70 Å²	70	46.4 Å²	46.4	33%	0.327	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-28.1	175.5	176.2	166.5	-127.5	0	0	114.4	H218 R271 D286 I288	E216-H218 PolarHBondContact O-N 2.91Å; E216-R271 IonicContact OE1-NH2 2.86Å; E216-D286 WeakPolarHBondContact CB-O 3.45Å; E216-D286 PolarHBondContact N-O 2.69Å; E216-I288 HydrophobicContact CB-CD1 3.66Å; E216-I288 HydrophobicContact CB-CG1 3.94Å; E216-I288 HydrophobicContact CG-CD1 3.65Å; E216-I288 HydrophobicContact CG-CG1 4.26Å
217	E	89	Confident	90.9	Very high	100 Å²	100	46.7 Å²	46.7	47%	0.467	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-17.7	175.5	-83.7	179.9	175.1	0	0	114	T215 K285	T215-E217 PolarHBondContact O-N 3.29Å; T215-E217 VanDerWaalsContact O-N 3.1Å; E217-K285 VanDerWaalsContact CD-CG 3.45Å; E217-K285 HydrophobicContact CG-CB 4.45Å; E217-K285 HydrophobicContact CG-CD 4.13Å; E217-K285 HydrophobicContact CG-CG 3.73Å; E217-K285 WeakPolarHBondContact OE1-CE 3.27Å; E217-K285 VanDerWaalsContact OE1-CG 3.29Å; E217-K285 WeakPolarHBondContact OE1-CG 3.43Å
218	H	91.6	Very high	90.4	Very high	65 Å²	65	49.6 Å²	49.6	30%	0.301	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-46.1	-174.1	-60.2	90.5	0	0	0	111.3	R57 L66 Y214 T215 E216	R57-H218 PolarHBondContact NH1-O 2.94Å; L66-H218 PolarHBondContact N-O 3.33Å; Y214-H218 HydrophobicContact CD1-CB 3.71Å; Y214-H218 HydrophobicContact CG-CB 4.19Å; T215-H218 PolarHBondContact O-N 3.16Å; T215-H218 PolarHBondContact OG1-ND1 3.17Å; E216-H218 PolarHBondContact O-N 2.91Å
219	V	92.8	Very high	90.1	Very high	4 Å²	4	52 Å²	52	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.9	-178.3	176.2	0	0	0	0	108.6	L66 V68 Y214 T215 L221	L66-V219 WeakPolarHBondContact O-CA 3.23Å; V68-V219 HydrophobicContact CB-CG1 4.28Å; V68-V219 HydrophobicContact CG2-CG1 3.87Å; Y214-V219 HydrophobicContact CD1-CG2 4.43Å; Y214-V219 HydrophobicContact CD2-CG2 3.68Å; Y214-V219 HydrophobicContact CE2-CG2 4.46Å; Y214-V219 HydrophobicContact CG-CB 4.47Å; Y214-V219 HydrophobicContact CG-CG2 3.65Å; T215-V219 PolarHBondContact O-N 3.01Å; V219-L221 HydrophobicContact CG1-CD2 4Å; V219-L221 HydrophobicContact CG1-CG 4.3Å
220	D	93.8	Very high	89.6	Confident	27 Å²	27	58.5 Å²	58.5	14%	0.144	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.3	171.9	179.9	26.2	0	0	0	109.2	V65 L66 T67 V68 Q222 R271 I288	V65-D220 HydrophobicContact CG1-CB 3.69Å; L66-D220 PolarHBondContact O-N 3.41Å; T67-D220 WeakPolarHBondContact CA-O 3.3Å; V68-D220 PolarHBondContact N-O 3.27Å; D220-Q222 PolarHBondContact OD2-NE2 3.15Å; D220-R271 IonicContact OD1-CZ 2.7Å; D220-R271 IonicContact OD1-NE 3.88Å; D220-R271 IonicContact OD1-NH2 3.52Å; D220-R271 PolarHBondContact OD1-NH2 2.94Å; D220-I288 HydrophobicContact CB-CD1 4.47Å; D220-I288 WeakPolarHBondContact OD1-CD1 3.24Å
221	L	94.3	Very high	89.2	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	122.6	176.1	-62.5	173.4	0	0	0	109.9	V68 L70 I153 V219 R271 I288 I290	V68-L221 HydrophobicContact CB-CD2 3.89Å; V68-L221 HydrophobicContact CG1-CD2 4.09Å; V68-L221 WeakPolarHBondContact O-CA 3.48Å; L70-L221 HydrophobicContact CD1-CD1 4.5Å; L70-L221 HydrophobicContact CD1-CD2 3.97Å; L70-L221 HydrophobicContact CG-CD2 4.34Å; I153-L221 HydrophobicContact CD1-CD1 4.18Å; I153-L221 HydrophobicContact CD1-CD2 3.47Å; I153-L221 VanDerWaalsContact CD1-CD2 3.47Å; I153-L221 HydrophobicContact CD1-CG 4.46Å; V219-L221 HydrophobicContact CG1-CD2 4Å; V219-L221 HydrophobicContact CG1-CG 4.3Å; L221-R271 WeakPolarHBondContact O-CD 3.49Å; L221-R271 PolarHBondContact O-NE 2.94Å; L221-I288 HydrophobicContact CB-CG2 3.85Å; L221-I288 WeakPolarHBondContact CD1-O 3.18Å; L221-I290 HydrophobicContact CB-CD1 4.05Å; L221-I290 HydrophobicContact CB-CG1 4.26Å
222	Q	93.3	Very high	88.8	Confident	73 Å²	73	65.7 Å²	65.7	34%	0.341	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	152.8	176.9	-63.5	-176.4	5.7	0	0	110	T67 V68 K69 L70 D220	T67-Q222 HydrophobicContact CG2-CB 4.39Å; T67-Q222 HydrophobicContact CG2-CG 3.97Å; V68-Q222 PolarHBondContact O-N 2.88Å; K69-Q222 CarbonylContact C-O 3.45Å; K69-Q222 VanDerWaalsContact CA-O 3.23Å; K69-Q222 WeakPolarHBondContact CA-O 3.47Å; K69-Q222 HydrophobicContact CG-CB 4.49Å; L70-Q222 PolarHBondContact N-O 3.47Å; D220-Q222 PolarHBondContact OD2-NE2 3.15Å
223	H	93.3	Very high	88.5	Confident	19 Å²	19	60.3 Å²	60.3	9%	0.088	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	148.1	170.6	-166.6	-97.2	0	0	0	110.2	L70 D225 I247 G250 Y292	L70-H223 CarbonylContact O-C 3.49Å; L70-H223 WeakPolarHBondContact O-CA 3.43Å; H223-D225 VanDerWaalsContact C-N 3.32Å; H223-D225 WeakPolarHBondContact ND1-CB 3.22Å; H223-D225 PolarHBondContact ND1-N 3.22Å; H223-D225 PolarHBondContact O-N 3.34Å; H223-I247 HydrophobicContact CB-CD1 3.26Å; H223-G250 PolarHBondContact NE2-O 3.24Å; H223-Y292 AromaticContact CD2-CE1 3.87Å; H223-Y292 AromaticContact NE2-CE1 3.71Å
224	M	92.3	Very high	88.2	Confident	32 Å²	32	60.4 Å²	60.4	16%	0.158	31%	0.312	C	S	.	.	S	Bend	trans	-70.2	-27.2	179.9	-70.5	-177.4	-176.9	0	0	114.1	K69 L70 K71 K120 E122	K69-M224 HydrophobicContact CB-CE 4.05Å; K69-M224 HydrophobicContact CB-CG 3.65Å; K69-M224 WeakPolarHBondContact O-CE 3.29Å; L70-M224 PolarHBondContact O-N 3.26Å; K71-M224 HydrophobicContact CB-CB 3.96Å; K71-M224 HydrophobicContact CB-CE 4.47Å; K71-M224 HydrophobicContact CB-CG 3.88Å; K71-M224 HydrophobicContact CB-SD 3.51Å; K71-M224 VanDerWaalsContact CB-SD 3.51Å; K71-M224 HydrophobicContact CD-CB 4.23Å; K71-M224 HydrophobicContact CD-SD 4.43Å; K120-M224 HydrophobicContact CB-CE 4.41Å; K120-M224 HydrophobicContact CB-SD 4.47Å; K120-M224 HydrophobicContact CD-CE 4.25Å; K120-M224 HydrophobicContact CD-SD 3.6Å; K120-M224 VanDerWaalsContact CD-SD 3.6Å; K120-M224 VanDerWaalsContact CE-SD 3.55Å; K120-M224 HydrophobicContact CG-CE 3.62Å; K120-M224 HydrophobicContact CG-SD 3.63Å; K120-M224 WeakPolarHBondContact O-CE 3.21Å; E122-M224 HydrophobicContact CB-CE 3.66Å; E122-M224 HydrophobicContact CG-CE 3.59Å; E122-M224 HydrophobicContact CG-SD 4.47Å
225	D	88.5	Confident	87.4	Confident	46 Å²	46	58.6 Å²	58.6	25%	0.246	31%	0.308	C	S	.	.			trans	-75	127.5	-178.8	-154.3	-41.5	0	0	0	111.3	H223 S227 I247	H223-D225 VanDerWaalsContact C-N 3.32Å; H223-D225 WeakPolarHBondContact ND1-CB 3.22Å; H223-D225 PolarHBondContact ND1-N 3.22Å; H223-D225 PolarHBondContact O-N 3.34Å; D225-S227 VanDerWaalsContact C-N 3.26Å; D225-S227 PolarHBondContact O-N 3.15Å; D225-S227 PolarHBondContact OD1-N 3.39Å; D225-S227 PolarHBondContact OD1-OG 2.86Å; D225-I247 HydrophobicContact CB-CG2 4.3Å
226	P	82.5	Confident	86.4	Confident	121 Å²	121	66.8 Å²	66.8	79%	0.786	35%	0.346	S	S	*	.	S	Bend	trans	-71.7	-12.7	179	29.2	-37.6	0	0	0	114.4	V228	P226-V228 PolarHBondContact O-N 3.42Å
227	S	82.5	Confident	85.3	Confident	66 Å²	66	67 Å²	67	46%	0.462	36%	0.36	S	S	.	.			trans	-77.5	60.9	-177.4	73.4	0	0	0	0	113	D225	D225-S227 VanDerWaalsContact C-N 3.26Å; D225-S227 PolarHBondContact O-N 3.15Å; D225-S227 PolarHBondContact OD1-N 3.39Å; D225-S227 PolarHBondContact OD1-OG 2.86Å
228	V	83.4	Confident	84.6	Confident	61 Å²	61	66.6 Å²	66.6	37%	0.37	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-85.8	117.1	-178.9	-177.9	0	0	0	0	110.2	P226 I247	P226-V228 PolarHBondContact O-N 3.42Å; V228-I247 HydrophobicContact CG2-CD1 4.33Å; V228-I247 HydrophobicContact CG2-CG1 4.27Å
229	E	87.4	Confident	83.9	Confident	81 Å²	81	65.7 Å²	65.7	38%	0.379	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.3	168.3	-65	178.9	-175.3	0	0	109	S245 I246 R248	E229-S245 CarbonylContact O-C 3.6Å; E229-S245 WeakPolarHBondContact O-CA 3.22Å; E229-I246 PolarHBondContact N-O 3.19Å; E229-I246 PolarHBondContact O-N 3.33Å; E229-R248 IonicContact OE1-CZ 3.47Å; E229-R248 IonicContact OE1-NE 3.97Å; E229-R248 PolarHBondContact OE1-NE 3.31Å; E229-R248 VanDerWaalsContact OE1-NE 3.12Å; E229-R248 IonicContact OE1-NH2 3.78Å; E229-R248 PolarHBondContact OE1-NH2 3.38Å; E229-R248 IonicContact OE2-CZ 3.65Å; E229-R248 IonicContact OE2-NE 3.65Å; E229-R248 PolarHBondContact OE2-NE 3.49Å; E229-R248 IonicContact OE2-NH2 2.79Å; E229-R248 PolarHBondContact OE2-NH2 3.41Å
230	H	83.9	Confident	83.3	Confident	137 Å²	137	67.6 Å²	67.6	63%	0.634	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.9	175.7	-68.7	-72.1	0	0	0	110.4	V244	H230-V244 WeakPolarHBondContact CA-O 3.33Å
231	V	85.2	Confident	82.7	Confident	63 Å²	63	74.3 Å²	74.3	38%	0.382	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.5	179.9	-177.4	0	0	0	0	109.4	V244 I246	V231-V244 PolarHBondContact N-O 3.47Å; V231-V244 PolarHBondContact O-N 3.42Å; V231-I246 HydrophobicContact CB-CD1 3.66Å; V231-I246 HydrophobicContact CB-CG1 4.22Å; V231-I246 HydrophobicContact CG1-CD1 4.21Å; V231-I246 HydrophobicContact CG2-CD1 3.71Å; V231-I246 HydrophobicContact CG2-CG1 4.19Å
232	M	82.6	Confident	82.1	Confident	93 Å²	93	77 Å²	77	46%	0.458	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.3	172.7	-62.3	-70.3	-55	0	0	109.2	W241 N243	M232-W241 HydrophobicContact CB-CE3 4.01Å; M232-W241 HydrophobicContact CE-CB 3.42Å; M232-W241 VanDerWaalsContact CE-CB 3.42Å; M232-W241 HydrophobicContact CE-CG 4.44Å; M232-N243 PolarHBondContact SD-OD1 3.39Å
233	E	82.3	Confident	81.6	Confident	62 Å²	62	79.3 Å²	79.3	29%	0.29	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.8	175.9	-167.6	162.3	-178	0	0	109.8	S235 R242 V244 K270	E233-S235 PolarHBondContact O-N 3.03Å; E233-R242 PolarHBondContact N-O 3.19Å; E233-R242 PolarHBondContact O-N 3.28Å; E233-V244 HydrophobicContact CB-CB 4.45Å; E233-V244 HydrophobicContact CB-CG2 3.78Å; E233-K270 IonicContact OE1-NZ 3.74Å; E233-K270 PolarHBondContact OE1-NZ 3.35Å; E233-K270 IonicContact OE2-NZ 3.01Å; E233-K270 PolarHBondContact OE2-NZ 3.02Å
234	L	82.6	Confident	81.4	Confident	89 Å²	89	78.8 Å²	78.8	47%	0.466	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	116.4	175.8	-165.4	86	0	0	0	108.5	E236 G239 W241	L234-E236 PolarHBondContact O-N 3.22Å; L234-G239 VanDerWaalsContact CD1-O 3.31Å; L234-G239 WeakPolarHBondContact CD1-O 3.3Å; L234-W241 HydrophobicContact CB-CE3 4.31Å; L234-W241 HydrophobicContact CB-CH2 4.43Å; L234-W241 HydrophobicContact CB-CZ3 4.26Å; L234-W241 HydrophobicContact CD1-CD2 3.88Å; L234-W241 HydrophobicContact CD1-CE3 4.45Å; L234-W241 HydrophobicContact CD1-CG 4.19Å; L234-W241 HydrophobicContact CD1-CZ2 3.93Å
235	S	73	Confident	81.2	Confident	17 Å²	17	78 Å²	78	12%	0.119	43%	0.427	C	S	.	.			trans	-70.6	120.7	177.9	-177.7	0	0	0	0	110.5	E233 A237 D238 G239 S240	E233-S235 PolarHBondContact O-N 3.03Å; S235-A237 PolarHBondContact O-N 3.35Å; S235-A237 VanDerWaalsContact O-N 3.17Å; S235-D238 PolarHBondContact O-N 3.15Å; S235-G239 VanDerWaalsContact O-CA 3.29Å; S235-G239 WeakPolarHBondContact O-CA 3.34Å; S235-G239 PolarHBondContact O-N 3.21Å; S235-S240 VanDerWaalsContact CB-O 3.31Å; S235-S240 WeakPolarHBondContact CB-O 3.29Å; S235-S240 PolarHBondContact N-O 3.1Å
236	E	70.5	Confident	81.3	Confident	175 Å²	175	77 Å²	77	82%	0.818	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.5	176.8	-66.8	175.2	160.8	0	0	113.4	L234	L234-E236 PolarHBondContact O-N 3.22Å
237	A	67.2	Low	81.8	Confident	75 Å²	75	71.5 Å²	71.5	62%	0.62	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-41.5	-175.9	0	0	0	0	0	113.3	S235	S235-A237 PolarHBondContact O-N 3.35Å; S235-A237 VanDerWaalsContact O-N 3.17Å
238	D	72.8	Confident	82.1	Confident	91 Å²	91	76.1 Å²	76.1	49%	0.487	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-5.1	-171.1	-55.6	-34.2	0	0	0	113	S235 S240 R242	S235-D238 PolarHBondContact O-N 3.15Å; D238-S240 PolarHBondContact O-N 3.34Å; D238-R242 IonicContact OD2-NH2 3.28Å; D238-R242 PolarHBondContact OD2-NH2 3.28Å
239	G	78.1	Confident	82.3	Confident	47 Å²	47	78.4 Å²	78.4	49%	0.485	40%	0.402	S	S	.	.	S	Bend	trans	65.3	11.3	-170.3	0	0	0	0	0	114.1	L234 S235	L234-G239 VanDerWaalsContact CD1-O 3.31Å; L234-G239 WeakPolarHBondContact CD1-O 3.3Å; S235-G239 VanDerWaalsContact O-CA 3.29Å; S235-G239 WeakPolarHBondContact O-CA 3.34Å; S235-G239 PolarHBondContact O-N 3.21Å
240	S	80.3	Confident	82.4	Confident	44 Å²	44	74.5 Å²	74.5	31%	0.308	38%	0.384	S	S	.	.			trans	-86.8	142.8	179.9	58.7	0	0	0	0	111.6	S235 D238 R242	S235-S240 VanDerWaalsContact CB-O 3.31Å; S235-S240 WeakPolarHBondContact CB-O 3.29Å; S235-S240 PolarHBondContact N-O 3.1Å; D238-S240 PolarHBondContact O-N 3.34Å; S240-R242 PolarHBondContact O-N 3.12Å
241	W	80.4	Confident	82.8	Confident	167 Å²	167	68.3 Å²	68.3	63%	0.633	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.2	172.5	-67.2	97	0	0	0	110.1	M232 L234	M232-W241 HydrophobicContact CB-CE3 4.01Å; M232-W241 HydrophobicContact CE-CB 3.42Å; M232-W241 VanDerWaalsContact CE-CB 3.42Å; M232-W241 HydrophobicContact CE-CG 4.44Å; L234-W241 HydrophobicContact CB-CE3 4.31Å; L234-W241 HydrophobicContact CB-CH2 4.43Å; L234-W241 HydrophobicContact CB-CZ3 4.26Å; L234-W241 HydrophobicContact CD1-CD2 3.88Å; L234-W241 HydrophobicContact CD1-CE3 4.45Å; L234-W241 HydrophobicContact CD1-CG 4.19Å; L234-W241 HydrophobicContact CD1-CZ2 3.93Å
242	R	81.1	Confident	83.2	Confident	59 Å²	59	66.9 Å²	66.9	22%	0.223	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.8	177.4	-63.4	-170.8	-175.8	-157.8	-3	110.4	E233 D238 S240 V244 A273 D286	E233-R242 PolarHBondContact N-O 3.19Å; E233-R242 PolarHBondContact O-N 3.28Å; D238-R242 IonicContact OD2-NH2 3.28Å; D238-R242 PolarHBondContact OD2-NH2 3.28Å; S240-R242 PolarHBondContact O-N 3.12Å; R242-V244 PolarHBondContact O-N 2.96Å; R242-A273 PolarHBondContact NH1-O 3.39Å; R242-D286 IonicContact CZ-OD2 2.77Å; R242-D286 IonicContact NH1-OD2 2.94Å; R242-D286 PolarHBondContact NH1-OD2 2.91Å
243	N	84.4	Confident	83.6	Confident	121 Å²	121	63.4 Å²	63.4	65%	0.647	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	115.2	171.5	-87.8	-39.7	0	0	0	109.5	M232	M232-N243 PolarHBondContact SD-OD1 3.39Å
244	V	87.7	Confident	83.8	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.6	177.1	178.4	0	0	0	0	108.6	H230 V231 E233 R242 I246 K270 R271	H230-V244 WeakPolarHBondContact CA-O 3.33Å; V231-V244 PolarHBondContact N-O 3.47Å; V231-V244 PolarHBondContact O-N 3.42Å; E233-V244 HydrophobicContact CB-CB 4.45Å; E233-V244 HydrophobicContact CB-CG2 3.78Å; R242-V244 PolarHBondContact O-N 2.96Å; V244-I246 HydrophobicContact CG1-CG1 4.1Å; V244-K270 HydrophobicContact CG1-CB 3.96Å; V244-K270 HydrophobicContact CG1-CD 4.34Å; V244-K270 HydrophobicContact CG1-CG 4.47Å; V244-R271 WeakPolarHBondContact CG1-O 3.33Å
245	S	88.9	Confident	83.9	Confident	16 Å²	16	63.6 Å²	63.6	11%	0.112	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.6	170.7	21.9	0	0	0	0	109.2	E229 K270 R271	E229-S245 CarbonylContact O-C 3.6Å; E229-S245 WeakPolarHBondContact O-CA 3.22Å; S245-K270 CarbonylContact O-C 3.4Å; S245-K270 WeakPolarHBondContact O-CA 3.46Å; S245-R271 PolarHBondContact O-N 3.46Å; S245-R271 WeakPolarHBondContact OG-CB 3.39Å
246	I	90.8	Very high	84.7	Confident	24 Å²	24	63.7 Å²	63.7	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.7	-177.9	-53.3	-170.4	0	0	0	108.9	E229 V231 V244 A269 K270	E229-I246 PolarHBondContact N-O 3.19Å; E229-I246 PolarHBondContact O-N 3.33Å; V231-I246 HydrophobicContact CB-CD1 3.66Å; V231-I246 HydrophobicContact CB-CG1 4.22Å; V231-I246 HydrophobicContact CG1-CD1 4.21Å; V231-I246 HydrophobicContact CG2-CD1 3.71Å; V231-I246 HydrophobicContact CG2-CG1 4.19Å; V244-I246 HydrophobicContact CG1-CG1 4.1Å; I246-A269 CarbonylContact C-O 3.57Å; I246-A269 WeakPolarHBondContact CA-O 3.42Å; I246-K270 HydrophobicContact CD1-CD 4.29Å; I246-K270 HydrophobicContact CD1-CG 4.4Å; I246-K270 HydrophobicContact CG1-CD 4.44Å; I246-K270 HydrophobicContact CG1-CG 4.09Å; I246-K270 HydrophobicContact CG2-CG 4.43Å
247	I	91.9	Very high	85.7	Confident	6 Å²	6	63.3 Å²	63.3	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.6	173.1	-64.3	135.6	0	0	0	106.8	H223 D225 V228 N249 P268 A269	H223-I247 HydrophobicContact CB-CD1 3.26Å; D225-I247 HydrophobicContact CB-CG2 4.3Å; V228-I247 HydrophobicContact CG2-CD1 4.33Å; V228-I247 HydrophobicContact CG2-CG1 4.27Å; I247-N249 VanDerWaalsContact C-N 3.34Å; I247-N249 PolarHBondContact O-N 2.84Å; I247-P268 CarbonylContact O-C 3.55Å; I247-P268 WeakPolarHBondContact O-CA 3.26Å; I247-A269 HydrophobicContact CB-CB 4.5Å; I247-A269 PolarHBondContact N-O 3.48Å; I247-A269 PolarHBondContact O-N 2.93Å
248	R	88.5	Confident	86.6	Confident	163 Å²	163	62.7 Å²	62.7	62%	0.615	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-39.2	-173.8	-61.4	-175.5	-173.4	-172.6	3.2	112.6	E229 I267 P268	E229-R248 IonicContact OE1-CZ 3.47Å; E229-R248 IonicContact OE1-NE 3.97Å; E229-R248 PolarHBondContact OE1-NE 3.31Å; E229-R248 VanDerWaalsContact OE1-NE 3.12Å; E229-R248 IonicContact OE1-NH2 3.78Å; E229-R248 PolarHBondContact OE1-NH2 3.38Å; E229-R248 IonicContact OE2-CZ 3.65Å; E229-R248 IonicContact OE2-NE 3.65Å; E229-R248 PolarHBondContact OE2-NE 3.49Å; E229-R248 IonicContact OE2-NH2 2.79Å; E229-R248 PolarHBondContact OE2-NH2 3.41Å; R248-I267 CarbonylContact O-C 3.55Å; R248-P268 WeakPolarHBondContact O-CA 3.42Å
249	N	89.4	Confident	87.2	Confident	109 Å²	109	59.6 Å²	59.6	58%	0.583	30%	0.303	S	S	*	.	B	Isolated β-bridge	trans	-108.5	67	176.3	-65.4	-12.7	0	0	0	109.4	I247 I251	I247-N249 VanDerWaalsContact C-N 3.34Å; I247-N249 PolarHBondContact O-N 2.84Å; N249-I251 VanDerWaalsContact C-N 3.33Å
250	G	89.2	Confident	87.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.319	C	S	.	.			trans	-74.1	-24	-176.8	0	0	0	0	0	113.8	H223 I267 Y292	H223-G250 PolarHBondContact NE2-O 3.24Å; G250-I267 PolarHBondContact N-O 3.22Å; G250-Y292 WeakPolarHBondContact O-CE1 3.17Å
251	I	92.4	Very high	87.7	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	131.8	-177.3	-53	177.3	0	0	0	109.8	L72 L74 N249 L253 I267 Y292 I294	L72-I251 HydrophobicContact CD2-CD1 4.3Å; L72-I251 HydrophobicContact CD2-CG1 4.35Å; L72-I251 WeakPolarHBondContact O-CA 3.38Å; L74-I251 HydrophobicContact CB-CG2 3.63Å; N249-I251 VanDerWaalsContact C-N 3.33Å; I251-L253 HydrophobicContact CG2-CD2 4.18Å; I251-L253 PolarHBondContact O-N 2.88Å; I251-I267 HydrophobicContact CB-CB 4.08Å; I251-I267 HydrophobicContact CB-CD1 3.84Å; I251-I267 HydrophobicContact CB-CG2 4.42Å; I251-I267 HydrophobicContact CD1-CB 4.06Å; I251-I267 HydrophobicContact CD1-CG2 3.99Å; I251-I267 HydrophobicContact CG1-CB 4.15Å; I251-I267 WeakPolarHBondContact O-CD1 3.37Å; I251-Y292 HydrophobicContact CD1-CD1 4.5Å; I251-Y292 HydrophobicContact CG1-CD1 3.72Å; I251-Y292 HydrophobicContact CG1-CG 4.31Å; I251-I294 HydrophobicContact CD1-CD1 4.04Å; I251-I294 HydrophobicContact CD1-CG1 3.65Å
252	D	92.2	Very high	88.1	Confident	32 Å²	32	55.8 Å²	55.8	17%	0.171	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	121	172.1	-175	4.7	0	0	0	110	L72 R73 L74 S254	L72-D252 PolarHBondContact O-N 3.07Å; R73-D252 WeakPolarHBondContact CA-O 3.34Å; R73-D252 HydrophobicContact CB-CB 3.98Å; R73-D252 HydrophobicContact CG-CB 4.02Å; R73-D252 WeakPolarHBondContact CG-O 3.27Å; R73-D252 IonicContact CZ-OD2 3.65Å; R73-D252 IonicContact NE-OD2 3.84Å; R73-D252 PolarHBondContact NE-OD2 3.21Å; R73-D252 IonicContact NH2-OD2 3.78Å; R73-D252 PolarHBondContact NH2-OD2 3.36Å; L74-D252 PolarHBondContact N-O 3.42Å; D252-S254 VanDerWaalsContact OD1-CB 3.3Å; D252-S254 WeakPolarHBondContact OD1-CB 3.39Å; D252-S254 PolarHBondContact OD1-N 3.48Å; D252-S254 VanDerWaalsContact OD1-N 3.1Å; D252-S254 PolarHBondContact OD1-OG 2.92Å; D252-S254 PolarHBondContact OD2-OG 3.41Å
253	L	91.2	Very high	88.5	Confident	20 Å²	20	54.6 Å²	54.6	11%	0.105	28%	0.281	C	S	.	.			trans	-108.4	15	-179.4	-59.9	178.9	0	0	0	112.6	L74 I251 D255 Y256 I264 I267 I563	L74-L253 HydrophobicContact CB-CD2 3.99Å; L74-L253 HydrophobicContact CD2-CD2 3.91Å; L74-L253 HydrophobicContact CG-CD2 4.47Å; I251-L253 HydrophobicContact CG2-CD2 4.18Å; I251-L253 PolarHBondContact O-N 2.88Å; L253-D255 VanDerWaalsContact C-N 3.31Å; L253-D255 PolarHBondContact O-N 3.02Å; L253-Y256 HydrophobicContact CD2-CD2 4.47Å; L253-Y256 HydrophobicContact CD2-CG 4.22Å; L253-Y256 WeakPolarHBondContact O-CB 3.46Å; L253-Y256 PolarHBondContact O-N 3.22Å; L253-I264 HydrophobicContact CD2-CD1 4.28Å; L253-I267 HydrophobicContact CD1-CD1 3.61Å; L253-I267 HydrophobicContact CD1-CG1 4.36Å; L253-I267 HydrophobicContact CD2-CD1 4.4Å; L253-I267 HydrophobicContact CG-CD1 3.76Å; L253-I563 HydrophobicContact CD1-CG2 3.82Å
254	S	87.5	Confident	88.9	Confident	63 Å²	63	49 Å²	49	44%	0.441	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-42.1	-178.8	41.6	0	0	0	0	113.7	D252	D252-S254 VanDerWaalsContact OD1-CB 3.3Å; D252-S254 WeakPolarHBondContact OD1-CB 3.39Å; D252-S254 PolarHBondContact OD1-N 3.48Å; D252-S254 VanDerWaalsContact OD1-N 3.1Å; D252-S254 PolarHBondContact OD1-OG 2.92Å; D252-S254 PolarHBondContact OD2-OG 3.41Å
255	D	85.4	Confident	89	Confident	93 Å²	93	49.5 Å²	49.5	50%	0.497	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	19.3	-179.6	-58.5	-38.5	0	0	0	112.3	R73 L253 Y257	R73-D255 VanDerWaalsContact CD-OD2 3.28Å; R73-D255 WeakPolarHBondContact CD-OD2 3.5Å; R73-D255 IonicContact CZ-OD2 3.84Å; R73-D255 IonicContact NE-OD2 3.64Å; R73-D255 IonicContact NH1-OD2 2.7Å; R73-D255 PolarHBondContact NH1-OD2 3.47Å; L253-D255 VanDerWaalsContact C-N 3.31Å; L253-D255 PolarHBondContact O-N 3.02Å; D255-Y257 PolarHBondContact O-N 3.42Å
256	Y	89.8	Confident	89.1	Confident	18 Å²	18	50.6 Å²	50.6	7%	0.071	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-74.8	120.7	-173.7	178.5	-113	0	0	0	112	L74 S75 I77 L253 P258 S259 I264 P565	L74-Y256 HydrophobicContact CD2-CD2 3.85Å; L74-Y256 HydrophobicContact CD2-CE2 3.78Å; L74-Y256 HydrophobicContact CG-CD2 3.84Å; L74-Y256 HydrophobicContact CG-CE2 4.08Å; S75-Y256 WeakPolarHBondContact O-CA 3.27Å; I77-Y256 HydrophobicContact CD1-CE2 4.5Å; I77-Y256 HydrophobicContact CG1-CE2 4.22Å; L253-Y256 HydrophobicContact CD2-CD2 4.47Å; L253-Y256 HydrophobicContact CD2-CG 4.22Å; L253-Y256 WeakPolarHBondContact O-CB 3.46Å; L253-Y256 PolarHBondContact O-N 3.22Å; Y256-P258 HydrophobicContact CE1-CB 4.36Å; Y256-S259 PolarHBondContact OH-N 2.8Å; Y256-I264 HydrophobicContact CD1-CD1 4.17Å; Y256-I264 HydrophobicContact CD2-CD1 4.39Å; Y256-I264 HydrophobicContact CE1-CD1 3.55Å; Y256-I264 HydrophobicContact CE1-CG1 4.44Å; Y256-I264 HydrophobicContact CE2-CD1 3.81Å; Y256-P565 HydrophobicContact CD1-CB 4.17Å; Y256-P565 HydrophobicContact CD1-CG 4.21Å
257	Y	89.8	Confident	89.3	Confident	168 Å²	168	49.7 Å²	49.7	66%	0.659	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-85.5	120.6	168.3	-169.5	-96.1	0	0	0	110.2	S75 D255	S75-Y257 PolarHBondContact O-N 2.81Å; D255-Y257 PolarHBondContact O-N 3.42Å
258	P	87.2	Confident	89.4	Confident	62 Å²	62	50.6 Å²	50.6	40%	0.403	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-65.9	138.1	-174.4	26.4	-34	0	0	0	112.6	Y256 P565	Y256-P258 HydrophobicContact CE1-CB 4.36Å; P258-P565 HydrophobicContact CB-CG 4.36Å; P258-P565 HydrophobicContact CG-CG 4.5Å
259	S	84.9	Confident	89.7	Confident	25 Å²	25	42.9 Å²	42.9	18%	0.175	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-75.6	147.4	175.4	-172.1	0	0	0	0	112.2	Y256 K299	Y256-S259 PolarHBondContact OH-N 2.8Å; S259-K299 PolarHBondContact O-NZ 3.02Å
260	V	85.5	Confident	89.9	Confident	135 Å²	135	39.5 Å²	39.5	82%	0.818	21%	0.214	S	C	*	.	S	Bend	trans	-73.9	-28.7	178	-178.2	0	0	0	0	111.6	K299	V260-K299 WeakPolarHBondContact O-CD 3.28Å
261	E	84.2	Confident	90.1	Very high	38 Å²	38	42 Å²	42	18%	0.178	22%	0.224	C	C	.	.	S	Bend	trans	-106.1	-24.6	-174	-175.2	163.6	-161.9	0	0	113.5	R298 K299 Y303	E261-R298 HydrophobicContact CG-CG 4.16Å; E261-R298 IonicContact OE1-CZ 2.73Å; E261-R298 IonicContact OE1-NH1 3.38Å; E261-R298 PolarHBondContact OE1-NH1 2.89Å; E261-K299 PolarHBondContact O-N 2.7Å; E261-Y303 WeakPolarHBondContact OE1-CE2 3.4Å; E261-Y303 PolarHBondContact OE1-OH 2.92Å
262	W	88.6	Confident	90.1	Very high	5 Å²	5	42.2 Å²	42.2	2%	0.019	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	135.1	-170.2	-61.5	99.9	0	0	0	112.4	L80 Q203 L296 R297 R298	L80-W262 HydrophobicContact CB-CZ2 4.33Å; L80-W262 HydrophobicContact CD2-CH2 3.8Å; L80-W262 HydrophobicContact CD2-CZ2 3.4Å; L80-W262 HydrophobicContact CG-CZ2 4.39Å; Q203-W262 HydrophobicContact CB-CZ3 4.36Å; Q203-W262 HydrophobicContact CG-CH2 3.58Å; Q203-W262 HydrophobicContact CG-CZ3 3.7Å; W262-L296 HydrophobicContact CB-CD2 4.44Å; W262-L296 HydrophobicContact CE3-CB 3.87Å; W262-L296 HydrophobicContact CZ3-CB 4.38Å; W262-R297 WeakPolarHBondContact CA-O 3.49Å; W262-R298 HydrophobicContact CE3-CB 4.04Å; W262-R298 HydrophobicContact CH2-CB 4.12Å; W262-R298 HydrophobicContact CH2-CG 4.43Å; W262-R298 VanDerWaalsContact CZ2-NH1 3.26Å; W262-R298 VanDerWaalsContact CZ2-NH2 3.27Å; W262-R298 HydrophobicContact CZ3-CB 3.68Å; W262-R298 HydrophobicContact CZ3-CG 4.36Å
263	D	90.1	Very high	89.9	Confident	34 Å²	34	42 Å²	42	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.1	166.4	-75.4	-35.8	0	0	0	110.2	L296 R297 K299 P562	D263-L296 CarbonylContact O-C 3.55Å; D263-L296 VanDerWaalsContact O-CA 3.31Å; D263-L296 WeakPolarHBondContact O-CA 3.48Å; D263-R297 HydrophobicContact CB-CB 4.48Å; D263-R297 PolarHBondContact N-O 3.08Å; D263-R297 PolarHBondContact O-N 3.06Å; D263-R297 IonicContact OD2-NH2 3.23Å; D263-K299 WeakPolarHBondContact OD1-CE 3.46Å; D263-K299 IonicContact OD1-NZ 3.11Å; D263-K299 PolarHBondContact OD1-NZ 3.46Å; D263-K299 VanDerWaalsContact OD2-CE 3.27Å; D263-K299 WeakPolarHBondContact OD2-CE 3.42Å; D263-P562 HydrophobicContact CB-CB 3.87Å
264	I	91.7	Very high	89.5	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.1	174	-61.1	170.6	0	0	0	108.8	L74 I77 L253 Y256 I267 L296 I563	L74-I264 HydrophobicContact CD2-CD1 3.92Å; I77-I264 HydrophobicContact CD1-CD1 4.11Å; I77-I264 HydrophobicContact CD1-CG1 4.12Å; L253-I264 HydrophobicContact CD2-CD1 4.28Å; Y256-I264 HydrophobicContact CD1-CD1 4.17Å; Y256-I264 HydrophobicContact CD2-CD1 4.39Å; Y256-I264 HydrophobicContact CE1-CD1 3.55Å; Y256-I264 HydrophobicContact CE1-CG1 4.44Å; Y256-I264 HydrophobicContact CE2-CD1 3.81Å; I264-I267 HydrophobicContact CG2-CG2 3.57Å; I264-L296 HydrophobicContact CG1-CD2 3.77Å; I264-I563 PolarHBondContact O-N 3.45Å
265	L	89.8	Confident	89.3	Confident	17 Å²	17	43.1 Å²	43.1	9%	0.089	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-46.8	177.7	-66.8	176.1	0	0	0	112	E202 N295 R297 R560 I563	E202-L265 HydrophobicContact CG-CD1 4.45Å; L265-N295 HydrophobicContact CB-CB 4.32Å; L265-N295 PolarHBondContact N-O 3.35Å; L265-R297 HydrophobicContact CD1-CB 3.9Å; L265-R297 HydrophobicContact CD2-CB 4.22Å; L265-R297 HydrophobicContact CG-CB 3.96Å; L265-R560 HydrophobicContact CD2-CB 4.2Å; L265-I563 WeakPolarHBondContact O-CD1 3.47Å; L265-I563 WeakPolarHBondContact O-CG1 3.34Å
266	S	91.3	Very high	89.2	Confident	39 Å²	39	41.6 Å²	41.6	27%	0.273	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	150.6	-179.5	66.3	0	0	0	0	111.7	N295	S266-N295 PolarHBondContact O-N 3.38Å; S266-N295 WeakPolarHBondContact OG-CB 3.46Å; S266-N295 PolarHBondContact OG-ND2 3.15Å
267	I	94.1	Very high	88.6	Confident	5 Å²	5	45.7 Å²	45.7	3%	0.026	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-133.1	58.2	-172.6	43.8	153.9	0	0	0	113	R248 G250 I251 L253 I264 Y293 I294 I563	R248-I267 CarbonylContact O-C 3.55Å; G250-I267 PolarHBondContact N-O 3.22Å; I251-I267 HydrophobicContact CB-CB 4.08Å; I251-I267 HydrophobicContact CB-CD1 3.84Å; I251-I267 HydrophobicContact CB-CG2 4.42Å; I251-I267 HydrophobicContact CD1-CB 4.06Å; I251-I267 HydrophobicContact CD1-CG2 3.99Å; I251-I267 HydrophobicContact CG1-CB 4.15Å; I251-I267 WeakPolarHBondContact O-CD1 3.37Å; L253-I267 HydrophobicContact CD1-CD1 3.61Å; L253-I267 HydrophobicContact CD1-CG1 4.36Å; L253-I267 HydrophobicContact CD2-CD1 4.4Å; L253-I267 HydrophobicContact CG-CD1 3.76Å; I264-I267 HydrophobicContact CG2-CG2 3.57Å; I267-Y293 CarbonylContact C-O 3.57Å; I267-Y293 VanDerWaalsContact CA-O 3.27Å; I267-Y293 WeakPolarHBondContact CA-O 3.44Å; I267-I294 HydrophobicContact CG2-CG2 4.38Å; I267-I563 HydrophobicContact CG1-CD1 4.08Å
268	P	94.3	Very high	88.1	Confident	25 Å²	25	43.2 Å²	43.2	16%	0.162	25%	0.245	C	C	.	.			trans	-76	142.5	-177.2	30.3	-31	0	0	0	112	I247 R248 Y293	I247-P268 CarbonylContact O-C 3.55Å; I247-P268 WeakPolarHBondContact O-CA 3.26Å; R248-P268 WeakPolarHBondContact O-CA 3.42Å; P268-Y293 WeakPolarHBondContact CD-O 3.37Å; P268-Y293 PolarHBondContact O-N 3.45Å
269	A	95.2	Very high	87.9	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135	166.9	0	0	0	0	0	109.9	I246 I247 T291 Y292	I246-A269 CarbonylContact C-O 3.57Å; I246-A269 WeakPolarHBondContact CA-O 3.42Å; I247-A269 HydrophobicContact CB-CB 4.5Å; I247-A269 PolarHBondContact N-O 3.48Å; I247-A269 PolarHBondContact O-N 2.93Å; A269-T291 WeakPolarHBondContact CA-O 3.47Å; A269-Y292 HydrophobicContact CB-CD1 3.66Å; A269-Y292 HydrophobicContact CB-CE1 3.79Å; A269-Y292 HydrophobicContact CB-CG 4.47Å
270	K	94	Very high	87.7	Confident	38 Å²	38	45.4 Å²	45.4	17%	0.165	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132	175	-59.2	-168.2	-178.2	-174.2	0	110.2	E233 V244 S245 I246 H272 T291 Y293	E233-K270 IonicContact OE1-NZ 3.74Å; E233-K270 PolarHBondContact OE1-NZ 3.35Å; E233-K270 IonicContact OE2-NZ 3.01Å; E233-K270 PolarHBondContact OE2-NZ 3.02Å; V244-K270 HydrophobicContact CG1-CB 3.96Å; V244-K270 HydrophobicContact CG1-CD 4.34Å; V244-K270 HydrophobicContact CG1-CG 4.47Å; S245-K270 CarbonylContact O-C 3.4Å; S245-K270 WeakPolarHBondContact O-CA 3.46Å; I246-K270 HydrophobicContact CD1-CD 4.29Å; I246-K270 HydrophobicContact CD1-CG 4.4Å; I246-K270 HydrophobicContact CG1-CD 4.44Å; I246-K270 HydrophobicContact CG1-CG 4.09Å; I246-K270 HydrophobicContact CG2-CG 4.43Å; K270-H272 VanDerWaalsContact CB-CE1 3.45Å; K270-H272 WeakPolarHBondContact CB-CE1 3.5Å; K270-T291 PolarHBondContact N-O 2.92Å; K270-T291 PolarHBondContact O-N 3.28Å; K270-Y293 HydrophobicContact CB-CE2 4.12Å; K270-Y293 HydrophobicContact CD-CD2 4.39Å; K270-Y293 HydrophobicContact CD-CE2 3.75Å; K270-Y293 HydrophobicContact CG-CD2 4.16Å; K270-Y293 HydrophobicContact CG-CE2 3.84Å
271	R	93.5	Very high	87.2	Confident	53 Å²	53	43 Å²	43	20%	0.2	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.6	171.5	174.7	-169	179.4	-79.4	6.7	109.6	E216 D220 L221 V244 S245 I288 D289 I290	E216-R271 IonicContact OE1-NH2 2.86Å; D220-R271 IonicContact OD1-CZ 2.7Å; D220-R271 IonicContact OD1-NE 3.88Å; D220-R271 IonicContact OD1-NH2 3.52Å; D220-R271 PolarHBondContact OD1-NH2 2.94Å; L221-R271 WeakPolarHBondContact O-CD 3.49Å; L221-R271 PolarHBondContact O-NE 2.94Å; V244-R271 WeakPolarHBondContact CG1-O 3.33Å; S245-R271 PolarHBondContact O-N 3.46Å; S245-R271 WeakPolarHBondContact OG-CB 3.39Å; R271-I288 HydrophobicContact CG-CG2 3.88Å; R271-D289 CarbonylContact C-O 3.58Å; R271-D289 WeakPolarHBondContact CA-O 3.3Å; R271-I290 HydrophobicContact CB-CG1 4.31Å; R271-I290 HydrophobicContact CG-CG1 4.36Å
272	H	90.9	Very high	86.9	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.056	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150.5	176.9	-45.8	89.9	0	0	0	110.4	K270 R274 I288 D289	K270-H272 VanDerWaalsContact CB-CE1 3.45Å; K270-H272 WeakPolarHBondContact CB-CE1 3.5Å; H272-R274 HydrophobicContact CB-CG 4.19Å; H272-I288 WeakPolarHBondContact O-CA 3.48Å; H272-D289 WeakPolarHBondContact CB-OD1 3.48Å; H272-D289 PolarHBondContact N-O 2.92Å; H272-D289 IonicContact ND1-OD2 3.72Å; H272-D289 PolarHBondContact O-N 2.81Å
273	A	88.8	Confident	86.3	Confident	27 Å²	27	55.7 Å²	55.7	22%	0.223	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	116	162.7	0	0	0	0	0	106.5	R242 D286	R242-A273 PolarHBondContact NH1-O 3.39Å; A273-D286 HydrophobicContact CB-CB 4.05Å
274	R	83.8	Confident	85.6	Confident	74 Å²	74	63.8 Å²	63.8	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132	-177.5	-68.5	-166.9	178.4	-150.4	0.3	111.2	H272 Y276 F287	H272-R274 HydrophobicContact CB-CG 4.19Å; R274-Y276 HydrophobicContact CB-CE2 4.32Å; R274-F287 PolarHBondContact N-O 3.21Å; R274-F287 PolarHBondContact O-N 3.47Å
275	A	82.8	Confident	85.2	Confident	32 Å²	32	67.8 Å²	67.8	26%	0.264	36%	0.355	S	S	.	.			trans	-88.6	123.3	169.3	0	0	0	0	0	110	N277	A275-N277 PolarHBondContact O-N 3.18Å
276	Y	82.8	Confident	85.1	Confident	62 Å²	62	68.7 Å²	68.7	24%	0.243	36%	0.36	C	S	.	.			trans	-97.6	84.5	176	-65.6	-76.6	0	0	0	110.7	K208 R274 S278 C280 F287	K208-Y276 PolarHBondContact NZ-OH 3.2Å; R274-Y276 HydrophobicContact CB-CE2 4.32Å; Y276-S278 VanDerWaalsContact C-N 3.26Å; Y276-S278 PolarHBondContact O-N 3.47Å; Y276-C280 CarbonylContact O-C 3.59Å; Y276-C280 WeakPolarHBondContact O-CA 3.27Å; Y276-C280 WeakPolarHBondContact O-CB 3.44Å; Y276-C280 PolarHBondContact O-N 2.96Å; Y276-F287 HydrophobicContact CD2-CB 4.12Å; Y276-F287 AromaticContact CD2-CD2 3.82Å; Y276-F287 HydrophobicContact CD2-CD2 3.82Å; Y276-F287 HydrophobicContact CD2-CG 4.13Å; Y276-F287 HydrophobicContact CE2-CB 3.93Å; Y276-F287 HydrophobicContact CE2-CD2 4.48Å; Y276-F287 HydrophobicContact CE2-CG 4.37Å
277	N	76.8	Confident	85.1	Confident	103 Å²	103	67.4 Å²	67.4	55%	0.551	35%	0.35	S	S	*	.	H	α-helix	trans	-66.5	-24.6	-176.1	-67.3	-14.4	0	0	0	113.6	A275 S281	A275-N277 PolarHBondContact O-N 3.18Å; N277-S281 PolarHBondContact O-OG 2.92Å
278	S	79.4	Confident	85	Confident	117 Å²	117	67.4 Å²	67.4	82%	0.818	35%	0.35	S	S	*	.	H	α-helix	trans	-72.7	-40.9	-174.1	54	0	0	0	0	114.2	Y276	Y276-S278 VanDerWaalsContact C-N 3.26Å; Y276-S278 PolarHBondContact O-N 3.47Å
279	C	83.1	Confident	85	Confident	99 Å²	99	66.3 Å²	66.3	67%	0.669	34%	0.342	S	S	*	.	H	α-helix	trans	-110.7	-28.4	-178.7	55.8	0	0	0	0	113.2
280	C	80.9	Confident	85	Confident	33 Å²	33	66.4 Å²	66.4	22%	0.223	34%	0.343	C	S	.	.	H	α-helix	trans	-123.8	27	-162.3	-74	0	0	0	0	113.6	Y276 K282 F283 F287	Y276-C280 CarbonylContact O-C 3.59Å; Y276-C280 WeakPolarHBondContact O-CA 3.27Å; Y276-C280 WeakPolarHBondContact O-CB 3.44Å; Y276-C280 PolarHBondContact O-N 2.96Å; C280-K282 PolarHBondContact O-N 3.13Å; C280-F283 HydrophobicContact CB-CD2 3.84Å; C280-F283 PolarHBondContact O-N 3.19Å; C280-F287 HydrophobicContact CB-CE2 3.97Å; C280-F287 HydrophobicContact CB-CZ 4.35Å
281	S	74.8	Confident	85.1	Confident	86 Å²	86	64.8 Å²	64.8	60%	0.601	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.8	-178.8	-1.5	0	0	0	0	114.3	N277 F283	N277-S281 PolarHBondContact O-OG 2.92Å; S281-F283 VanDerWaalsContact C-N 3.31Å
282	K	78.1	Confident	85.2	Confident	202 Å²	202	62.2 Å²	62.2	88%	0.878	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-30.9	171.5	-68.7	-176.1	-179.5	177.5	0	112.8	C280 K284	C280-K282 PolarHBondContact O-N 3.13Å; K282-K284 PolarHBondContact O-N 3.35Å
283	F	75.9	Confident	85.4	Confident	106 Å²	106	63.9 Å²	63.9	47%	0.465	33%	0.333	S	S	.	.			trans	-81	116.6	177.1	-63.1	-81.6	0	0	0	108.1	T215 C280 S281 K285 F287	T215-F283 HydrophobicContact CG2-CB 4.17Å; T215-F283 HydrophobicContact CG2-CD1 3.95Å; T215-F283 HydrophobicContact CG2-CG 4.2Å; C280-F283 HydrophobicContact CB-CD2 3.84Å; C280-F283 PolarHBondContact O-N 3.19Å; S281-F283 VanDerWaalsContact C-N 3.31Å; F283-K285 PolarHBondContact O-N 3.4Å; F283-K285 VanDerWaalsContact O-N 3.13Å; F283-F287 HydrophobicContact CB-CE2 4.45Å; F283-F287 HydrophobicContact CD2-CZ 4.25Å; F283-F287 HydrophobicContact CG-CZ 4.4Å
284	K	75.9	Confident	85.6	Confident	204 Å²	204	62.6 Å²	62.6	89%	0.887	32%	0.322	S	S	*	.			trans	-72.9	1.8	-179.7	-65.4	-174	177.9	-178.5	0	113.6	K282	K282-K284 PolarHBondContact O-N 3.35Å
285	K	83.5	Confident	86.1	Confident	89 Å²	89	60.8 Å²	60.8	39%	0.387	32%	0.318	S	S	.	.	S	Bend	trans	-133	150.2	-166.4	-69.6	-72	-167.7	178.5	0	111	E217 F283	E217-K285 VanDerWaalsContact CD-CG 3.45Å; E217-K285 HydrophobicContact CG-CB 4.45Å; E217-K285 HydrophobicContact CG-CD 4.13Å; E217-K285 HydrophobicContact CG-CG 3.73Å; E217-K285 WeakPolarHBondContact OE1-CE 3.27Å; E217-K285 VanDerWaalsContact OE1-CG 3.29Å; E217-K285 WeakPolarHBondContact OE1-CG 3.43Å; F283-K285 PolarHBondContact O-N 3.4Å; F283-K285 VanDerWaalsContact O-N 3.13Å
286	D	87.8	Confident	86.4	Confident	37 Å²	37	59.3 Å²	59.3	20%	0.198	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-72.2	153.5	-176.9	-69.3	23.7	0	0	0	110.8	E216 R242 A273	E216-D286 WeakPolarHBondContact CB-O 3.45Å; E216-D286 PolarHBondContact N-O 2.69Å; R242-D286 IonicContact CZ-OD2 2.77Å; R242-D286 IonicContact NH1-OD2 2.94Å; R242-D286 PolarHBondContact NH1-OD2 2.91Å; A273-D286 HydrophobicContact CB-CB 4.05Å
287	F	90.6	Very high	86.8	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.053	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.7	167.8	-70	-99	0	0	0	108.1	T215 R274 Y276 C280 F283	T215-F287 HydrophobicContact CG2-CD1 4.25Å; T215-F287 HydrophobicContact CG2-CD2 4.36Å; T215-F287 HydrophobicContact CG2-CE1 3.8Å; T215-F287 HydrophobicContact CG2-CE2 3.93Å; T215-F287 HydrophobicContact CG2-CZ 3.64Å; R274-F287 PolarHBondContact N-O 3.21Å; R274-F287 PolarHBondContact O-N 3.47Å; Y276-F287 HydrophobicContact CD2-CB 4.12Å; Y276-F287 AromaticContact CD2-CD2 3.82Å; Y276-F287 HydrophobicContact CD2-CD2 3.82Å; Y276-F287 HydrophobicContact CD2-CG 4.13Å; Y276-F287 HydrophobicContact CE2-CB 3.93Å; Y276-F287 HydrophobicContact CE2-CD2 4.48Å; Y276-F287 HydrophobicContact CE2-CG 4.37Å; C280-F287 HydrophobicContact CB-CE2 3.97Å; C280-F287 HydrophobicContact CB-CZ 4.35Å; F283-F287 HydrophobicContact CB-CE2 4.45Å; F283-F287 HydrophobicContact CD2-CZ 4.25Å; F283-F287 HydrophobicContact CG-CZ 4.4Å
288	I	92.6	Very high	87.3	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.8	177	-60.6	161.6	0	0	0	108.6	E216 D220 L221 R271 H272	E216-I288 HydrophobicContact CB-CD1 3.66Å; E216-I288 HydrophobicContact CB-CG1 3.94Å; E216-I288 HydrophobicContact CG-CD1 3.65Å; E216-I288 HydrophobicContact CG-CG1 4.26Å; D220-I288 HydrophobicContact CB-CD1 4.47Å; D220-I288 WeakPolarHBondContact OD1-CD1 3.24Å; L221-I288 HydrophobicContact CB-CG2 3.85Å; L221-I288 WeakPolarHBondContact CD1-O 3.18Å; R271-I288 HydrophobicContact CG-CG2 3.88Å; H272-I288 WeakPolarHBondContact O-CA 3.48Å
289	D	93.8	Very high	87.7	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.1	172	60.9	-60.6	0	0	0	111.1	Y156 K208 F209 R271 H272 T291	Y156-D289 HydrophobicContact CE2-CB 4.24Å; K208-D289 WeakPolarHBondContact CE-OD2 3.48Å; K208-D289 HydrophobicContact CG-CB 4.23Å; K208-D289 IonicContact NZ-OD2 3.82Å; F209-D289 CarbonylContact O-C 3.49Å; F209-D289 VanDerWaalsContact O-CA 3.24Å; F209-D289 WeakPolarHBondContact O-CA 3.46Å; F209-D289 WeakPolarHBondContact O-CB 3.39Å; R271-D289 CarbonylContact C-O 3.58Å; R271-D289 WeakPolarHBondContact CA-O 3.3Å; H272-D289 WeakPolarHBondContact CB-OD1 3.48Å; H272-D289 PolarHBondContact N-O 2.92Å; H272-D289 IonicContact ND1-OD2 3.72Å; H272-D289 PolarHBondContact O-N 2.81Å; D289-T291 PolarHBondContact OD2-OG1 3.45Å
290	I	95	Very high	87.9	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.8	170.3	-58.8	-177.1	0	0	0	107.5	L70 F209 L221 R271 Y292	L70-I290 HydrophobicContact CB-CD1 4.25Å; L70-I290 HydrophobicContact CD1-CD1 4.24Å; F209-I290 PolarHBondContact N-O 2.65Å; F209-I290 PolarHBondContact O-N 2.97Å; L221-I290 HydrophobicContact CB-CD1 4.05Å; L221-I290 HydrophobicContact CB-CG1 4.26Å; R271-I290 HydrophobicContact CB-CG1 4.31Å; R271-I290 HydrophobicContact CG-CG1 4.36Å; I290-Y292 HydrophobicContact CB-CE2 4.46Å; I290-Y292 HydrophobicContact CG2-CD2 4.3Å; I290-Y292 HydrophobicContact CG2-CE1 4.38Å; I290-Y292 HydrophobicContact CG2-CE2 3.71Å
291	T	95.4	Very high	88.2	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.3	-179.9	-52.5	0	0	0	0	109.6	H206 L207 K208 A269 K270 D289 Y293	H206-T291 HydrophobicContact CB-CG2 3.76Å; L207-T291 WeakPolarHBondContact O-CA 3.35Å; K208-T291 HydrophobicContact CB-CG2 4.44Å; A269-T291 WeakPolarHBondContact CA-O 3.47Å; K270-T291 PolarHBondContact N-O 2.92Å; K270-T291 PolarHBondContact O-N 3.28Å; D289-T291 PolarHBondContact OD2-OG1 3.45Å; T291-Y293 HydrophobicContact CG2-CD2 4.06Å; T291-Y293 HydrophobicContact CG2-CE1 4.26Å; T291-Y293 HydrophobicContact CG2-CE2 3.53Å
292	Y	95.9	Very high	88.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	117.9	172.7	-61.6	-89.4	0	0	0	108.9	L72 H206 L207 F209 H223 G250 I251 A269 I290	L72-Y292 HydrophobicContact CB-CD1 4Å; L72-Y292 HydrophobicContact CB-CD2 4.36Å; L72-Y292 HydrophobicContact CB-CE1 3.76Å; L72-Y292 HydrophobicContact CB-CE2 4.13Å; L72-Y292 HydrophobicContact CB-CG 4.29Å; L72-Y292 HydrophobicContact CD2-CD1 4.36Å; L72-Y292 HydrophobicContact CD2-CD2 4.12Å; L72-Y292 HydrophobicContact CD2-CG 3.97Å; H206-Y292 CarbonylContact C-O 3.6Å; H206-Y292 WeakPolarHBondContact CA-O 3.27Å; L207-Y292 PolarHBondContact N-O 2.93Å; L207-Y292 PolarHBondContact O-N 3.29Å; F209-Y292 AromaticContact CD2-CD2 3.72Å; F209-Y292 HydrophobicContact CD2-CD2 3.72Å; F209-Y292 AromaticContact CD2-CE2 3.79Å; F209-Y292 HydrophobicContact CD2-CE2 3.79Å; F209-Y292 HydrophobicContact CE2-CD2 4.08Å; F209-Y292 HydrophobicContact CE2-CE2 4.32Å; H223-Y292 AromaticContact CD2-CE1 3.87Å; H223-Y292 AromaticContact NE2-CE1 3.71Å; G250-Y292 WeakPolarHBondContact O-CE1 3.17Å; I251-Y292 HydrophobicContact CD1-CD1 4.5Å; I251-Y292 HydrophobicContact CG1-CD1 3.72Å; I251-Y292 HydrophobicContact CG1-CG 4.31Å; A269-Y292 HydrophobicContact CB-CD1 3.66Å; A269-Y292 HydrophobicContact CB-CE1 3.79Å; A269-Y292 HydrophobicContact CB-CG 4.47Å; I290-Y292 HydrophobicContact CB-CE2 4.46Å; I290-Y292 HydrophobicContact CG2-CD2 4.3Å; I290-Y292 HydrophobicContact CG2-CE1 4.38Å; I290-Y292 HydrophobicContact CG2-CE2 3.71Å
293	Y	95.2	Very high	89.2	Confident	46 Å²	46	46.5 Å²	46.5	18%	0.18	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.8	175.1	-66.1	-94.1	0	0	0	109.6	T204 C205 H206 I267 P268 K270 T291	T204-Y293 HydrophobicContact CG2-CD1 4.11Å; C205-Y293 CarbonylContact O-C 3.58Å; C205-Y293 WeakPolarHBondContact O-CA 3.34Å; H206-Y293 HydrophobicContact CB-CD1 3.71Å; H206-Y293 HydrophobicContact CB-CE1 3.86Å; H206-Y293 HydrophobicContact CB-CG 4.27Å; I267-Y293 CarbonylContact C-O 3.57Å; I267-Y293 VanDerWaalsContact CA-O 3.27Å; I267-Y293 WeakPolarHBondContact CA-O 3.44Å; P268-Y293 WeakPolarHBondContact CD-O 3.37Å; P268-Y293 PolarHBondContact O-N 3.45Å; K270-Y293 HydrophobicContact CB-CE2 4.12Å; K270-Y293 HydrophobicContact CD-CD2 4.39Å; K270-Y293 HydrophobicContact CD-CE2 3.75Å; K270-Y293 HydrophobicContact CG-CD2 4.16Å; K270-Y293 HydrophobicContact CG-CE2 3.84Å; T291-Y293 HydrophobicContact CG2-CD2 4.06Å; T291-Y293 HydrophobicContact CG2-CE1 4.26Å; T291-Y293 HydrophobicContact CG2-CE2 3.53Å
294	I	93.8	Very high	89.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	106.8	175.3	-50.1	-179.7	0	0	0	106.5	M113 C205 L207 I251 I267 L296	M113-I294 HydrophobicContact CE-CD1 4.02Å; M113-I294 HydrophobicContact SD-CD1 4.38Å; C205-I294 PolarHBondContact N-O 3.13Å; C205-I294 PolarHBondContact O-N 3.46Å; L207-I294 HydrophobicContact CD1-CD1 4.3Å; I251-I294 HydrophobicContact CD1-CD1 4.04Å; I251-I294 HydrophobicContact CD1-CG1 3.65Å; I267-I294 HydrophobicContact CG2-CG2 4.38Å; I294-L296 HydrophobicContact CG2-CD1 4.3Å; I294-L296 HydrophobicContact CG2-CD2 3.59Å; I294-L296 HydrophobicContact CG2-CG 3.81Å
295	N	93.1	Very high	90.2	Very high	37 Å²	37	37 Å²	37	20%	0.198	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.4	174.7	-65.8	-14.8	0	0	0	108.5	T204 L265 S266	T204-N295 WeakPolarHBondContact CG2-OD1 3.38Å; T204-N295 PolarHBondContact OG1-OD1 3.16Å; L265-N295 HydrophobicContact CB-CB 4.32Å; L265-N295 PolarHBondContact N-O 3.35Å; S266-N295 PolarHBondContact O-N 3.38Å; S266-N295 WeakPolarHBondContact OG-CB 3.46Å; S266-N295 PolarHBondContact OG-ND2 3.15Å
296	L	89.9	Confident	90.4	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	141.7	-171.6	-61.4	169.1	0	0	0	110.2	I77 L80 E202 Q203 W262 D263 I264 I294	I77-L296 HydrophobicContact CD1-CD1 4.43Å; I77-L296 HydrophobicContact CD1-CD2 3.57Å; L80-L296 HydrophobicContact CD1-CD1 3.38Å; E202-L296 CarbonylContact C-O 3.27Å; E202-L296 VanDerWaalsContact CA-O 3.3Å; E202-L296 WeakPolarHBondContact CA-O 3.14Å; Q203-L296 HydrophobicContact CB-CB 4.44Å; Q203-L296 PolarHBondContact N-O 3.28Å; Q203-L296 PolarHBondContact O-N 2.88Å; W262-L296 HydrophobicContact CB-CD2 4.44Å; W262-L296 HydrophobicContact CE3-CB 3.87Å; W262-L296 HydrophobicContact CZ3-CB 4.38Å; D263-L296 CarbonylContact O-C 3.55Å; D263-L296 VanDerWaalsContact O-CA 3.31Å; D263-L296 WeakPolarHBondContact O-CA 3.48Å; I264-L296 HydrophobicContact CG1-CD2 3.77Å; I294-L296 HydrophobicContact CG2-CD1 4.3Å; I294-L296 HydrophobicContact CG2-CD2 3.59Å; I294-L296 HydrophobicContact CG2-CG 3.81Å
297	R	90.4	Very high	90.2	Very high	41 Å²	41	35.5 Å²	35.5	16%	0.155	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132	171.6	-176.8	176.4	65.3	-166.2	-3.1	109.6	E202 W262 D263 L265 D558 R560	E202-R297 HydrophobicContact CG-CG 4.46Å; W262-R297 WeakPolarHBondContact CA-O 3.49Å; D263-R297 HydrophobicContact CB-CB 4.48Å; D263-R297 PolarHBondContact N-O 3.08Å; D263-R297 PolarHBondContact O-N 3.06Å; D263-R297 IonicContact OD2-NH2 3.23Å; L265-R297 HydrophobicContact CD1-CB 3.9Å; L265-R297 HydrophobicContact CD2-CB 4.22Å; L265-R297 HydrophobicContact CG-CB 3.96Å; R297-D558 IonicContact NH1-OD2 2.95Å; R297-R560 PolarHBondContact NH1-O 3.35Å; R297-R560 PolarHBondContact NH2-O 3.42Å
298	R	88.7	Confident	89.9	Confident	19 Å²	19	35.4 Å²	35.4	7%	0.072	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	142.7	176.8	-166.9	-177.9	-57.7	-88.4	-1.3	110.8	D201 E261 W262 P300	D201-R298 PolarHBondContact O-N 3Å; D201-R298 WeakPolarHBondContact OD1-CD 3.28Å; D201-R298 IonicContact OD1-CZ 3.25Å; D201-R298 IonicContact OD1-NE 2.94Å; D201-R298 PolarHBondContact OD1-NE 2.72Å; D201-R298 IonicContact OD1-NH2 3.52Å; D201-R298 IonicContact OD2-CZ 3.35Å; D201-R298 IonicContact OD2-NE 3.1Å; D201-R298 PolarHBondContact OD2-NE 3.15Å; D201-R298 IonicContact OD2-NH2 2.74Å; D201-R298 PolarHBondContact OD2-NH2 3.31Å; E261-R298 HydrophobicContact CG-CG 4.16Å; E261-R298 IonicContact OE1-CZ 2.73Å; E261-R298 IonicContact OE1-NH1 3.38Å; E261-R298 PolarHBondContact OE1-NH1 2.89Å; W262-R298 HydrophobicContact CE3-CB 4.04Å; W262-R298 HydrophobicContact CH2-CB 4.12Å; W262-R298 HydrophobicContact CH2-CG 4.43Å; W262-R298 VanDerWaalsContact CZ2-NH1 3.26Å; W262-R298 VanDerWaalsContact CZ2-NH2 3.27Å; W262-R298 HydrophobicContact CZ3-CB 3.68Å; W262-R298 HydrophobicContact CZ3-CG 4.36Å; R298-P300 VanDerWaalsContact O-CD 3.26Å; R298-P300 WeakPolarHBondContact O-CD 3.44Å
299	K	88.2	Confident	89.6	Confident	73 Å²	73	41.3 Å²	41.3	32%	0.317	20%	0.204	S	C	.	.			trans	-81.7	106.8	167.1	-67.8	176.1	-178.8	166.4	0	109.6	S259 V260 E261 D263 L301	S259-K299 PolarHBondContact O-NZ 3.02Å; V260-K299 WeakPolarHBondContact O-CD 3.28Å; E261-K299 PolarHBondContact O-N 2.7Å; D263-K299 WeakPolarHBondContact OD1-CE 3.46Å; D263-K299 IonicContact OD1-NZ 3.11Å; D263-K299 PolarHBondContact OD1-NZ 3.46Å; D263-K299 VanDerWaalsContact OD2-CE 3.27Å; D263-K299 WeakPolarHBondContact OD2-CE 3.42Å; K299-L301 VanDerWaalsContact C-N 3.32Å; K299-L301 PolarHBondContact O-N 2.86Å
300	P	87.4	Confident	89.3	Confident	41 Å²	41	43.2 Å²	43.2	27%	0.266	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.3	-168.7	31.4	-36.4	0	0	0	114	F200 R298 F302 Y303 T304	F200-P300 HydrophobicContact CD1-CB 3.78Å; F200-P300 HydrophobicContact CD1-CG 3.96Å; F200-P300 HydrophobicContact CE1-CB 3.62Å; F200-P300 HydrophobicContact CE1-CG 3.75Å; F200-P300 HydrophobicContact CZ-CB 4.33Å; R298-P300 VanDerWaalsContact O-CD 3.26Å; R298-P300 WeakPolarHBondContact O-CD 3.44Å; P300-F302 VanDerWaalsContact C-N 3.33Å; P300-F302 PolarHBondContact O-N 3.37Å; P300-F302 VanDerWaalsContact O-N 3.15Å; P300-Y303 PolarHBondContact O-N 2.99Å; P300-T304 PolarHBondContact O-N 3.41Å; P300-T304 PolarHBondContact O-OG1 3.35Å; P300-T304 VanDerWaalsContact O-OG1 3.12Å
301	L	87.3	Confident	88.8	Confident	136 Å²	136	43.3 Å²	43.3	71%	0.712	22%	0.216	S	C	*	.	H	α-helix	trans	-50.9	-46.1	-167.7	-171	112	0	0	0	113.9	K299 Y303 T304 V305	K299-L301 VanDerWaalsContact C-N 3.32Å; K299-L301 PolarHBondContact O-N 2.86Å; L301-Y303 VanDerWaalsContact C-N 3.34Å; L301-Y303 PolarHBondContact O-N 2.89Å; L301-T304 PolarHBondContact O-N 3.39Å; L301-V305 WeakPolarHBondContact O-CG2 3.44Å; L301-V305 PolarHBondContact O-N 3.41Å
302	F	87.5	Confident	88.4	Confident	113 Å²	113	46.6 Å²	46.6	50%	0.496	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-44	179.2	175.6	-94.7	0	0	0	112	P300 N306	P300-F302 VanDerWaalsContact C-N 3.33Å; P300-F302 PolarHBondContact O-N 3.37Å; P300-F302 VanDerWaalsContact O-N 3.15Å; F302-N306 VanDerWaalsContact CD2-ND2 3.28Å; F302-N306 WeakPolarHBondContact CD2-ND2 3.42Å; F302-N306 WeakPolarHBondContact CE2-ND2 3.33Å; F302-N306 WeakPolarHBondContact O-CB 3.39Å; F302-N306 PolarHBondContact O-N 3.12Å; F302-N306 VanDerWaalsContact O-N 3.08Å; F302-N306 PolarHBondContact O-ND2 2.83Å; F302-N306 VanDerWaalsContact O-ND2 3.12Å
303	Y	84.4	Confident	88	Confident	9 Å²	9	48.2 Å²	48.2	4%	0.035	25%	0.248	C	C	.	.	H	α-helix	trans	-75.7	-36.2	-179.7	-60.3	-79.1	0	0	0	111.5	R82 F198 P199 E261 P300 L301 L307 I308 I352	R82-Y303 PolarHBondContact NH2-OH 3.42Å; F198-Y303 HydrophobicContact CE1-CD1 4.34Å; F198-Y303 AromaticContact CZ-CD1 3.92Å; F198-Y303 HydrophobicContact CZ-CD1 3.92Å; F198-Y303 AromaticContact CZ-CE1 3.72Å; F198-Y303 HydrophobicContact CZ-CE1 3.72Å; F198-Y303 HydrophobicContact CZ-CG 4.42Å; P199-Y303 HydrophobicContact CB-CD2 3.88Å; P199-Y303 HydrophobicContact CB-CG 3.81Å; E261-Y303 WeakPolarHBondContact OE1-CE2 3.4Å; E261-Y303 PolarHBondContact OE1-OH 2.92Å; P300-Y303 PolarHBondContact O-N 2.99Å; L301-Y303 VanDerWaalsContact C-N 3.34Å; L301-Y303 PolarHBondContact O-N 2.89Å; Y303-L307 WeakPolarHBondContact O-CA 3.41Å; Y303-L307 WeakPolarHBondContact O-CB 3.32Å; Y303-L307 PolarHBondContact O-N 3.46Å; Y303-I308 PolarHBondContact O-N 3.01Å; Y303-I352 HydrophobicContact CE1-CG2 4.02Å
304	T	85.4	Confident	87.7	Confident	36 Å²	36	46.6 Å²	46.6	22%	0.221	24%	0.242	C	C	.	.	I	π-helix	trans	-60.2	-50	174.5	-54.3	0	0	0	0	111	P300 L301 I308 F309	P300-T304 PolarHBondContact O-N 3.41Å; P300-T304 PolarHBondContact O-OG1 3.35Å; P300-T304 VanDerWaalsContact O-OG1 3.12Å; L301-T304 PolarHBondContact O-N 3.39Å; T304-I308 HydrophobicContact CG2-CB 4.46Å; T304-I308 HydrophobicContact CG2-CD1 4.31Å; T304-I308 WeakPolarHBondContact O-CB 3.44Å; T304-I308 PolarHBondContact O-N 3.37Å; T304-F309 HydrophobicContact CG2-CD2 4.43Å; T304-F309 HydrophobicContact CG2-CE2 4.17Å; T304-F309 WeakPolarHBondContact O-CD2 3.43Å; T304-F309 PolarHBondContact O-N 3.41Å; T304-F309 VanDerWaalsContact O-N 3.12Å
305	V	88.5	Confident	87.3	Confident	75 Å²	75	47.1 Å²	47.1	46%	0.455	25%	0.245	S	C	.	.	I	π-helix	trans	-67.9	-46.2	-178.6	177.8	0	0	0	0	112.6	L301 P310	L301-V305 WeakPolarHBondContact O-CG2 3.44Å; L301-V305 PolarHBondContact O-N 3.41Å; V305-P310 WeakPolarHBondContact O-CD 3.47Å
306	N	87	Confident	87.1	Confident	81 Å²	81	51.1 Å²	51.1	43%	0.433	26%	0.261	S	S	.	.	I	π-helix	trans	-91.4	-14.3	-170.4	-63.5	-41.4	0	0	0	114.4	F302 P310	F302-N306 VanDerWaalsContact CD2-ND2 3.28Å; F302-N306 WeakPolarHBondContact CD2-ND2 3.42Å; F302-N306 WeakPolarHBondContact CE2-ND2 3.33Å; F302-N306 WeakPolarHBondContact O-CB 3.39Å; F302-N306 PolarHBondContact O-N 3.12Å; F302-N306 VanDerWaalsContact O-N 3.08Å; F302-N306 PolarHBondContact O-ND2 2.83Å; F302-N306 VanDerWaalsContact O-ND2 3.12Å; N306-P310 WeakPolarHBondContact O-CG 3.02Å
307	L	83.5	Confident	87.1	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.068	28%	0.279	C	S	.	.	I	π-helix	trans	-123.2	-49.6	-174.2	-156.5	162.3	0	0	0	111.7	Y303 C311 L349 I363	Y303-L307 WeakPolarHBondContact O-CA 3.41Å; Y303-L307 WeakPolarHBondContact O-CB 3.32Å; Y303-L307 PolarHBondContact O-N 3.46Å; L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.03Å; L307-L349 HydrophobicContact CD1-CD1 3.59Å; L307-L349 HydrophobicContact CD2-CD1 4.27Å; L307-L349 HydrophobicContact CG-CD1 4.47Å; L307-I363 HydrophobicContact CD2-CD1 3.41Å; L307-I363 VanDerWaalsContact CD2-CD1 3.41Å; L307-I363 HydrophobicContact CD2-CG1 3.42Å; L307-I363 VanDerWaalsContact CD2-CG1 3.42Å
308	I	84.3	Confident	87	Confident	10 Å²	10	52.9 Å²	52.9	5%	0.051	27%	0.273	C	S	.	.	I	π-helix	trans	-70.9	-50	-177.3	-61.7	179.6	0	0	0	111	F200 Y303 T304 C311 F312 I363 L550	F200-I308 HydrophobicContact CE2-CD1 3.89Å; F200-I308 HydrophobicContact CZ-CD1 4.26Å; Y303-I308 PolarHBondContact O-N 3.01Å; T304-I308 HydrophobicContact CG2-CB 4.46Å; T304-I308 HydrophobicContact CG2-CD1 4.31Å; T304-I308 WeakPolarHBondContact O-CB 3.44Å; T304-I308 PolarHBondContact O-N 3.37Å; I308-C311 PolarHBondContact O-N 3.19Å; I308-F312 HydrophobicContact CG2-CD2 3.46Å; I308-F312 VanDerWaalsContact CG2-CD2 3.46Å; I308-F312 HydrophobicContact CG2-CE2 3.29Å; I308-F312 VanDerWaalsContact O-CD2 3.28Å; I308-F312 WeakPolarHBondContact O-CD2 3.43Å; I308-F312 PolarHBondContact O-N 3.46Å; I308-I363 HydrophobicContact CG1-CD1 4.25Å; I308-L550 HydrophobicContact CD1-CD2 4.45Å
309	F	86.7	Confident	87	Confident	130 Å²	130	53.1 Å²	53.1	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-60.6	-45.2	-179.2	-83.2	-79.5	0	0	0	114.4	T304 C311 F312 G313	T304-F309 HydrophobicContact CG2-CD2 4.43Å; T304-F309 HydrophobicContact CG2-CE2 4.17Å; T304-F309 WeakPolarHBondContact O-CD2 3.43Å; T304-F309 PolarHBondContact O-N 3.41Å; T304-F309 VanDerWaalsContact O-N 3.12Å; F309-C311 VanDerWaalsContact C-N 3.3Å; F309-C311 PolarHBondContact O-N 2.95Å; F309-F312 WeakPolarHBondContact O-CB 3.26Å; F309-F312 PolarHBondContact O-N 3.48Å; F309-G313 PolarHBondContact O-N 3.12Å
310	P	87.6	Confident	87.1	Confident	41 Å²	41	52.9 Å²	52.9	27%	0.266	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-37.7	174.5	-27.9	37.5	0	0	0	113.3	V305 N306 G313 I314 F345	V305-P310 WeakPolarHBondContact O-CD 3.47Å; N306-P310 WeakPolarHBondContact O-CG 3.02Å; P310-G313 PolarHBondContact O-N 3.38Å; P310-I314 WeakPolarHBondContact O-CG1 3.38Å; P310-I314 PolarHBondContact O-N 2.88Å; P310-F345 HydrophobicContact CB-CE1 3.7Å; P310-F345 HydrophobicContact CB-CE2 4.35Å; P310-F345 HydrophobicContact CB-CZ 3.53Å; P310-F345 HydrophobicContact CG-CE1 4.35Å; P310-F345 HydrophobicContact CG-CZ 4.42Å
311	C	85	Confident	87.2	Confident	4 Å²	4	51 Å²	51	3%	0.027	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-38.8	178.2	-170	0	0	0	0	112.5	L307 I308 F309 G313 I314 S315 Y366 L367	L307-C311 WeakPolarHBondContact O-CB 3.32Å; L307-C311 PolarHBondContact O-N 3.03Å; I308-C311 PolarHBondContact O-N 3.19Å; F309-C311 VanDerWaalsContact C-N 3.3Å; F309-C311 PolarHBondContact O-N 2.95Å; C311-G313 VanDerWaalsContact C-N 3.34Å; C311-I314 PolarHBondContact O-N 3.22Å; C311-S315 WeakPolarHBondContact O-CB 3.4Å; C311-S315 PolarHBondContact O-N 3.43Å; C311-S315 PolarHBondContact O-OG 3.32Å; C311-Y366 HydrophobicContact CB-CE1 3.82Å; C311-Y366 WeakPolarHBondContact SG-CE1 3.15Å; C311-L367 HydrophobicContact CB-CD2 4.36Å; C311-L367 WeakPolarHBondContact SG-CD2 3.49Å
312	F	86.4	Confident	87.3	Confident	73 Å²	73	44.8 Å²	44.8	32%	0.32	23%	0.233	S	C	.	.	H	α-helix	trans	-59.5	-44.2	167.9	-87.5	-68.4	0	0	0	112.3	I308 F309 I314 S315 F316 T546 L550	I308-F312 HydrophobicContact CG2-CD2 3.46Å; I308-F312 VanDerWaalsContact CG2-CD2 3.46Å; I308-F312 HydrophobicContact CG2-CE2 3.29Å; I308-F312 VanDerWaalsContact O-CD2 3.28Å; I308-F312 WeakPolarHBondContact O-CD2 3.43Å; I308-F312 PolarHBondContact O-N 3.46Å; F309-F312 WeakPolarHBondContact O-CB 3.26Å; F309-F312 PolarHBondContact O-N 3.48Å; F312-I314 PolarHBondContact O-N 2.98Å; F312-S315 PolarHBondContact O-N 3.33Å; F312-F316 PolarHBondContact O-N 3.4Å; F312-T546 HydrophobicContact CD1-CG2 3.92Å; F312-T546 HydrophobicContact CE1-CG2 3.01Å; F312-T546 HydrophobicContact CE2-CG2 4.09Å; F312-T546 HydrophobicContact CZ-CG2 3.12Å; F312-L550 HydrophobicContact CE2-CD1 3.87Å; F312-L550 HydrophobicContact CZ-CD1 3.51Å
313	G	88.6	Confident	87.4	Confident	34 Å²	34	48 Å²	48	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-46.9	176.4	0	0	0	0	0	112	F309 P310 C311 S315 F316 L317	F309-G313 PolarHBondContact O-N 3.12Å; P310-G313 PolarHBondContact O-N 3.38Å; C311-G313 VanDerWaalsContact C-N 3.34Å; G313-S315 VanDerWaalsContact C-N 3.35Å; G313-S315 PolarHBondContact O-N 3.21Å; G313-F316 WeakPolarHBondContact O-CB 3.31Å; G313-F316 PolarHBondContact O-N 3.18Å; G313-L317 WeakPolarHBondContact O-CG 3.39Å; G313-L317 PolarHBondContact O-N 3.49Å
314	I	88	Confident	87.6	Confident	11 Å²	11	50.1 Å²	50.1	6%	0.056	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-42.4	176.2	-66.6	168.7	0	0	0	111.3	P310 C311 F312 F316 L317 T318 I338 F345	P310-I314 WeakPolarHBondContact O-CG1 3.38Å; P310-I314 PolarHBondContact O-N 2.88Å; C311-I314 PolarHBondContact O-N 3.22Å; F312-I314 PolarHBondContact O-N 2.98Å; I314-F316 PolarHBondContact O-N 2.8Å; I314-L317 PolarHBondContact O-N 3.35Å; I314-T318 PolarHBondContact O-N 3.46Å; I314-T318 VanDerWaalsContact O-N 3.13Å; I314-I338 HydrophobicContact CG2-CG2 3.75Å; I314-F345 HydrophobicContact CD1-CD2 3.31Å; I314-F345 HydrophobicContact CD1-CE2 3.49Å; I314-F345 VanDerWaalsContact CD1-CE2 3.49Å; I314-F345 HydrophobicContact CD1-CG 4.31Å
315	S	85.9	Confident	87.7	Confident	11 Å²	11	52 Å²	52	8%	0.077	27%	0.267	C	S	.	.	H	α-helix	trans	-65.2	-27.5	177.1	-58.8	0	0	0	0	112.9	C311 F312 G313 T318 T370	C311-S315 WeakPolarHBondContact O-CB 3.4Å; C311-S315 PolarHBondContact O-N 3.43Å; C311-S315 PolarHBondContact O-OG 3.32Å; F312-S315 PolarHBondContact O-N 3.33Å; G313-S315 VanDerWaalsContact C-N 3.35Å; G313-S315 PolarHBondContact O-N 3.21Å; S315-T318 PolarHBondContact O-OG1 3.37Å; S315-T370 WeakPolarHBondContact OG-CG2 3.35Å
316	F	87.7	Confident	87.5	Confident	121 Å²	121	48.7 Å²	48.7	53%	0.531	25%	0.247	S	C	.	.	H	α-helix	trans	-77.3	-39.2	172.5	-179.6	-105.9	0	0	0	111.8	F312 G313 I314 T318 I319 L320	F312-F316 PolarHBondContact O-N 3.4Å; G313-F316 WeakPolarHBondContact O-CB 3.31Å; G313-F316 PolarHBondContact O-N 3.18Å; I314-F316 PolarHBondContact O-N 2.8Å; F316-T318 VanDerWaalsContact C-N 3.27Å; F316-T318 PolarHBondContact O-N 2.93Å; F316-I319 WeakPolarHBondContact O-CB 3.49Å; F316-I319 PolarHBondContact O-N 2.79Å; F316-I319 VanDerWaalsContact O-N 3.1Å; F316-L320 HydrophobicContact CD1-CD1 4Å; F316-L320 HydrophobicContact CD1-CG 4.34Å; F316-L320 HydrophobicContact CE1-CD1 3.6Å; F316-L320 HydrophobicContact CE1-CD2 4.29Å; F316-L320 HydrophobicContact CE1-CG 3.96Å; F316-L320 HydrophobicContact CZ-CD1 4.3Å; F316-L320 HydrophobicContact CZ-CD2 4.17Å; F316-L320 HydrophobicContact CZ-CG 4.24Å; F316-L320 PolarHBondContact O-N 3.3Å; F316-L320 VanDerWaalsContact O-N 3.15Å
317	L	90.2	Very high	87.4	Confident	73 Å²	73	49.8 Å²	49.8	38%	0.382	25%	0.254	S	S	.	.	H	α-helix	trans	-59.6	-36.4	175.5	-69.2	178.6	0	0	0	112	G313 I314 I319 L320 V321 I338	G313-L317 WeakPolarHBondContact O-CG 3.39Å; G313-L317 PolarHBondContact O-N 3.49Å; I314-L317 PolarHBondContact O-N 3.35Å; L317-I319 VanDerWaalsContact C-N 3.31Å; L317-I319 PolarHBondContact O-N 2.7Å; L317-L320 HydrophobicContact CD2-CD1 4.16Å; L317-L320 WeakPolarHBondContact O-CB 3.4Å; L317-L320 PolarHBondContact O-N 2.83Å; L317-V321 WeakPolarHBondContact O-CG2 3.49Å; L317-V321 PolarHBondContact O-N 3.25Å; L317-I338 HydrophobicContact CB-CD1 3.89Å; L317-I338 HydrophobicContact CB-CG1 4.23Å
318	T	87.9	Confident	87.4	Confident	6 Å²	6	52 Å²	52	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-33.4	175.3	56.5	0	0	0	0	113.3	I314 S315 F316 V321 I338 V374	I314-T318 PolarHBondContact O-N 3.46Å; I314-T318 VanDerWaalsContact O-N 3.13Å; S315-T318 PolarHBondContact O-OG1 3.37Å; F316-T318 VanDerWaalsContact C-N 3.27Å; F316-T318 PolarHBondContact O-N 2.93Å; T318-V321 WeakPolarHBondContact O-CB 3.42Å; T318-V321 PolarHBondContact O-N 2.88Å; T318-I338 HydrophobicContact CG2-CD1 4.22Å; T318-I338 HydrophobicContact CG2-CG2 3.54Å; T318-V374 HydrophobicContact CG2-CB 4.36Å; T318-V374 HydrophobicContact CG2-CG1 4.34Å; T318-V374 HydrophobicContact CG2-CG2 3.64Å
319	I	89.8	Confident	87.3	Confident	25 Å²	25	56.8 Å²	56.8	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-68.5	-40.5	174.9	-60.9	166	0	0	0	109.9	F316 L317 V321 F322 L535 C542	F316-I319 WeakPolarHBondContact O-CB 3.49Å; F316-I319 PolarHBondContact O-N 2.79Å; F316-I319 VanDerWaalsContact O-N 3.1Å; L317-I319 VanDerWaalsContact C-N 3.31Å; L317-I319 PolarHBondContact O-N 2.7Å; I319-V321 PolarHBondContact O-N 2.97Å; I319-F322 PolarHBondContact O-N 3.34Å; I319-F322 VanDerWaalsContact O-N 3.12Å; I319-L535 HydrophobicContact CG2-CG 4.33Å; I319-C542 HydrophobicContact CD1-CB 4.1Å
320	L	89.1	Confident	87.4	Confident	68 Å²	68	56 Å²	56	36%	0.356	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-27.4	176.7	-69.5	178.9	0	0	0	113.3	F316 L317 F322 Y323 L324	F316-L320 HydrophobicContact CD1-CD1 4Å; F316-L320 HydrophobicContact CD1-CG 4.34Å; F316-L320 HydrophobicContact CE1-CD1 3.6Å; F316-L320 HydrophobicContact CE1-CD2 4.29Å; F316-L320 HydrophobicContact CE1-CG 3.96Å; F316-L320 HydrophobicContact CZ-CD1 4.3Å; F316-L320 HydrophobicContact CZ-CD2 4.17Å; F316-L320 HydrophobicContact CZ-CG 4.24Å; F316-L320 PolarHBondContact O-N 3.3Å; F316-L320 VanDerWaalsContact O-N 3.15Å; L317-L320 HydrophobicContact CD2-CD1 4.16Å; L317-L320 WeakPolarHBondContact O-CB 3.4Å; L317-L320 PolarHBondContact O-N 2.83Å; L320-F322 PolarHBondContact O-N 2.91Å; L320-Y323 WeakPolarHBondContact O-CB 3.47Å; L320-Y323 PolarHBondContact O-N 3.01Å; L320-L324 PolarHBondContact O-N 3.38Å; L320-L324 VanDerWaalsContact O-N 3.13Å
321	V	90.5	Very high	87.5	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-35	174.3	-180	0	0	0	0	111.7	L317 T318 I319 Y323 K331 L334 I338 T381	L317-V321 WeakPolarHBondContact O-CG2 3.49Å; L317-V321 PolarHBondContact O-N 3.25Å; T318-V321 WeakPolarHBondContact O-CB 3.42Å; T318-V321 PolarHBondContact O-N 2.88Å; I319-V321 PolarHBondContact O-N 2.97Å; V321-Y323 VanDerWaalsContact C-N 3.34Å; V321-K331 HydrophobicContact CG1-CG 3.8Å; V321-K331 VanDerWaalsContact O-CE 3.27Å; V321-K331 WeakPolarHBondContact O-CE 3.16Å; V321-L334 HydrophobicContact CG2-CD2 3.69Å; V321-L334 HydrophobicContact CG2-CG 3.88Å; V321-I338 HydrophobicContact CG2-CD1 3.66Å; V321-T381 HydrophobicContact CG1-CG2 3.5Å
322	F	90.1	Very high	87.6	Confident	5 Å²	5	58 Å²	58	2%	0.022	30%	0.301	C	S	.	.	H	α-helix	trans	-78.4	-18.7	177.1	-64.8	-65.5	0	0	0	113.6	I319 L320 V380 T381 F534 L535 F538	I319-F322 PolarHBondContact O-N 3.34Å; I319-F322 VanDerWaalsContact O-N 3.12Å; L320-F322 PolarHBondContact O-N 2.91Å; F322-V380 HydrophobicContact CE1-CB 4.15Å; F322-V380 HydrophobicContact CE1-CG1 3.63Å; F322-V380 HydrophobicContact CZ-CB 4.28Å; F322-V380 HydrophobicContact CZ-CG1 4.12Å; F322-T381 HydrophobicContact CD1-CG2 4.28Å; F322-T381 HydrophobicContact CE1-CG2 3.74Å; F322-T381 HydrophobicContact CZ-CG2 4.2Å; F322-F534 HydrophobicContact CD1-CB 4.22Å; F322-F534 HydrophobicContact CE1-CB 4.04Å; F322-F534 HydrophobicContact CZ-CB 4.32Å; F322-L535 HydrophobicContact CB-CB 3.83Å; F322-L535 HydrophobicContact CB-CD1 4.34Å; F322-L535 HydrophobicContact CB-CG 4.3Å; F322-F538 HydrophobicContact CD2-CD2 4.19Å; F322-F538 HydrophobicContact CE2-CB 4.15Å; F322-F538 AromaticContact CE2-CD2 3.3Å; F322-F538 HydrophobicContact CE2-CD2 3.3Å; F322-F538 AromaticContact CE2-CE2 3.8Å; F322-F538 HydrophobicContact CE2-CE2 3.8Å; F322-F538 AromaticContact CE2-CG 3.78Å; F322-F538 HydrophobicContact CE2-CG 3.78Å; F322-F538 AromaticContact CZ-CD2 3.52Å; F322-F538 HydrophobicContact CZ-CD2 3.52Å; F322-F538 AromaticContact CZ-CE2 3.52Å; F322-F538 HydrophobicContact CZ-CE2 3.52Å; F322-F538 HydrophobicContact CZ-CG 4.37Å; F322-F538 HydrophobicContact CZ-CZ 4.38Å
323	Y	88.6	Confident	87.8	Confident	182 Å²	182	57.7 Å²	57.7	71%	0.714	31%	0.308	S	S	*	.	H	α-helix	trans	-81.9	-28.3	174.8	-171.6	-102.1	0	0	0	112.2	L320 V321 L535	L320-Y323 WeakPolarHBondContact O-CB 3.47Å; L320-Y323 PolarHBondContact O-N 3.01Å; V321-Y323 VanDerWaalsContact C-N 3.34Å; Y323-L535 HydrophobicContact CD2-CD1 4.19Å
324	L	89.2	Confident	87.8	Confident	53 Å²	53	58.9 Å²	58.9	28%	0.277	31%	0.306	S	S	.	.	S	Bend	trans	-67.5	126.5	-179.1	-167.8	74.5	0	0	0	111.2	L320 E330 K331	L320-L324 PolarHBondContact O-N 3.38Å; L320-L324 VanDerWaalsContact O-N 3.13Å; L324-E330 HydrophobicContact CD2-CB 4.31Å; L324-K331 HydrophobicContact CD2-CB 4.23Å
325	P	87.3	Confident	87.9	Confident	74 Å²	74	58.7 Å²	58.7	48%	0.481	31%	0.305	S	S	.	.			trans	-66.1	136.6	178.5	27.2	-33.5	0	0	0	111.2	D327 S328	P325-D327 PolarHBondContact O-N 2.98Å; P325-D327 VanDerWaalsContact O-N 3.15Å; P325-S328 PolarHBondContact O-N 3.18Å
326	S	84.8	Confident	88	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.042	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-64.2	-17	-177.7	-65.4	0	0	0	0	114.1	S328	S326-S328 PolarHBondContact O-N 3.17Å
327	D	85	Confident	88.2	Confident	105 Å²	105	59.9 Å²	59.9	56%	0.561	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-64.6	-22.6	175	-67.2	-48.1	0	0	0	113.5	P325 N329 H388	P325-D327 PolarHBondContact O-N 2.98Å; P325-D327 VanDerWaalsContact O-N 3.15Å; D327-N329 VanDerWaalsContact C-N 3.29Å; D327-N329 PolarHBondContact O-N 3.41Å; D327-H388 IonicContact OD1-CE1 3.12Å; D327-H388 PolarHBondContact OD1-CE1 3.32Å; D327-H388 IonicContact OD1-NE2 3.36Å; D327-H388 PolarHBondContact OD1-NE2 3.38Å
328	S	81.8	Confident	88.2	Confident	59 Å²	59	56.8 Å²	56.8	41%	0.413	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-77.9	-7.9	-174	-61.6	0	0	0	0	114.2	P325 S326 E330	P325-S328 PolarHBondContact O-N 3.18Å; S326-S328 PolarHBondContact O-N 3.17Å; S328-E330 PolarHBondContact O-N 3.2Å
329	N	82.9	Confident	88.2	Confident	110 Å²	110	59.7 Å²	59.7	59%	0.588	32%	0.322	S	S	*	.	S	Bend	trans	55	-10.2	-175.2	-62	-40.4	0	0	0	116.7	D327 K331	D327-N329 VanDerWaalsContact C-N 3.29Å; D327-N329 PolarHBondContact O-N 3.41Å; N329-K331 VanDerWaalsContact C-N 3.28Å; N329-K331 PolarHBondContact O-N 3.16Å
330	E	88.3	Confident	88.2	Confident	115 Å²	115	62.6 Å²	62.6	54%	0.537	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-8.7	179.5	-70.4	-54.3	132.5	0	0	114.2	L324 S328 I332 S333 L334	L324-E330 HydrophobicContact CD2-CB 4.31Å; S328-E330 PolarHBondContact O-N 3.2Å; E330-I332 PolarHBondContact O-N 3.37Å; E330-S333 WeakPolarHBondContact O-CB 3.39Å; E330-S333 PolarHBondContact O-N 3.31Å; E330-L334 PolarHBondContact O-N 3.32Å
331	K	89.5	Confident	88.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.7	-40.4	-175.5	-169.6	169.9	177.9	167	0	113.1	V321 L324 N329 C335 L385 D531	V321-K331 HydrophobicContact CG1-CG 3.8Å; V321-K331 VanDerWaalsContact O-CE 3.27Å; V321-K331 WeakPolarHBondContact O-CE 3.16Å; L324-K331 HydrophobicContact CD2-CB 4.23Å; N329-K331 VanDerWaalsContact C-N 3.28Å; N329-K331 PolarHBondContact O-N 3.16Å; K331-C335 WeakPolarHBondContact O-CB 3.49Å; K331-C335 PolarHBondContact O-N 3.08Å; K331-L385 HydrophobicContact CD-CD2 4.38Å; K331-D531 IonicContact NZ-OD1 2.78Å; K331-D531 PolarHBondContact NZ-OD1 3.08Å; K331-D531 IonicContact NZ-OD2 3.37Å; K331-D531 PolarHBondContact NZ-OD2 3.1Å
332	I	87.9	Confident	88.1	Confident	86 Å²	86	61.5 Å²	61.5	44%	0.441	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-42.9	177.4	-59.1	-179.1	0	0	0	110.6	E330 L334 C335 I336 L385	E330-I332 PolarHBondContact O-N 3.37Å; I332-L334 PolarHBondContact O-N 3.44Å; I332-C335 WeakPolarHBondContact O-CB 3.28Å; I332-C335 PolarHBondContact O-N 2.93Å; I332-C335 VanDerWaalsContact O-N 3.15Å; I332-I336 HydrophobicContact CG2-CD1 3.74Å; I332-I336 HydrophobicContact CG2-CG1 4.25Å; I332-I336 WeakPolarHBondContact O-CG1 3.32Å; I332-I336 PolarHBondContact O-N 3.4Å; I332-L385 HydrophobicContact CD1-CD1 3.68Å; I332-L385 HydrophobicContact CG1-CD1 3.25Å
333	S	90.3	Very high	87.9	Confident	67 Å²	67	64.8 Å²	64.8	47%	0.469	36%	0.359	S	S	.	.	H	α-helix	trans	-57.6	-49.7	-179.9	-176.9	0	0	0	0	111.2	E330 C335 I336 A337	E330-S333 WeakPolarHBondContact O-CB 3.39Å; E330-S333 PolarHBondContact O-N 3.31Å; S333-C335 VanDerWaalsContact C-N 3.32Å; S333-C335 PolarHBondContact O-N 3.24Å; S333-I336 PolarHBondContact O-N 3.15Å; S333-A337 PolarHBondContact O-N 3.39Å
334	L	90.1	Very high	87.9	Confident	59 Å²	59	60.2 Å²	60.2	31%	0.309	35%	0.35	S	S	.	.	H	α-helix	trans	-59.5	-42.3	175.5	-178.9	60.8	0	0	0	112	V321 E330 I332 A337 I338	V321-L334 HydrophobicContact CG2-CD2 3.69Å; V321-L334 HydrophobicContact CG2-CG 3.88Å; E330-L334 PolarHBondContact O-N 3.32Å; I332-L334 PolarHBondContact O-N 3.44Å; L334-A337 PolarHBondContact O-N 3.01Å; L334-I338 HydrophobicContact CD1-CD1 4.27Å; L334-I338 HydrophobicContact CD1-CG1 4.48Å; L334-I338 HydrophobicContact CG-CD1 4.07Å; L334-I338 VanDerWaalsContact O-CG1 3.26Å; L334-I338 WeakPolarHBondContact O-CG1 3.22Å; L334-I338 PolarHBondContact O-N 3.12Å
335	C	88.9	Confident	87.7	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.041	35%	0.349	C	S	.	.	H	α-helix	trans	-63.2	-44	-179.9	-165	0	0	0	0	112.6	K331 I332 S333 I338 L339 V378	K331-C335 WeakPolarHBondContact O-CB 3.49Å; K331-C335 PolarHBondContact O-N 3.08Å; I332-C335 WeakPolarHBondContact O-CB 3.28Å; I332-C335 PolarHBondContact O-N 2.93Å; I332-C335 VanDerWaalsContact O-N 3.15Å; S333-C335 VanDerWaalsContact C-N 3.32Å; S333-C335 PolarHBondContact O-N 3.24Å; C335-I338 PolarHBondContact O-N 3.28Å; C335-L339 PolarHBondContact O-N 3.34Å; C335-V378 VanDerWaalsContact SG-CA 3.57Å; C335-V378 WeakPolarHBondContact SG-CG2 3.38Å
336	I	88.8	Confident	87.5	Confident	99 Å²	99	59.1 Å²	59.1	51%	0.508	34%	0.339	S	S	.	.	H	α-helix	trans	-65.1	-42.9	175.9	-66.3	170.5	0	0	0	110.7	I332 S333 I338 L339 V340	I332-I336 HydrophobicContact CG2-CD1 3.74Å; I332-I336 HydrophobicContact CG2-CG1 4.25Å; I332-I336 WeakPolarHBondContact O-CG1 3.32Å; I332-I336 PolarHBondContact O-N 3.4Å; S333-I336 PolarHBondContact O-N 3.15Å; I336-I338 VanDerWaalsContact C-N 3.33Å; I336-I338 PolarHBondContact O-N 3.4Å; I336-L339 PolarHBondContact O-N 3.07Å; I336-V340 HydrophobicContact CG2-CG2 4.45Å; I336-V340 WeakPolarHBondContact O-CG2 3.09Å; I336-V340 PolarHBondContact O-N 2.95Å
337	A	91.6	Very high	87.5	Confident	58 Å²	58	63.6 Å²	63.6	48%	0.479	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-41.1	178.8	0	0	0	0	0	112.4	S333 L334 V340 S341	S333-A337 PolarHBondContact O-N 3.39Å; L334-A337 PolarHBondContact O-N 3.01Å; A337-V340 PolarHBondContact O-N 3.46Å; A337-S341 WeakPolarHBondContact O-CB 3.46Å; A337-S341 PolarHBondContact O-N 3.44Å
338	I	90.1	Very high	87.5	Confident	8 Å²	8	62.2 Å²	62.2	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-62.6	-44.2	175.3	-67.2	165.7	0	0	0	110.6	I314 L317 T318 V321 L334 C335 I336 V340 S341 L342 V374	I314-I338 HydrophobicContact CG2-CG2 3.75Å; L317-I338 HydrophobicContact CB-CD1 3.89Å; L317-I338 HydrophobicContact CB-CG1 4.23Å; T318-I338 HydrophobicContact CG2-CD1 4.22Å; T318-I338 HydrophobicContact CG2-CG2 3.54Å; V321-I338 HydrophobicContact CG2-CD1 3.66Å; L334-I338 HydrophobicContact CD1-CD1 4.27Å; L334-I338 HydrophobicContact CD1-CG1 4.48Å; L334-I338 HydrophobicContact CG-CD1 4.07Å; L334-I338 VanDerWaalsContact O-CG1 3.26Å; L334-I338 WeakPolarHBondContact O-CG1 3.22Å; L334-I338 PolarHBondContact O-N 3.12Å; C335-I338 PolarHBondContact O-N 3.28Å; I336-I338 VanDerWaalsContact C-N 3.33Å; I336-I338 PolarHBondContact O-N 3.4Å; I338-V340 PolarHBondContact O-N 2.84Å; I338-S341 PolarHBondContact O-N 2.96Å; I338-L342 WeakPolarHBondContact O-CB 3.48Å; I338-L342 PolarHBondContact O-N 3.07Å; I338-V374 HydrophobicContact CG2-CG1 4.01Å; I338-V374 HydrophobicContact CG2-CG2 4.48Å
339	L	87.3	Confident	87.4	Confident	67 Å²	67	60.1 Å²	60.1	35%	0.351	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-44	179.7	-176.2	66.2	0	0	0	112.2	C335 I336 L342 T343 V374	C335-L339 PolarHBondContact O-N 3.34Å; I336-L339 PolarHBondContact O-N 3.07Å; L339-L342 PolarHBondContact O-N 2.86Å; L339-T343 PolarHBondContact O-N 2.94Å; L339-T343 VanDerWaalsContact O-N 3.07Å; L339-T343 PolarHBondContact O-OG1 3.45Å; L339-V374 HydrophobicContact CD1-CG1 4.47Å
340	V	91.3	Very high	87.1	Confident	87 Å²	87	58.6 Å²	58.6	53%	0.527	33%	0.334	S	S	.	.	H	α-helix	trans	-63.5	-46.6	175.8	174.6	0	0	0	0	110.6	I336 A337 I338 L342 T343 V344	I336-V340 HydrophobicContact CG2-CG2 4.45Å; I336-V340 WeakPolarHBondContact O-CG2 3.09Å; I336-V340 PolarHBondContact O-N 2.95Å; A337-V340 PolarHBondContact O-N 3.46Å; I338-V340 PolarHBondContact O-N 2.84Å; V340-L342 VanDerWaalsContact C-N 3.33Å; V340-L342 PolarHBondContact O-N 3.12Å; V340-T343 WeakPolarHBondContact O-CB 3.26Å; V340-T343 PolarHBondContact O-N 2.85Å; V340-T343 VanDerWaalsContact O-N 3.16Å; V340-V344 WeakPolarHBondContact O-CG2 3.25Å; V340-V344 PolarHBondContact O-N 3.23Å; V340-V344 VanDerWaalsContact O-N 3.08Å
341	S	89.5	Confident	86.7	Confident	43 Å²	43	59.4 Å²	59.4	30%	0.301	34%	0.337	S	S	.	.	H	α-helix	trans	-58.9	-44.4	177.5	-173.3	0	0	0	0	111.7	A337 I338 T343 V344 F345	A337-S341 WeakPolarHBondContact O-CB 3.46Å; A337-S341 PolarHBondContact O-N 3.44Å; I338-S341 PolarHBondContact O-N 2.96Å; S341-T343 VanDerWaalsContact C-N 3.29Å; S341-T343 PolarHBondContact O-N 3.42Å; S341-V344 PolarHBondContact O-N 3.29Å; S341-F345 WeakPolarHBondContact O-CD2 3.34Å; S341-F345 PolarHBondContact O-N 3.2Å
342	L	86.2	Confident	86.2	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-60.3	-41.4	177.6	-175.9	74.5	0	0	0	111.4	I338 L339 V340 V344 F345 V346 M371 V374	I338-L342 WeakPolarHBondContact O-CB 3.48Å; I338-L342 PolarHBondContact O-N 3.07Å; L339-L342 PolarHBondContact O-N 2.86Å; V340-L342 VanDerWaalsContact C-N 3.33Å; V340-L342 PolarHBondContact O-N 3.12Å; L342-V344 VanDerWaalsContact C-N 3.34Å; L342-V344 PolarHBondContact O-N 3.4Å; L342-F345 PolarHBondContact O-N 2.98Å; L342-V346 WeakPolarHBondContact O-CG2 3.35Å; L342-V346 PolarHBondContact O-N 3.33Å; L342-M371 HydrophobicContact CD2-CB 3.87Å; L342-M371 HydrophobicContact CD2-CG 4Å; L342-V374 HydrophobicContact CD2-CB 4.16Å; L342-V374 HydrophobicContact CD2-CG1 4.36Å; L342-V374 HydrophobicContact CD2-CG2 4.14Å
343	T	86.5	Confident	85.5	Confident	73 Å²	73	59 Å²	59	45%	0.448	34%	0.335	S	S	.	.	H	α-helix	trans	-63.1	-41.5	179.4	-54.6	0	0	0	0	111	L339 V340 S341 V346 L347	L339-T343 PolarHBondContact O-N 2.94Å; L339-T343 VanDerWaalsContact O-N 3.07Å; L339-T343 PolarHBondContact O-OG1 3.45Å; V340-T343 WeakPolarHBondContact O-CB 3.26Å; V340-T343 PolarHBondContact O-N 2.85Å; V340-T343 VanDerWaalsContact O-N 3.16Å; S341-T343 VanDerWaalsContact C-N 3.29Å; S341-T343 PolarHBondContact O-N 3.42Å; T343-V346 PolarHBondContact O-N 3.4Å; T343-L347 WeakPolarHBondContact O-CG 3.37Å; T343-L347 PolarHBondContact O-N 3.19Å
344	V	89	Confident	84.6	Confident	87 Å²	87	56.7 Å²	56.7	53%	0.527	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-42.2	174.9	174.2	0	0	0	0	111.7	V340 S341 L342 V346 L347 L348	V340-V344 WeakPolarHBondContact O-CG2 3.25Å; V340-V344 PolarHBondContact O-N 3.23Å; V340-V344 VanDerWaalsContact O-N 3.08Å; S341-V344 PolarHBondContact O-N 3.29Å; L342-V344 VanDerWaalsContact C-N 3.34Å; L342-V344 PolarHBondContact O-N 3.4Å; V344-V346 VanDerWaalsContact C-N 3.32Å; V344-V346 PolarHBondContact O-N 2.9Å; V344-L347 PolarHBondContact O-N 3.34Å; V344-L348 PolarHBondContact O-N 2.73Å
345	F	84.4	Confident	83.5	Confident	57 Å²	57	58 Å²	58	25%	0.25	34%	0.338	C	S	.	.	H	α-helix	trans	-65.7	-33.8	175.9	-83.8	-72.1	0	0	0	113.1	P310 I314 S341 L342 L348 L349	P310-F345 HydrophobicContact CB-CE1 3.7Å; P310-F345 HydrophobicContact CB-CE2 4.35Å; P310-F345 HydrophobicContact CB-CZ 3.53Å; P310-F345 HydrophobicContact CG-CE1 4.35Å; P310-F345 HydrophobicContact CG-CZ 4.42Å; I314-F345 HydrophobicContact CD1-CD2 3.31Å; I314-F345 HydrophobicContact CD1-CE2 3.49Å; I314-F345 VanDerWaalsContact CD1-CE2 3.49Å; I314-F345 HydrophobicContact CD1-CG 4.31Å; S341-F345 WeakPolarHBondContact O-CD2 3.34Å; S341-F345 PolarHBondContact O-N 3.2Å; L342-F345 PolarHBondContact O-N 2.98Å; F345-L348 HydrophobicContact CD1-CD2 4.46Å; F345-L349 PolarHBondContact O-N 2.87Å; F345-L349 VanDerWaalsContact O-N 3.08Å
346	V	83.5	Confident	82.6	Confident	46 Å²	46	59.6 Å²	59.6	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-65.2	-43.7	172.9	170.1	0	0	0	0	110.7	L342 T343 V344 L348 L349 T350 L367	L342-V346 WeakPolarHBondContact O-CG2 3.35Å; L342-V346 PolarHBondContact O-N 3.33Å; T343-V346 PolarHBondContact O-N 3.4Å; V344-V346 VanDerWaalsContact C-N 3.32Å; V344-V346 PolarHBondContact O-N 2.9Å; V346-L348 PolarHBondContact O-N 3.27Å; V346-L349 WeakPolarHBondContact O-CB 3.22Å; V346-L349 PolarHBondContact O-N 2.79Å; V346-L349 VanDerWaalsContact O-N 3.14Å; V346-T350 HydrophobicContact CG1-CG2 4.43Å; V346-T350 WeakPolarHBondContact O-CG2 3.44Å; V346-T350 PolarHBondContact O-N 3.22Å; V346-T350 PolarHBondContact O-OG1 2.84Å; V346-L367 HydrophobicContact CG2-CD1 4.09Å
347	L	85.5	Confident	82	Confident	101 Å²	101	60.9 Å²	60.9	53%	0.529	37%	0.365	S	S	.	.	H	α-helix	trans	-58.8	-48.1	176.4	-68.5	174.6	0	0	0	111.4	T343 V344 L349 T350 E351	T343-L347 WeakPolarHBondContact O-CG 3.37Å; T343-L347 PolarHBondContact O-N 3.19Å; V344-L347 PolarHBondContact O-N 3.34Å; L347-L349 VanDerWaalsContact C-N 3.26Å; L347-L349 PolarHBondContact O-N 3.28Å; L347-T350 PolarHBondContact O-N 2.74Å; L347-T350 VanDerWaalsContact O-N 3.11Å; L347-T350 PolarHBondContact O-OG1 3.1Å; L347-E351 PolarHBondContact O-N 2.77Å
348	L	84.1	Confident	81.3	Confident	76 Å²	76	64.9 Å²	64.9	40%	0.398	38%	0.377	S	S	.	.	H	α-helix	trans	-54.3	-43.4	174.8	-173.1	87.3	0	0	0	111.7	V344 F345 V346 E351 I352	V344-L348 PolarHBondContact O-N 2.73Å; F345-L348 HydrophobicContact CD1-CD2 4.46Å; V346-L348 PolarHBondContact O-N 3.27Å; L348-E351 PolarHBondContact O-N 3.12Å; L348-I352 HydrophobicContact CD2-CD1 4.38Å; L348-I352 HydrophobicContact CG-CD1 4.05Å; L348-I352 WeakPolarHBondContact O-CG1 3.29Å; L348-I352 PolarHBondContact O-N 3.24Å
349	L	78.9	Confident	80.8	Confident	15 Å²	15	66.8 Å²	66.8	8%	0.079	39%	0.389	C	S	.	.	H	α-helix	trans	-64.9	-41.7	178.9	-169.6	75.2	0	0	0	112.2	L307 F345 V346 L347 E351 I352 I353 I363 L367	L307-L349 HydrophobicContact CD1-CD1 3.59Å; L307-L349 HydrophobicContact CD2-CD1 4.27Å; L307-L349 HydrophobicContact CG-CD1 4.47Å; F345-L349 PolarHBondContact O-N 2.87Å; F345-L349 VanDerWaalsContact O-N 3.08Å; V346-L349 WeakPolarHBondContact O-CB 3.22Å; V346-L349 PolarHBondContact O-N 2.79Å; V346-L349 VanDerWaalsContact O-N 3.14Å; L347-L349 VanDerWaalsContact C-N 3.26Å; L347-L349 PolarHBondContact O-N 3.28Å; L349-E351 PolarHBondContact O-N 2.68Å; L349-I352 PolarHBondContact O-N 3.08Å; L349-I353 HydrophobicContact CD1-CD1 3.56Å; L349-I353 HydrophobicContact CD1-CG1 4.06Å; L349-I353 HydrophobicContact CD2-CD1 4.02Å; L349-I353 HydrophobicContact CG-CD1 3.69Å; L349-I353 HydrophobicContact CG-CG1 4.19Å; L349-I353 PolarHBondContact O-N 3.28Å; L349-I363 HydrophobicContact CD1-CG1 4.03Å; L349-I363 HydrophobicContact CD1-CG2 3.88Å; L349-I363 HydrophobicContact CD2-CG1 4.5Å; L349-I363 HydrophobicContact CD2-CG2 4.22Å; L349-L367 HydrophobicContact CB-CD1 3.9Å; L349-L367 HydrophobicContact CD2-CD1 3.34Å; L349-L367 HydrophobicContact CD2-CG 4.02Å; L349-L367 HydrophobicContact CG-CD1 4.11Å
350	T	78.2	Confident	80.5	Confident	78 Å²	78	68.9 Å²	68.9	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-66.7	-24.5	-178.6	58.2	0	0	0	0	113.6	K109 V346 L347	K109-T350 PolarHBondContact NZ-O 3.01Å; V346-T350 HydrophobicContact CG1-CG2 4.43Å; V346-T350 WeakPolarHBondContact O-CG2 3.44Å; V346-T350 PolarHBondContact O-N 3.22Å; V346-T350 PolarHBondContact O-OG1 2.84Å; L347-T350 PolarHBondContact O-N 2.74Å; L347-T350 VanDerWaalsContact O-N 3.11Å; L347-T350 PolarHBondContact O-OG1 3.1Å
351	E	79.8	Confident	80.2	Confident	131 Å²	131	65.3 Å²	65.3	61%	0.612	38%	0.379	S	S	*	.	H	α-helix	trans	-77	-37.5	172.9	-69.2	-177.3	173.4	0	0	112.2	L347 L348 L349	L347-E351 PolarHBondContact O-N 2.77Å; L348-E351 PolarHBondContact O-N 3.12Å; L349-E351 PolarHBondContact O-N 2.68Å
352	I	78.3	Confident	80	Confident	63 Å²	63	63.7 Å²	63.7	32%	0.323	37%	0.367	S	S	.	.	H	α-helix	trans	-77.7	-41.2	-177	-65.2	167	0	0	0	112.2	F198 Y303 L348 L349	F198-I352 HydrophobicContact CZ-CG2 4.1Å; Y303-I352 HydrophobicContact CE1-CG2 4.02Å; L348-I352 HydrophobicContact CD2-CD1 4.38Å; L348-I352 HydrophobicContact CG-CD1 4.05Å; L348-I352 WeakPolarHBondContact O-CG1 3.29Å; L348-I352 PolarHBondContact O-N 3.24Å; L349-I352 PolarHBondContact O-N 3.08Å
353	I	74.1	Confident	79.8	Confident	14 Å²	14	64 Å²	64	7%	0.072	37%	0.368	C	S	.	.	S	Bend	trans	-89.4	137.5	-173.4	-59.5	-172.7	0	0	0	110.2	K109 F198 L349 P361 I363	K109-I353 PolarHBondContact NZ-O 3.14Å; F198-I353 HydrophobicContact CD1-CD1 3.84Å; F198-I353 HydrophobicContact CD1-CG1 4.19Å; F198-I353 HydrophobicContact CE1-CD1 4.04Å; F198-I353 HydrophobicContact CE1-CG1 4.02Å; L349-I353 HydrophobicContact CD1-CD1 3.56Å; L349-I353 HydrophobicContact CD1-CG1 4.06Å; L349-I353 HydrophobicContact CD2-CD1 4.02Å; L349-I353 HydrophobicContact CG-CD1 3.69Å; L349-I353 HydrophobicContact CG-CG1 4.19Å; L349-I353 PolarHBondContact O-N 3.28Å; I353-P361 HydrophobicContact CD1-CB 4.2Å; I353-P361 HydrophobicContact CD1-CG 3.74Å; I353-P361 HydrophobicContact CG2-CG 4.24Å; I353-I363 HydrophobicContact CD1-CG2 3.58Å
354	P	70.7	Confident	79.7	Confident	20 Å²	20	61.2 Å²	61.2	13%	0.13	35%	0.354	C	S	.	.			trans	-62.2	146	174.8	28	-35.6	0	0	0	111.2	K109 V195 T356	K109-P354 HydrophobicContact CB-CB 4.13Å; K109-P354 HydrophobicContact CD-CB 4.31Å; V195-P354 HydrophobicContact CG1-CG 3.8Å; P354-T356 HydrophobicContact CB-CG2 4.19Å; P354-T356 HydrophobicContact CG-CG2 4.3Å; P354-T356 PolarHBondContact O-N 3.47Å
355	A	66.6	Low	79.5	Confident	86 Å²	86	60.8 Å²	60.8	71%	0.711	35%	0.345	S	S	*	.			trans	-79.8	59	-176.9	0	0	0	0	0	109.8	K109	K109-A355 HydrophobicContact CD-CB 3.84Å; K109-A355 VanDerWaalsContact NZ-N 3.12Å
356	T	69.7	Low	79.6	Confident	39 Å²	39	58.4 Å²	58.4	24%	0.239	33%	0.334	C	S	.	.			trans	-89.2	129.5	177.8	55.6	0	0	0	0	109.8	V195 P354	V195-T356 WeakPolarHBondContact CG2-OG1 3.47Å; P354-T356 HydrophobicContact CB-CG2 4.19Å; P354-T356 HydrophobicContact CG-CG2 4.3Å; P354-T356 PolarHBondContact O-N 3.47Å
357	S	76	Confident	79.7	Confident	126 Å²	126	56.7 Å²	56.7	88%	0.881	32%	0.324	S	S	*	.	S	Bend	trans	-90.4	-1.6	177.7	55.4	0	0	0	0	114.2
358	I	76.8	Confident	79.6	Confident	143 Å²	143	56.3 Å²	56.3	73%	0.733	32%	0.322	S	S	*	.	S	Bend	trans	-68.3	-48.2	-174.5	-60.5	166	0	0	0	111
359	V	81.1	Confident	79.8	Confident	48 Å²	48	55.2 Å²	55.2	29%	0.291	31%	0.314	S	S	.	.			trans	-143.1	141.6	179.2	-73.3	0	0	0	0	110.5	V195 E196	V195-V359 HydrophobicContact CG2-CG2 3.88Å; E196-V359 HydrophobicContact CB-CG2 4.11Å
360	L	81.3	Confident	80.1	Confident	111 Å²	111	54.7 Å²	54.7	58%	0.581	31%	0.311	S	S	*	.			trans	-76.9	126.7	169	-77.9	158.9	0	0	0	109.5	K365	L360-K365 HydrophobicContact CB-CG 4.22Å; L360-K365 VanDerWaalsContact O-CE 3.26Å; L360-K365 WeakPolarHBondContact O-CE 3.46Å; L360-K365 PolarHBondContact O-NZ 3.05Å
361	P	84.8	Confident	80.5	Confident	12 Å²	12	55.1 Å²	55.1	8%	0.078	31%	0.309	C	S	.	.			trans	-65.2	154.6	179.8	28.3	-35.6	0	0	0	111.4	V195 E196 F198 I353 I363 G364 K365	V195-P361 HydrophobicContact CB-CB 4.47Å; V195-P361 VanDerWaalsContact O-CA 3.29Å; V195-P361 WeakPolarHBondContact O-CA 3.17Å; V195-P361 WeakPolarHBondContact O-CB 3.32Å; E196-P361 CarbonylContact O-C 3.56Å; F198-P361 HydrophobicContact CB-CB 4.29Å; I353-P361 HydrophobicContact CD1-CB 4.2Å; I353-P361 HydrophobicContact CD1-CG 3.74Å; I353-P361 HydrophobicContact CG2-CG 4.24Å; P361-I363 VanDerWaalsContact C-N 3.27Å; P361-I363 HydrophobicContact CB-CG2 4.25Å; P361-I363 HydrophobicContact CG-CG2 4.42Å; P361-I363 PolarHBondContact O-N 3.04Å; P361-G364 CarbonylContact O-C 3.57Å; P361-G364 WeakPolarHBondContact O-CA 3.29Å; P361-G364 PolarHBondContact O-N 3.46Å; P361-K365 PolarHBondContact O-N 2.74Å
362	L	84.3	Confident	80.9	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-53.6	-45.7	178.8	-172.2	70.8	0	0	0	111.8	E196 W197 G364 K365 Y366 I549 A553	E196-L362 PolarHBondContact O-N 3.26Å; W197-L362 HydrophobicContact CE3-CB 4.48Å; W197-L362 HydrophobicContact CE3-CD1 4.16Å; W197-L362 HydrophobicContact CE3-CD2 4.26Å; W197-L362 HydrophobicContact CZ3-CD1 3.95Å; L362-G364 VanDerWaalsContact C-N 3.29Å; L362-G364 PolarHBondContact O-N 3.28Å; L362-K365 WeakPolarHBondContact O-CB 3.02Å; L362-K365 PolarHBondContact O-N 3.01Å; L362-Y366 PolarHBondContact O-N 3.18Å; L362-I549 HydrophobicContact CD1-CG2 3.84Å; L362-I549 HydrophobicContact CG-CG2 4.04Å; L362-A553 HydrophobicContact CD2-CB 3.82Å
363	I	82.6	Confident	81.4	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.046	29%	0.292	C	S	.	.	H	α-helix	trans	-65.1	-33	175.9	-170.1	61.8	0	0	0	112.8	F198 L307 I308 L349 I353 P361 Y366 L367	F198-I363 HydrophobicContact CD1-CG2 3.76Å; F198-I363 HydrophobicContact CE1-CG2 4.35Å; L307-I363 HydrophobicContact CD2-CD1 3.41Å; L307-I363 VanDerWaalsContact CD2-CD1 3.41Å; L307-I363 HydrophobicContact CD2-CG1 3.42Å; L307-I363 VanDerWaalsContact CD2-CG1 3.42Å; I308-I363 HydrophobicContact CG1-CD1 4.25Å; L349-I363 HydrophobicContact CD1-CG1 4.03Å; L349-I363 HydrophobicContact CD1-CG2 3.88Å; L349-I363 HydrophobicContact CD2-CG1 4.5Å; L349-I363 HydrophobicContact CD2-CG2 4.22Å; I353-I363 HydrophobicContact CD1-CG2 3.58Å; P361-I363 VanDerWaalsContact C-N 3.27Å; P361-I363 HydrophobicContact CB-CG2 4.25Å; P361-I363 HydrophobicContact CG-CG2 4.42Å; P361-I363 PolarHBondContact O-N 3.04Å; I363-Y366 HydrophobicContact CD1-CD1 4.01Å; I363-Y366 WeakPolarHBondContact O-CB 3.32Å; I363-Y366 PolarHBondContact O-N 2.82Å; I363-L367 WeakPolarHBondContact O-CG 3.27Å; I363-L367 PolarHBondContact O-N 3.5Å
364	G	83.5	Confident	82	Confident	15 Å²	15	50.8 Å²	50.8	16%	0.155	29%	0.289	C	S	.	.	H	α-helix	trans	-67.7	-39.9	174.1	0	0	0	0	0	111.9	P361 L362 Y366 L367 L368	P361-G364 CarbonylContact O-C 3.57Å; P361-G364 WeakPolarHBondContact O-CA 3.29Å; P361-G364 PolarHBondContact O-N 3.46Å; L362-G364 VanDerWaalsContact C-N 3.29Å; L362-G364 PolarHBondContact O-N 3.28Å; G364-Y366 VanDerWaalsContact C-N 3.32Å; G364-L367 PolarHBondContact O-N 3Å; G364-L368 WeakPolarHBondContact O-CB 2.72Å; G364-L368 PolarHBondContact O-N 3.02Å
365	K	86	Confident	82.9	Confident	78 Å²	78	52.7 Å²	52.7	34%	0.339	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-41.2	171.8	-67.8	171.1	-178.4	157.9	0	111.1	L360 P361 L362 F369	L360-K365 HydrophobicContact CB-CG 4.22Å; L360-K365 VanDerWaalsContact O-CE 3.26Å; L360-K365 WeakPolarHBondContact O-CE 3.46Å; L360-K365 PolarHBondContact O-NZ 3.05Å; P361-K365 PolarHBondContact O-N 2.74Å; L362-K365 WeakPolarHBondContact O-CB 3.02Å; L362-K365 PolarHBondContact O-N 3.01Å; K365-F369 WeakPolarHBondContact O-CB 3.47Å; K365-F369 PolarHBondContact O-N 3.18Å
366	Y	86.2	Confident	84	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.027	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-50.1	174.3	-176	-122.1	0	0	0	112.1	C311 L362 I363 G364 L368 F369 T370 T546 I549	C311-Y366 HydrophobicContact CB-CE1 3.82Å; C311-Y366 WeakPolarHBondContact SG-CE1 3.15Å; L362-Y366 PolarHBondContact O-N 3.18Å; I363-Y366 HydrophobicContact CD1-CD1 4.01Å; I363-Y366 WeakPolarHBondContact O-CB 3.32Å; I363-Y366 PolarHBondContact O-N 2.82Å; G364-Y366 VanDerWaalsContact C-N 3.32Å; Y366-L368 VanDerWaalsContact C-N 3.34Å; Y366-L368 PolarHBondContact O-N 2.83Å; Y366-F369 WeakPolarHBondContact O-CB 3.43Å; Y366-F369 PolarHBondContact O-N 2.78Å; Y366-T370 HydrophobicContact CD2-CG2 4.23Å; Y366-T370 HydrophobicContact CE1-CG2 4.17Å; Y366-T370 HydrophobicContact CE2-CG2 3.81Å; Y366-T370 WeakPolarHBondContact O-CG2 3.4Å; Y366-T370 PolarHBondContact O-N 3.42Å; Y366-T370 PolarHBondContact O-OG1 2.83Å; Y366-T546 HydrophobicContact CD2-CG2 4.24Å; Y366-T546 HydrophobicContact CE2-CG2 3.38Å; Y366-T546 WeakPolarHBondContact CE2-OG1 3.3Å; Y366-I549 HydrophobicContact CD2-CD1 3.99Å; Y366-I549 HydrophobicContact CD2-CG2 4.44Å
367	L	84.3	Confident	85	Confident	11 Å²	11	51 Å²	51	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-42.1	177.9	-71.7	-161	0	0	0	111.9	C311 V346 L349 I363 G364 F369 T370 M371	C311-L367 HydrophobicContact CB-CD2 4.36Å; C311-L367 WeakPolarHBondContact SG-CD2 3.49Å; V346-L367 HydrophobicContact CG2-CD1 4.09Å; L349-L367 HydrophobicContact CB-CD1 3.9Å; L349-L367 HydrophobicContact CD2-CD1 3.34Å; L349-L367 HydrophobicContact CD2-CG 4.02Å; L349-L367 HydrophobicContact CG-CD1 4.11Å; I363-L367 WeakPolarHBondContact O-CG 3.27Å; I363-L367 PolarHBondContact O-N 3.5Å; G364-L367 PolarHBondContact O-N 3Å; L367-F369 VanDerWaalsContact C-N 3.34Å; L367-F369 PolarHBondContact O-N 2.78Å; L367-T370 WeakPolarHBondContact CA-OG1 3.43Å; L367-T370 PolarHBondContact O-N 2.86Å; L367-T370 PolarHBondContact O-OG1 3.09Å; L367-M371 WeakPolarHBondContact O-CB 3.44Å; L367-M371 PolarHBondContact O-N 3.48Å
368	L	85.2	Confident	85.6	Confident	92 Å²	92	46.8 Å²	46.8	48%	0.482	25%	0.247	S	C	.	.	H	α-helix	trans	-60.3	-44.8	175.8	-177.6	65.2	0	0	0	111.6	G364 Y366 M371 I372	G364-L368 WeakPolarHBondContact O-CB 2.72Å; G364-L368 PolarHBondContact O-N 3.02Å; Y366-L368 VanDerWaalsContact C-N 3.34Å; Y366-L368 PolarHBondContact O-N 2.83Å; L368-M371 PolarHBondContact O-N 2.73Å; L368-I372 HydrophobicContact CD1-CD1 4.34Å; L368-I372 HydrophobicContact CG-CD1 4.15Å; L368-I372 WeakPolarHBondContact O-CG1 3.38Å; L368-I372 PolarHBondContact O-N 2.92Å
369	F	87.6	Confident	86.3	Confident	54 Å²	54	44.6 Å²	44.6	24%	0.237	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-49.5	174.3	170.4	-101.7	0	0	0	111.5	K365 Y366 L367 M371 I372 M373 A541 I549	K365-F369 WeakPolarHBondContact O-CB 3.47Å; K365-F369 PolarHBondContact O-N 3.18Å; Y366-F369 WeakPolarHBondContact O-CB 3.43Å; Y366-F369 PolarHBondContact O-N 2.78Å; L367-F369 VanDerWaalsContact C-N 3.34Å; L367-F369 PolarHBondContact O-N 2.78Å; F369-M371 VanDerWaalsContact C-N 3.29Å; F369-M371 PolarHBondContact O-N 2.77Å; F369-I372 PolarHBondContact O-N 3.46Å; F369-M373 HydrophobicContact CD1-CG 4.46Å; F369-M373 HydrophobicContact CD2-CG 4.2Å; F369-M373 HydrophobicContact CE1-CG 4.04Å; F369-M373 HydrophobicContact CE2-CG 3.76Å; F369-M373 HydrophobicContact CE2-SD 4.23Å; F369-M373 HydrophobicContact CZ-CE 4.38Å; F369-M373 HydrophobicContact CZ-CG 3.67Å; F369-M373 HydrophobicContact CZ-SD 4.25Å; F369-M373 WeakPolarHBondContact O-CB 3.36Å; F369-M373 VanDerWaalsContact O-CG 3.27Å; F369-M373 WeakPolarHBondContact O-CG 3.29Å; F369-M373 PolarHBondContact O-N 2.91Å; F369-A541 WeakPolarHBondContact CZ-O 3.46Å; F369-I549 HydrophobicContact CB-CD1 4.14Å; F369-I549 HydrophobicContact CD1-CD1 4.23Å; F369-I549 HydrophobicContact CG-CD1 4.21Å
370	T	85.7	Confident	86.8	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.018	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-36.2	178	62.3	0	0	0	0	112.2	S315 Y366 L367 M373 V374	S315-T370 WeakPolarHBondContact OG-CG2 3.35Å; Y366-T370 HydrophobicContact CD2-CG2 4.23Å; Y366-T370 HydrophobicContact CE1-CG2 4.17Å; Y366-T370 HydrophobicContact CE2-CG2 3.81Å; Y366-T370 WeakPolarHBondContact O-CG2 3.4Å; Y366-T370 PolarHBondContact O-N 3.42Å; Y366-T370 PolarHBondContact O-OG1 2.83Å; L367-T370 WeakPolarHBondContact CA-OG1 3.43Å; L367-T370 PolarHBondContact O-N 2.86Å; L367-T370 PolarHBondContact O-OG1 3.09Å; T370-M373 PolarHBondContact O-N 3.15Å; T370-V374 WeakPolarHBondContact O-CB 3.26Å; T370-V374 WeakPolarHBondContact O-CG2 3.31Å; T370-V374 PolarHBondContact O-N 3.33Å
371	M	85.2	Confident	87.2	Confident	88 Å²	88	38 Å²	38	43%	0.433	20%	0.2	S	C	.	.	H	α-helix	trans	-66.6	-43.5	177.8	-173.8	-179.2	-179.9	0	0	112.7	L342 L367 L368 F369 M373 T375	L342-M371 HydrophobicContact CD2-CB 3.87Å; L342-M371 HydrophobicContact CD2-CG 4Å; L367-M371 WeakPolarHBondContact O-CB 3.44Å; L367-M371 PolarHBondContact O-N 3.48Å; L368-M371 PolarHBondContact O-N 2.73Å; F369-M371 VanDerWaalsContact C-N 3.29Å; F369-M371 PolarHBondContact O-N 2.77Å; M371-M373 VanDerWaalsContact C-N 3.34Å; M371-T375 VanDerWaalsContact O-CB 3.31Å; M371-T375 WeakPolarHBondContact O-CB 3.21Å; M371-T375 PolarHBondContact O-N 3.11Å; M371-T375 PolarHBondContact O-OG1 3.3Å
372	I	88.8	Confident	87.5	Confident	91 Å²	91	41.5 Å²	41.5	47%	0.467	22%	0.221	S	C	.	.	H	α-helix	trans	-62.8	-46	174.2	-66.6	167	0	0	0	109.6	L368 F369 T375 L376	L368-I372 HydrophobicContact CD1-CD1 4.34Å; L368-I372 HydrophobicContact CG-CD1 4.15Å; L368-I372 WeakPolarHBondContact O-CG1 3.38Å; L368-I372 PolarHBondContact O-N 2.92Å; F369-I372 PolarHBondContact O-N 3.46Å; I372-T375 PolarHBondContact O-N 2.73Å; I372-L376 HydrophobicContact CG2-CD1 4Å; I372-L376 HydrophobicContact CG2-CG 4.45Å; I372-L376 WeakPolarHBondContact O-CB 3.5Å; I372-L376 WeakPolarHBondContact O-CG 3.45Å; I372-L376 PolarHBondContact O-N 3.42Å
373	M	88.6	Confident	87.8	Confident	22 Å²	22	44.1 Å²	44.1	11%	0.108	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-45.4	179.3	-73	-65	-77.5	0	0	112.8	F369 T370 M371 L376 S377 F538 A541	F369-M373 HydrophobicContact CD1-CG 4.46Å; F369-M373 HydrophobicContact CD2-CG 4.2Å; F369-M373 HydrophobicContact CE1-CG 4.04Å; F369-M373 HydrophobicContact CE2-CG 3.76Å; F369-M373 HydrophobicContact CE2-SD 4.23Å; F369-M373 HydrophobicContact CZ-CE 4.38Å; F369-M373 HydrophobicContact CZ-CG 3.67Å; F369-M373 HydrophobicContact CZ-SD 4.25Å; F369-M373 WeakPolarHBondContact O-CB 3.36Å; F369-M373 VanDerWaalsContact O-CG 3.27Å; F369-M373 WeakPolarHBondContact O-CG 3.29Å; F369-M373 PolarHBondContact O-N 2.91Å; T370-M373 PolarHBondContact O-N 3.15Å; M371-M373 VanDerWaalsContact C-N 3.34Å; M373-L376 PolarHBondContact O-N 3.19Å; M373-S377 WeakPolarHBondContact O-CB 3.31Å; M373-S377 PolarHBondContact O-N 3.39Å; M373-F538 HydrophobicContact CE-CD1 3.39Å; M373-F538 HydrophobicContact CE-CE1 3.9Å; M373-F538 HydrophobicContact CE-CG 4.41Å; M373-F538 WeakPolarHBondContact O-CE1 3.3Å; M373-F538 HydrophobicContact SD-CD1 4.27Å; M373-F538 HydrophobicContact SD-CE1 4.17Å; M373-A541 HydrophobicContact CE-CB 3.41Å; M373-A541 VanDerWaalsContact CE-CB 3.41Å; M373-A541 HydrophobicContact SD-CB 4.44Å
374	V	88	Confident	88.2	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-45.8	175.8	173.1	0	0	0	0	109.9	T318 I338 L339 L342 T370 L376 S377 V378	T318-V374 HydrophobicContact CG2-CB 4.36Å; T318-V374 HydrophobicContact CG2-CG1 4.34Å; T318-V374 HydrophobicContact CG2-CG2 3.64Å; I338-V374 HydrophobicContact CG2-CG1 4.01Å; I338-V374 HydrophobicContact CG2-CG2 4.48Å; L339-V374 HydrophobicContact CD1-CG1 4.47Å; L342-V374 HydrophobicContact CD2-CB 4.16Å; L342-V374 HydrophobicContact CD2-CG1 4.36Å; L342-V374 HydrophobicContact CD2-CG2 4.14Å; T370-V374 WeakPolarHBondContact O-CB 3.26Å; T370-V374 WeakPolarHBondContact O-CG2 3.31Å; T370-V374 PolarHBondContact O-N 3.33Å; V374-L376 PolarHBondContact O-N 3.29Å; V374-S377 WeakPolarHBondContact CA-OG 3.47Å; V374-S377 WeakPolarHBondContact O-CB 3.4Å; V374-S377 PolarHBondContact O-N 2.68Å; V374-S377 VanDerWaalsContact O-N 3.13Å; V374-S377 PolarHBondContact O-OG 3.23Å; V374-V378 HydrophobicContact CG1-CG2 4.41Å; V374-V378 WeakPolarHBondContact O-CG2 3.45Å; V374-V378 PolarHBondContact O-N 2.85Å
375	T	87.7	Confident	88.5	Confident	61 Å²	61	43.8 Å²	43.8	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-45.2	179.3	-55.7	0	0	0	0	111.8	M371 I372 S377 V378 I379	M371-T375 VanDerWaalsContact O-CB 3.31Å; M371-T375 WeakPolarHBondContact O-CB 3.21Å; M371-T375 PolarHBondContact O-N 3.11Å; M371-T375 PolarHBondContact O-OG1 3.3Å; I372-T375 PolarHBondContact O-N 2.73Å; T375-S377 VanDerWaalsContact C-N 3.31Å; T375-S377 PolarHBondContact O-N 2.7Å; T375-V378 WeakPolarHBondContact O-CB 3.3Å; T375-V378 PolarHBondContact O-N 2.86Å; T375-I379 HydrophobicContact CG2-CD1 4.46Å; T375-I379 WeakPolarHBondContact O-CG1 3.36Å; T375-I379 PolarHBondContact O-N 2.79Å; T375-I379 VanDerWaalsContact O-N 3.15Å
376	L	90.5	Very high	88.7	Confident	85 Å²	85	44 Å²	44	45%	0.445	24%	0.237	S	C	.	.	H	α-helix	trans	-62.9	-39.2	174.7	-71.3	174.3	0	0	0	111.5	I372 M373 V374 V378 I379 V380 F538	I372-L376 HydrophobicContact CG2-CD1 4Å; I372-L376 HydrophobicContact CG2-CG 4.45Å; I372-L376 WeakPolarHBondContact O-CB 3.5Å; I372-L376 WeakPolarHBondContact O-CG 3.45Å; I372-L376 PolarHBondContact O-N 3.42Å; M373-L376 PolarHBondContact O-N 3.19Å; V374-L376 PolarHBondContact O-N 3.29Å; L376-V378 VanDerWaalsContact C-N 3.32Å; L376-V378 PolarHBondContact O-N 3.28Å; L376-I379 PolarHBondContact O-N 2.94Å; L376-V380 VanDerWaalsContact O-CG2 3.3Å; L376-V380 WeakPolarHBondContact O-CG2 3.32Å; L376-V380 PolarHBondContact O-N 2.84Å; L376-F538 HydrophobicContact CB-CE1 4.21Å; L376-F538 HydrophobicContact CB-CZ 4.02Å
377	S	90.4	Very high	88.8	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-41.3	176.7	79.9	0	0	0	0	111.6	M373 V374 T375 I379 V380 T381	M373-S377 WeakPolarHBondContact O-CB 3.31Å; M373-S377 PolarHBondContact O-N 3.39Å; V374-S377 WeakPolarHBondContact CA-OG 3.47Å; V374-S377 WeakPolarHBondContact O-CB 3.4Å; V374-S377 PolarHBondContact O-N 2.68Å; V374-S377 VanDerWaalsContact O-N 3.13Å; V374-S377 PolarHBondContact O-OG 3.23Å; T375-S377 VanDerWaalsContact C-N 3.31Å; T375-S377 PolarHBondContact O-N 2.7Å; S377-I379 PolarHBondContact O-N 3.02Å; S377-V380 PolarHBondContact O-N 3.19Å; S377-T381 WeakPolarHBondContact O-CG2 3.47Å; S377-T381 PolarHBondContact O-N 2.87Å; S377-T381 PolarHBondContact O-OG1 3.21Å
378	V	88.9	Confident	89	Confident	38 Å²	38	44.7 Å²	44.7	23%	0.23	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-48.6	176.4	178.2	0	0	0	0	110.2	C335 V374 T375 L376 V380 T381 V382	C335-V378 VanDerWaalsContact SG-CA 3.57Å; C335-V378 WeakPolarHBondContact SG-CG2 3.38Å; V374-V378 HydrophobicContact CG1-CG2 4.41Å; V374-V378 WeakPolarHBondContact O-CG2 3.45Å; V374-V378 PolarHBondContact O-N 2.85Å; T375-V378 WeakPolarHBondContact O-CB 3.3Å; T375-V378 PolarHBondContact O-N 2.86Å; L376-V378 VanDerWaalsContact C-N 3.32Å; L376-V378 PolarHBondContact O-N 3.28Å; V378-V380 PolarHBondContact O-N 2.84Å; V378-T381 WeakPolarHBondContact CA-OG1 3.3Å; V378-T381 PolarHBondContact O-N 3.05Å; V378-T381 PolarHBondContact O-OG1 3.12Å; V378-V382 WeakPolarHBondContact O-CG2 2.98Å; V378-V382 PolarHBondContact O-N 2.95Å; V378-V382 VanDerWaalsContact O-N 3.08Å
379	I	91.2	Very high	89.2	Confident	97 Å²	97	45.8 Å²	45.8	50%	0.497	24%	0.241	S	C	.	.	H	α-helix	trans	-59.5	-47.2	179	-64.8	166.7	0	0	0	110.9	T375 L376 S377 T381 V382 V383	T375-I379 HydrophobicContact CG2-CD1 4.46Å; T375-I379 WeakPolarHBondContact O-CG1 3.36Å; T375-I379 PolarHBondContact O-N 2.79Å; T375-I379 VanDerWaalsContact O-N 3.15Å; L376-I379 PolarHBondContact O-N 2.94Å; S377-I379 PolarHBondContact O-N 3.02Å; I379-T381 VanDerWaalsContact C-N 3.32Å; I379-T381 PolarHBondContact O-N 2.77Å; I379-V382 PolarHBondContact O-N 2.91Å; I379-V383 WeakPolarHBondContact O-CG2 3.42Å; I379-V383 PolarHBondContact O-N 3.34Å
380	V	91.2	Very high	89.2	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.109	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-39.4	178.8	174	0	0	0	0	111.3	F322 L376 S377 V378 V382 V383 S384 F530 F534 F538	F322-V380 HydrophobicContact CE1-CB 4.15Å; F322-V380 HydrophobicContact CE1-CG1 3.63Å; F322-V380 HydrophobicContact CZ-CB 4.28Å; F322-V380 HydrophobicContact CZ-CG1 4.12Å; L376-V380 VanDerWaalsContact O-CG2 3.3Å; L376-V380 WeakPolarHBondContact O-CG2 3.32Å; L376-V380 PolarHBondContact O-N 2.84Å; S377-V380 PolarHBondContact O-N 3.19Å; V378-V380 PolarHBondContact O-N 2.84Å; V380-V382 PolarHBondContact O-N 2.8Å; V380-V383 PolarHBondContact O-N 2.9Å; V380-S384 WeakPolarHBondContact O-CB 3.27Å; V380-S384 PolarHBondContact O-N 3.35Å; V380-F530 HydrophobicContact CG1-CE1 3.67Å; V380-F530 HydrophobicContact CG1-CZ 4.27Å; V380-F534 HydrophobicContact CG1-CB 3.91Å; V380-F534 HydrophobicContact CG1-CD1 3.83Å; V380-F534 HydrophobicContact CG1-CD2 3.45Å; V380-F534 VanDerWaalsContact CG1-CD2 3.45Å; V380-F534 HydrophobicContact CG1-CE1 4.19Å; V380-F534 HydrophobicContact CG1-CE2 3.89Å; V380-F534 HydrophobicContact CG1-CG 3.43Å; V380-F534 VanDerWaalsContact CG1-CG 3.43Å; V380-F534 HydrophobicContact CG1-CZ 4.22Å; V380-F534 HydrophobicContact CG2-CD1 4.02Å; V380-F534 HydrophobicContact CG2-CE1 3.82Å; V380-F534 HydrophobicContact CG2-CG 4.46Å; V380-F534 HydrophobicContact CG2-CZ 4.14Å; V380-F538 HydrophobicContact CB-CE2 4.49Å; V380-F538 HydrophobicContact CG2-CE2 4.21Å; V380-F538 HydrophobicContact CG2-CZ 4.43Å
381	T	90.4	Very high	89	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-38.9	177.8	61.8	0	0	0	0	112.5	V321 F322 S377 V378 I379 V383 S384 L385	V321-T381 HydrophobicContact CG1-CG2 3.5Å; F322-T381 HydrophobicContact CD1-CG2 4.28Å; F322-T381 HydrophobicContact CE1-CG2 3.74Å; F322-T381 HydrophobicContact CZ-CG2 4.2Å; S377-T381 WeakPolarHBondContact O-CG2 3.47Å; S377-T381 PolarHBondContact O-N 2.87Å; S377-T381 PolarHBondContact O-OG1 3.21Å; V378-T381 WeakPolarHBondContact CA-OG1 3.3Å; V378-T381 PolarHBondContact O-N 3.05Å; V378-T381 PolarHBondContact O-OG1 3.12Å; I379-T381 VanDerWaalsContact C-N 3.32Å; I379-T381 PolarHBondContact O-N 2.77Å; T381-V383 VanDerWaalsContact C-N 3.35Å; T381-S384 PolarHBondContact O-N 3.27Å; T381-L385 VanDerWaalsContact O-CG 3.3Å; T381-L385 WeakPolarHBondContact O-CG 3.48Å; T381-L385 PolarHBondContact O-N 3.37Å
382	V	90.9	Very high	88.8	Confident	85 Å²	85	46.9 Å²	46.9	52%	0.515	25%	0.249	S	C	.	.	H	α-helix	trans	-64.3	-40.6	174.3	174.2	0	0	0	0	111	V378 I379 V380 L385 N386	V378-V382 WeakPolarHBondContact O-CG2 2.98Å; V378-V382 PolarHBondContact O-N 2.95Å; V378-V382 VanDerWaalsContact O-N 3.08Å; I379-V382 PolarHBondContact O-N 2.91Å; V380-V382 PolarHBondContact O-N 2.8Å; V382-L385 PolarHBondContact O-N 2.84Å; V382-N386 PolarHBondContact O-N 3.19Å
383	V	91.2	Very high	88.5	Confident	64 Å²	64	47.2 Å²	47.2	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-43.2	175.2	173.9	0	0	0	0	111.3	I379 V380 T381 L385 N386 L387 F530	I379-V383 WeakPolarHBondContact O-CG2 3.42Å; I379-V383 PolarHBondContact O-N 3.34Å; V380-V383 PolarHBondContact O-N 2.9Å; T381-V383 VanDerWaalsContact C-N 3.35Å; V383-L385 VanDerWaalsContact C-N 3.34Å; V383-L385 PolarHBondContact O-N 3.19Å; V383-N386 WeakPolarHBondContact O-CB 3.45Å; V383-N386 PolarHBondContact O-N 2.73Å; V383-L387 HydrophobicContact CG1-CD1 4.26Å; V383-L387 WeakPolarHBondContact O-CG 3.3Å; V383-L387 PolarHBondContact O-N 3.25Å; V383-F530 HydrophobicContact CB-CE1 4.44Å; V383-F530 HydrophobicContact CB-CZ 4.39Å; V383-F530 HydrophobicContact CG1-CE1 4.11Å; V383-F530 HydrophobicContact CG1-CZ 3.75Å
384	S	90.1	Very high	88.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-43.9	176.7	178.6	0	0	0	0	111.9	V380 T381 N386 L387 H388 D531	V380-S384 WeakPolarHBondContact O-CB 3.27Å; V380-S384 PolarHBondContact O-N 3.35Å; T381-S384 PolarHBondContact O-N 3.27Å; S384-N386 PolarHBondContact O-N 2.66Å; S384-L387 WeakPolarHBondContact O-CB 3.05Å; S384-L387 PolarHBondContact O-N 3.1Å; S384-L387 VanDerWaalsContact O-N 3.16Å; S384-H388 PolarHBondContact O-N 3.49Å; S384-D531 WeakPolarHBondContact CB-OD1 3.3Å; S384-D531 PolarHBondContact OG-OD1 3.31Å; S384-D531 PolarHBondContact OG-OD2 3.24Å; S384-D531 VanDerWaalsContact OG-OD2 3.06Å
385	L	90.1	Very high	88.3	Confident	16 Å²	16	54.1 Å²	54.1	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-40	174.6	-70.6	166.2	0	0	0	111.9	K331 I332 T381 V382 V383 L387 H388 F389	K331-L385 HydrophobicContact CD-CD2 4.38Å; I332-L385 HydrophobicContact CD1-CD1 3.68Å; I332-L385 HydrophobicContact CG1-CD1 3.25Å; T381-L385 VanDerWaalsContact O-CG 3.3Å; T381-L385 WeakPolarHBondContact O-CG 3.48Å; T381-L385 PolarHBondContact O-N 3.37Å; V382-L385 PolarHBondContact O-N 2.84Å; V383-L385 VanDerWaalsContact C-N 3.34Å; V383-L385 PolarHBondContact O-N 3.19Å; L385-L387 VanDerWaalsContact C-N 3.28Å; L385-L387 PolarHBondContact O-N 3.16Å; L385-H388 PolarHBondContact O-N 2.84Å; L385-F389 HydrophobicContact CD2-CE2 4.37Å; L385-F389 WeakPolarHBondContact O-CD2 3.43Å; L385-F389 PolarHBondContact O-N 2.77Å; L385-F389 VanDerWaalsContact O-N 3.16Å
386	N	90.8	Very high	88.1	Confident	82 Å²	82	62.6 Å²	62.6	44%	0.439	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-38.4	173	-176.4	-95.7	0	0	0	111.9	V382 V383 S384 R390	V382-N386 PolarHBondContact O-N 3.19Å; V383-N386 WeakPolarHBondContact O-CB 3.45Å; V383-N386 PolarHBondContact O-N 2.73Å; S384-N386 PolarHBondContact O-N 2.66Å; N386-R390 WeakPolarHBondContact O-CG 3.09Å; N386-R390 PolarHBondContact OD1-NE 2.03Å; N386-R390 VanDerWaalsContact OD1-NE 3.17Å; N386-R390 PolarHBondContact OD1-NH2 3.33Å
387	L	88.3	Confident	87.7	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-36	176.4	-68.7	171	0	0	0	112.2	V383 S384 L385 W523 A527 F530	V383-L387 HydrophobicContact CG1-CD1 4.26Å; V383-L387 WeakPolarHBondContact O-CG 3.3Å; V383-L387 PolarHBondContact O-N 3.25Å; S384-L387 WeakPolarHBondContact O-CB 3.05Å; S384-L387 PolarHBondContact O-N 3.1Å; S384-L387 VanDerWaalsContact O-N 3.16Å; L385-L387 VanDerWaalsContact C-N 3.28Å; L385-L387 PolarHBondContact O-N 3.16Å; L387-W523 HydrophobicContact CD2-CE3 4.39Å; L387-W523 HydrophobicContact CD2-CZ3 3.83Å; L387-A527 HydrophobicContact CB-CB 4.11Å; L387-F530 HydrophobicContact CD1-CB 4.34Å; L387-F530 HydrophobicContact CD1-CD1 4.18Å; L387-F530 HydrophobicContact CD1-CD2 3.93Å; L387-F530 HydrophobicContact CD1-CE1 4.43Å; L387-F530 HydrophobicContact CD1-CE2 4.2Å; L387-F530 HydrophobicContact CD1-CG 3.92Å; L387-F530 HydrophobicContact CD1-CZ 4.45Å
388	H	88.7	Confident	87.6	Confident	17 Å²	17	61.7 Å²	61.7	8%	0.079	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-41.3	-179.6	-174.3	-96.3	0	0	0	113.2	D327 S384 L385 R390 A527	D327-H388 IonicContact OD1-CE1 3.12Å; D327-H388 PolarHBondContact OD1-CE1 3.32Å; D327-H388 IonicContact OD1-NE2 3.36Å; D327-H388 PolarHBondContact OD1-NE2 3.38Å; S384-H388 PolarHBondContact O-N 3.49Å; L385-H388 PolarHBondContact O-N 2.84Å; H388-R390 VanDerWaalsContact C-N 3.33Å; H388-R390 PolarHBondContact O-N 3.02Å; H388-A527 HydrophobicContact CB-CB 3.93Å
389	F	87.8	Confident	87.4	Confident	115 Å²	115	69.1 Å²	69.1	50%	0.504	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	22.2	-178.8	-66.7	-70	0	0	0	113.8	L385 N391	L385-F389 HydrophobicContact CD2-CE2 4.37Å; L385-F389 WeakPolarHBondContact O-CD2 3.43Å; L385-F389 PolarHBondContact O-N 2.77Å; L385-F389 VanDerWaalsContact O-N 3.16Å; F389-N391 PolarHBondContact O-OD1 2.94Å
390	R	88.1	Confident	87.3	Confident	57 Å²	57	72 Å²	72	22%	0.215	36%	0.36	C	S	.	.			trans	-82.6	119.5	172.7	-85.7	171.5	-169.1	-162	1	110.6	N386 H388 H395 W523	N386-R390 WeakPolarHBondContact O-CG 3.09Å; N386-R390 PolarHBondContact OD1-NE 2.03Å; N386-R390 VanDerWaalsContact OD1-NE 3.17Å; N386-R390 PolarHBondContact OD1-NH2 3.33Å; H388-R390 VanDerWaalsContact C-N 3.33Å; H388-R390 PolarHBondContact O-N 3.02Å; R390-H395 HydrophobicContact CG-CB 4.24Å; R390-W523 HydrophobicContact CB-CD2 3.85Å; R390-W523 HydrophobicContact CB-CE3 4.21Å; R390-W523 HydrophobicContact CB-CG 4.05Å
391	N	82.7	Confident	87.1	Confident	76 Å²	76	71.5 Å²	71.5	41%	0.406	36%	0.357	S	S	.	.			trans	-101	156.5	176.9	-62.1	10.8	0	0	0	110.9	F389 A393 T394 H395 D520	F389-N391 PolarHBondContact O-OD1 2.94Å; N391-A393 PolarHBondContact O-N 2.8Å; N391-A393 VanDerWaalsContact O-N 3.13Å; N391-T394 PolarHBondContact O-N 2.9Å; N391-T394 PolarHBondContact O-OG1 3.43Å; N391-H395 PolarHBondContact O-N 2.86Å; N391-D520 WeakPolarHBondContact CA-OD1 3.39Å
392	P	80.3	Confident	86.8	Confident	35 Å²	35	75.4 Å²	75.4	23%	0.227	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-23	176.9	23.6	-35.6	0	0	0	113.3	D516 I519 D520	P392-D516 HydrophobicContact CG-CB 3.91Å; P392-I519 HydrophobicContact CB-CB 4.41Å; P392-I519 HydrophobicContact CB-CD1 4.36Å; P392-I519 HydrophobicContact CB-CG2 4.04Å; P392-D520 WeakPolarHBondContact CD-OD1 3.37Å
393	A	82.6	Confident	86.4	Confident	98 Å²	98	75.7 Å²	75.7	81%	0.81	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.1	175.2	0	0	0	0	0	113.2	N391	N391-A393 PolarHBondContact O-N 2.8Å; N391-A393 VanDerWaalsContact O-N 3.13Å
394	T	86.2	Confident	86.1	Confident	92 Å²	92	76.1 Å²	76.1	56%	0.564	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-36.9	-175.9	62.1	0	0	0	0	112.6	N391	N391-T394 PolarHBondContact O-N 2.9Å; N391-T394 PolarHBondContact O-OG1 3.43Å
395	H	85.6	Confident	85.8	Confident	78 Å²	78	77.4 Å²	77.4	36%	0.361	37%	0.374	S	S	.	.			trans	-135.8	128.9	-174.2	-66.3	77	0	0	0	112.3	R390 N391 W523	R390-H395 HydrophobicContact CG-CB 4.24Å; N391-H395 PolarHBondContact O-N 2.86Å; H395-W523 HydrophobicContact CB-CZ2 4.22Å
396	R	83.4	Confident	85.2	Confident	239 Å²	239	77.4 Å²	77.4	90%	0.902	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-85.1	125.6	167.6	-69.1	-173.4	178.4	-173.7	0.8	109.7	P398	R396-P398 VanDerWaalsContact O-CD 3.28Å; R396-P398 WeakPolarHBondContact O-CD 3.21Å
397	M	83.7	Confident	84.5	Confident	27 Å²	27	81.7 Å²	81.7	13%	0.133	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-66.2	117.8	179.8	-169	179.7	-176.6	0	0	111.3	V401 K402 L406 D522 W523 V526	M397-V401 HydrophobicContact CE-CB 4.26Å; M397-V401 HydrophobicContact CE-CG1 3.69Å; M397-V401 HydrophobicContact CG-CB 4.38Å; M397-V401 HydrophobicContact CG-CG1 4.37Å; M397-K402 HydrophobicContact CE-CB 4.19Å; M397-K402 HydrophobicContact CE-CD 4.49Å; M397-K402 HydrophobicContact CE-CG 3.36Å; M397-K402 HydrophobicContact CG-CG 3.92Å; M397-K402 HydrophobicContact SD-CD 3.98Å; M397-K402 WeakPolarHBondContact SD-CE 3.28Å; M397-K402 HydrophobicContact SD-CG 3.4Å; M397-K402 WeakPolarHBondContact SD-CG 3.22Å; M397-L406 HydrophobicContact CE-CD1 3.83Å; M397-L406 HydrophobicContact CE-CG 4.14Å; M397-D522 HydrophobicContact SD-CB 4.38Å; M397-W523 HydrophobicContact CB-CZ2 3.87Å; M397-W523 HydrophobicContact CG-CH2 4.39Å; M397-W523 HydrophobicContact CG-CZ2 4.07Å; M397-V526 HydrophobicContact CE-CG2 3.62Å
398	P	87.4	Confident	84.1	Confident	43 Å²	43	83.9 Å²	83.9	28%	0.279	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-63.9	146.5	177.6	-15.5	26.7	0	0	0	111.5	R396 W400 V401 K402	R396-P398 VanDerWaalsContact O-CD 3.28Å; R396-P398 WeakPolarHBondContact O-CD 3.21Å; P398-W400 HydrophobicContact CB-CD2 4.4Å; P398-W400 HydrophobicContact CB-CG 4.03Å; P398-W400 HydrophobicContact CG-CZ2 4.49Å; P398-W400 PolarHBondContact O-N 2.95Å; P398-V401 HydrophobicContact CB-CB 4.48Å; P398-V401 HydrophobicContact CB-CG2 3.96Å; P398-V401 HydrophobicContact CG-CB 4.45Å; P398-V401 HydrophobicContact CG-CG2 3.65Å; P398-V401 PolarHBondContact O-N 2.9Å; P398-V401 VanDerWaalsContact O-N 3.1Å; P398-K402 PolarHBondContact O-N 2.81Å
399	K	84.4	Confident	83.7	Confident	193 Å²	193	84.4 Å²	84.4	84%	0.839	40%	0.401	S	S	*	.	H	α-helix	trans	-59.2	-33.6	176.6	-65.4	-176.2	-179.5	179.1	0	112.4	K402 Q403	K399-K402 PolarHBondContact O-N 2.89Å; K399-Q403 PolarHBondContact O-N 3.03Å
400	W	89.5	Confident	83.2	Confident	157 Å²	157	79.2 Å²	79.2	60%	0.595	38%	0.38	S	S	*	.	H	α-helix	trans	-67.2	-37.8	177.3	71.1	-101	0	0	0	112.2	P398 K402 Q403 I404 F405	P398-W400 HydrophobicContact CB-CD2 4.4Å; P398-W400 HydrophobicContact CB-CG 4.03Å; P398-W400 HydrophobicContact CG-CZ2 4.49Å; P398-W400 PolarHBondContact O-N 2.95Å; W400-K402 VanDerWaalsContact C-N 3.35Å; W400-Q403 PolarHBondContact O-N 2.93Å; W400-I404 HydrophobicContact CE3-CD1 3.92Å; W400-I404 HydrophobicContact CZ3-CD1 4.4Å; W400-I404 WeakPolarHBondContact O-CG1 3.42Å; W400-I404 PolarHBondContact O-N 2.93Å; W400-F405 HydrophobicContact CZ3-CE2 4.36Å
401	V	87.2	Confident	82.5	Confident	8 Å²	8	83.9 Å²	83.9	5%	0.048	40%	0.404	C	S	.	.	H	α-helix	trans	-63.4	-43.9	175.7	178.4	0	0	0	0	109.8	M397 P398 Q403 I404 F405 V526	M397-V401 HydrophobicContact CE-CB 4.26Å; M397-V401 HydrophobicContact CE-CG1 3.69Å; M397-V401 HydrophobicContact CG-CB 4.38Å; M397-V401 HydrophobicContact CG-CG1 4.37Å; P398-V401 HydrophobicContact CB-CB 4.48Å; P398-V401 HydrophobicContact CB-CG2 3.96Å; P398-V401 HydrophobicContact CG-CB 4.45Å; P398-V401 HydrophobicContact CG-CG2 3.65Å; P398-V401 PolarHBondContact O-N 2.9Å; P398-V401 VanDerWaalsContact O-N 3.1Å; V401-Q403 VanDerWaalsContact C-N 3.34Å; V401-Q403 PolarHBondContact O-N 3.41Å; V401-I404 PolarHBondContact O-N 3.48Å; V401-F405 HydrophobicContact CG1-CD2 3.81Å; V401-F405 WeakPolarHBondContact O-CB 3.42Å; V401-F405 PolarHBondContact O-N 2.97Å; V401-V526 HydrophobicContact CG1-CG1 4.07Å; V401-V526 HydrophobicContact CG1-CG2 4.26Å
402	K	83.1	Confident	82.3	Confident	86 Å²	86	88.5 Å²	88.5	37%	0.374	42%	0.417	S	S	.	.	I	π-helix	trans	-57.9	-45.9	174.7	-72.4	-169.7	172.7	-160.5	0	111.6	M397 P398 K399 W400 L406	M397-K402 HydrophobicContact CE-CB 4.19Å; M397-K402 HydrophobicContact CE-CD 4.49Å; M397-K402 HydrophobicContact CE-CG 3.36Å; M397-K402 HydrophobicContact CG-CG 3.92Å; M397-K402 HydrophobicContact SD-CD 3.98Å; M397-K402 WeakPolarHBondContact SD-CE 3.28Å; M397-K402 HydrophobicContact SD-CG 3.4Å; M397-K402 WeakPolarHBondContact SD-CG 3.22Å; P398-K402 PolarHBondContact O-N 2.81Å; K399-K402 PolarHBondContact O-N 2.89Å; W400-K402 VanDerWaalsContact C-N 3.35Å; K402-L406 HydrophobicContact CB-CD1 4.23Å; K402-L406 HydrophobicContact CG-CD1 4.02Å; K402-L406 WeakPolarHBondContact O-CB 3.35Å; K402-L406 PolarHBondContact O-N 2.88Å; K402-L406 VanDerWaalsContact O-N 3.14Å
403	Q	82.4	Confident	82.1	Confident	90 Å²	90	88 Å²	88	42%	0.421	41%	0.411	S	S	.	.	I	π-helix	trans	-67	-45.6	-178.7	-169.2	68.4	12.2	0	0	112.2	K399 W400 V401 R407 T408	K399-Q403 PolarHBondContact O-N 3.03Å; W400-Q403 PolarHBondContact O-N 2.93Å; V401-Q403 VanDerWaalsContact C-N 3.34Å; V401-Q403 PolarHBondContact O-N 3.41Å; Q403-R407 WeakPolarHBondContact O-CB 3.41Å; Q403-R407 PolarHBondContact O-N 3.26Å; Q403-R407 VanDerWaalsContact OE1-CD 3.23Å; Q403-T408 PolarHBondContact O-N 3.09Å; Q403-T408 VanDerWaalsContact O-N 3.16Å; Q403-T408 PolarHBondContact O-OG1 2.96Å
404	I	85.6	Confident	81.5	Confident	74 Å²	74	92.7 Å²	92.7	38%	0.379	41%	0.414	S	S	.	.	I	π-helix	trans	-74.8	-52.4	-174.9	-64.1	-179.8	0	0	0	111.5	W400 V401 T408 L409	W400-I404 HydrophobicContact CE3-CD1 3.92Å; W400-I404 HydrophobicContact CZ3-CD1 4.4Å; W400-I404 WeakPolarHBondContact O-CG1 3.42Å; W400-I404 PolarHBondContact O-N 2.93Å; V401-I404 PolarHBondContact O-N 3.48Å; I404-T408 PolarHBondContact O-N 3.25Å; I404-L409 HydrophobicContact CG2-CD1 3.83Å; I404-L409 HydrophobicContact CG2-CG 4.18Å; I404-L409 WeakPolarHBondContact O-CB 3.41Å; I404-L409 WeakPolarHBondContact O-CG 3.41Å; I404-L409 PolarHBondContact O-N 2.94Å
405	F	83.2	Confident	80.8	Confident	26 Å²	26	89.2 Å²	89.2	11%	0.114	39%	0.392	C	S	.	.	I	π-helix	trans	-86.7	-27.5	-171.4	-71.3	-83.2	0	0	0	114.3	W400 V401 L409 P410 V526 V529 F530	W400-F405 HydrophobicContact CZ3-CE2 4.36Å; V401-F405 HydrophobicContact CG1-CD2 3.81Å; V401-F405 WeakPolarHBondContact O-CB 3.42Å; V401-F405 PolarHBondContact O-N 2.97Å; F405-L409 HydrophobicContact CD1-CD1 3.55Å; F405-L409 HydrophobicContact CE1-CD1 3.65Å; F405-L409 HydrophobicContact CG-CD1 4.18Å; F405-L409 HydrophobicContact CZ-CD1 4.39Å; F405-P410 WeakPolarHBondContact O-CD 3.42Å; F405-P410 WeakPolarHBondContact O-CG 3.43Å; F405-V526 HydrophobicContact CB-CB 4.31Å; F405-V526 HydrophobicContact CB-CG1 3.94Å; F405-V526 HydrophobicContact CB-CG2 3.77Å; F405-V526 HydrophobicContact CD1-CG1 4.15Å; F405-V526 HydrophobicContact CD2-CG1 4.17Å; F405-V526 HydrophobicContact CG-CG1 3.83Å; F405-V529 HydrophobicContact CD1-CG1 4.16Å; F405-F530 HydrophobicContact CE1-CB 4.08Å; F405-F530 AromaticContact CE1-CD2 3.71Å; F405-F530 HydrophobicContact CE1-CD2 3.71Å; F405-F530 HydrophobicContact CE1-CG 4.4Å; F405-F530 AromaticContact CZ-CD2 3.83Å; F405-F530 HydrophobicContact CZ-CD2 3.83Å
406	L	77.6	Confident	79.5	Confident	16 Å²	16	96 Å²	96	8%	0.084	41%	0.414	C	S	.	.	I	π-helix	trans	-94.9	-26.7	179.2	-56.2	176.9	0	0	0	113.7	M397 K402 Y525 V526	M397-L406 HydrophobicContact CE-CD1 3.83Å; M397-L406 HydrophobicContact CE-CG 4.14Å; K402-L406 HydrophobicContact CB-CD1 4.23Å; K402-L406 HydrophobicContact CG-CD1 4.02Å; K402-L406 WeakPolarHBondContact O-CB 3.35Å; K402-L406 PolarHBondContact O-N 2.88Å; K402-L406 VanDerWaalsContact O-N 3.14Å; L406-Y525 HydrophobicContact CD2-CD1 3.49Å; L406-Y525 VanDerWaalsContact CD2-CD1 3.49Å; L406-Y525 HydrophobicContact CD2-CE1 4.05Å; L406-Y525 HydrophobicContact CD2-CG 4.47Å; L406-V526 HydrophobicContact CD2-CG2 3.89Å; L406-V526 HydrophobicContact CG-CG2 4.3Å
407	R	77.5	Confident	78.5	Confident	173 Å²	173	89.2 Å²	89.2	65%	0.653	39%	0.388	S	S	*	.	I	π-helix	trans	-110	-53.8	-177	-67.6	173.6	171.4	-178.5	-7.9	113	Q403	Q403-R407 WeakPolarHBondContact O-CB 3.41Å; Q403-R407 PolarHBondContact O-N 3.26Å; Q403-R407 VanDerWaalsContact OE1-CD 3.23Å
408	T	78.4	Confident	77.2	Confident	62 Å²	62	92.9 Å²	92.9	38%	0.38	41%	0.414	S	S	.	.	I	π-helix	trans	-77.9	-54.8	-171.2	-50.6	0	0	0	0	113.1	Q403 I404 H411 Y412	Q403-T408 PolarHBondContact O-N 3.09Å; Q403-T408 VanDerWaalsContact O-N 3.16Å; Q403-T408 PolarHBondContact O-OG1 2.96Å; I404-T408 PolarHBondContact O-N 3.25Å; T408-H411 WeakPolarHBondContact O-CB 3.37Å; T408-H411 PolarHBondContact O-N 2.83Å; T408-Y412 HydrophobicContact CG2-CD2 4.19Å; T408-Y412 HydrophobicContact CG2-CE2 3.85Å; T408-Y412 VanDerWaalsContact O-CD2 3.32Å; T408-Y412 WeakPolarHBondContact O-CD2 3.29Å
409	L	81.2	Confident	75.2	Confident	27 Å²	27	96.7 Å²	96.7	14%	0.141	43%	0.432	C	S	.	.	H	α-helix	trans	-67	-39.9	-172.9	-76.6	172	0	0	0	115.5	I404 F405 H411 Y412 L413 V529 L533	I404-L409 HydrophobicContact CG2-CD1 3.83Å; I404-L409 HydrophobicContact CG2-CG 4.18Å; I404-L409 WeakPolarHBondContact O-CB 3.41Å; I404-L409 WeakPolarHBondContact O-CG 3.41Å; I404-L409 PolarHBondContact O-N 2.94Å; F405-L409 HydrophobicContact CD1-CD1 3.55Å; F405-L409 HydrophobicContact CE1-CD1 3.65Å; F405-L409 HydrophobicContact CG-CD1 4.18Å; F405-L409 HydrophobicContact CZ-CD1 4.39Å; L409-H411 PolarHBondContact O-N 2.95Å; L409-Y412 PolarHBondContact O-N 3.43Å; L409-Y412 VanDerWaalsContact O-N 3.09Å; L409-L413 HydrophobicContact CB-CD1 4.36Å; L409-L413 WeakPolarHBondContact O-CB 3.5Å; L409-L413 WeakPolarHBondContact O-CG 3.21Å; L409-L413 PolarHBondContact O-N 2.89Å; L409-V529 HydrophobicContact CB-CG1 3.79Å; L409-V529 HydrophobicContact CD1-CG1 4.35Å; L409-L533 HydrophobicContact CD1-CD2 4.13Å; L409-L533 HydrophobicContact CD2-CD1 4.14Å; L409-L533 HydrophobicContact CD2-CD2 4.24Å
410	P	76.7	Confident	73.4	Confident	7 Å²	7	90.3 Å²	90.3	5%	0.045	42%	0.421	C	S	.	.	H	α-helix	trans	-60.9	-30.5	179.2	-25.9	36.6	0	0	0	112.9	F405 L413 F414 M415 Y525 V529	F405-P410 WeakPolarHBondContact O-CD 3.42Å; F405-P410 WeakPolarHBondContact O-CG 3.43Å; P410-L413 PolarHBondContact O-N 2.95Å; P410-F414 PolarHBondContact O-N 2.89Å; P410-M415 HydrophobicContact CB-CB 4.06Å; P410-M415 PolarHBondContact O-N 2.82Å; P410-Y525 HydrophobicContact CG-CE1 4.02Å; P410-V529 HydrophobicContact CG-CG1 4.44Å; P410-V529 HydrophobicContact CG-CG2 4.1Å
411	H	74.1	Confident	71.4	Confident	155 Å²	155	86.2 Å²	86.2	72%	0.718	41%	0.411	S	S	*	.	H	α-helix	trans	-65.6	-43.8	175.2	-166.2	70.5	0	0	0	111.7	T408 L409	T408-H411 WeakPolarHBondContact O-CB 3.37Å; T408-H411 PolarHBondContact O-N 2.83Å; L409-H411 PolarHBondContact O-N 2.95Å
412	Y	79.2	Confident	69.3	Low	173 Å²	173	91.1 Å²	91.1	68%	0.678	44%	0.436	S	S	*	.	H	α-helix	trans	-70.7	-30.8	175.7	-74.5	-73.1	0	0	0	113.4	T408 L409	T408-Y412 HydrophobicContact CG2-CD2 4.19Å; T408-Y412 HydrophobicContact CG2-CE2 3.85Å; T408-Y412 VanDerWaalsContact O-CD2 3.32Å; T408-Y412 WeakPolarHBondContact O-CD2 3.29Å; L409-Y412 PolarHBondContact O-N 3.43Å; L409-Y412 VanDerWaalsContact O-N 3.09Å
413	L	75	Confident	67.4	Low	23 Å²	23	92.9 Å²	92.9	12%	0.12	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	13.2	-176.4	-67.6	165.9	0	0	0	113.7	L409 P410 M415 V529 L533 W536	L409-L413 HydrophobicContact CB-CD1 4.36Å; L409-L413 WeakPolarHBondContact O-CB 3.5Å; L409-L413 WeakPolarHBondContact O-CG 3.21Å; L409-L413 PolarHBondContact O-N 2.89Å; P410-L413 PolarHBondContact O-N 2.95Å; L413-M415 HydrophobicContact CB-CE 3.48Å; L413-M415 VanDerWaalsContact CB-CE 3.48Å; L413-M415 HydrophobicContact CD1-CE 3.72Å; L413-M415 HydrophobicContact CG-CE 4.21Å; L413-M415 PolarHBondContact O-N 2.94Å; L413-M415 VanDerWaalsContact O-N 3.13Å; L413-V529 HydrophobicContact CD1-CG1 4.01Å; L413-L533 HydrophobicContact CD1-CB 4.01Å; L413-W536 HydrophobicContact CD2-CG 4.35Å
414	F	71	Confident	65.8	Low	197 Å²	197	92.9 Å²	92.9	86%	0.864	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	37.2	-177.5	-68.3	-75.3	0	0	0	114.1	P410	P410-F414 PolarHBondContact O-N 2.89Å
415	M	70.4	Confident	63.9	Low	20 Å²	20	93.9 Å²	93.9	10%	0.099	46%	0.459	C	S	.	.			trans	-93.7	119	174.4	-85.2	-176.7	-98.8	0	0	110.5	P410 L413 R417 V529 R532	P410-M415 HydrophobicContact CB-CB 4.06Å; P410-M415 PolarHBondContact O-N 2.82Å; L413-M415 HydrophobicContact CB-CE 3.48Å; L413-M415 VanDerWaalsContact CB-CE 3.48Å; L413-M415 HydrophobicContact CD1-CE 3.72Å; L413-M415 HydrophobicContact CG-CE 4.21Å; L413-M415 PolarHBondContact O-N 2.94Å; L413-M415 VanDerWaalsContact O-N 3.13Å; M415-R417 PolarHBondContact O-N 3.27Å; M415-V529 HydrophobicContact CE-CB 4.42Å; M415-V529 HydrophobicContact CE-CG1 4.42Å; M415-V529 HydrophobicContact CE-CG2 4.14Å; M415-V529 HydrophobicContact SD-CG2 4.01Å; M415-R532 HydrophobicContact CE-CB 3.59Å; M415-R532 HydrophobicContact CE-CG 4.02Å; M415-R532 WeakPolarHBondContact SD-CD 3.23Å; M415-R532 PolarHBondContact SD-NH1 3.14Å; M415-R532 VanDerWaalsContact SD-NH1 3.37Å
416	R	59.1	Low	61.9	Low	220 Å²	220	96 Å²	96	83%	0.83	47%	0.474	S	S	*	.			trans	-79.7	110.9	167.5	-151	169.5	-168	166.3	2.1	107.4
417	R	61.7	Low	60.1	Low	96 Å²	96	102.5 Å²	102.5	36%	0.362	50%	0.502	S	S	.	.			trans	-56.1	132	169	-163.7	174.8	-168.7	-159.7	-0.7	106.9	M415 L419 D522 Y525	M415-R417 PolarHBondContact O-N 3.27Å; R417-L419 PolarHBondContact O-N 2.93Å; R417-D522 IonicContact NH2-OD1 2.59Å; R417-D522 PolarHBondContact NH2-OD1 2.83Å; R417-Y525 HydrophobicContact CG-CE2 4.46Å
418	P	56.1	Low	58.6	Low	104 Å²	104	101.2 Å²	101.2	68%	0.675	50%	0.497	S	S	*	.			trans	-55.2	112	170.3	20.3	-28.5	0	0	0	107.1	G420	P418-G420 PolarHBondContact O-N 2.83Å
419	L	45.5	Very low	56.9	Low	124 Å²	124	105.9 Å²	105.9	65%	0.649	51%	0.508	S	S	*	.			trans	-65.5	100.4	176.2	-81.3	115.3	0	0	0	106.7	R417	R417-L419 PolarHBondContact O-N 2.93Å
420	G	46.6	Very low	55.1	Low	59 Å²	59	108.5 Å²	108.5	61%	0.608	53%	0.525	S	S	*	.			trans	-134.3	8.6	172.7	0	0	0	0	0	113.2	P418	P418-G420 PolarHBondContact O-N 2.83Å
421	D	47.6	Very low	53.6	Low	71 Å²	71	111.7 Å²	111.7	38%	0.38	55%	0.547	S	S	.	.	S	Bend	trans	-120	0.4	-174.6	-110.5	-3.3	0	0	0	114.9	K518	D421-K518 VanDerWaalsContact CG-NZ 3.29Å; D421-K518 IonicContact OD1-NZ 3.18Å; D421-K518 PolarHBondContact OD1-NZ 2.92Å; D421-K518 IonicContact OD2-NZ 3.21Å; D421-K518 PolarHBondContact OD2-NZ 2.77Å
422	D	44.3	Very low	52.2	Low	110 Å²	110	108 Å²	108	59%	0.588	54%	0.538	S	S	*	.	S	Bend	trans	-87	-10	173.2	-73	-37.6	0	0	0	113	T426	D422-T426 PolarHBondContact O-OG1 3.25Å
423	D	42.9	Very low	50.5	Low	124 Å²	124	109.5 Å²	109.5	66%	0.663	54%	0.543	S	S	*	.	H	α-helix	trans	-88.2	-18.2	178.5	-73.6	-35.5	0	0	0	113.7	T426 F427	D423-T426 PolarHBondContact O-N 3.35Å; D423-F427 PolarHBondContact O-N 3.07Å
424	D	48.3	Very low	48.9	Very low	90 Å²	90	118.6 Å²	118.6	48%	0.481	58%	0.576	S	S	.	*	H	α-helix	trans	-78.2	-30.3	-179.1	-140.4	12.9	0	0	0	111.9	T426 R428	D424-T426 VanDerWaalsContact C-N 3.31Å; D424-R428 PolarHBondContact O-N 3.47Å; D424-R428 VanDerWaalsContact O-N 3.15Å
425	D	44.8	Very low	47.5	Very low	95 Å²	95	113.4 Å²	113.4	51%	0.508	56%	0.564	S	S	.	*	H	α-helix	trans	-73.8	-25.3	169.3	-87.1	-12.5	0	0	0	112.2	R429	D425-R429 WeakPolarHBondContact O-CB 3.39Å; D425-R429 WeakPolarHBondContact O-CG 3.32Å; D425-R429 PolarHBondContact O-N 2.85Å
426	T	42.3	Very low	46	Very low	70 Å²	70	119.5 Å²	119.5	43%	0.429	60%	0.597	S	S	.	*	H	α-helix	trans	-78	-39.3	177.2	-49.1	0	0	0	0	110.7	D422 D423 D424 R429 V430	D422-T426 PolarHBondContact O-OG1 3.25Å; D423-T426 PolarHBondContact O-N 3.35Å; D424-T426 VanDerWaalsContact C-N 3.31Å; T426-R429 PolarHBondContact O-N 3.21Å; T426-V430 VanDerWaalsContact O-CG2 3.23Å; T426-V430 WeakPolarHBondContact O-CG2 3.45Å; T426-V430 PolarHBondContact O-N 2.89Å
427	F	40.5	Very low	45	Very low	153 Å²	153	112.8 Å²	112.8	67%	0.671	59%	0.589	S	S	*	*	H	α-helix	trans	-68.3	-38	174.5	-163.3	-99.1	0	0	0	112.4	D423 V430 S431	D423-F427 PolarHBondContact O-N 3.07Å; F427-V430 PolarHBondContact O-N 2.87Å; F427-S431 PolarHBondContact O-N 2.85Å; F427-S431 PolarHBondContact O-OG 2.85Å
428	R	44.6	Very low	43.5	Very low	145 Å²	145	117.1 Å²	117.1	55%	0.547	61%	0.613	S	S	.	*	H	α-helix	trans	-67.4	-33.9	171.9	-88.6	-179.1	162.2	152.8	-5.4	113.9	D424 S431 S432 D449	D424-R428 PolarHBondContact O-N 3.47Å; D424-R428 VanDerWaalsContact O-N 3.15Å; R428-S431 PolarHBondContact O-OG 2.91Å; R428-S432 VanDerWaalsContact O-CB 3.27Å; R428-S432 WeakPolarHBondContact O-CB 3.44Å; R428-S432 PolarHBondContact O-N 2.77Å; R428-D449 IonicContact NH2-OD2 3.65Å
429	R	42.4	Very low	42.2	Very low	161 Å²	161	121.5 Å²	121.5	61%	0.608	62%	0.622	S	S	*	*	H	α-helix	trans	-72.3	-31	172.7	-83.7	-176.1	-165.1	143.5	8.1	112.9	D425 T426 R433	D425-R429 WeakPolarHBondContact O-CB 3.39Å; D425-R429 WeakPolarHBondContact O-CG 3.32Å; D425-R429 PolarHBondContact O-N 2.85Å; T426-R429 PolarHBondContact O-N 3.21Å; R429-R433 WeakPolarHBondContact O-CB 3.43Å; R429-R433 WeakPolarHBondContact O-CG 3.49Å; R429-R433 PolarHBondContact O-N 2.89Å
430	V	44.6	Very low	41.6	Very low	82 Å²	82	120.8 Å²	120.8	50%	0.497	63%	0.625	S	S	.	*	H	α-helix	trans	-75.3	-35.3	176.7	172.8	0	0	0	0	111.2	T426 F427 R433 R434	T426-V430 VanDerWaalsContact O-CG2 3.23Å; T426-V430 WeakPolarHBondContact O-CG2 3.45Å; T426-V430 PolarHBondContact O-N 2.89Å; F427-V430 PolarHBondContact O-N 2.87Å; V430-R433 PolarHBondContact O-N 3.37Å; V430-R434 PolarHBondContact O-N 3.36Å
431	S	45	Very low	40.8	Very low	73 Å²	73	126.1 Å²	126.1	51%	0.51	63%	0.634	S	S	.	*	H	α-helix	trans	-69.8	-37	171.9	66.9	0	0	0	0	112.4	F427 R428	F427-S431 PolarHBondContact O-N 2.85Å; F427-S431 PolarHBondContact O-OG 2.85Å; R428-S431 PolarHBondContact O-OG 2.91Å
432	S	44.3	Very low	40.2	Very low	77 Å²	77	129 Å²	129	54%	0.538	65%	0.654	S	S	.	*	H	α-helix	trans	-71.5	-23.5	174.4	173.5	0	0	0	0	114.3	R428 S435	R428-S432 VanDerWaalsContact O-CB 3.27Å; R428-S432 WeakPolarHBondContact O-CB 3.44Å; R428-S432 PolarHBondContact O-N 2.77Å; S432-S435 PolarHBondContact O-OG 2.92Å
433	R	42.6	Very low	39.4	Very low	205 Å²	205	135.3 Å²	135.3	77%	0.774	67%	0.669	S	S	*	*	H	α-helix	trans	-89.5	-11.6	177.5	-82	-178.7	176	173.1	-0.8	114	R429 V430	R429-R433 WeakPolarHBondContact O-CB 3.43Å; R429-R433 WeakPolarHBondContact O-CG 3.49Å; R429-R433 PolarHBondContact O-N 2.89Å; V430-R433 PolarHBondContact O-N 3.37Å
434	R	42.6	Very low	39.3	Very low	214 Å²	214	136.7 Å²	136.7	81%	0.808	68%	0.675	S	S	*	*	S	Bend	trans	-90.2	-8.2	178.3	-129.2	174.4	-175.5	167.5	0.5	113.5	V430	V430-R434 PolarHBondContact O-N 3.36Å
435	S	41.5	Very low	38.7	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-1.9	-179.9	38.5	0	0	0	0	115.4	S432	S432-S435 PolarHBondContact O-OG 2.92Å
436	D	38.5	Very low	38.2	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	11.4	178.3	-80.3	-26.1	0	0	0	114.3	Q438	D436-Q438 PolarHBondContact O-N 2.85Å
437	A	39	Very low	37.9	Very low	79 Å²	79	139.5 Å²	139.5	65%	0.653	72%	0.718	S	S	*	*	S	Bend	trans	-88.3	82.9	172.7	0	0	0	0	0	111.3	F439	A437-F439 PolarHBondContact O-N 3.37Å
438	Q	29.9	Very low	37.7	Very low	187 Å²	187	135.3 Å²	135.3	87%	0.874	72%	0.718	S	S	*	*			trans	-0.2	92.6	158.1	-158.6	157.1	13.8	0	0	117.2	D436	D436-Q438 PolarHBondContact O-N 2.85Å
439	F	29.2	Very low	37.4	Very low	195 Å²	195	135.3 Å²	135.3	86%	0.855	73%	0.729	S	S	*	*			trans	-133.5	139.1	154.5	-86.9	-83.7	0	0	0	109.8	A437	A437-F439 PolarHBondContact O-N 3.37Å
440	P	31	Very low	37.5	Very low	110 Å²	110	136.9 Å²	136.9	71%	0.714	74%	0.743	S	S	*	*			trans	-84.4	136.5	-163.9	-5.3	24.9	0	0	0	113.2
441	H	30.8	Very low	37.4	Very low	171 Å²	171	135.2 Å²	135.2	79%	0.792	74%	0.738	S	S	*	*			trans	69.9	88.7	152.4	-65.7	-70.6	0	0	0	120.4
442	V	34.5	Very low	37.8	Very low	132 Å²	132	137.6 Å²	137.6	80%	0.8	75%	0.745	S	S	*	*				-147.1	122.1	127.1	-176.8	0	0	0	0	108.4	I444	V442-I444 HydrophobicContact CG1-CD1 4.34Å; V442-I444 HydrophobicContact CG1-CG1 4.1Å
443	R	28.5	Very low	38.4	Very low	242 Å²	242	135.8 Å²	135.8	91%	0.913	73%	0.732	S	S	*	*			trans	-82.1	112.6	176.5	-71.1	-178	-175.6	168.6	1.9	109.7
444	I	40	Very low	38.7	Very low	153 Å²	153	132.7 Å²	132.7	79%	0.785	72%	0.721	S	S	*	*			trans	-127.6	120.2	165.7	-58.9	179.9	0	0	0	107.4	V442	V442-I444 HydrophobicContact CG1-CD1 4.34Å; V442-I444 HydrophobicContact CG1-CG1 4.1Å
445	G	36.5	Very low	39.1	Very low	61 Å²	61	126.9 Å²	126.9	63%	0.629	71%	0.706	S	S	*	*			trans	-68.5	164.2	-175.7	0	0	0	0	0	113.8	S447	G445-S447 PolarHBondContact O-N 2.98Å
446	P	34.1	Very low	39.5	Very low	132 Å²	132	127.6 Å²	127.6	86%	0.857	70%	0.7	S	S	*	*			trans	-85.7	108	-168.8	33.2	-29.5	0	0	0	109.8
447	S	35	Very low	39.9	Very low	120 Å²	120	121.4 Å²	121.4	84%	0.839	67%	0.667	S	S	*	*			trans	-154.4	95.6	169	-72.4	0	0	0	0	111.2	G445	G445-S447 PolarHBondContact O-N 2.98Å
448	G	36.7	Very low	40.3	Very low	65 Å²	65	120.3 Å²	120.3	67%	0.67	66%	0.655	S	S	*	*			trans	72.8	86.9	143.9	0	0	0	0	0	118.3	Q450	G448-Q450 PolarHBondContact O-N 3.47Å
449	D	37.9	Very low	41.2	Very low	145 Å²	145	114.8 Å²	114.8	78%	0.775	64%	0.637	S	S	*	*	S	Bend	trans	12.3	16.6	137.1	-84	13.8	0	0	0	123.8	R428	R428-D449 IonicContact NH2-OD2 3.65Å
450	Q	45	Very low	42.1	Very low	194 Å²	194	110 Å²	110	91%	0.907	62%	0.616	S	S	*	*	S	Bend	trans	-135.8	2.5	-177.4	-79.2	-178.5	11.5	0	0	116.4	G448	G448-Q450 PolarHBondContact O-N 3.47Å
451	A	42.6	Very low	42.9	Very low	47 Å²	47	110.4 Å²	110.4	39%	0.388	61%	0.608	S	S	.	*			trans	-104.6	-6.7	-169.3	0	0	0	0	0	117.2	C453 Y454 D455	A451-C453 PolarHBondContact O-N 2.92Å; A451-C453 VanDerWaalsContact O-N 3.12Å; A451-Y454 PolarHBondContact O-N 2.95Å; A451-D455 HydrophobicContact CB-CB 4.47Å; A451-D455 WeakPolarHBondContact CB-OD2 3.31Å; A451-D455 PolarHBondContact O-N 3.28Å
452	N	54.1	Low	43.7	Very low	124 Å²	124	111.7 Å²	111.7	66%	0.663	61%	0.606	S	S	*	*	H	α-helix	trans	-62.6	-29.5	-159.7	-96.4	-9	0	0	0	117.7	Q456	N452-Q456 WeakPolarHBondContact O-CB 3.19Å; N452-Q456 VanDerWaalsContact O-CG 3.23Å; N452-Q456 WeakPolarHBondContact O-CG 3.36Å; N452-Q456 PolarHBondContact O-N 3.2Å
453	C	57	Low	44.3	Very low	38 Å²	38	106.8 Å²	106.8	26%	0.257	58%	0.582	S	S	.	*	H	α-helix	trans	-80.4	-25.8	-177.2	-119.8	0	0	0	0	113.6	A451 T457 C504	A451-C453 PolarHBondContact O-N 2.92Å; A451-C453 VanDerWaalsContact O-N 3.12Å; C453-T457 PolarHBondContact O-OG1 2.83Å; C453-C504 HydrophobicContact CB-CB 3.82Å; C453-C504 WeakPolarHBondContact CB-SG 3.3Å; C453-C504 WeakPolarHBondContact SG-CB 3.44Å; C453-C504 CovalentContact SG-SG 2.05Å; C453-C504 PolarHBondContact SG-SG 3.39Å
454	Y	48.8	Very low	45.1	Very low	140 Å²	140	102.6 Å²	102.6	55%	0.549	57%	0.566	S	S	.	*	H	α-helix	trans	-98.2	-32.4	178.3	-77	-54.4	0	0	0	112.6	A451 Q456 T457 S458 R508	A451-Y454 PolarHBondContact O-N 2.95Å; Y454-Q456 VanDerWaalsContact C-N 3.29Å; Y454-Q456 PolarHBondContact O-N 2.88Å; Y454-T457 WeakPolarHBondContact CA-OG1 3.27Å; Y454-T457 PolarHBondContact O-N 2.94Å; Y454-T457 VanDerWaalsContact O-N 3.16Å; Y454-T457 PolarHBondContact O-OG1 3.47Å; Y454-S458 PolarHBondContact O-N 3.42Å; Y454-S458 PolarHBondContact O-OG 2.88Å; Y454-R508 PolarHBondContact OH-NH1 3.01Å
455	D	51	Low	45.3	Very low	92 Å²	92	100 Å²	100	49%	0.492	56%	0.562	S	S	.	*	H	α-helix	trans	-69.1	-29.3	174.9	-98.1	-19.4	0	0	0	112.3	A451 T457 S458 S459	A451-D455 HydrophobicContact CB-CB 4.47Å; A451-D455 WeakPolarHBondContact CB-OD2 3.31Å; A451-D455 PolarHBondContact O-N 3.28Å; D455-T457 VanDerWaalsContact C-N 3.32Å; D455-S458 WeakPolarHBondContact CA-OG 3.29Å; D455-S458 PolarHBondContact O-OG 2.99Å; D455-S458 PolarHBondContact OD1-OG 2.7Å; D455-S459 WeakPolarHBondContact O-CB 3.12Å; D455-S459 PolarHBondContact O-N 2.7Å; D455-S459 PolarHBondContact O-OG 2.85Å
456	Q	49	Very low	45.9	Very low	105 Å²	105	104.3 Å²	104.3	49%	0.491	57%	0.565	S	S	.	*	H	α-helix	trans	-68	-32.7	170.8	-76.1	178	12.7	0	0	112.2	N452 Y454 S459 F460	N452-Q456 WeakPolarHBondContact O-CB 3.19Å; N452-Q456 VanDerWaalsContact O-CG 3.23Å; N452-Q456 WeakPolarHBondContact O-CG 3.36Å; N452-Q456 PolarHBondContact O-N 3.2Å; Y454-Q456 VanDerWaalsContact C-N 3.29Å; Y454-Q456 PolarHBondContact O-N 2.88Å; Q456-S459 WeakPolarHBondContact CA-OG 3.31Å; Q456-S459 PolarHBondContact O-OG 2.99Å; Q456-F460 WeakPolarHBondContact O-CB 3.11Å; Q456-F460 PolarHBondContact O-N 3.48Å; Q456-F460 VanDerWaalsContact O-N 3.14Å
457	T	46.8	Very low	46.3	Very low	18 Å²	18	104.8 Å²	104.8	11%	0.11	56%	0.558	C	S	.	*	H	α-helix	trans	-76.8	-37.7	176.7	0.2	0	0	0	0	112	C453 Y454 D455 Q461 L497 F500	C453-T457 PolarHBondContact O-OG1 2.83Å; Y454-T457 WeakPolarHBondContact CA-OG1 3.27Å; Y454-T457 PolarHBondContact O-N 2.94Å; Y454-T457 VanDerWaalsContact O-N 3.16Å; Y454-T457 PolarHBondContact O-OG1 3.47Å; D455-T457 VanDerWaalsContact C-N 3.32Å; T457-Q461 WeakPolarHBondContact O-CG 3.44Å; T457-Q461 PolarHBondContact O-N 2.73Å; T457-Q461 VanDerWaalsContact O-N 3.15Å; T457-L497 HydrophobicContact CG2-CD2 4.33Å; T457-F500 HydrophobicContact CG2-CD1 3.99Å; T457-F500 HydrophobicContact CG2-CE1 4.07Å
458	S	47.8	Very low	46.8	Very low	56 Å²	56	104.6 Å²	104.6	39%	0.392	55%	0.552	S	S	.	*	H	α-helix	trans	-74.6	-39.6	178.7	69.1	0	0	0	0	112.1	Y454 D455 Q461 R462	Y454-S458 PolarHBondContact O-N 3.42Å; Y454-S458 PolarHBondContact O-OG 2.88Å; D455-S458 WeakPolarHBondContact CA-OG 3.29Å; D455-S458 PolarHBondContact O-OG 2.99Å; D455-S458 PolarHBondContact OD1-OG 2.7Å; S458-Q461 PolarHBondContact O-N 3.34Å; S458-R462 VanDerWaalsContact O-CB 3.31Å; S458-R462 WeakPolarHBondContact O-CB 3.45Å; S458-R462 PolarHBondContact O-N 3.03Å
459	S	49.7	Very low	46.9	Very low	70 Å²	70	104.7 Å²	104.7	49%	0.49	55%	0.553	S	S	.	*	H	α-helix	trans	-68.9	-36	174.7	58.8	0	0	0	0	112.6	D455 Q456 Q461 R462 G463	D455-S459 WeakPolarHBondContact O-CB 3.12Å; D455-S459 PolarHBondContact O-N 2.7Å; D455-S459 PolarHBondContact O-OG 2.85Å; Q456-S459 WeakPolarHBondContact CA-OG 3.31Å; Q456-S459 PolarHBondContact O-OG 2.99Å; S459-Q461 VanDerWaalsContact C-N 3.32Å; S459-Q461 PolarHBondContact O-N 2.8Å; S459-R462 PolarHBondContact O-N 2.91Å; S459-G463 PolarHBondContact O-N 3.03Å
460	F	48.3	Very low	47.1	Very low	95 Å²	95	108.8 Å²	108.8	42%	0.417	56%	0.557	S	S	.	*	H	α-helix	trans	-67.4	-31.7	173.7	-166.6	-110.6	0	0	0	112.5	Q456 F491 F492	Q456-F460 WeakPolarHBondContact O-CB 3.11Å; Q456-F460 PolarHBondContact O-N 3.48Å; Q456-F460 VanDerWaalsContact O-N 3.14Å; F460-F491 HydrophobicContact CZ-CB 4.4Å; F460-F492 HydrophobicContact CD1-CD1 4.32Å; F460-F492 AromaticContact CD1-CE1 3.46Å; F460-F492 HydrophobicContact CD1-CE1 3.46Å; F460-F492 VanDerWaalsContact CD1-CE1 3.46Å; F460-F492 AromaticContact CD1-CZ 3.86Å; F460-F492 HydrophobicContact CD1-CZ 3.86Å; F460-F492 AromaticContact CE1-CD1 3.72Å; F460-F492 HydrophobicContact CE1-CD1 3.72Å; F460-F492 AromaticContact CE1-CE1 3.02Å; F460-F492 HydrophobicContact CE1-CE1 3.02Å; F460-F492 HydrophobicContact CE1-CE2 4Å; F460-F492 HydrophobicContact CE1-CG 4.46Å; F460-F492 AromaticContact CE1-CZ 3.16Å; F460-F492 HydrophobicContact CE1-CZ 3.16Å; F460-F492 HydrophobicContact CE2-CZ 4.06Å; F460-F492 HydrophobicContact CG-CE1 4.44Å; F460-F492 AromaticContact CZ-CE1 3.7Å; F460-F492 HydrophobicContact CZ-CE1 3.7Å; F460-F492 AromaticContact CZ-CE2 3.85Å; F460-F492 HydrophobicContact CZ-CE2 3.85Å; F460-F492 AromaticContact CZ-CZ 3.27Å; F460-F492 HydrophobicContact CZ-CZ 3.27Å
461	Q	46.9	Very low	46.8	Very low	119 Å²	119	106.7 Å²	106.7	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-78.1	-31.6	170.9	-75.1	-178.5	-13.6	0	0	113.1	T457 S458 S459 R464	T457-Q461 WeakPolarHBondContact O-CG 3.44Å; T457-Q461 PolarHBondContact O-N 2.73Å; T457-Q461 VanDerWaalsContact O-N 3.15Å; S458-Q461 PolarHBondContact O-N 3.34Å; S459-Q461 VanDerWaalsContact C-N 3.32Å; S459-Q461 PolarHBondContact O-N 2.8Å; Q461-R464 WeakPolarHBondContact O-CB 3.29Å; Q461-R464 PolarHBondContact O-N 2.94Å
462	R	46.9	Very low	46.6	Very low	197 Å²	197	113.4 Å²	113.4	74%	0.743	57%	0.568	S	S	*	*	H	α-helix	trans	-74.7	-33.7	-179.5	-151.2	173.9	-163.1	176.8	3.4	112.6	S458 S459 R464 S465	S458-R462 VanDerWaalsContact O-CB 3.31Å; S458-R462 WeakPolarHBondContact O-CB 3.45Å; S458-R462 PolarHBondContact O-N 3.03Å; S459-R462 PolarHBondContact O-N 2.91Å; R462-R464 PolarHBondContact O-N 2.8Å; R462-S465 PolarHBondContact O-N 3.36Å; R462-S465 VanDerWaalsContact O-N 3.1Å
463	G	47.6	Very low	45.9	Very low	29 Å²	29	112.9 Å²	112.9	30%	0.299	57%	0.574	S	S	.	*	H	α-helix	trans	-61.1	-25.9	173.3	0	0	0	0	0	114	S459 S465 E466 M467	S459-G463 PolarHBondContact O-N 3.03Å; G463-S465 VanDerWaalsContact C-N 3.32Å; G463-S465 PolarHBondContact O-N 2.85Å; G463-E466 PolarHBondContact O-N 2.95Å; G463-M467 PolarHBondContact O-N 2.82Å
464	R	44.6	Very low	45.1	Very low	154 Å²	154	118.6 Å²	118.6	58%	0.581	60%	0.602	S	S	*	*	H	α-helix	trans	-69.7	-25.9	175.6	-169.3	173	178.8	153.5	-0.3	113.1	Q461 R462 V468	Q461-R464 WeakPolarHBondContact O-CB 3.29Å; Q461-R464 PolarHBondContact O-N 2.94Å; R462-R464 PolarHBondContact O-N 2.8Å; R464-V468 WeakPolarHBondContact O-CG2 3.33Å
465	S	45.5	Very low	44.5	Very low	99 Å²	99	116.7 Å²	116.7	69%	0.692	62%	0.615	S	S	*	*	H	α-helix	trans	-84.6	-18	179.5	-159.2	0	0	0	0	113.2	R462 G463	R462-S465 PolarHBondContact O-N 3.36Å; R462-S465 VanDerWaalsContact O-N 3.1Å; G463-S465 VanDerWaalsContact C-N 3.32Å; G463-S465 PolarHBondContact O-N 2.85Å
466	E	47.8	Very low	43.8	Very low	151 Å²	151	116.6 Å²	116.6	71%	0.706	63%	0.627	S	S	*	*	H	α-helix	trans	-97.2	-25.5	178.9	-72.6	-178.4	160.6	0	0	113.1	G463	G463-E466 PolarHBondContact O-N 2.95Å
467	M	43.6	Very low	43.4	Very low	142 Å²	142	117.7 Å²	117.7	70%	0.7	64%	0.641	S	S	*	*	H	α-helix	trans	-81.9	-26.2	174.1	-73.1	-172.9	-162.1	0	0	113.9	G463 G469	G463-M467 PolarHBondContact O-N 2.82Å; M467-G469 PolarHBondContact O-N 2.87Å
468	V	44.8	Very low	43	Very low	117 Å²	117	125.1 Å²	125.1	71%	0.709	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-15.1	176.3	174	0	0	0	0	112.1	R464	R464-V468 WeakPolarHBondContact O-CG2 3.33Å
469	G	39.4	Very low	42.4	Very low	67 Å²	67	128 Å²	128	69%	0.691	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	0.6	177.2	0	0	0	0	0	115.9	M467	M467-G469 PolarHBondContact O-N 2.87Å
470	R	42.5	Very low	41.9	Very low	231 Å²	231	129.8 Å²	129.8	87%	0.872	71%	0.707	S	S	*	*	S	Bend	trans	-126.5	12.4	-173.4	-89.3	-175.9	172.6	175.6	-1.2	115.2
471	H	39.1	Very low	41.5	Very low	149 Å²	149	131.9 Å²	131.9	69%	0.69	72%	0.722	S	S	*	*			trans	-113.1	130.4	175.4	-92.4	-84.1	0	0	0	110.8
472	F	38.2	Very low	41	Very low	189 Å²	189	138.8 Å²	138.8	83%	0.829	74%	0.743	S	S	*	*			trans	90.1	49.7	169.4	-73.7	-87.9	0	0	0	118.7
473	S	39	Very low	41	Very low	113 Å²	113	133.5 Å²	133.5	79%	0.79	74%	0.742	S	S	*	*	S	Bend		-97.9	144.9	127.6	-64.3	0	0	0	0	107.5
474	D	40.9	Very low	41	Very low	158 Å²	158	137.7 Å²	137.7	85%	0.845	76%	0.762	S	S	*	*			trans	85.6	112.5	177.3	-57.8	-21.7	0	0	0	117.3
475	A	34.9	Very low	41.1	Very low	99 Å²	99	133.3 Å²	133.3	82%	0.818	76%	0.764	S	S	*	*			trans	-92.3	163.8	-179.5	0	0	0	0	0	111.3
476	A	36.8	Very low	41.5	Very low	90 Å²	90	132.2 Å²	132.2	74%	0.744	76%	0.756	S	S	*	*			trans	96.8	136.8	157.7	0	0	0	0	0	118
477	T	41.3	Very low	41.8	Very low	128 Å²	128	128.8 Å²	128.8	79%	0.785	75%	0.746	S	S	*	*			trans	85.7	86.7	158.6	21.3	0	0	0	0	119.5
478	E	38.2	Very low	42.3	Very low	175 Å²	175	126.9 Å²	126.9	82%	0.818	74%	0.739	S	S	*	*				48.9	112.9	122.1	-69.3	-175	155.4	0	0	122
479	S	34.6	Very low	42.7	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	74%	0.739	S	S	*	*			trans	64.5	107.6	132.1	65.6	0	0	0	0	121.2
480	S	38.1	Very low	43.5	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	73%	0.732	S	S	*	*			trans	138.4	103.5	145.2	-148.5	0	0	0	0	106.3
481	D	40.5	Very low	44.2	Very low	139 Å²	139	125 Å²	125	74%	0.743	72%	0.715	S	S	*	*				-165.5	126.5	68	-78.9	-32.4	0	0	0	110.1	A483	D481-A483 PolarHBondContact O-N 2.86Å
482	R	37.7	Very low	45.2	Very low	264 Å²	264	120.9 Å²	120.9	100%	0.996	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	26.7	-169.9	-99.3	-174.1	178.4	105.7	-2.1	115.5
483	A	46	Very low	46.6	Very low	86 Å²	86	113.2 Å²	113.2	71%	0.711	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	-9.9	-170.5	0	0	0	0	0	116.7	D481	D481-A483 PolarHBondContact O-N 2.86Å
484	V	47.4	Very low	48.4	Very low	118 Å²	118	112.2 Å²	112.2	72%	0.715	66%	0.657	S	S	*	*	S	Bend	trans	-100.6	-13.9	-170.2	-179.4	0	0	0	0	113.8	S486	V484-S486 PolarHBondContact O-N 3.47Å
485	G	47	Very low	50.2	Low	62 Å²	62	109 Å²	109	64%	0.639	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-5.4	-173.3	0	0	0	0	0	117.3
486	S	53.5	Low	52.2	Low	75 Å²	75	106.9 Å²	106.9	52%	0.524	62%	0.622	S	S	.	*	H	α-helix	trans	-91.4	-15.9	-176.1	126.5	0	0	0	0	114	V484 I490	V484-S486 PolarHBondContact O-N 3.47Å; S486-I490 WeakPolarHBondContact O-CD1 3.4Å; S486-I490 VanDerWaalsContact O-CG1 3.27Å; S486-I490 WeakPolarHBondContact O-CG1 3.47Å
487	V	54.4	Low	54.2	Low	79 Å²	79	104.6 Å²	104.6	48%	0.479	60%	0.597	S	S	.	*	H	α-helix	trans	-81.2	-41.1	-172.7	-174.2	0	0	0	0	110.2	I490 F491	V487-I490 PolarHBondContact O-N 3.17Å; V487-F491 HydrophobicContact CG1-CD2 4.1Å; V487-F491 HydrophobicContact CG1-CE2 3.72Å; V487-F491 WeakPolarHBondContact O-CD2 3.13Å; V487-F491 PolarHBondContact O-N 3.18Å
488	D	53.9	Low	55.9	Low	103 Å²	103	107 Å²	107	55%	0.551	59%	0.591	S	S	*	*	H	α-helix	trans	-67.9	-41	-177.8	-71.2	-30.8	0	0	0	112.7	I490 F491 F492	D488-I490 VanDerWaalsContact C-N 3.25Å; D488-I490 PolarHBondContact O-N 3.15Å; D488-F491 PolarHBondContact O-N 3.1Å; D488-F491 VanDerWaalsContact O-N 3.13Å; D488-F492 WeakPolarHBondContact O-CD2 3.27Å; D488-F492 PolarHBondContact O-N 3.28Å
489	E	53.5	Low	58.1	Low	155 Å²	155	101 Å²	101	72%	0.724	57%	0.572	S	S	*	*	H	α-helix	trans	-62.1	-31	177.5	-88	-169.3	153.2	0	0	113.5	F492 A493	E489-F492 PolarHBondContact O-N 2.75Å; E489-A493 PolarHBondContact O-N 3.21Å
490	I	55.8	Low	60.3	Low	105 Å²	105	99.1 Å²	99.1	54%	0.538	55%	0.549	S	S	.	.	H	α-helix	trans	-69	-37.8	177.1	-63.1	167.6	0	0	0	110.5	S486 V487 D488 F492 A493 V496	S486-I490 WeakPolarHBondContact O-CD1 3.4Å; S486-I490 VanDerWaalsContact O-CG1 3.27Å; S486-I490 WeakPolarHBondContact O-CG1 3.47Å; V487-I490 PolarHBondContact O-N 3.17Å; D488-I490 VanDerWaalsContact C-N 3.25Å; D488-I490 PolarHBondContact O-N 3.15Å; I490-F492 VanDerWaalsContact C-N 3.25Å; I490-F492 PolarHBondContact O-N 2.83Å; I490-A493 PolarHBondContact O-N 3.1Å; I490-V496 WeakPolarHBondContact O-CG2 3.33Å
491	F	58.3	Low	62.4	Low	116 Å²	116	99 Å²	99	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-22.9	177.8	-81.5	-77	0	0	0	113.5	F460 V487 D488	F460-F491 HydrophobicContact CZ-CB 4.4Å; V487-F491 HydrophobicContact CG1-CD2 4.1Å; V487-F491 HydrophobicContact CG1-CE2 3.72Å; V487-F491 WeakPolarHBondContact O-CD2 3.13Å; V487-F491 PolarHBondContact O-N 3.18Å; D488-F491 PolarHBondContact O-N 3.1Å; D488-F491 VanDerWaalsContact O-N 3.13Å
492	F	60.3	Low	64.5	Low	61 Å²	61	97.2 Å²	97.2	27%	0.268	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	4.6	179.1	-67	-73.8	0	0	0	114.6	F460 D488 E489 I490	F460-F492 HydrophobicContact CD1-CD1 4.32Å; F460-F492 AromaticContact CD1-CE1 3.46Å; F460-F492 HydrophobicContact CD1-CE1 3.46Å; F460-F492 VanDerWaalsContact CD1-CE1 3.46Å; F460-F492 AromaticContact CD1-CZ 3.86Å; F460-F492 HydrophobicContact CD1-CZ 3.86Å; F460-F492 AromaticContact CE1-CD1 3.72Å; F460-F492 HydrophobicContact CE1-CD1 3.72Å; F460-F492 AromaticContact CE1-CE1 3.02Å; F460-F492 HydrophobicContact CE1-CE1 3.02Å; F460-F492 HydrophobicContact CE1-CE2 4Å; F460-F492 HydrophobicContact CE1-CG 4.46Å; F460-F492 AromaticContact CE1-CZ 3.16Å; F460-F492 HydrophobicContact CE1-CZ 3.16Å; F460-F492 HydrophobicContact CE2-CZ 4.06Å; F460-F492 HydrophobicContact CG-CE1 4.44Å; F460-F492 AromaticContact CZ-CE1 3.7Å; F460-F492 HydrophobicContact CZ-CE1 3.7Å; F460-F492 AromaticContact CZ-CE2 3.85Å; F460-F492 HydrophobicContact CZ-CE2 3.85Å; F460-F492 AromaticContact CZ-CZ 3.27Å; F460-F492 HydrophobicContact CZ-CZ 3.27Å; D488-F492 WeakPolarHBondContact O-CD2 3.27Å; D488-F492 PolarHBondContact O-N 3.28Å; E489-F492 PolarHBondContact O-N 2.75Å; I490-F492 VanDerWaalsContact C-N 3.25Å; I490-F492 PolarHBondContact O-N 2.83Å
493	A	67	Low	66.9	Low	29 Å²	29	89.1 Å²	89.1	24%	0.24	51%	0.507	C	S	.	.	S	Bend	trans	-63.8	134.1	175	0	0	0	0	0	110.7	E489 I490 P495 V496 L497	E489-A493 PolarHBondContact O-N 3.21Å; I490-A493 PolarHBondContact O-N 3.1Å; A493-P495 VanDerWaalsContact C-N 3.29Å; A493-P495 HydrophobicContact CB-CG 4.1Å; A493-P495 VanDerWaalsContact O-N 3.13Å; A493-V496 HydrophobicContact CB-CG2 4.18Å; A493-V496 PolarHBondContact O-N 3.11Å; A493-L497 PolarHBondContact O-N 2.91Å
494	P	75.4	Confident	68.8	Low	91 Å²	91	85.2 Å²	85.2	59%	0.591	47%	0.474	S	S	*	.	H	α-helix	trans	-46.1	-39.7	176.1	-26.7	32.4	0	0	0	115.8	R498	P494-R498 WeakPolarHBondContact O-CG 3.37Å; P494-R498 PolarHBondContact O-N 2.88Å; P494-R498 VanDerWaalsContact O-N 3.16Å
495	P	80	Confident	70.7	Confident	91 Å²	91	85.7 Å²	85.7	59%	0.591	47%	0.467	S	S	*	.	H	α-helix	trans	-65.5	-34.2	175.1	22.9	-33.8	0	0	0	113.8	A493 R498 A499	A493-P495 VanDerWaalsContact C-N 3.29Å; A493-P495 HydrophobicContact CB-CG 4.1Å; A493-P495 VanDerWaalsContact O-N 3.13Å; P495-R498 PolarHBondContact O-N 3.1Å; P495-A499 WeakPolarHBondContact O-CB 2.78Å; P495-A499 PolarHBondContact O-N 3.01Å
496	V	77.1	Confident	72.8	Confident	55 Å²	55	87.1 Å²	87.1	33%	0.333	46%	0.459	S	S	.	.	H	α-helix	trans	-72.6	-41.3	-179.2	178.1	0	0	0	0	111	I490 A493 R498 A499 F500	I490-V496 WeakPolarHBondContact O-CG2 3.33Å; A493-V496 HydrophobicContact CB-CG2 4.18Å; A493-V496 PolarHBondContact O-N 3.11Å; V496-R498 PolarHBondContact O-N 3.17Å; V496-A499 WeakPolarHBondContact O-CB 3.39Å; V496-A499 PolarHBondContact O-N 2.92Å; V496-F500 PolarHBondContact O-N 2.73Å
497	L	77.3	Confident	74.5	Confident	42 Å²	42	85.9 Å²	85.9	22%	0.22	45%	0.453	C	S	.	.	H	α-helix	trans	-62	-41.8	172.7	-85.4	154.4	0	0	0	112.6	T457 A493 F500 Q501	T457-L497 HydrophobicContact CG2-CD2 4.33Å; A493-L497 PolarHBondContact O-N 2.91Å; L497-F500 PolarHBondContact O-N 3.05Å; L497-Q501 WeakPolarHBondContact O-CG 3.26Å; L497-Q501 PolarHBondContact O-N 2.73Å
498	R	78	Confident	76.2	Confident	177 Å²	177	86 Å²	86	67%	0.668	45%	0.445	S	S	*	.	H	α-helix	trans	-65.2	-40.6	173.7	-73.4	-178.9	-172.5	175.4	3.4	111.9	P494 P495 V496 Q501 N502	P494-R498 WeakPolarHBondContact O-CG 3.37Å; P494-R498 PolarHBondContact O-N 2.88Å; P494-R498 VanDerWaalsContact O-N 3.16Å; P495-R498 PolarHBondContact O-N 3.1Å; V496-R498 PolarHBondContact O-N 3.17Å; R498-Q501 PolarHBondContact O-N 3.38Å; R498-N502 WeakPolarHBondContact O-CB 3.4Å; R498-N502 VanDerWaalsContact O-CG 3.23Å; R498-N502 PolarHBondContact O-N 2.81Å; R498-N502 PolarHBondContact O-ND2 2.82Å
499	A	84.9	Confident	77.9	Confident	49 Å²	49	85.9 Å²	85.9	41%	0.405	44%	0.444	S	S	.	.	H	α-helix	trans	-61.5	-43.3	175.4	0	0	0	0	0	111.5	P495 V496 N502 V503	P495-A499 WeakPolarHBondContact O-CB 2.78Å; P495-A499 PolarHBondContact O-N 3.01Å; V496-A499 WeakPolarHBondContact O-CB 3.39Å; V496-A499 PolarHBondContact O-N 2.92Å; A499-N502 PolarHBondContact O-N 2.75Å; A499-V503 VanDerWaalsContact O-CG2 3.32Å; A499-V503 WeakPolarHBondContact O-CG2 3.45Å; A499-V503 PolarHBondContact O-N 2.83Å
500	F	79.8	Confident	79.7	Confident	77 Å²	77	82.9 Å²	82.9	34%	0.338	43%	0.433	S	S	.	.	H	α-helix	trans	-61.9	-45	175.4	-173.6	-94.5	0	0	0	112.3	T457 V496 L497 N502 V503 C504	T457-F500 HydrophobicContact CG2-CD1 3.99Å; T457-F500 HydrophobicContact CG2-CE1 4.07Å; V496-F500 PolarHBondContact O-N 2.73Å; L497-F500 PolarHBondContact O-N 3.05Å; F500-N502 VanDerWaalsContact C-N 3.34Å; F500-N502 PolarHBondContact O-N 2.82Å; F500-V503 PolarHBondContact O-N 2.91Å; F500-C504 VanDerWaalsContact CE1-SG 3.58Å; F500-C504 WeakPolarHBondContact O-CB 3.29Å; F500-C504 PolarHBondContact O-N 2.77Å
501	Q	81.9	Confident	81.3	Confident	106 Å²	106	84.4 Å²	84.4	50%	0.495	44%	0.437	S	S	.	.	H	α-helix	trans	-60.4	-41.9	174.5	-73.9	178.9	-11.4	0	0	112.3	L497 R498 C504 F505	L497-Q501 WeakPolarHBondContact O-CG 3.26Å; L497-Q501 PolarHBondContact O-N 2.73Å; R498-Q501 PolarHBondContact O-N 3.38Å; Q501-C504 PolarHBondContact O-N 2.94Å; Q501-F505 WeakPolarHBondContact O-CB 3.36Å; Q501-F505 PolarHBondContact O-N 2.99Å
502	N	85.9	Confident	82.8	Confident	100 Å²	100	85.3 Å²	85.3	54%	0.535	44%	0.441	S	S	.	.	H	α-helix	trans	-64.4	-44	176.2	-72.2	-13.8	0	0	0	111.7	R498 A499 F500 F505 I506	R498-N502 WeakPolarHBondContact O-CB 3.4Å; R498-N502 VanDerWaalsContact O-CG 3.23Å; R498-N502 PolarHBondContact O-N 2.81Å; R498-N502 PolarHBondContact O-ND2 2.82Å; A499-N502 PolarHBondContact O-N 2.75Å; F500-N502 VanDerWaalsContact C-N 3.34Å; F500-N502 PolarHBondContact O-N 2.82Å; N502-F505 PolarHBondContact O-N 2.83Å; N502-I506 VanDerWaalsContact O-CG1 3.23Å; N502-I506 WeakPolarHBondContact O-CG1 3.37Å; N502-I506 PolarHBondContact O-N 3.11Å
503	V	87.7	Confident	84.2	Confident	94 Å²	94	87.5 Å²	87.5	57%	0.57	45%	0.45	S	S	*	.	H	α-helix	trans	-62.9	-44.1	176.2	171.9	0	0	0	0	110.9	A499 F500 F505 I506 A507	A499-V503 VanDerWaalsContact O-CG2 3.32Å; A499-V503 WeakPolarHBondContact O-CG2 3.45Å; A499-V503 PolarHBondContact O-N 2.83Å; F500-V503 PolarHBondContact O-N 2.91Å; V503-F505 VanDerWaalsContact C-N 3.32Å; V503-F505 PolarHBondContact O-N 2.88Å; V503-I506 PolarHBondContact O-N 2.76Å; V503-A507 WeakPolarHBondContact O-CB 3.22Å; V503-A507 PolarHBondContact O-N 3.46Å
504	C	86.2	Confident	85.3	Confident	4 Å²	4	90.9 Å²	90.9	3%	0.027	47%	0.465	C	S	.	.	H	α-helix	trans	-61.6	-38.3	174	-80.3	0	0	0	0	112.4	C453 F500 Q501 R508	C453-C504 HydrophobicContact CB-CB 3.82Å; C453-C504 WeakPolarHBondContact CB-SG 3.3Å; C453-C504 WeakPolarHBondContact SG-CB 3.44Å; C453-C504 CovalentContact SG-SG 2.05Å; C453-C504 PolarHBondContact SG-SG 3.39Å; F500-C504 VanDerWaalsContact CE1-SG 3.58Å; F500-C504 WeakPolarHBondContact O-CB 3.29Å; F500-C504 PolarHBondContact O-N 2.77Å; Q501-C504 PolarHBondContact O-N 2.94Å; C504-R508 WeakPolarHBondContact O-CG 3.41Å; C504-R508 PolarHBondContact O-N 2.86Å; C504-R508 VanDerWaalsContact O-N 3.09Å
505	F	87.8	Confident	85.9	Confident	129 Å²	129	93.4 Å²	93.4	57%	0.566	47%	0.466	S	S	*	.	H	α-helix	trans	-66	-46.3	175.1	178.3	-97.5	0	0	0	111.8	Q501 N502 V503 A507 R508 L509	Q501-F505 WeakPolarHBondContact O-CB 3.36Å; Q501-F505 PolarHBondContact O-N 2.99Å; N502-F505 PolarHBondContact O-N 2.83Å; V503-F505 VanDerWaalsContact C-N 3.32Å; V503-F505 PolarHBondContact O-N 2.88Å; F505-A507 PolarHBondContact O-N 2.8Å; F505-R508 PolarHBondContact O-N 3.26Å; F505-L509 WeakPolarHBondContact O-CB 3.03Å; F505-L509 PolarHBondContact O-N 3.18Å
506	I	91	Very high	86.3	Confident	92 Å²	92	91.5 Å²	91.5	47%	0.472	45%	0.451	S	S	.	.	H	α-helix	trans	-60.2	-45.6	176	-67.3	165.7	0	0	0	110.3	N502 V503 R508 L509 L510	N502-I506 VanDerWaalsContact O-CG1 3.23Å; N502-I506 WeakPolarHBondContact O-CG1 3.37Å; N502-I506 PolarHBondContact O-N 3.11Å; V503-I506 PolarHBondContact O-N 2.76Å; I506-R508 VanDerWaalsContact C-N 3.32Å; I506-R508 PolarHBondContact O-N 3.31Å; I506-L509 PolarHBondContact O-N 2.79Å; I506-L509 VanDerWaalsContact O-N 3.16Å; I506-L510 HydrophobicContact CG2-CD1 3.84Å; I506-L510 HydrophobicContact CG2-CG 4.23Å; I506-L510 WeakPolarHBondContact O-CB 3.39Å; I506-L510 WeakPolarHBondContact O-CG 3.23Å; I506-L510 PolarHBondContact O-N 3.15Å
507	A	89.3	Confident	86.8	Confident	49 Å²	49	91.7 Å²	91.7	41%	0.405	45%	0.45	S	S	.	.	H	α-helix	trans	-59.4	-40.9	177.6	0	0	0	0	0	112.1	V503 F505 Q511	V503-A507 WeakPolarHBondContact O-CB 3.22Å; V503-A507 PolarHBondContact O-N 3.46Å; F505-A507 PolarHBondContact O-N 2.8Å; A507-Q511 VanDerWaalsContact O-CB 3.29Å; A507-Q511 WeakPolarHBondContact O-CB 3.44Å; A507-Q511 PolarHBondContact O-N 3.47Å
508	R	88.3	Confident	87.3	Confident	81 Å²	81	93.6 Å²	93.6	31%	0.306	46%	0.457	S	S	.	.	H	α-helix	trans	-70.4	-36.5	174.7	-71.7	-170.7	-156.4	119.4	5.6	113.3	Y454 C504 F505 I506 K512	Y454-R508 PolarHBondContact OH-NH1 3.01Å; C504-R508 WeakPolarHBondContact O-CG 3.41Å; C504-R508 PolarHBondContact O-N 2.86Å; C504-R508 VanDerWaalsContact O-N 3.09Å; F505-R508 PolarHBondContact O-N 3.26Å; I506-R508 VanDerWaalsContact C-N 3.32Å; I506-R508 PolarHBondContact O-N 3.31Å; R508-K512 VanDerWaalsContact O-CB 3.24Å; R508-K512 WeakPolarHBondContact O-CB 3.47Å; R508-K512 PolarHBondContact O-N 3.45Å
509	L	90.6	Very high	87.7	Confident	100 Å²	100	87.2 Å²	87.2	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-65.3	-44.2	175.9	-175.7	67.8	0	0	0	110.5	F505 I506 K512 K513	F505-L509 WeakPolarHBondContact O-CB 3.03Å; F505-L509 PolarHBondContact O-N 3.18Å; I506-L509 PolarHBondContact O-N 2.79Å; I506-L509 VanDerWaalsContact O-N 3.16Å; L509-K512 PolarHBondContact O-N 3.27Å; L509-K513 WeakPolarHBondContact O-CB 3.42Å; L509-K513 PolarHBondContact O-N 3.25Å
510	L	91.3	Very high	87.8	Confident	93 Å²	93	86.7 Å²	86.7	49%	0.487	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-50.6	173.4	-71.5	172.4	0	0	0	110.7	I506 K512 K513 D514	I506-L510 HydrophobicContact CG2-CD1 3.84Å; I506-L510 HydrophobicContact CG2-CG 4.23Å; I506-L510 WeakPolarHBondContact O-CB 3.39Å; I506-L510 WeakPolarHBondContact O-CG 3.23Å; I506-L510 PolarHBondContact O-N 3.15Å; L510-K512 VanDerWaalsContact C-N 3.31Å; L510-K512 PolarHBondContact O-N 3.21Å; L510-K513 CarbonylContact O-C 3.57Å; L510-K513 WeakPolarHBondContact O-CA 3.24Å; L510-K513 WeakPolarHBondContact O-CB 3.42Å; L510-K513 PolarHBondContact O-N 2.8Å; L510-K513 VanDerWaalsContact O-N 3.09Å; L510-D514 PolarHBondContact O-N 2.92Å
511	Q	89.7	Confident	88.1	Confident	137 Å²	137	89.3 Å²	89.3	64%	0.64	44%	0.439	S	S	*	.	H	α-helix	trans	-61.2	-38	178.6	-170.9	-178.8	25.5	0	0	112.9	A507 K515	A507-Q511 VanDerWaalsContact O-CB 3.29Å; A507-Q511 WeakPolarHBondContact O-CB 3.44Å; A507-Q511 PolarHBondContact O-N 3.47Å; Q511-K515 WeakPolarHBondContact O-CB 3.45Å; Q511-K515 PolarHBondContact O-N 3.04Å; Q511-K515 VanDerWaalsContact O-N 3.1Å
512	K	88.7	Confident	88.4	Confident	134 Å²	134	85.4 Å²	85.4	58%	0.583	42%	0.422	S	S	*	.	H	α-helix	trans	-67.4	-44.3	174.4	-177.3	-178.9	175.5	-173.2	0	110.7	R508 L509 L510 K515 D516	R508-K512 VanDerWaalsContact O-CB 3.24Å; R508-K512 WeakPolarHBondContact O-CB 3.47Å; R508-K512 PolarHBondContact O-N 3.45Å; L509-K512 PolarHBondContact O-N 3.27Å; L510-K512 VanDerWaalsContact C-N 3.31Å; L510-K512 PolarHBondContact O-N 3.21Å; K512-K515 PolarHBondContact O-N 3.06Å; K512-D516 WeakPolarHBondContact O-CB 3.48Å; K512-D516 VanDerWaalsContact O-CG 3.3Å; K512-D516 PolarHBondContact O-N 3.45Å
513	K	90	Very high	88.6	Confident	107 Å²	107	80.7 Å²	80.7	47%	0.465	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-47.7	176.5	179.8	174.9	165.5	41.1	0	111.1	L509 L510 K515 D516 D517	L509-K513 WeakPolarHBondContact O-CB 3.42Å; L509-K513 PolarHBondContact O-N 3.25Å; L510-K513 CarbonylContact O-C 3.57Å; L510-K513 WeakPolarHBondContact O-CA 3.24Å; L510-K513 WeakPolarHBondContact O-CB 3.42Å; L510-K513 PolarHBondContact O-N 2.8Å; L510-K513 VanDerWaalsContact O-N 3.09Å; K513-K515 VanDerWaalsContact C-N 3.27Å; K513-K515 PolarHBondContact O-N 3.04Å; K513-D516 PolarHBondContact O-N 2.89Å; K513-D516 VanDerWaalsContact O-N 3.15Å; K513-D517 WeakPolarHBondContact CE-OD2 3.31Å; K513-D517 WeakPolarHBondContact CG-OD2 3.26Å; K513-D517 IonicContact NZ-OD1 3.02Å; K513-D517 PolarHBondContact NZ-OD1 2.85Å; K513-D517 IonicContact NZ-OD2 3.22Å; K513-D517 PolarHBondContact NZ-OD2 2.89Å; K513-D517 VanDerWaalsContact O-CB 3.3Å; K513-D517 WeakPolarHBondContact O-CB 3.44Å; K513-D517 PolarHBondContact O-N 2.93Å
514	D	90.2	Very high	88.7	Confident	101 Å²	101	80.7 Å²	80.7	54%	0.54	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-38.8	177.1	-65.4	-16.6	0	0	0	111.5	L510 K518	L510-D514 PolarHBondContact O-N 2.92Å; D514-K518 VanDerWaalsContact O-CB 3.3Å; D514-K518 WeakPolarHBondContact O-CB 3.41Å; D514-K518 PolarHBondContact O-N 3.27Å
515	K	88.1	Confident	88.8	Confident	143 Å²	143	81.9 Å²	81.9	62%	0.622	39%	0.393	S	S	*	.	H	α-helix	trans	-68.2	-40.8	175.9	-175.8	178	178.8	179.1	0	112.6	Q511 K512 K513 I519	Q511-K515 WeakPolarHBondContact O-CB 3.45Å; Q511-K515 PolarHBondContact O-N 3.04Å; Q511-K515 VanDerWaalsContact O-N 3.1Å; K512-K515 PolarHBondContact O-N 3.06Å; K513-K515 VanDerWaalsContact C-N 3.27Å; K513-K515 PolarHBondContact O-N 3.04Å; K515-I519 WeakPolarHBondContact O-CG1 3.37Å; K515-I519 PolarHBondContact O-N 2.83Å
516	D	88.7	Confident	88.8	Confident	52 Å²	52	75.8 Å²	75.8	28%	0.278	37%	0.366	S	S	.	.	H	α-helix	trans	-69.1	-43.6	177.7	-71.3	-18.7	0	0	0	110.1	P392 K512 K513 K518 I519 D520	P392-D516 HydrophobicContact CG-CB 3.91Å; K512-D516 WeakPolarHBondContact O-CB 3.48Å; K512-D516 VanDerWaalsContact O-CG 3.3Å; K512-D516 PolarHBondContact O-N 3.45Å; K513-D516 PolarHBondContact O-N 2.89Å; K513-D516 VanDerWaalsContact O-N 3.15Å; D516-K518 VanDerWaalsContact C-N 3.34Å; D516-K518 PolarHBondContact O-N 2.95Å; D516-I519 PolarHBondContact O-N 3.14Å; D516-I519 VanDerWaalsContact O-N 3.09Å; D516-D520 PolarHBondContact O-N 2.64Å
517	D	87.6	Confident	88.7	Confident	58 Å²	58	71.4 Å²	71.4	31%	0.31	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-40.3	175.5	-69.1	-11.7	0	0	0	110.8	K513 I519 D520 E521	K513-D517 WeakPolarHBondContact CE-OD2 3.31Å; K513-D517 WeakPolarHBondContact CG-OD2 3.26Å; K513-D517 IonicContact NZ-OD1 3.02Å; K513-D517 PolarHBondContact NZ-OD1 2.85Å; K513-D517 IonicContact NZ-OD2 3.22Å; K513-D517 PolarHBondContact NZ-OD2 2.89Å; K513-D517 VanDerWaalsContact O-CB 3.3Å; K513-D517 WeakPolarHBondContact O-CB 3.44Å; K513-D517 PolarHBondContact O-N 2.93Å; D517-I519 VanDerWaalsContact C-N 3.34Å; D517-I519 PolarHBondContact O-N 2.92Å; D517-D520 WeakPolarHBondContact O-CB 3.07Å; D517-D520 PolarHBondContact O-N 2.92Å; D517-E521 WeakPolarHBondContact O-CG 3.23Å; D517-E521 PolarHBondContact O-N 3.05Å
518	K	87.4	Confident	88.7	Confident	83 Å²	83	73.4 Å²	73.4	36%	0.361	35%	0.346	S	S	.	.	H	α-helix	trans	-64	-34.6	173.7	-173.2	170.4	-175.3	167.7	0	113.3	D421 D514 D516 D522	D421-K518 VanDerWaalsContact CG-NZ 3.29Å; D421-K518 IonicContact OD1-NZ 3.18Å; D421-K518 PolarHBondContact OD1-NZ 2.92Å; D421-K518 IonicContact OD2-NZ 3.21Å; D421-K518 PolarHBondContact OD2-NZ 2.77Å; D514-K518 VanDerWaalsContact O-CB 3.3Å; D514-K518 WeakPolarHBondContact O-CB 3.41Å; D514-K518 PolarHBondContact O-N 3.27Å; D516-K518 VanDerWaalsContact C-N 3.34Å; D516-K518 PolarHBondContact O-N 2.95Å; K518-D522 PolarHBondContact O-N 3.34Å
519	I	86.9	Confident	88.7	Confident	42 Å²	42	69.6 Å²	69.6	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-72.2	-38	175.7	-67.7	165.7	0	0	0	110.5	P392 K515 D516 D517 D522 W523	P392-I519 HydrophobicContact CB-CB 4.41Å; P392-I519 HydrophobicContact CB-CD1 4.36Å; P392-I519 HydrophobicContact CB-CG2 4.04Å; K515-I519 WeakPolarHBondContact O-CG1 3.37Å; K515-I519 PolarHBondContact O-N 2.83Å; D516-I519 PolarHBondContact O-N 3.14Å; D516-I519 VanDerWaalsContact O-N 3.09Å; D517-I519 VanDerWaalsContact C-N 3.34Å; D517-I519 PolarHBondContact O-N 2.92Å; I519-D522 PolarHBondContact O-N 2.99Å; I519-W523 PolarHBondContact O-N 3.38Å
520	D	86.7	Confident	88.7	Confident	39 Å²	39	66 Å²	66	21%	0.209	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-44	173.4	-81.7	-3.4	0	0	0	111.1	N391 P392 D516 D517 D522 W523 K524	N391-D520 WeakPolarHBondContact CA-OD1 3.39Å; P392-D520 WeakPolarHBondContact CD-OD1 3.37Å; D516-D520 PolarHBondContact O-N 2.64Å; D517-D520 WeakPolarHBondContact O-CB 3.07Å; D517-D520 PolarHBondContact O-N 2.92Å; D520-D522 PolarHBondContact O-N 3.33Å; D520-W523 PolarHBondContact O-N 3.03Å; D520-K524 WeakPolarHBondContact O-CG 3.38Å; D520-K524 PolarHBondContact O-N 3.05Å
521	E	86.8	Confident	88.7	Confident	132 Å²	132	62 Å²	62	62%	0.617	29%	0.291	S	S	*	.	H	α-helix	trans	-60.5	-42.2	173.9	-73.9	-176.8	173.2	0	0	112.6	D517 W523 K524 Y525	D517-E521 WeakPolarHBondContact O-CG 3.23Å; D517-E521 PolarHBondContact O-N 3.05Å; E521-W523 PolarHBondContact O-N 3.3Å; E521-K524 PolarHBondContact O-N 2.65Å; E521-Y525 WeakPolarHBondContact O-CB 3.47Å; E521-Y525 PolarHBondContact O-N 3.48Å
522	D	88.7	Confident	88.6	Confident	23 Å²	23	60.6 Å²	60.6	12%	0.123	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-42.6	174.4	-91.3	-15.3	0	0	0	111.2	M397 R417 K518 I519 D520 Y525 V526	M397-D522 HydrophobicContact SD-CB 4.38Å; R417-D522 IonicContact NH2-OD1 2.59Å; R417-D522 PolarHBondContact NH2-OD1 2.83Å; K518-D522 PolarHBondContact O-N 3.34Å; I519-D522 PolarHBondContact O-N 2.99Å; D520-D522 PolarHBondContact O-N 3.33Å; D522-Y525 PolarHBondContact O-N 3.35Å; D522-V526 VanDerWaalsContact O-CG2 3.29Å; D522-V526 WeakPolarHBondContact O-CG2 3.48Å; D522-V526 PolarHBondContact O-N 3.45Å
523	W	89	Confident	88.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-43	176.5	-84.2	117	0	0	0	112.8	L387 R390 H395 M397 I519 D520 E521 Y525 V526 A527	L387-W523 HydrophobicContact CD2-CE3 4.39Å; L387-W523 HydrophobicContact CD2-CZ3 3.83Å; R390-W523 HydrophobicContact CB-CD2 3.85Å; R390-W523 HydrophobicContact CB-CE3 4.21Å; R390-W523 HydrophobicContact CB-CG 4.05Å; H395-W523 HydrophobicContact CB-CZ2 4.22Å; M397-W523 HydrophobicContact CB-CZ2 3.87Å; M397-W523 HydrophobicContact CG-CH2 4.39Å; M397-W523 HydrophobicContact CG-CZ2 4.07Å; I519-W523 PolarHBondContact O-N 3.38Å; D520-W523 PolarHBondContact O-N 3.03Å; E521-W523 PolarHBondContact O-N 3.3Å; W523-Y525 VanDerWaalsContact C-N 3.31Å; W523-Y525 PolarHBondContact O-N 2.89Å; W523-V526 WeakPolarHBondContact O-CB 3.46Å; W523-V526 PolarHBondContact O-N 3.27Å; W523-A527 PolarHBondContact O-N 3.1Å
524	K	89.1	Confident	88.8	Confident	93 Å²	93	53.4 Å²	53.4	40%	0.404	25%	0.25	S	S	.	.	H	α-helix	trans	-60.6	-42	174.5	-70.2	178.3	-178	-178.2	0	111.4	D520 E521 A527 M528	D520-K524 WeakPolarHBondContact O-CG 3.38Å; D520-K524 PolarHBondContact O-N 3.05Å; E521-K524 PolarHBondContact O-N 2.65Å; K524-A527 PolarHBondContact O-N 3.39Å; K524-M528 PolarHBondContact O-N 3.24Å
525	Y	88.6	Confident	88.8	Confident	29 Å²	29	50.1 Å²	50.1	11%	0.114	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-41.3	175.1	-172.7	-91.6	0	0	0	111.7	L406 P410 R417 E521 D522 W523 A527 M528 V529	L406-Y525 HydrophobicContact CD2-CD1 3.49Å; L406-Y525 VanDerWaalsContact CD2-CD1 3.49Å; L406-Y525 HydrophobicContact CD2-CE1 4.05Å; L406-Y525 HydrophobicContact CD2-CG 4.47Å; P410-Y525 HydrophobicContact CG-CE1 4.02Å; R417-Y525 HydrophobicContact CG-CE2 4.46Å; E521-Y525 WeakPolarHBondContact O-CB 3.47Å; E521-Y525 PolarHBondContact O-N 3.48Å; D522-Y525 PolarHBondContact O-N 3.35Å; W523-Y525 VanDerWaalsContact C-N 3.31Å; W523-Y525 PolarHBondContact O-N 2.89Å; Y525-A527 VanDerWaalsContact C-N 3.35Å; Y525-A527 PolarHBondContact O-N 2.73Å; Y525-M528 PolarHBondContact O-N 3.2Å; Y525-V529 HydrophobicContact CD1-CG2 3.86Å; Y525-V529 HydrophobicContact CE1-CG2 3.51Å; Y525-V529 VanDerWaalsContact O-CG2 3.31Å; Y525-V529 WeakPolarHBondContact O-CG2 3.35Å; Y525-V529 PolarHBondContact O-N 3.31Å
526	V	89.3	Confident	88.9	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-44	173.4	168.4	0	0	0	0	111.6	M397 V401 F405 L406 D522 W523 V529 F530	M397-V526 HydrophobicContact CE-CG2 3.62Å; V401-V526 HydrophobicContact CG1-CG1 4.07Å; V401-V526 HydrophobicContact CG1-CG2 4.26Å; F405-V526 HydrophobicContact CB-CB 4.31Å; F405-V526 HydrophobicContact CB-CG1 3.94Å; F405-V526 HydrophobicContact CB-CG2 3.77Å; F405-V526 HydrophobicContact CD1-CG1 4.15Å; F405-V526 HydrophobicContact CD2-CG1 4.17Å; F405-V526 HydrophobicContact CG-CG1 3.83Å; L406-V526 HydrophobicContact CD2-CG2 3.89Å; L406-V526 HydrophobicContact CG-CG2 4.3Å; D522-V526 VanDerWaalsContact O-CG2 3.29Å; D522-V526 WeakPolarHBondContact O-CG2 3.48Å; D522-V526 PolarHBondContact O-N 3.45Å; W523-V526 WeakPolarHBondContact O-CB 3.46Å; W523-V526 PolarHBondContact O-N 3.27Å; V526-V529 PolarHBondContact O-N 3.1Å; V526-F530 VanDerWaalsContact O-CB 3.29Å; V526-F530 WeakPolarHBondContact O-CB 3.46Å; V526-F530 PolarHBondContact O-N 3.42Å
527	A	89	Confident	89	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-42	176.1	0	0	0	0	0	111.9	L387 H388 W523 K524 Y525 F530 D531	L387-A527 HydrophobicContact CB-CB 4.11Å; H388-A527 HydrophobicContact CB-CB 3.93Å; W523-A527 PolarHBondContact O-N 3.1Å; K524-A527 PolarHBondContact O-N 3.39Å; Y525-A527 VanDerWaalsContact C-N 3.35Å; Y525-A527 PolarHBondContact O-N 2.73Å; A527-F530 WeakPolarHBondContact O-CB 3.46Å; A527-F530 PolarHBondContact O-N 3.31Å; A527-D531 PolarHBondContact O-N 3.03Å
528	M	87.5	Confident	89.3	Confident	91 Å²	91	50 Å²	50	45%	0.448	23%	0.226	S	C	.	.	H	α-helix	trans	-64	-40.8	176.1	-171.5	-174.3	-60.7	0	0	112.7	K524 Y525 R532	K524-M528 PolarHBondContact O-N 3.24Å; Y525-M528 PolarHBondContact O-N 3.2Å; M528-R532 WeakPolarHBondContact O-CG 3.44Å; M528-R532 PolarHBondContact O-N 2.8Å; M528-R532 VanDerWaalsContact O-N 3.12Å
529	V	89.3	Confident	89.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-41	175.5	173.7	0	0	0	0	110.7	F405 L409 P410 L413 M415 Y525 V526 R532 L533	F405-V529 HydrophobicContact CD1-CG1 4.16Å; L409-V529 HydrophobicContact CB-CG1 3.79Å; L409-V529 HydrophobicContact CD1-CG1 4.35Å; P410-V529 HydrophobicContact CG-CG1 4.44Å; P410-V529 HydrophobicContact CG-CG2 4.1Å; L413-V529 HydrophobicContact CD1-CG1 4.01Å; M415-V529 HydrophobicContact CE-CB 4.42Å; M415-V529 HydrophobicContact CE-CG1 4.42Å; M415-V529 HydrophobicContact CE-CG2 4.14Å; M415-V529 HydrophobicContact SD-CG2 4.01Å; Y525-V529 HydrophobicContact CD1-CG2 3.86Å; Y525-V529 HydrophobicContact CE1-CG2 3.51Å; Y525-V529 VanDerWaalsContact O-CG2 3.31Å; Y525-V529 WeakPolarHBondContact O-CG2 3.35Å; Y525-V529 PolarHBondContact O-N 3.31Å; V526-V529 PolarHBondContact O-N 3.1Å; V529-R532 PolarHBondContact O-N 2.79Å; V529-L533 WeakPolarHBondContact O-CB 3.48Å; V529-L533 PolarHBondContact O-N 3.13Å
530	F	89.9	Confident	89.6	Confident	25 Å²	25	50.5 Å²	50.5	11%	0.11	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-47.4	176.1	-174.9	-90.9	0	0	0	111.4	V380 V383 L387 F405 V526 A527 R532 L533 F534	V380-F530 HydrophobicContact CG1-CE1 3.67Å; V380-F530 HydrophobicContact CG1-CZ 4.27Å; V383-F530 HydrophobicContact CB-CE1 4.44Å; V383-F530 HydrophobicContact CB-CZ 4.39Å; V383-F530 HydrophobicContact CG1-CE1 4.11Å; V383-F530 HydrophobicContact CG1-CZ 3.75Å; L387-F530 HydrophobicContact CD1-CB 4.34Å; L387-F530 HydrophobicContact CD1-CD1 4.18Å; L387-F530 HydrophobicContact CD1-CD2 3.93Å; L387-F530 HydrophobicContact CD1-CE1 4.43Å; L387-F530 HydrophobicContact CD1-CE2 4.2Å; L387-F530 HydrophobicContact CD1-CG 3.92Å; L387-F530 HydrophobicContact CD1-CZ 4.45Å; F405-F530 HydrophobicContact CE1-CB 4.08Å; F405-F530 AromaticContact CE1-CD2 3.71Å; F405-F530 HydrophobicContact CE1-CD2 3.71Å; F405-F530 HydrophobicContact CE1-CG 4.4Å; F405-F530 AromaticContact CZ-CD2 3.83Å; F405-F530 HydrophobicContact CZ-CD2 3.83Å; V526-F530 VanDerWaalsContact O-CB 3.29Å; V526-F530 WeakPolarHBondContact O-CB 3.46Å; V526-F530 PolarHBondContact O-N 3.42Å; A527-F530 WeakPolarHBondContact O-CB 3.46Å; A527-F530 PolarHBondContact O-N 3.31Å; F530-R532 PolarHBondContact O-N 2.96Å; F530-L533 WeakPolarHBondContact O-CB 3.19Å; F530-L533 PolarHBondContact O-N 3.17Å; F530-F534 AromaticContact CD1-CD2 3.94Å; F530-F534 HydrophobicContact CD1-CD2 3.94Å; F530-F534 HydrophobicContact CD1-CE2 4.16Å; F530-F534 HydrophobicContact CD2-CD2 4.39Å; F530-F534 AromaticContact CD2-CE2 3.99Å; F530-F534 HydrophobicContact CD2-CE2 3.99Å; F530-F534 AromaticContact CE1-CD2 3.73Å; F530-F534 HydrophobicContact CE1-CD2 3.73Å; F530-F534 AromaticContact CE1-CE2 3.65Å; F530-F534 HydrophobicContact CE1-CE2 3.65Å; F530-F534 HydrophobicContact CE2-CD2 4.2Å; F530-F534 AromaticContact CE2-CE2 3.46Å; F530-F534 HydrophobicContact CE2-CE2 3.46Å; F530-F534 VanDerWaalsContact CE2-CE2 3.46Å; F530-F534 HydrophobicContact CE2-CZ 4.4Å; F530-F534 HydrophobicContact CG-CD2 4.27Å; F530-F534 HydrophobicContact CG-CE2 4.31Å; F530-F534 AromaticContact CZ-CD2 3.86Å; F530-F534 HydrophobicContact CZ-CD2 3.86Å; F530-F534 AromaticContact CZ-CE2 3.27Å; F530-F534 HydrophobicContact CZ-CE2 3.27Å; F530-F534 HydrophobicContact CZ-CZ 4.13Å; F530-F534 WeakPolarHBondContact O-CD2 3.26Å; F530-F534 PolarHBondContact O-N 2.69Å; F530-F534 VanDerWaalsContact O-N 3.15Å
531	D	90.9	Very high	89.9	Confident	9 Å²	9	50.1 Å²	50.1	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-47.4	175.6	-84.4	-27	0	0	0	112.4	K331 S384 A527 L533 F534 L535	K331-D531 IonicContact NZ-OD1 2.78Å; K331-D531 PolarHBondContact NZ-OD1 3.08Å; K331-D531 IonicContact NZ-OD2 3.37Å; K331-D531 PolarHBondContact NZ-OD2 3.1Å; S384-D531 WeakPolarHBondContact CB-OD1 3.3Å; S384-D531 PolarHBondContact OG-OD1 3.31Å; S384-D531 PolarHBondContact OG-OD2 3.24Å; S384-D531 VanDerWaalsContact OG-OD2 3.06Å; A527-D531 PolarHBondContact O-N 3.03Å; D531-L533 PolarHBondContact O-N 3.06Å; D531-F534 PolarHBondContact O-N 3.34Å; D531-L535 WeakPolarHBondContact O-CB 3.46Å; D531-L535 PolarHBondContact O-N 2.82Å
532	R	89.1	Confident	90	Very high	108 Å²	108	44.3 Å²	44.3	41%	0.408	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-33.8	-179.8	-74.1	173.2	-179.7	-152.8	12.2	113	M415 M528 V529 F530 L535 W536	M415-R532 HydrophobicContact CE-CB 3.59Å; M415-R532 HydrophobicContact CE-CG 4.02Å; M415-R532 WeakPolarHBondContact SD-CD 3.23Å; M415-R532 PolarHBondContact SD-NH1 3.14Å; M415-R532 VanDerWaalsContact SD-NH1 3.37Å; M528-R532 WeakPolarHBondContact O-CG 3.44Å; M528-R532 PolarHBondContact O-N 2.8Å; M528-R532 VanDerWaalsContact O-N 3.12Å; V529-R532 PolarHBondContact O-N 2.79Å; F530-R532 PolarHBondContact O-N 2.96Å; R532-L535 WeakPolarHBondContact O-CB 3.38Å; R532-L535 PolarHBondContact O-N 3.46Å; R532-W536 VanDerWaalsContact O-CD1 3.26Å; R532-W536 PolarHBondContact O-N 3.46Å
533	L	90.4	Very high	90.1	Very high	44 Å²	44	50.1 Å²	50.1	23%	0.23	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-50.3	172.7	177.1	63.4	0	0	0	110.6	L409 L413 V529 F530 D531 L535 W536 I537	L409-L533 HydrophobicContact CD1-CD2 4.13Å; L409-L533 HydrophobicContact CD2-CD1 4.14Å; L409-L533 HydrophobicContact CD2-CD2 4.24Å; L413-L533 HydrophobicContact CD1-CB 4.01Å; V529-L533 WeakPolarHBondContact O-CB 3.48Å; V529-L533 PolarHBondContact O-N 3.13Å; F530-L533 WeakPolarHBondContact O-CB 3.19Å; F530-L533 PolarHBondContact O-N 3.17Å; D531-L533 PolarHBondContact O-N 3.06Å; L533-L535 VanDerWaalsContact C-N 3.35Å; L533-W536 PolarHBondContact O-N 2.56Å; L533-I537 HydrophobicContact CD1-CD1 4.12Å; L533-I537 HydrophobicContact CG-CD1 3.98Å; L533-I537 WeakPolarHBondContact O-CG1 3.25Å; L533-I537 PolarHBondContact O-N 2.68Å; L533-I537 VanDerWaalsContact O-N 3.15Å
534	F	91.3	Very high	90.2	Very high	46 Å²	46	54.1 Å²	54.1	20%	0.202	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-32.9	179.4	-81.4	-75.2	0	0	0	112.5	F322 V380 F530 D531 W536 I537 F538	F322-F534 HydrophobicContact CD1-CB 4.22Å; F322-F534 HydrophobicContact CE1-CB 4.04Å; F322-F534 HydrophobicContact CZ-CB 4.32Å; V380-F534 HydrophobicContact CG1-CB 3.91Å; V380-F534 HydrophobicContact CG1-CD1 3.83Å; V380-F534 HydrophobicContact CG1-CD2 3.45Å; V380-F534 VanDerWaalsContact CG1-CD2 3.45Å; V380-F534 HydrophobicContact CG1-CE1 4.19Å; V380-F534 HydrophobicContact CG1-CE2 3.89Å; V380-F534 HydrophobicContact CG1-CG 3.43Å; V380-F534 VanDerWaalsContact CG1-CG 3.43Å; V380-F534 HydrophobicContact CG1-CZ 4.22Å; V380-F534 HydrophobicContact CG2-CD1 4.02Å; V380-F534 HydrophobicContact CG2-CE1 3.82Å; V380-F534 HydrophobicContact CG2-CG 4.46Å; V380-F534 HydrophobicContact CG2-CZ 4.14Å; F530-F534 AromaticContact CD1-CD2 3.94Å; F530-F534 HydrophobicContact CD1-CD2 3.94Å; F530-F534 HydrophobicContact CD1-CE2 4.16Å; F530-F534 HydrophobicContact CD2-CD2 4.39Å; F530-F534 AromaticContact CD2-CE2 3.99Å; F530-F534 HydrophobicContact CD2-CE2 3.99Å; F530-F534 AromaticContact CE1-CD2 3.73Å; F530-F534 HydrophobicContact CE1-CD2 3.73Å; F530-F534 AromaticContact CE1-CE2 3.65Å; F530-F534 HydrophobicContact CE1-CE2 3.65Å; F530-F534 HydrophobicContact CE2-CD2 4.2Å; F530-F534 AromaticContact CE2-CE2 3.46Å; F530-F534 HydrophobicContact CE2-CE2 3.46Å; F530-F534 VanDerWaalsContact CE2-CE2 3.46Å; F530-F534 HydrophobicContact CE2-CZ 4.4Å; F530-F534 HydrophobicContact CG-CD2 4.27Å; F530-F534 HydrophobicContact CG-CE2 4.31Å; F530-F534 AromaticContact CZ-CD2 3.86Å; F530-F534 HydrophobicContact CZ-CD2 3.86Å; F530-F534 AromaticContact CZ-CE2 3.27Å; F530-F534 HydrophobicContact CZ-CE2 3.27Å; F530-F534 HydrophobicContact CZ-CZ 4.13Å; F530-F534 WeakPolarHBondContact O-CD2 3.26Å; F530-F534 PolarHBondContact O-N 2.69Å; F530-F534 VanDerWaalsContact O-N 3.15Å; D531-F534 PolarHBondContact O-N 3.34Å; F534-W536 VanDerWaalsContact C-N 3.33Å; F534-W536 PolarHBondContact O-N 2.94Å; F534-I537 HydrophobicContact CD1-CD1 4.46Å; F534-I537 PolarHBondContact O-N 3.02Å; F534-F538 HydrophobicContact CB-CD2 3.97Å; F534-F538 HydrophobicContact CB-CE2 4.16Å; F534-F538 HydrophobicContact CD1-CD2 4.03Å; F534-F538 AromaticContact CD1-CE2 3.59Å; F534-F538 HydrophobicContact CD1-CE2 3.59Å; F534-F538 HydrophobicContact CE1-CE2 4.44Å; F534-F538 HydrophobicContact CG-CD2 4.49Å; F534-F538 HydrophobicContact CG-CE2 4.26Å; F534-F538 WeakPolarHBondContact O-CB 3.33Å; F534-F538 WeakPolarHBondContact O-CD2 3.43Å; F534-F538 PolarHBondContact O-N 2.9Å
535	L	91.4	Very high	90.2	Very high	32 Å²	32	50.3 Å²	50.3	17%	0.168	25%	0.245	C	C	.	.	H	α-helix	trans	-53.4	-50.2	171.2	-172.7	159.1	0	0	0	111.3	I319 F322 Y323 D531 R532 L533 S539	I319-L535 HydrophobicContact CG2-CG 4.33Å; F322-L535 HydrophobicContact CB-CB 3.83Å; F322-L535 HydrophobicContact CB-CD1 4.34Å; F322-L535 HydrophobicContact CB-CG 4.3Å; Y323-L535 HydrophobicContact CD2-CD1 4.19Å; D531-L535 WeakPolarHBondContact O-CB 3.46Å; D531-L535 PolarHBondContact O-N 2.82Å; R532-L535 WeakPolarHBondContact O-CB 3.38Å; R532-L535 PolarHBondContact O-N 3.46Å; L533-L535 VanDerWaalsContact C-N 3.35Å; L535-S539 WeakPolarHBondContact O-CB 3.44Å; L535-S539 PolarHBondContact O-N 2.81Å
536	W	89.8	Confident	90.1	Very high	151 Å²	151	49.4 Å²	49.4	57%	0.572	24%	0.242	S	C	*	.	H	α-helix	trans	-64.5	-44.4	178.2	-79.9	104.2	0	0	0	112.5	L413 R532 L533 F534 S539 I540	L413-W536 HydrophobicContact CD2-CG 4.35Å; R532-W536 VanDerWaalsContact O-CD1 3.26Å; R532-W536 PolarHBondContact O-N 3.46Å; L533-W536 PolarHBondContact O-N 2.56Å; F534-W536 VanDerWaalsContact C-N 3.33Å; F534-W536 PolarHBondContact O-N 2.94Å; W536-S539 PolarHBondContact O-N 2.92Å; W536-I540 WeakPolarHBondContact O-CB 3.5Å; W536-I540 VanDerWaalsContact O-CG1 3.27Å; W536-I540 WeakPolarHBondContact O-CG1 3.41Å; W536-I540 PolarHBondContact O-N 3.09Å
537	I	91.4	Very high	90	Very high	86 Å²	86	52 Å²	52	44%	0.441	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-51.2	179.3	-66.5	169.1	0	0	0	110.8	L533 F534 I540 A541	L533-I537 HydrophobicContact CD1-CD1 4.12Å; L533-I537 HydrophobicContact CG-CD1 3.98Å; L533-I537 WeakPolarHBondContact O-CG1 3.25Å; L533-I537 PolarHBondContact O-N 2.68Å; L533-I537 VanDerWaalsContact O-N 3.15Å; F534-I537 HydrophobicContact CD1-CD1 4.46Å; F534-I537 PolarHBondContact O-N 3.02Å; I537-I540 PolarHBondContact O-N 2.96Å; I537-A541 VanDerWaalsContact O-CB 3.22Å; I537-A541 WeakPolarHBondContact O-CB 3.49Å; I537-A541 PolarHBondContact O-N 3.13Å
538	F	92.3	Very high	90	Very high	13 Å²	13	57.3 Å²	57.3	6%	0.057	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-38.1	-179.9	-80.6	-76.3	0	0	0	111.7	F322 M373 L376 V380 F534 A541 C542	F322-F538 HydrophobicContact CD2-CD2 4.19Å; F322-F538 HydrophobicContact CE2-CB 4.15Å; F322-F538 AromaticContact CE2-CD2 3.3Å; F322-F538 HydrophobicContact CE2-CD2 3.3Å; F322-F538 AromaticContact CE2-CE2 3.8Å; F322-F538 HydrophobicContact CE2-CE2 3.8Å; F322-F538 AromaticContact CE2-CG 3.78Å; F322-F538 HydrophobicContact CE2-CG 3.78Å; F322-F538 AromaticContact CZ-CD2 3.52Å; F322-F538 HydrophobicContact CZ-CD2 3.52Å; F322-F538 AromaticContact CZ-CE2 3.52Å; F322-F538 HydrophobicContact CZ-CE2 3.52Å; F322-F538 HydrophobicContact CZ-CG 4.37Å; F322-F538 HydrophobicContact CZ-CZ 4.38Å; M373-F538 HydrophobicContact CE-CD1 3.39Å; M373-F538 HydrophobicContact CE-CE1 3.9Å; M373-F538 HydrophobicContact CE-CG 4.41Å; M373-F538 WeakPolarHBondContact O-CE1 3.3Å; M373-F538 HydrophobicContact SD-CD1 4.27Å; M373-F538 HydrophobicContact SD-CE1 4.17Å; L376-F538 HydrophobicContact CB-CE1 4.21Å; L376-F538 HydrophobicContact CB-CZ 4.02Å; V380-F538 HydrophobicContact CB-CE2 4.49Å; V380-F538 HydrophobicContact CG2-CE2 4.21Å; V380-F538 HydrophobicContact CG2-CZ 4.43Å; F534-F538 HydrophobicContact CB-CD2 3.97Å; F534-F538 HydrophobicContact CB-CE2 4.16Å; F534-F538 HydrophobicContact CD1-CD2 4.03Å; F534-F538 AromaticContact CD1-CE2 3.59Å; F534-F538 HydrophobicContact CD1-CE2 3.59Å; F534-F538 HydrophobicContact CE1-CE2 4.44Å; F534-F538 HydrophobicContact CG-CD2 4.49Å; F534-F538 HydrophobicContact CG-CE2 4.26Å; F534-F538 WeakPolarHBondContact O-CB 3.33Å; F534-F538 WeakPolarHBondContact O-CD2 3.43Å; F534-F538 PolarHBondContact O-N 2.9Å; F538-A541 PolarHBondContact O-N 3.1Å; F538-C542 WeakPolarHBondContact O-CB 3.35Å; F538-C542 PolarHBondContact O-N 3.07Å; F538-C542 PolarHBondContact O-SG 2.91Å
539	S	90.5	Very high	90	Very high	44 Å²	44	54.3 Å²	54.3	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-46	176.4	-174.6	0	0	0	0	112	L535 W536 F543	L535-S539 WeakPolarHBondContact O-CB 3.44Å; L535-S539 PolarHBondContact O-N 2.81Å; W536-S539 PolarHBondContact O-N 2.92Å; S539-F543 VanDerWaalsContact O-CB 3.29Å; S539-F543 WeakPolarHBondContact O-CB 3.25Å; S539-F543 PolarHBondContact O-N 3.5Å
540	I	91.7	Very high	89.7	Confident	91 Å²	91	56.9 Å²	56.9	47%	0.467	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-45.3	177.8	-67.7	167.8	0	0	0	110.1	W536 I537 F543 L544	W536-I540 WeakPolarHBondContact O-CB 3.5Å; W536-I540 VanDerWaalsContact O-CG1 3.27Å; W536-I540 WeakPolarHBondContact O-CG1 3.41Å; W536-I540 PolarHBondContact O-N 3.09Å; I537-I540 PolarHBondContact O-N 2.96Å; I540-F543 PolarHBondContact O-N 3.32Å; I540-L544 HydrophobicContact CG2-CD1 3.57Å; I540-L544 HydrophobicContact CG2-CG 4.16Å; I540-L544 WeakPolarHBondContact O-CB 3.3Å; I540-L544 WeakPolarHBondContact O-CG 2.91Å; I540-L544 PolarHBondContact O-N 3.4Å
541	A	91.7	Very high	89.4	Confident	32 Å²	32	59.8 Å²	59.8	26%	0.264	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-42.8	-179.7	0	0	0	0	0	112.4	F369 M373 I537 F538 G545	F369-A541 WeakPolarHBondContact CZ-O 3.46Å; M373-A541 HydrophobicContact CE-CB 3.41Å; M373-A541 VanDerWaalsContact CE-CB 3.41Å; M373-A541 HydrophobicContact SD-CB 4.44Å; I537-A541 VanDerWaalsContact O-CB 3.22Å; I537-A541 WeakPolarHBondContact O-CB 3.49Å; I537-A541 PolarHBondContact O-N 3.13Å; F538-A541 PolarHBondContact O-N 3.1Å; A541-G545 WeakPolarHBondContact O-CA 3.29Å; A541-G545 PolarHBondContact O-N 2.84Å
542	C	89.6	Confident	89.2	Confident	10 Å²	10	67.3 Å²	67.3	7%	0.068	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-44.1	175.7	-73.1	0	0	0	0	111.9	I319 F538 T546	I319-C542 HydrophobicContact CD1-CB 4.1Å; F538-C542 WeakPolarHBondContact O-CB 3.35Å; F538-C542 PolarHBondContact O-N 3.07Å; F538-C542 PolarHBondContact O-SG 2.91Å; C542-T546 WeakPolarHBondContact O-CB 3.35Å; C542-T546 PolarHBondContact O-N 3.46Å; C542-T546 PolarHBondContact O-OG1 2.98Å
543	F	89.8	Confident	88.7	Confident	144 Å²	144	62.2 Å²	62.2	63%	0.632	31%	0.309	S	S	*	.	H	α-helix	trans	-64.7	-54.8	178.8	-179	-100	0	0	0	111.6	S539 I540 T546 V547	S539-F543 VanDerWaalsContact O-CB 3.29Å; S539-F543 WeakPolarHBondContact O-CB 3.25Å; S539-F543 PolarHBondContact O-N 3.5Å; I540-F543 PolarHBondContact O-N 3.32Å; F543-T546 PolarHBondContact O-N 3.32Å; F543-V547 HydrophobicContact CE1-CG2 4.27Å; F543-V547 HydrophobicContact CE2-CG2 4.22Å; F543-V547 HydrophobicContact CZ-CG2 4.1Å; F543-V547 WeakPolarHBondContact O-CB 3.36Å; F543-V547 VanDerWaalsContact O-CG2 3.29Å; F543-V547 WeakPolarHBondContact O-CG2 3.39Å; F543-V547 PolarHBondContact O-N 3.34Å
544	L	91.5	Very high	88	Confident	87 Å²	87	63.2 Å²	63.2	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-45.1	179.9	-67.6	177.6	0	0	0	111.5	I540 T546 V547 I548	I540-L544 HydrophobicContact CG2-CD1 3.57Å; I540-L544 HydrophobicContact CG2-CG 4.16Å; I540-L544 WeakPolarHBondContact O-CB 3.3Å; I540-L544 WeakPolarHBondContact O-CG 2.91Å; I540-L544 PolarHBondContact O-N 3.4Å; L544-T546 VanDerWaalsContact C-N 3.29Å; L544-T546 PolarHBondContact O-N 3.09Å; L544-V547 PolarHBondContact O-N 2.91Å; L544-I548 HydrophobicContact CB-CD1 4.35Å; L544-I548 VanDerWaalsContact O-CB 3.28Å; L544-I548 WeakPolarHBondContact O-CB 3.12Å; L544-I548 WeakPolarHBondContact O-CD1 3.47Å; L544-I548 WeakPolarHBondContact O-CG1 3.31Å; L544-I548 PolarHBondContact O-N 3.48Å
545	G	89.6	Confident	87.1	Confident	13 Å²	13	62.1 Å²	62.1	13%	0.134	32%	0.316	C	S	.	.	H	α-helix	trans	-57.4	-44.5	178.3	0	0	0	0	0	111.6	A541 I549	A541-G545 WeakPolarHBondContact O-CA 3.29Å; A541-G545 PolarHBondContact O-N 2.84Å; G545-I549 WeakPolarHBondContact O-CB 3.35Å; G545-I549 WeakPolarHBondContact O-CD1 3.28Å; G545-I549 WeakPolarHBondContact O-CG1 3.34Å; G545-I549 PolarHBondContact O-N 3.12Å; G545-I549 VanDerWaalsContact O-N 3.12Å
546	T	86.8	Confident	86.2	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.055	33%	0.333	C	S	.	.	H	α-helix	trans	-72.4	-41.6	-179.4	-43.7	0	0	0	0	113	F312 Y366 C542 F543 L544 I549 L550	F312-T546 HydrophobicContact CD1-CG2 3.92Å; F312-T546 HydrophobicContact CE1-CG2 3.01Å; F312-T546 HydrophobicContact CE2-CG2 4.09Å; F312-T546 HydrophobicContact CZ-CG2 3.12Å; Y366-T546 HydrophobicContact CD2-CG2 4.24Å; Y366-T546 HydrophobicContact CE2-CG2 3.38Å; Y366-T546 WeakPolarHBondContact CE2-OG1 3.3Å; C542-T546 WeakPolarHBondContact O-CB 3.35Å; C542-T546 PolarHBondContact O-N 3.46Å; C542-T546 PolarHBondContact O-OG1 2.98Å; F543-T546 PolarHBondContact O-N 3.32Å; L544-T546 VanDerWaalsContact C-N 3.29Å; L544-T546 PolarHBondContact O-N 3.09Å; T546-I549 PolarHBondContact O-N 3.48Å; T546-L550 HydrophobicContact CG2-CD1 3.99Å; T546-L550 HydrophobicContact CG2-CG 4.28Å; T546-L550 WeakPolarHBondContact O-CB 3.35Å; T546-L550 WeakPolarHBondContact O-CG 3.27Å; T546-L550 PolarHBondContact O-N 3.45Å
547	V	87.2	Confident	85.5	Confident	55 Å²	55	65.1 Å²	65.1	33%	0.333	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-45.8	176.9	171.7	0	0	0	0	110.8	F543 L544 I549 L550 L551	F543-V547 HydrophobicContact CE1-CG2 4.27Å; F543-V547 HydrophobicContact CE2-CG2 4.22Å; F543-V547 HydrophobicContact CZ-CG2 4.1Å; F543-V547 WeakPolarHBondContact O-CB 3.36Å; F543-V547 VanDerWaalsContact O-CG2 3.29Å; F543-V547 WeakPolarHBondContact O-CG2 3.39Å; F543-V547 PolarHBondContact O-N 3.34Å; L544-V547 PolarHBondContact O-N 2.91Å; V547-I549 VanDerWaalsContact C-N 3.33Å; V547-I549 PolarHBondContact O-N 3.43Å; V547-L550 PolarHBondContact O-N 2.97Å; V547-L551 HydrophobicContact CG1-CD1 3.53Å; V547-L551 HydrophobicContact CG1-CG 4.05Å; V547-L551 VanDerWaalsContact O-CB 3.3Å; V547-L551 WeakPolarHBondContact O-CB 3.33Å; V547-L551 VanDerWaalsContact O-CG 3.24Å; V547-L551 WeakPolarHBondContact O-CG 3.47Å; V547-L551 PolarHBondContact O-N 3.07Å
548	I	88.6	Confident	84.7	Confident	113 Å²	113	62.4 Å²	62.4	58%	0.579	32%	0.319	S	S	*	.	H	α-helix	trans	-61.2	-42.9	179.5	-70.8	165.6	0	0	0	111.2	L544 R552	L544-I548 HydrophobicContact CB-CD1 4.35Å; L544-I548 VanDerWaalsContact O-CB 3.28Å; L544-I548 WeakPolarHBondContact O-CB 3.12Å; L544-I548 WeakPolarHBondContact O-CD1 3.47Å; L544-I548 WeakPolarHBondContact O-CG1 3.31Å; L544-I548 PolarHBondContact O-N 3.48Å; I548-R552 PolarHBondContact O-N 3.22Å
549	I	86.8	Confident	83.7	Confident	29 Å²	29	68.9 Å²	68.9	15%	0.149	35%	0.354	C	S	.	.	H	α-helix	trans	-68.9	-43.8	-178.5	-68.1	167.4	0	0	0	110.6	L362 Y366 F369 G545 T546 V547 R552	L362-I549 HydrophobicContact CD1-CG2 3.84Å; L362-I549 HydrophobicContact CG-CG2 4.04Å; Y366-I549 HydrophobicContact CD2-CD1 3.99Å; Y366-I549 HydrophobicContact CD2-CG2 4.44Å; F369-I549 HydrophobicContact CB-CD1 4.14Å; F369-I549 HydrophobicContact CD1-CD1 4.23Å; F369-I549 HydrophobicContact CG-CD1 4.21Å; G545-I549 WeakPolarHBondContact O-CB 3.35Å; G545-I549 WeakPolarHBondContact O-CD1 3.28Å; G545-I549 WeakPolarHBondContact O-CG1 3.34Å; G545-I549 PolarHBondContact O-N 3.12Å; G545-I549 VanDerWaalsContact O-N 3.12Å; T546-I549 PolarHBondContact O-N 3.48Å; V547-I549 VanDerWaalsContact C-N 3.33Å; V547-I549 PolarHBondContact O-N 3.43Å; I549-R552 PolarHBondContact O-N 3.48Å
550	L	82.5	Confident	83.3	Confident	53 Å²	53	72.1 Å²	72.1	28%	0.277	36%	0.36	S	S	.	.	H	α-helix	trans	-68.6	-41.5	179	-70.5	177.7	0	0	0	112.9	I308 F312 T546 V547 R552 A553	I308-L550 HydrophobicContact CD1-CD2 4.45Å; F312-L550 HydrophobicContact CE2-CD1 3.87Å; F312-L550 HydrophobicContact CZ-CD1 3.51Å; T546-L550 HydrophobicContact CG2-CD1 3.99Å; T546-L550 HydrophobicContact CG2-CG 4.28Å; T546-L550 WeakPolarHBondContact O-CB 3.35Å; T546-L550 WeakPolarHBondContact O-CG 3.27Å; T546-L550 PolarHBondContact O-N 3.45Å; V547-L550 PolarHBondContact O-N 2.97Å; L550-R552 PolarHBondContact O-N 2.97Å; L550-A553 WeakPolarHBondContact O-CB 3.15Å; L550-A553 PolarHBondContact O-N 2.91Å; L550-A553 VanDerWaalsContact O-N 3.17Å
551	L	84.7	Confident	82.7	Confident	86 Å²	86	73.3 Å²	73.3	45%	0.45	37%	0.371	S	S	.	.	H	α-helix	trans	-69.2	-13.3	179.3	-70.2	-178.8	0	0	0	113.6	V547 A553 L556 Y557	V547-L551 HydrophobicContact CG1-CD1 3.53Å; V547-L551 HydrophobicContact CG1-CG 4.05Å; V547-L551 VanDerWaalsContact O-CB 3.3Å; V547-L551 WeakPolarHBondContact O-CB 3.33Å; V547-L551 VanDerWaalsContact O-CG 3.24Å; V547-L551 WeakPolarHBondContact O-CG 3.47Å; V547-L551 PolarHBondContact O-N 3.07Å; L551-A553 VanDerWaalsContact C-N 3.29Å; L551-L556 HydrophobicContact CD2-CD2 4.21Å; L551-Y557 WeakPolarHBondContact O-CE2 3.45Å; L551-Y557 PolarHBondContact O-OH 3.48Å
552	R	85.5	Confident	82.3	Confident	168 Å²	168	73.4 Å²	73.4	63%	0.634	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-17.6	175.2	-154.4	-177.1	167.3	82.7	0.5	112.3	W197 I548 I549 L550 P554	W197-R552 HydrophobicContact CH2-CB 4.49Å; W197-R552 HydrophobicContact CH2-CG 3.77Å; W197-R552 VanDerWaalsContact CH2-O 3.32Å; W197-R552 WeakPolarHBondContact CH2-O 3.44Å; W197-R552 HydrophobicContact CZ3-CB 4.09Å; W197-R552 HydrophobicContact CZ3-CG 3.86Å; W197-R552 WeakPolarHBondContact CZ3-O 3.5Å; I548-R552 PolarHBondContact O-N 3.22Å; I549-R552 PolarHBondContact O-N 3.48Å; L550-R552 PolarHBondContact O-N 2.97Å; R552-P554 VanDerWaalsContact O-CD 3.29Å; R552-P554 WeakPolarHBondContact O-CD 3.24Å
553	A	80.2	Confident	81.9	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.008	38%	0.38	C	S	.	.			trans	-67	113.8	178.6	0	0	0	0	0	110.4	F200 L362 L550 L551 S555 L556	F200-A553 HydrophobicContact CB-CB 4.05Å; F200-A553 HydrophobicContact CD2-CB 4.15Å; F200-A553 HydrophobicContact CG-CB 4.19Å; L362-A553 HydrophobicContact CD2-CB 3.82Å; L550-A553 WeakPolarHBondContact O-CB 3.15Å; L550-A553 PolarHBondContact O-N 2.91Å; L550-A553 VanDerWaalsContact O-N 3.17Å; L551-A553 VanDerWaalsContact C-N 3.29Å; A553-S555 VanDerWaalsContact C-N 3.31Å; A553-S555 PolarHBondContact O-N 3.05Å; A553-L556 WeakPolarHBondContact O-CB 3.5Å; A553-L556 PolarHBondContact O-N 3.02Å
554	P	75.3	Confident	80.9	Confident	65 Å²	65	76.2 Å²	76.2	42%	0.422	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-67.2	-32.1	-174.4	26	-33.5	0	0	0	112.5	W197 R552 L556 Y557	W197-P554 HydrophobicContact CD2-CG 3.99Å; W197-P554 VanDerWaalsContact CE3-CD 3.49Å; W197-P554 HydrophobicContact CG-CG 4.09Å; R552-P554 VanDerWaalsContact O-CD 3.29Å; R552-P554 WeakPolarHBondContact O-CD 3.24Å; P554-L556 PolarHBondContact O-N 2.89Å; P554-Y557 PolarHBondContact O-N 3.45Å
555	S	71.3	Confident	79.5	Confident	22 Å²	22	73.6 Å²	73.6	15%	0.154	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-70.9	-9.6	-178.5	59.2	0	0	0	0	114.1	F200 A553 Y557 D558	F200-S555 WeakPolarHBondContact CB-OG 3.36Å; F200-S555 PolarHBondContact O-OG 2.85Å; A553-S555 VanDerWaalsContact C-N 3.31Å; A553-S555 PolarHBondContact O-N 3.05Å; S555-Y557 PolarHBondContact O-N 3.04Å; S555-D558 PolarHBondContact O-N 2.58Å
556	L	72.3	Confident	77.9	Confident	100 Å²	100	84.1 Å²	84.1	52%	0.524	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-65.9	-24.6	167.6	-165.3	73	0	0	0	111.7	L551 A553 P554	L551-L556 HydrophobicContact CD2-CD2 4.21Å; A553-L556 WeakPolarHBondContact O-CB 3.5Å; A553-L556 PolarHBondContact O-N 3.02Å; P554-L556 PolarHBondContact O-N 2.89Å
557	Y	75.2	Confident	76.2	Confident	147 Å²	147	90.3 Å²	90.3	58%	0.576	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-101.9	5.8	177.1	-52.2	-82.2	0	0	0	112.6	L551 P554 S555 D559	L551-Y557 WeakPolarHBondContact O-CE2 3.45Å; L551-Y557 PolarHBondContact O-OH 3.48Å; P554-Y557 PolarHBondContact O-N 3.45Å; S555-Y557 PolarHBondContact O-N 3.04Å; Y557-D559 PolarHBondContact O-N 2.9Å
558	D	75.1	Confident	74.1	Confident	29 Å²	29	93.6 Å²	93.6	16%	0.155	46%	0.463	C	S	.	.			trans	-90.4	95.5	-178.4	-177.9	25.5	0	0	0	111.5	R297 S555 R560	R297-D558 IonicContact NH1-OD2 2.95Å; S555-D558 PolarHBondContact O-N 2.58Å; D558-R560 VanDerWaalsContact CG-NE 3.31Å; D558-R560 PolarHBondContact O-N 3.09Å; D558-R560 WeakPolarHBondContact OD1-CB 3.45Å; D558-R560 WeakPolarHBondContact OD1-CG 3.34Å; D558-R560 IonicContact OD1-CZ 2.81Å; D558-R560 PolarHBondContact OD1-N 3.14Å; D558-R560 IonicContact OD1-NE 3.75Å; D558-R560 PolarHBondContact OD1-NE 3Å; D558-R560 IonicContact OD1-NH2 3.59Å; D558-R560 IonicContact OD2-CZ 2.91Å; D558-R560 IonicContact OD2-NE 2.89Å; D558-R560 PolarHBondContact OD2-NE 3.06Å; D558-R560 VanDerWaalsContact OD2-NE 3.1Å; D558-R560 IonicContact OD2-NH2 2.8Å; D558-R560 PolarHBondContact OD2-NH2 3.49Å
559	D	72.5	Confident	71.6	Confident	149 Å²	149	94.2 Å²	94.2	80%	0.797	47%	0.472	S	S	*	.			trans	-83.1	11.6	178.7	-64.2	-42.7	0	0	0	113.7	Y557 V561	Y557-D559 PolarHBondContact O-N 2.9Å; D559-V561 PolarHBondContact O-N 3.3Å
560	R	80.9	Confident	69.1	Low	112 Å²	112	98.5 Å²	98.5	42%	0.423	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-61.9	125.3	177.5	-72.7	177.5	-62.5	175.6	3	110.7	E202 L265 R297 D558	E202-R560 IonicContact OE1-NH2 3.9Å; E202-R560 PolarHBondContact OE1-NH2 3.46Å; E202-R560 IonicContact OE2-CZ 2.72Å; E202-R560 IonicContact OE2-NH1 3.79Å; E202-R560 IonicContact OE2-NH2 2.78Å; E202-R560 PolarHBondContact OE2-NH2 2.94Å; L265-R560 HydrophobicContact CD2-CB 4.2Å; R297-R560 PolarHBondContact NH1-O 3.35Å; R297-R560 PolarHBondContact NH2-O 3.42Å; D558-R560 VanDerWaalsContact CG-NE 3.31Å; D558-R560 PolarHBondContact O-N 3.09Å; D558-R560 WeakPolarHBondContact OD1-CB 3.45Å; D558-R560 WeakPolarHBondContact OD1-CG 3.34Å; D558-R560 IonicContact OD1-CZ 2.81Å; D558-R560 PolarHBondContact OD1-N 3.14Å; D558-R560 IonicContact OD1-NE 3.75Å; D558-R560 PolarHBondContact OD1-NE 3Å; D558-R560 IonicContact OD1-NH2 3.59Å; D558-R560 IonicContact OD2-CZ 2.91Å; D558-R560 IonicContact OD2-NE 2.89Å; D558-R560 PolarHBondContact OD2-NE 3.06Å; D558-R560 VanDerWaalsContact OD2-NE 3.1Å; D558-R560 IonicContact OD2-NH2 2.8Å; D558-R560 PolarHBondContact OD2-NH2 3.49Å
561	V	80.4	Confident	66.9	Low	115 Å²	115	101.8 Å²	101.8	70%	0.697	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-73.9	130	175.1	-175.4	0	0	0	0	108.4	D559	D559-V561 PolarHBondContact O-N 3.3Å
562	P	82.6	Confident	64.6	Low	34 Å²	34	106.5 Å²	106.5	22%	0.221	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-66.1	152.7	175.7	31	-35	0	0	0	110.4	D263 E564	D263-P562 HydrophobicContact CB-CB 3.87Å; P562-E564 PolarHBondContact O-N 3Å
563	I	81.6	Confident	62.2	Low	59 Å²	59	104 Å²	104	30%	0.303	55%	0.547	S	S	.	.			trans	-69.9	105.6	172.7	-62.5	173.5	0	0	0	107.4	L253 I264 L265 I267	L253-I563 HydrophobicContact CD1-CG2 3.82Å; I264-I563 PolarHBondContact O-N 3.45Å; L265-I563 WeakPolarHBondContact O-CD1 3.47Å; L265-I563 WeakPolarHBondContact O-CG1 3.34Å; I267-I563 HydrophobicContact CG1-CD1 4.08Å
564	E	67.8	Low	60	Low	155 Å²	155	112.7 Å²	112.7	72%	0.724	59%	0.593	S	S	*	*			trans	-70.4	126	173.5	-67.5	-175.2	176.8	0	0	109.2	P562 R566	P562-E564 PolarHBondContact O-N 3Å; E564-R566 PolarHBondContact O-N 3.42Å
565	P	61.8	Low	58.3	Low	32 Å²	32	116.8 Å²	116.8	21%	0.208	61%	0.606	C	S	.	*			trans	-59.3	132.1	166	22.4	-27	0	0	0	107.4	Y256 P258 L567	Y256-P565 HydrophobicContact CD1-CB 4.17Å; Y256-P565 HydrophobicContact CD1-CG 4.21Å; P258-P565 HydrophobicContact CB-CG 4.36Å; P258-P565 HydrophobicContact CG-CG 4.5Å; P565-L567 PolarHBondContact O-N 2.97Å
566	R	56.3	Low	56.5	Low	233 Å²	233	123.7 Å²	123.7	88%	0.879	64%	0.636	S	S	*	*			trans	-64.2	90.9	167.6	-68.9	-175.9	-175.5	159.6	1.5	106.5	E564	E564-R566 PolarHBondContact O-N 3.42Å
567	L	51.3	Low	55.4	Low	139 Å²	139	126 Å²	126	73%	0.728	65%	0.654	S	S	*	*			trans	-47.8	134.3	160.8	-83.9	148.9	0	0	0	106	P565 T569	P565-L567 PolarHBondContact O-N 2.97Å; L567-T569 PolarHBondContact O-N 3.09Å
568	P	42.7	Very low	53.6	Low	125 Å²	125	133.3 Å²	133.3	81%	0.812	68%	0.682	S	S	*	*			trans	-60	95.5	175.3	22.9	-30.4	0	0	0	107.4	T570	P568-T570 PolarHBondContact O-N 3.08Å; P568-T570 VanDerWaalsContact O-N 3.12Å
569	T	37.6	Very low	52.5	Low	125 Å²	125	138.5 Å²	138.5	77%	0.767	71%	0.709	S	S	*	*			trans	-60.5	118	167.1	47.2	0	0	0	0	104.8	L567	L567-T569 PolarHBondContact O-N 3.09Å
570	T	34.2	Very low	51.5	Low	119 Å²	119	137.9 Å²	137.9	73%	0.73	70%	0.704	S	S	*	*			trans	-36.5	129.6	163.1	5.6	0	0	0	0	108.5	P568 Q572	P568-T570 PolarHBondContact O-N 3.08Å; P568-T570 VanDerWaalsContact O-N 3.12Å; T570-Q572 PolarHBondContact O-N 3.23Å
571	P	36.4	Very low	49.9	Very low	122 Å²	122	139.4 Å²	139.4	79%	0.792	72%	0.72	S	S	*	*			trans	-63.6	99.4	-175.2	24.7	-31.6	0	0	0	108.9	T573	P571-T573 PolarHBondContact O-N 3Å
572	Q	35.3	Very low	48.1	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	72%	0.721	S	S	*	*			trans	-75.4	81.3	165	-74.2	-171.8	-13.2	0	0	107.7	T570	T570-Q572 PolarHBondContact O-N 3.23Å
573	T	36.4	Very low	45.9	Very low	116 Å²	116	147.5 Å²	147.5	71%	0.712	75%	0.752	S	S	*	*			trans	-164.3	76.3	149.8	26.2	0	0	0	0	108.1	P571 Q575	P571-T573 PolarHBondContact O-N 3Å; T573-Q575 PolarHBondContact O-N 3.16Å
574	L	33.9	Very low	43.5	Very low	184 Å²	184	153.4 Å²	153.4	96%	0.963	78%	0.782	S	S	*	*			trans	-72.4	90	143.5	-108.9	166.5	0	0	0	105.7
575	Q	37.9	Very low	41.8	Very low	151 Å²	151	153.3 Å²	153.3	71%	0.706	79%	0.786	S	S	*	*			trans	-150.6	110	163.5	-109.3	179	-14.1	0	0	109.9	T573	T573-Q575 PolarHBondContact O-N 3.16Å
576	H	34.6	Very low	40.3	Very low	166 Å²	166	162.6 Å²	162.6	77%	0.769	83%	0.831	S	S	*	*			trans	71	89.3	160	-58.4	-74.1	0	0	0	118.9
577	V	48.1	Very low	38.9	Very low	149 Å²	149	156.8 Å²	156.8	90%	0.903	83%	0.827	S	S	*	*				-137.6	103	126.2	-174.2	0	0	0	0	107.7
578	Y	38.7	Very low	37.8	Very low	300 Å²	300	158.4 Å²	158.4	100%	1.176	84%	0.836	S	S	*	*			trans	-90	0	143.7	-115	-80.3	0	0	0	106.9

Retrieved 578 of 578 residues in 515.1 ms (Link to these results)

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