A0A096N933_PAPAN Loading...

vesicle-fusing ATPase

AlphaFold DB , UniProt , Accession A0A096N933, Species PAPAN (Papio anubis, Olive baboon), Gene VPS4B, Length 532 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	32.1	Very low	28.8	Very low	235 Å²	235	143.5 Å²	143.5	100%	1.158	85%	0.854	S	S	*	*				0	107.9	0	-90	167.5	152.2	0	0	108.8
2	T	29.9	Very low	28.7	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	84%	0.836	S	S	*	*			trans	54	127.7	146.3	62.5	0	0	0	0	122.6
3	K	28.8	Very low	28.6	Very low	195 Å²	195	136.7 Å²	136.7	85%	0.848	84%	0.84	S	S	*	*			trans	117.3	132.5	139.9	-67.3	-172.5	179.6	-179.9	0	113.1
4	S	29.1	Very low	28.4	Very low	112 Å²	112	139.8 Å²	139.8	78%	0.783	84%	0.84	S	S	*	*			cis	-176.8	147.8	-6.1	39.6	0	0	0	0	107.5
5	E	27	Very low	28.3	Very low	181 Å²	181	138.9 Å²	138.9	85%	0.846	84%	0.839	S	S	*	*			trans	-78.5	140.8	179.4	-81.7	175	130.1	0	0	114.8
6	V	28.2	Very low	28.2	Very low	126 Å²	126	145.6 Å²	145.6	76%	0.764	84%	0.844	S	S	*	*			trans	71.5	158	130.4	-177.8	0	0	0	0	119.1
7	P	38.1	Very low	28.2	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	84%	0.836	S	S	*	*			cis	-131.5	169.1	-8.1	22.7	1	0	0	0	117.7
8	G	25.1	Very low	28.1	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	84%	0.839	S	S	*	*				93.2	99.5	121.1	0	0	0	0	0	121.1
9	A	25.9	Very low	28.2	Very low	103 Å²	103	143.8 Å²	143.8	85%	0.851	84%	0.84	S	S	*	*			trans	-145.7	114.5	148.2	0	0	0	0	0	109.5
10	E	25.1	Very low	28.3	Very low	202 Å²	202	143.2 Å²	143.2	94%	0.944	83%	0.833	S	S	*	*			trans	-65.1	125	177.5	-66.8	179.4	139.4	0	0	111
11	A	27.7	Very low	28.3	Very low	101 Å²	101	139.4 Å²	139.4	84%	0.835	81%	0.814	S	S	*	*			trans	-97.2	112.3	163.8	0	0	0	0	0	108.4
12	G	27.7	Very low	28.5	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.1	162.4	172.6	0	0	0	0	0	112.7	E14	G12-E14 PolarHBondContact O-N 3.37Å
13	P	26.5	Very low	29.2	Very low	136 Å²	136	126.3 Å²	126.3	88%	0.883	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-75	127.4	-175	29.6	-32	0	0	0	111.8
14	E	26.7	Very low	29.7	Very low	180 Å²	180	119.7 Å²	119.7	84%	0.841	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-59.7	146.4	168.1	-78.7	-172.9	146.8	0	0	112.3	G12 R16	G12-E14 PolarHBondContact O-N 3.37Å; E14-R16 PolarHBondContact O-N 3.22Å
15	P	27.3	Very low	30.2	Very low	127 Å²	127	114.9 Å²	114.9	83%	0.825	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-77.4	124.2	-177.1	31.3	-32.2	0	0	0	111.4	G17	P15-G17 PolarHBondContact O-N 3.4Å; P15-G17 VanDerWaalsContact O-N 3.07Å
16	R	26.8	Very low	31.1	Very low	245 Å²	245	108.3 Å²	108.3	93%	0.925	68%	0.677	S	S	*	*			trans	-71.2	95.9	170.3	-61.9	-177.4	-159.9	-154.5	5.7	110	E14	E14-R16 PolarHBondContact O-N 3.22Å
17	G	26.8	Very low	32	Very low	69 Å²	69	110.4 Å²	110.4	71%	0.711	67%	0.672	S	S	*	*			trans	-107.3	145.6	170.8	0	0	0	0	0	112.6	P15	P15-G17 PolarHBondContact O-N 3.4Å; P15-G17 VanDerWaalsContact O-N 3.07Å
18	A	27.7	Very low	32.2	Very low	107 Å²	107	105.4 Å²	105.4	88%	0.884	64%	0.639	S	S	*	*			trans	79.5	67.7	174.3	0	0	0	0	0	117.7	D20	A18-D20 PolarHBondContact O-N 3.16Å
19	R	29.3	Very low	33.4	Very low	227 Å²	227	107.7 Å²	107.7	86%	0.857	62%	0.622	S	S	*	*			trans	-83	105.9	151.9	-72.5	-170.7	-152.5	-169	7.7	109.5	C21	R19-C21 PolarHBondContact O-N 3.11Å
20	D	30.5	Very low	34.5	Very low	131 Å²	131	107 Å²	107	70%	0.701	61%	0.607	S	S	*	*			trans	-1.3	83.4	156	-148	-7.2	0	0	0	117.7	A18 G22	A18-D20 PolarHBondContact O-N 3.16Å; D20-G22 PolarHBondContact O-N 3.07Å; D20-G22 VanDerWaalsContact O-N 3.15Å; D20-G22 PolarHBondContact OD1-N 3.24Å
21	C	29.1	Very low	35.4	Very low	64 Å²	64	102 Å²	102	43%	0.432	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-1.4	169	-73.6	0	0	0	0	113.2	R19	R19-C21 PolarHBondContact O-N 3.11Å
22	G	35.8	Very low	36.2	Very low	40 Å²	40	98.4 Å²	98.4	41%	0.412	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.5	-36.7	-177.5	0	0	0	0	0	114.3	D20 K161	D20-G22 PolarHBondContact O-N 3.07Å; D20-G22 VanDerWaalsContact O-N 3.15Å; D20-G22 PolarHBondContact OD1-N 3.24Å; G22-K161 PolarHBondContact O-NZ 3.07Å
23	S	43.9	Very low	37.1	Very low	46 Å²	46	100.5 Å²	100.5	32%	0.322	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-15	-166.6	69.4	0	0	0	0	115.8	R27	S23-R27 WeakPolarHBondContact O-CD 3.46Å; S23-R27 VanDerWaalsContact O-CG 3.24Å; S23-R27 WeakPolarHBondContact O-CG 3.41Å; S23-R27 PolarHBondContact O-N 3.44Å
24	L	39.2	Very low	37.9	Very low	57 Å²	57	102 Å²	102	30%	0.298	53%	0.534	S	S	.	.	H	α-helix	trans	-79.9	-40.1	-168.8	-137.6	82.7	0	0	0	113.3	G26 R27 V28	L24-G26 PolarHBondContact O-N 3.46Å; L24-R27 PolarHBondContact O-N 3.25Å; L24-V28 VanDerWaalsContact O-CG2 3.32Å; L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 3.01Å
25	V	39.8	Very low	38.7	Very low	11 Å²	11	94.5 Å²	94.5	7%	0.067	50%	0.501	C	S	.	.	H	α-helix	trans	-64.8	-43.1	-177.6	-177.9	0	0	0	0	111.5	R27 V28 R29 Q123 E158	V25-R27 PolarHBondContact O-N 3.27Å; V25-V28 PolarHBondContact O-N 3.35Å; V25-R29 PolarHBondContact O-N 3.34Å; V25-Q123 HydrophobicContact CG2-CG 4.49Å; V25-E158 HydrophobicContact CG1-CG 4.23Å
26	G	45.2	Very low	39.3	Very low	43 Å²	43	92.6 Å²	92.6	44%	0.443	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-41.1	175.3	0	0	0	0	0	112.3	L24 V28 R29 V30	L24-G26 PolarHBondContact O-N 3.46Å; G26-V28 PolarHBondContact O-N 2.82Å; G26-R29 PolarHBondContact O-N 3.47Å; G26-V30 WeakPolarHBondContact O-CG2 3.1Å; G26-V30 PolarHBondContact O-N 3.22Å
27	R	47	Very low	40	Very low	170 Å²	170	84 Å²	84	64%	0.642	46%	0.461	S	S	*	.	H	α-helix	trans	-64.2	-39.5	176.2	-72.7	175	-171.6	-172.8	4	112.4	S23 L24 V25 L31	S23-R27 WeakPolarHBondContact O-CD 3.46Å; S23-R27 VanDerWaalsContact O-CG 3.24Å; S23-R27 WeakPolarHBondContact O-CG 3.41Å; S23-R27 PolarHBondContact O-N 3.44Å; L24-R27 PolarHBondContact O-N 3.25Å; V25-R27 PolarHBondContact O-N 3.27Å; R27-L31 WeakPolarHBondContact O-CB 3.39Å; R27-L31 PolarHBondContact O-N 3.4Å
28	V	44.2	Very low	40.6	Very low	12 Å²	12	86.1 Å²	86.1	7%	0.073	45%	0.452	C	S	.	.	H	α-helix	trans	-68	-36.8	177.7	173.8	0	0	0	0	111.4	L24 V25 G26 L31 L32 V126 Q127 L130 L154	L24-V28 VanDerWaalsContact O-CG2 3.32Å; L24-V28 WeakPolarHBondContact O-CG2 3.4Å; L24-V28 PolarHBondContact O-N 3.01Å; V25-V28 PolarHBondContact O-N 3.35Å; G26-V28 PolarHBondContact O-N 2.82Å; V28-L31 WeakPolarHBondContact O-CB 3.36Å; V28-L31 PolarHBondContact O-N 2.89Å; V28-L32 PolarHBondContact O-N 2.98Å; V28-V126 HydrophobicContact CG1-CG1 3.7Å; V28-Q127 HydrophobicContact CG2-CG 4.36Å; V28-L130 HydrophobicContact CG1-CD1 4.11Å; V28-L154 HydrophobicContact CG1-CD2 4.04Å
29	R	48.8	Very low	41	Very low	128 Å²	128	84.8 Å²	84.8	48%	0.483	43%	0.43	S	S	.	.	H	α-helix	trans	-68.3	-43.9	175.7	-174.1	172.4	176.5	162.2	-1.5	112.9	V25 G26 L31 L32 E33 E158	V25-R29 PolarHBondContact O-N 3.34Å; G26-R29 PolarHBondContact O-N 3.47Å; R29-L31 PolarHBondContact O-N 3.46Å; R29-L32 WeakPolarHBondContact O-CB 3.46Å; R29-L32 PolarHBondContact O-N 2.65Å; R29-L32 VanDerWaalsContact O-N 3.1Å; R29-E33 IonicContact NE-OE1 3.17Å; R29-E33 PolarHBondContact O-N 2.89Å; R29-E158 IonicContact NH1-OE1 3.6Å
30	V	49.4	Very low	41.3	Very low	88 Å²	88	82.6 Å²	82.6	53%	0.533	43%	0.427	S	S	.	.	H	α-helix	trans	-59.2	-38.8	172.5	171.5	0	0	0	0	110.6	G26 R34	G26-V30 WeakPolarHBondContact O-CG2 3.1Å; G26-V30 PolarHBondContact O-N 3.22Å; V30-R34 VanDerWaalsContact O-CB 3.25Å; V30-R34 WeakPolarHBondContact O-CB 3.37Å; V30-R34 PolarHBondContact O-N 3.2Å
31	L	43.8	Very low	41.3	Very low	98 Å²	98	85.9 Å²	85.9	51%	0.513	44%	0.435	S	S	.	.	H	α-helix	trans	-65.3	-40.6	175	-144.3	85.1	0	0	0	112	R27 V28 R29 R34 V35 L130	R27-L31 WeakPolarHBondContact O-CB 3.39Å; R27-L31 PolarHBondContact O-N 3.4Å; V28-L31 WeakPolarHBondContact O-CB 3.36Å; V28-L31 PolarHBondContact O-N 2.89Å; R29-L31 PolarHBondContact O-N 3.46Å; L31-R34 PolarHBondContact O-N 3.37Å; L31-V35 WeakPolarHBondContact O-CB 3.31Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.45Å; L31-V35 PolarHBondContact O-N 3.38Å; L31-L130 HydrophobicContact CD2-CD1 4.42Å
32	L	44.5	Very low	41.4	Very low	25 Å²	25	93.5 Å²	93.5	13%	0.131	46%	0.455	C	S	.	.	H	α-helix	trans	-64.5	-46.5	177.1	-155.2	111.6	0	0	0	111.2	V28 R29 R34 V35 L36 L130 C150 L154	V28-L32 PolarHBondContact O-N 2.98Å; R29-L32 WeakPolarHBondContact O-CB 3.46Å; R29-L32 PolarHBondContact O-N 2.65Å; R29-L32 VanDerWaalsContact O-N 3.1Å; L32-R34 PolarHBondContact O-N 2.94Å; L32-V35 PolarHBondContact O-N 3.37Å; L32-L36 HydrophobicContact CD2-CD1 4.05Å; L32-L36 WeakPolarHBondContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CG 3.38Å; L32-L36 PolarHBondContact O-N 2.76Å; L32-L130 HydrophobicContact CD1-CD1 4.26Å; L32-L130 HydrophobicContact CD1-CD2 3.81Å; L32-L130 HydrophobicContact CD1-CG 4.36Å; L32-C150 HydrophobicContact CD1-CB 4.29Å; L32-L154 HydrophobicContact CD1-CD1 4.03Å
33	E	46.3	Very low	41.1	Very low	106 Å²	106	100.3 Å²	100.3	50%	0.495	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-39	176.7	-74.1	176.4	-176.6	0	0	111.9	R29 L36 S37	R29-E33 IonicContact NE-OE1 3.17Å; R29-E33 PolarHBondContact O-N 2.89Å; E33-L36 PolarHBondContact O-N 2.94Å; E33-S37 PolarHBondContact O-N 3.49Å
34	R	43	Very low	40.4	Very low	168 Å²	168	102.1 Å²	102.1	63%	0.634	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-43.7	176.5	-159	169.9	-173.6	168.4	2.9	111.9	V30 L31 L32 L36 S37 E38	V30-R34 VanDerWaalsContact O-CB 3.25Å; V30-R34 WeakPolarHBondContact O-CB 3.37Å; V30-R34 PolarHBondContact O-N 3.2Å; L31-R34 PolarHBondContact O-N 3.37Å; L32-R34 PolarHBondContact O-N 2.94Å; R34-L36 VanDerWaalsContact C-N 3.32Å; R34-L36 PolarHBondContact O-N 3.33Å; R34-S37 PolarHBondContact O-N 3.49Å; R34-S37 PolarHBondContact O-OG 3.4Å; R34-E38 PolarHBondContact O-N 3.31Å
35	V	43.5	Very low	39.8	Very low	23 Å²	23	102.8 Å²	102.8	14%	0.139	52%	0.52	C	S	.	.	H	α-helix	trans	-66.7	-31	174.6	171.5	0	0	0	0	112.3	L31 L32	L31-V35 WeakPolarHBondContact O-CB 3.31Å; L31-V35 VanDerWaalsContact O-CG2 3.25Å; L31-V35 WeakPolarHBondContact O-CG2 3.45Å; L31-V35 PolarHBondContact O-N 3.38Å; L32-V35 PolarHBondContact O-N 3.37Å
36	L	41.2	Very low	39	Very low	87 Å²	87	108.8 Å²	108.8	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-71.8	-33.2	173.6	-72	168.8	0	0	0	112	L32 E33 R34	L32-L36 HydrophobicContact CD2-CD1 4.05Å; L32-L36 WeakPolarHBondContact O-CB 3.31Å; L32-L36 WeakPolarHBondContact O-CG 3.38Å; L32-L36 PolarHBondContact O-N 2.76Å; E33-L36 PolarHBondContact O-N 2.94Å; R34-L36 VanDerWaalsContact C-N 3.32Å; R34-L36 PolarHBondContact O-N 3.33Å
37	S	42.2	Very low	38	Very low	65 Å²	65	113.2 Å²	113.2	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-72.6	-36.4	178.3	78.6	0	0	0	0	113.3	E33 R34 N39 K40	E33-S37 PolarHBondContact O-N 3.49Å; R34-S37 PolarHBondContact O-N 3.49Å; R34-S37 PolarHBondContact O-OG 3.4Å; S37-N39 PolarHBondContact O-N 3.5Å; S37-N39 VanDerWaalsContact O-N 3.16Å; S37-K40 PolarHBondContact O-N 3.47Å; S37-K40 VanDerWaalsContact O-N 3.13Å
38	E	38.8	Very low	36.9	Very low	112 Å²	112	110.5 Å²	110.5	52%	0.523	59%	0.59	S	S	.	*	H	α-helix	trans	-63.1	-22.8	-177.4	-78	176	173	0	0	113.9	R34	R34-E38 PolarHBondContact O-N 3.31Å
39	N	36.1	Very low	35.9	Very low	80 Å²	80	121.4 Å²	121.4	43%	0.428	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	-10.8	177.8	-104.6	10.4	0	0	0	114.7	S37 F41	S37-N39 PolarHBondContact O-N 3.5Å; S37-N39 VanDerWaalsContact O-N 3.16Å; N39-F41 VanDerWaalsContact C-N 3.34Å
40	K	35.7	Very low	34.7	Very low	181 Å²	181	120.4 Å²	120.4	79%	0.787	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-23	172.5	-95.6	-177.4	176.1	-179.8	0	112.4	S37	S37-K40 PolarHBondContact O-N 3.47Å; S37-K40 VanDerWaalsContact O-N 3.13Å
41	F	29	Very low	33.5	Very low	200 Å²	200	124.5 Å²	124.5	88%	0.877	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-6.5	-179.4	-107.9	-91.3	0	0	0	115	N39	N39-F41 VanDerWaalsContact C-N 3.34Å
42	R	31.7	Very low	32.6	Very low	224 Å²	224	126.1 Å²	126.1	85%	0.845	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	2.2	178.8	-86.9	-171.9	173.8	-160.6	-0.6	115.6
43	K	30.8	Very low	31.7	Very low	183 Å²	183	133.9 Å²	133.9	80%	0.796	70%	0.7	S	S	*	*			trans	-127	66	171.5	-73.7	-170.1	178.9	-178.4	0	110.8
44	G	27.7	Very low	30.6	Very low	83 Å²	83	139.9 Å²	139.9	86%	0.856	72%	0.719	S	S	*	*			trans	-115.3	85.2	162.9	0	0	0	0	0	108.8
45	G	26.4	Very low	30.1	Very low	72 Å²	72	137.2 Å²	137.2	74%	0.742	72%	0.723	S	S	*	*			trans	-167.4	118.6	177.9	0	0	0	0	0	110.6
46	C	24.2	Very low	29.3	Very low	137 Å²	137	141.9 Å²	141.9	93%	0.926	75%	0.754	S	S	*	*			trans	75.8	104	179.5	-75.5	0	0	0	0	117.5
47	C	23.6	Very low	28.5	Very low	135 Å²	135	147 Å²	147	91%	0.912	78%	0.775	S	S	*	*			trans	-90.9	124.5	163.2	-164.9	0	0	0	0	108.5
48	S	23.4	Very low	27.6	Very low	113 Å²	113	154.2 Å²	154.2	79%	0.79	80%	0.799	S	S	*	*			trans	-156.4	121.6	156.3	36.1	0	0	0	0	111.9
49	R	23.8	Very low	26.9	Very low	241 Å²	241	152.7 Å²	152.7	91%	0.909	81%	0.813	S	S	*	*			trans	-3.6	134.1	158.6	-80.9	171.3	163.9	-176.8	-5.6	118.6
50	S	23.1	Very low	26.4	Very low	108 Å²	108	152.3 Å²	152.3	76%	0.755	83%	0.828	S	S	*	*				169.7	126.3	99.7	62	0	0	0	0	113.2
51	E	25	Very low	25.7	Very low	174 Å²	174	150 Å²	150	81%	0.813	83%	0.834	S	S	*	*			trans	40.3	138.3	137.6	-70	173.6	138.4	0	0	125.3
52	N	24.3	Very low	25.5	Very low	132 Å²	132	151.5 Å²	151.5	71%	0.706	84%	0.835	S	S	*	*			trans	67.7	108.5	143.8	-70.6	-20.4	0	0	0	121.4
53	H	25.7	Very low	26.1	Very low	187 Å²	187	146.7 Å²	146.7	87%	0.866	83%	0.833	S	S	*	*				178.8	147.2	102.3	-102.3	-62.1	0	0	0	113.9
54	R	24	Very low	25.8	Very low	232 Å²	232	141.8 Å²	141.8	88%	0.875	83%	0.834	S	S	*	*			trans	-68	161.3	173.7	-106.7	-174.8	-97.4	-153	-5.9	113.2
55	P	31.4	Very low	25.8	Very low	113 Å²	113	150.3 Å²	150.3	73%	0.734	84%	0.84	S	S	*	*			trans	-96.7	164.4	-178.2	38.8	-32	0	0	0	113.2
56	P	27	Very low	25.8	Very low	120 Å²	120	148.8 Å²	148.8	78%	0.779	83%	0.825	S	S	*	*			trans	-118.4	119.7	150.5	32.2	-18.5	0	0	0	110.3
57	Q	24.3	Very low	26.2	Very low	194 Å²	194	148.1 Å²	148.1	91%	0.907	82%	0.821	S	S	*	*				75	119.8	89.6	-73.6	-153.8	14.6	0	0	115.6
58	F	24.6	Very low	26.4	Very low	217 Å²	217	147.8 Å²	147.8	95%	0.952	82%	0.816	S	S	*	*			trans	-70.9	140.6	174.5	-89.2	-102.5	0	0	0	112
59	G	23.4	Very low	26.7	Very low	80 Å²	80	146.4 Å²	146.4	83%	0.825	81%	0.806	S	S	*	*			trans	-111.7	121.8	159.3	0	0	0	0	0	109.5
60	G	24.5	Very low	27.1	Very low	72 Å²	72	140.7 Å²	140.7	74%	0.742	79%	0.793	S	S	*	*			trans	-88.3	162	-178.5	0	0	0	0	0	114.1
61	C	22.4	Very low	27.5	Very low	134 Å²	134	142 Å²	142	91%	0.905	79%	0.79	S	S	*	*			trans	-158.9	129.3	155.5	-97.4	0	0	0	0	109.5
62	Y	25.3	Very low	27.9	Very low	231 Å²	231	140.1 Å²	140.1	91%	0.906	79%	0.785	S	S	*	*			trans	-136.3	169.9	165.8	-90	-73.2	0	0	0	106.5
63	P	43.7	Very low	28.5	Very low	123 Å²	123	137 Å²	137	80%	0.799	78%	0.778	S	S	*	*			cis	-131.7	167.1	-31.5	32.2	-14.3	0	0	0	112.5
64	G	24.4	Very low	29.2	Very low	79 Å²	79	133.2 Å²	133.2	81%	0.814	76%	0.763	S	S	*	*			trans	-155.4	118.1	172.7	0	0	0	0	0	113.8
65	R	28.2	Very low	30.1	Very low	263 Å²	263	124.2 Å²	124.2	99%	0.992	73%	0.733	S	S	*	*			trans	-29.8	138.1	-178.2	-64.3	172.4	-172.4	-137.6	-0.7	118.5
66	G	25.4	Very low	30.7	Very low	40 Å²	40	121.6 Å²	121.6	41%	0.412	72%	0.72	S	S	.	*			trans	163.6	64.8	162.7	0	0	0	0	0	114.7	T68 S69	G66-T68 PolarHBondContact O-N 3.07Å; G66-S69 PolarHBondContact O-N 3.04Å
67	S	31.9	Very low	31.7	Very low	122 Å²	122	118.3 Å²	118.3	85%	0.853	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	8.4	-168.5	-161.4	0	0	0	0	117.2
68	T	28.7	Very low	33.4	Very low	129 Å²	129	114.9 Å²	114.9	79%	0.791	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	-10.1	174.3	42	0	0	0	0	113.2	G66	G66-T68 PolarHBondContact O-N 3.07Å
69	S	29.2	Very low	34.6	Very low	83 Å²	83	108.8 Å²	108.8	58%	0.58	66%	0.662	S	S	*	*	H	α-helix	trans	-89.5	-28.3	178.8	-163.8	0	0	0	0	112.8	G66 L71 L72 A73	G66-S69 PolarHBondContact O-N 3.04Å; S69-L71 PolarHBondContact O-N 2.81Å; S69-L72 PolarHBondContact O-N 2.72Å; S69-A73 VanDerWaalsContact O-CB 3.27Å; S69-A73 WeakPolarHBondContact O-CB 3.09Å; S69-A73 PolarHBondContact O-N 2.95Å
70	L	32.6	Very low	36.1	Very low	122 Å²	122	108.8 Å²	108.8	64%	0.639	65%	0.647	S	S	*	*	H	α-helix	trans	-66	-35.8	-178.4	-100	102.8	0	0	0	113.8	A73 L74	L70-A73 PolarHBondContact O-N 3.02Å; L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 WeakPolarHBondContact O-CD1 3.41Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 3.44Å
71	L	31.6	Very low	37.3	Very low	134 Å²	134	107.5 Å²	107.5	70%	0.702	62%	0.62	S	S	*	*	H	α-helix	trans	-72.7	-34.4	-177.7	-150.2	79.2	0	0	0	111.9	S69 L75	S69-L71 PolarHBondContact O-N 2.81Å; L71-L75 WeakPolarHBondContact O-CG 3.39Å
72	L	32.8	Very low	38.5	Very low	136 Å²	136	109.9 Å²	109.9	71%	0.712	62%	0.615	S	S	*	*	H	α-helix	trans	-76.3	-36.3	173.1	-117.5	88.8	0	0	0	111.9	S69 L74 L75 A76	S69-L72 PolarHBondContact O-N 2.72Å; L72-L74 VanDerWaalsContact C-N 3.32Å; L72-L74 PolarHBondContact O-N 3.34Å; L72-L75 CarbonylContact O-C 3.5Å; L72-L75 WeakPolarHBondContact O-CA 3.38Å; L72-L75 PolarHBondContact O-N 3.31Å; L72-A76 PolarHBondContact O-N 3.12Å
73	A	37.3	Very low	39.8	Very low	67 Å²	67	102.5 Å²	102.5	55%	0.554	60%	0.595	S	S	*	*	H	α-helix	trans	-65.1	-34.4	176.4	0	0	0	0	0	112.5	S69 L70 L75 A76	S69-A73 VanDerWaalsContact O-CB 3.27Å; S69-A73 WeakPolarHBondContact O-CB 3.09Å; S69-A73 PolarHBondContact O-N 2.95Å; L70-A73 PolarHBondContact O-N 3.02Å; A73-L75 PolarHBondContact O-N 2.96Å; A73-A76 WeakPolarHBondContact O-CB 3.45Å; A73-A76 PolarHBondContact O-N 3.04Å
74	L	41.1	Very low	39.6	Very low	106 Å²	106	101.6 Å²	101.6	56%	0.555	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-14.5	172.8	-75.5	165.4	0	0	0	113.5	L70 L72	L70-L74 WeakPolarHBondContact O-CB 3.24Å; L70-L74 WeakPolarHBondContact O-CD1 3.41Å; L70-L74 VanDerWaalsContact O-CG 3.25Å; L70-L74 WeakPolarHBondContact O-CG 3.48Å; L70-L74 PolarHBondContact O-N 3.44Å; L72-L74 VanDerWaalsContact C-N 3.32Å; L72-L74 PolarHBondContact O-N 3.34Å
75	L	41.9	Very low	40.2	Very low	44 Å²	44	101.3 Å²	101.3	23%	0.23	59%	0.587	C	S	.	*	T	Hydrogen-bonded Turn	trans	-100.4	6.4	177.6	-70.5	171.5	0	0	0	113.5	L71 L72 A73 R156	L71-L75 WeakPolarHBondContact O-CG 3.39Å; L72-L75 CarbonylContact O-C 3.5Å; L72-L75 WeakPolarHBondContact O-CA 3.38Å; L72-L75 PolarHBondContact O-N 3.31Å; A73-L75 PolarHBondContact O-N 2.96Å; L75-R156 PolarHBondContact O-NH2 3.41Å
76	A	44.2	Very low	40.4	Very low	57 Å²	57	96.4 Å²	96.4	47%	0.471	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-61.6	129.9	-178.8	0	0	0	0	0	111.8	L72 A73	L72-A76 PolarHBondContact O-N 3.12Å; A73-A76 WeakPolarHBondContact O-CB 3.45Å; A73-A76 PolarHBondContact O-N 3.04Å
77	P	47.8	Very low	40.6	Very low	51 Å²	51	99.7 Å²	99.7	33%	0.331	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-71.1	137.8	-177.6	22.8	-27.6	0	0	0	111.1	K111	P77-K111 HydrophobicContact CB-CD 4.29Å; P77-K111 HydrophobicContact CB-CG 3.42Å; P77-K111 VanDerWaalsContact CB-CG 3.42Å; P77-K111 HydrophobicContact CG-CB 4.33Å; P77-K111 HydrophobicContact CG-CD 4.17Å; P77-K111 HydrophobicContact CG-CG 3.24Å
78	R	59.8	Low	40.4	Very low	123 Å²	123	98.1 Å²	98.1	46%	0.464	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-83.9	144.4	-176.5	-61.9	-155.8	-179.3	-157.8	4.2	112.3	S107 E152	R78-S107 PolarHBondContact O-OG 2.95Å; R78-S107 VanDerWaalsContact O-OG 3.08Å; R78-E152 WeakPolarHBondContact CD-OE1 3.49Å; R78-E152 IonicContact CZ-OE1 2.79Å; R78-E152 IonicContact NE-OE1 3.66Å; R78-E152 IonicContact NH1-OE1 2.69Å; R78-E152 PolarHBondContact NH1-OE1 3.36Å; R78-E152 IonicContact NH1-OE2 2.76Å
79	S	51.4	Low	40.9	Very low	89 Å²	89	101.9 Å²	101.9	62%	0.622	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-67.2	149	-178	45.4	0	0	0	0	112.5	W81	S79-W81 PolarHBondContact O-N 3.29Å
80	P	53.9	Low	41.2	Very low	79 Å²	79	102.7 Å²	102.7	51%	0.513	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-59.1	134.6	175.3	-19.9	31.1	0	0	0	110.9
81	W	50.8	Low	41.9	Very low	45 Å²	45	102.8 Å²	102.8	17%	0.17	62%	0.619	C	S	.	*	P	Polyproline II helix	trans	-75.7	131.6	-180	-179.8	69.4	0	0	0	111.1	S79 P83 I100 K149	S79-W81 PolarHBondContact O-N 3.29Å; W81-P83 HydrophobicContact CH2-CB 3.64Å; W81-P83 HydrophobicContact CZ2-CB 4.25Å; W81-P83 HydrophobicContact CZ3-CB 3.84Å; W81-P83 HydrophobicContact CZ3-CG 4.48Å; W81-I100 HydrophobicContact CE3-CD1 4.35Å; W81-I100 HydrophobicContact CE3-CG1 4.27Å; W81-I100 HydrophobicContact CZ3-CD1 4.04Å; W81-I100 HydrophobicContact CZ3-CG1 4.31Å; W81-K149 HydrophobicContact CB-CD 4.13Å; W81-K149 HydrophobicContact CD2-CG 4.41Å; W81-K149 HydrophobicContact CG-CD 3.86Å; W81-K149 HydrophobicContact CG-CG 4.1Å
82	K	47.5	Very low	43.1	Very low	184 Å²	184	100.1 Å²	100.1	80%	0.8	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-103.7	132.1	166.3	-75.5	-171.9	177.2	-174.2	0	109.4
83	P	50.7	Low	44.8	Very low	76 Å²	76	95 Å²	95	49%	0.494	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-63.3	145.2	176.3	24.9	-31.7	0	0	0	111	W81 G85	W81-P83 HydrophobicContact CH2-CB 3.64Å; W81-P83 HydrophobicContact CZ2-CB 4.25Å; W81-P83 HydrophobicContact CZ3-CB 3.84Å; W81-P83 HydrophobicContact CZ3-CG 4.48Å; P83-G85 PolarHBondContact O-N 2.91Å
84	P	40.4	Very low	46.7	Very low	104 Å²	104	96.3 Å²	96.3	68%	0.675	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-65.2	123.8	176.4	25.8	-31.2	0	0	0	109.7
85	G	36.2	Very low	48.3	Very low	74 Å²	74	93.1 Å²	93.1	76%	0.763	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-68.6	133.7	-173.6	0	0	0	0	0	113.4	P83	P83-G85 PolarHBondContact O-N 2.91Å
86	N	32.3	Very low	50.1	Low	160 Å²	160	92.5 Å²	92.5	86%	0.856	57%	0.567	S	S	*	*			trans	-131.8	146.7	143.5	-123.6	5.5	0	0	0	108.1
87	S	30.9	Very low	51.8	Low	109 Å²	109	93.6 Å²	93.6	76%	0.762	56%	0.562	S	S	*	*	S	Bend	trans	-50.2	152.7	-169.1	41.8	0	0	0	0	116.4
88	A	27.9	Very low	53.5	Low	88 Å²	88	96.6 Å²	96.6	73%	0.727	57%	0.57	S	S	*	*	S	Bend	trans	73.3	127	172.9	0	0	0	0	0	115.9	S90	A88-S90 VanDerWaalsContact C-N 3.32Å; A88-S90 PolarHBondContact O-N 3.23Å
89	M	37.6	Very low	54.6	Low	208 Å²	208	90.7 Å²	90.7	100%	1.025	55%	0.548	S	S	*	.			trans	-49.4	92.5	168.8	-71.1	164.1	113.5	0	0	110.1
90	S	36	Very low	56.2	Low	100 Å²	100	88 Å²	88	70%	0.699	53%	0.526	S	S	*	.			trans	-118	129.2	163.1	63.8	0	0	0	0	107.1	A88 T92	A88-S90 VanDerWaalsContact C-N 3.32Å; A88-S90 PolarHBondContact O-N 3.23Å; S90-T92 PolarHBondContact O-N 3.46Å; S90-T92 VanDerWaalsContact O-N 3.09Å
91	S	47.3	Very low	57.7	Low	124 Å²	124	88 Å²	88	87%	0.867	52%	0.522	S	S	*	.			trans	-42.5	108.5	-168.8	51.6	0	0	0	0	113.7	S93	S91-S93 PolarHBondContact O-N 3.4Å
92	T	57.8	Low	59.4	Low	78 Å²	78	87.6 Å²	87.6	48%	0.479	52%	0.523	S	S	.	.			trans	-62.3	133.8	164.5	-53	0	0	0	0	107.9	S90 L96	S90-T92 PolarHBondContact O-N 3.46Å; S90-T92 VanDerWaalsContact O-N 3.09Å; T92-L96 HydrophobicContact CG2-CB 4.18Å; T92-L96 HydrophobicContact CG2-CD2 3.86Å; T92-L96 HydrophobicContact CG2-CG 4Å
93	S	67.1	Low	61.2	Low	30 Å²	30	78.9 Å²	78.9	21%	0.21	49%	0.485	C	S	.	.			trans	-60.3	141.9	-176.3	73.3	0	0	0	0	110.7	S91 N95 L96 Q97 E136	S91-S93 PolarHBondContact O-N 3.4Å; S93-N95 PolarHBondContact O-N 2.97Å; S93-N95 VanDerWaalsContact O-N 3.11Å; S93-L96 PolarHBondContact O-N 2.93Å; S93-L96 WeakPolarHBondContact OG-CB 3.39Å; S93-L96 PolarHBondContact OG-N 3.45Å; S93-Q97 PolarHBondContact O-N 3.24Å; S93-E136 WeakPolarHBondContact CB-OE2 3.22Å; S93-E136 PolarHBondContact OG-OE2 3.07Å
94	P	76.9	Confident	62.9	Low	93 Å²	93	76 Å²	76	60%	0.604	47%	0.469	S	S	*	.	H	α-helix	trans	-60	-27.9	-175.2	23.1	-33.8	0	0	0	112.4	K98	P94-K98 VanDerWaalsContact O-CG 3.32Å; P94-K98 WeakPolarHBondContact O-CG 3.23Å; P94-K98 PolarHBondContact O-N 3.24Å
95	N	76	Confident	65.1	Low	40 Å²	40	76.6 Å²	76.6	21%	0.214	46%	0.461	C	S	.	.	H	α-helix	trans	-79.3	-33.6	177.2	-68.1	-34.9	0	0	0	112.8	S93 A99 V132 E136	S93-N95 PolarHBondContact O-N 2.97Å; S93-N95 VanDerWaalsContact O-N 3.11Å; N95-A99 WeakPolarHBondContact O-CB 3.28Å; N95-A99 PolarHBondContact O-N 3.18Å; N95-V132 HydrophobicContact CB-CG2 4.03Å; N95-E136 PolarHBondContact ND2-OE1 3.45Å
96	L	78.8	Confident	67.5	Low	30 Å²	30	73.1 Å²	73.1	16%	0.157	43%	0.425	C	S	.	.	H	α-helix	trans	-68.4	-40.3	173.3	179.4	57.1	0	0	0	111.4	T92 S93 A99 I100 F129 V132 I146	T92-L96 HydrophobicContact CG2-CB 4.18Å; T92-L96 HydrophobicContact CG2-CD2 3.86Å; T92-L96 HydrophobicContact CG2-CG 4Å; S93-L96 PolarHBondContact O-N 2.93Å; S93-L96 WeakPolarHBondContact OG-CB 3.39Å; S93-L96 PolarHBondContact OG-N 3.45Å; L96-A99 WeakPolarHBondContact O-CB 3.3Å; L96-A99 PolarHBondContact O-N 3.13Å; L96-I100 HydrophobicContact CD1-CD1 4.19Å; L96-I100 HydrophobicContact CD1-CG1 4.4Å; L96-I100 HydrophobicContact CG-CD1 4.11Å; L96-I100 VanDerWaalsContact O-CG1 3.32Å; L96-I100 WeakPolarHBondContact O-CG1 3.32Å; L96-I100 PolarHBondContact O-N 3.45Å; L96-F129 HydrophobicContact CD1-CD1 4.15Å; L96-F129 HydrophobicContact CD1-CE1 3.9Å; L96-V132 HydrophobicContact CB-CG1 4.17Å; L96-V132 HydrophobicContact CB-CG2 4.02Å; L96-V132 HydrophobicContact CD1-CG1 4.24Å; L96-I146 HydrophobicContact CD1-CD1 4.34Å
97	Q	81.1	Confident	70	Confident	81 Å²	81	65.5 Å²	65.5	38%	0.379	38%	0.384	S	S	.	.	H	α-helix	trans	-62.7	-46.2	176.1	-169	60.5	37.2	0	0	111.4	S93 A99 I100 D101	S93-Q97 PolarHBondContact O-N 3.24Å; Q97-A99 VanDerWaalsContact C-N 3.29Å; Q97-A99 PolarHBondContact O-N 3.1Å; Q97-I100 PolarHBondContact O-N 3.1Å; Q97-D101 PolarHBondContact NE2-OD1 3.23Å; Q97-D101 VanDerWaalsContact O-CG 3.23Å; Q97-D101 PolarHBondContact O-N 3.16Å
98	K	83.2	Confident	72.6	Confident	113 Å²	113	66.1 Å²	66.1	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-58.4	-39.1	174.2	-76.4	177.1	-178.7	179.9	0	112.8	P94 D101 L102	P94-K98 VanDerWaalsContact O-CG 3.32Å; P94-K98 WeakPolarHBondContact O-CG 3.23Å; P94-K98 PolarHBondContact O-N 3.24Å; K98-D101 PolarHBondContact O-N 2.62Å; K98-L102 WeakPolarHBondContact O-CB 3.48Å; K98-L102 VanDerWaalsContact O-CG 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.44Å; K98-L102 PolarHBondContact O-N 3.01Å
99	A	82.9	Confident	75.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-63.8	-41.8	177.2	0	0	0	0	0	112.1	N95 L96 Q97 A103 F129	N95-A99 WeakPolarHBondContact O-CB 3.28Å; N95-A99 PolarHBondContact O-N 3.18Å; L96-A99 WeakPolarHBondContact O-CB 3.3Å; L96-A99 PolarHBondContact O-N 3.13Å; Q97-A99 VanDerWaalsContact C-N 3.29Å; Q97-A99 PolarHBondContact O-N 3.1Å; A99-A103 WeakPolarHBondContact O-CB 3.3Å; A99-A103 PolarHBondContact O-N 3.38Å; A99-F129 HydrophobicContact CB-CD1 3.67Å; A99-F129 HydrophobicContact CB-CD2 4.06Å; A99-F129 HydrophobicContact CB-CE1 3.63Å; A99-F129 HydrophobicContact CB-CE2 4.01Å; A99-F129 HydrophobicContact CB-CG 3.88Å; A99-F129 HydrophobicContact CB-CZ 3.8Å
100	I	85.4	Confident	77.4	Confident	32 Å²	32	54.5 Å²	54.5	16%	0.164	30%	0.303	C	S	.	.	H	α-helix	trans	-66.8	-43.6	177.9	-65.5	165.6	0	0	0	110.7	W81 L96 Q97 A103 G104 F129	W81-I100 HydrophobicContact CE3-CD1 4.35Å; W81-I100 HydrophobicContact CE3-CG1 4.27Å; W81-I100 HydrophobicContact CZ3-CD1 4.04Å; W81-I100 HydrophobicContact CZ3-CG1 4.31Å; L96-I100 HydrophobicContact CD1-CD1 4.19Å; L96-I100 HydrophobicContact CD1-CG1 4.4Å; L96-I100 HydrophobicContact CG-CD1 4.11Å; L96-I100 VanDerWaalsContact O-CG1 3.32Å; L96-I100 WeakPolarHBondContact O-CG1 3.32Å; L96-I100 PolarHBondContact O-N 3.45Å; Q97-I100 PolarHBondContact O-N 3.1Å; I100-A103 PolarHBondContact O-N 3.14Å; I100-G104 PolarHBondContact O-N 3.2Å; I100-F129 HydrophobicContact CG1-CE1 4.18Å; I100-F129 HydrophobicContact CG1-CZ 4.17Å
101	D	84.3	Confident	79.7	Confident	79 Å²	79	55.7 Å²	55.7	42%	0.422	30%	0.296	S	S	.	.	H	α-helix	trans	-64.7	-42.3	179.6	-64	-18.5	0	0	0	111.5	Q97 K98 G104 K105	Q97-D101 PolarHBondContact NE2-OD1 3.23Å; Q97-D101 VanDerWaalsContact O-CG 3.23Å; Q97-D101 PolarHBondContact O-N 3.16Å; K98-D101 PolarHBondContact O-N 2.62Å; D101-G104 PolarHBondContact O-N 3.43Å; D101-K105 WeakPolarHBondContact O-CG 3.41Å; D101-K105 PolarHBondContact O-N 2.82Å
102	L	87.2	Confident	81.3	Confident	36 Å²	36	52.9 Å²	52.9	19%	0.188	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-41.5	175.5	-73.8	170.6	0	0	0	112.2	K98 G104 K105 A106 L121 H124 A125 Y128	K98-L102 WeakPolarHBondContact O-CB 3.48Å; K98-L102 VanDerWaalsContact O-CG 3.28Å; K98-L102 WeakPolarHBondContact O-CG 3.44Å; K98-L102 PolarHBondContact O-N 3.01Å; L102-G104 VanDerWaalsContact C-N 3.32Å; L102-K105 PolarHBondContact O-N 3.4Å; L102-A106 WeakPolarHBondContact O-CB 3.28Å; L102-A106 PolarHBondContact O-N 2.79Å; L102-L121 HydrophobicContact CD2-CD2 4.13Å; L102-H124 HydrophobicContact CD1-CB 4.44Å; L102-A125 HydrophobicContact CB-CB 4.06Å; L102-Y128 HydrophobicContact CD1-CD2 3.57Å; L102-Y128 HydrophobicContact CD1-CE2 3.76Å
103	A	85.1	Confident	82.3	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-36.5	175	0	0	0	0	0	112.2	A99 I100 A106 S107 A125 F129 Y153	A99-A103 WeakPolarHBondContact O-CB 3.3Å; A99-A103 PolarHBondContact O-N 3.38Å; I100-A103 PolarHBondContact O-N 3.14Å; A103-A106 PolarHBondContact O-N 3.06Å; A103-S107 PolarHBondContact O-N 3.03Å; A103-A125 HydrophobicContact CB-CB 4.02Å; A103-F129 HydrophobicContact CB-CE2 4.03Å; A103-F129 HydrophobicContact CB-CZ 4.43Å; A103-Y153 HydrophobicContact CB-CE2 3.91Å
104	G	86.2	Confident	83.1	Confident	14 Å²	14	53.1 Å²	53.1	14%	0.144	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-46.9	174.2	0	0	0	0	0	112.2	I100 D101 L102 S107 Q108	I100-G104 PolarHBondContact O-N 3.2Å; D101-G104 PolarHBondContact O-N 3.43Å; L102-G104 VanDerWaalsContact C-N 3.32Å; G104-S107 PolarHBondContact O-N 3.23Å; G104-Q108 WeakPolarHBondContact O-CG 3.49Å; G104-Q108 PolarHBondContact O-N 3.38Å; G104-Q108 VanDerWaalsContact O-N 3.14Å
105	K	87.9	Confident	83.3	Confident	118 Å²	118	51.3 Å²	51.3	51%	0.513	27%	0.265	S	S	.	.	H	α-helix	trans	-61.8	-44.5	174	-71.4	178.8	-179.4	-175.2	0	111.8	D101 L102 S107 Q108 E109 L121	D101-K105 WeakPolarHBondContact O-CG 3.41Å; D101-K105 PolarHBondContact O-N 2.82Å; L102-K105 PolarHBondContact O-N 3.4Å; K105-S107 VanDerWaalsContact C-N 3.3Å; K105-S107 PolarHBondContact O-N 3.23Å; K105-Q108 WeakPolarHBondContact O-CB 3.45Å; K105-Q108 PolarHBondContact O-N 3.41Å; K105-E109 PolarHBondContact O-N 2.95Å; K105-L121 HydrophobicContact CB-CD1 4.21Å
106	A	85.5	Confident	83.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-56.4	-44.1	176.6	0	0	0	0	0	112.2	L102 A103 Q108 E109 D110 L121 Y122	L102-A106 WeakPolarHBondContact O-CB 3.28Å; L102-A106 PolarHBondContact O-N 2.79Å; A103-A106 PolarHBondContact O-N 3.06Å; A106-Q108 VanDerWaalsContact C-N 3.31Å; A106-Q108 PolarHBondContact O-N 2.93Å; A106-E109 PolarHBondContact O-N 3.47Å; A106-D110 WeakPolarHBondContact O-CB 3.41Å; A106-D110 PolarHBondContact O-N 2.82Å; A106-L121 HydrophobicContact CB-CB 3.59Å; A106-Y122 HydrophobicContact CB-CD1 3.59Å; A106-Y122 HydrophobicContact CB-CD2 4.02Å; A106-Y122 HydrophobicContact CB-CE1 3.59Å; A106-Y122 HydrophobicContact CB-CE2 4.06Å; A106-Y122 HydrophobicContact CB-CG 3.79Å
107	S	85.8	Confident	83.8	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.007	30%	0.3	C	S	.	.	H	α-helix	trans	-69	-24.3	176.4	-78.4	0	0	0	0	114.1	R78 A103 G104 K105 K111 Y122	R78-S107 PolarHBondContact O-OG 2.95Å; R78-S107 VanDerWaalsContact O-OG 3.08Å; A103-S107 PolarHBondContact O-N 3.03Å; G104-S107 PolarHBondContact O-N 3.23Å; K105-S107 VanDerWaalsContact C-N 3.3Å; K105-S107 PolarHBondContact O-N 3.23Å; S107-K111 WeakPolarHBondContact O-CD 3.44Å; S107-K111 VanDerWaalsContact O-CG 3.31Å; S107-K111 WeakPolarHBondContact O-CG 3.31Å; S107-K111 PolarHBondContact O-N 3.12Å; S107-Y122 WeakPolarHBondContact CA-OH 3.49Å; S107-Y122 PolarHBondContact OG-OH 3.4Å
108	Q	84.8	Confident	83.9	Confident	121 Å²	121	55.2 Å²	55.2	57%	0.565	28%	0.281	S	S	*	.	H	α-helix	trans	-77	-43.1	173.8	-72.2	173	0.5	0	0	110.9	G104 K105 A106 D110 K111 A112	G104-Q108 WeakPolarHBondContact O-CG 3.49Å; G104-Q108 PolarHBondContact O-N 3.38Å; G104-Q108 VanDerWaalsContact O-N 3.14Å; K105-Q108 WeakPolarHBondContact O-CB 3.45Å; K105-Q108 PolarHBondContact O-N 3.41Å; A106-Q108 VanDerWaalsContact C-N 3.31Å; A106-Q108 PolarHBondContact O-N 2.93Å; Q108-D110 VanDerWaalsContact C-N 3.33Å; Q108-D110 PolarHBondContact O-N 3.11Å; Q108-K111 WeakPolarHBondContact O-CA 3.26Å; Q108-K111 VanDerWaalsContact O-CB 3.31Å; Q108-K111 WeakPolarHBondContact O-CB 3.41Å; Q108-K111 PolarHBondContact O-N 2.83Å; Q108-K111 VanDerWaalsContact O-N 3.11Å; Q108-A112 PolarHBondContact O-N 3.29Å
109	E	83.9	Confident	83.9	Confident	47 Å²	47	50.4 Å²	50.4	22%	0.22	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-35.4	176	-65.7	-49.9	135.7	0	0	112.2	K105 A106 K111 A112 G113 N114 E117 A118 L121	K105-E109 PolarHBondContact O-N 2.95Å; A106-E109 PolarHBondContact O-N 3.47Å; E109-K111 VanDerWaalsContact C-N 3.27Å; E109-K111 PolarHBondContact O-N 3.41Å; E109-A112 PolarHBondContact O-N 3.37Å; E109-A112 VanDerWaalsContact O-N 3.16Å; E109-G113 PolarHBondContact O-N 3.35Å; E109-G113 VanDerWaalsContact O-N 3.08Å; E109-N114 HydrophobicContact CB-CB 4.34Å; E109-N114 PolarHBondContact O-N 3.46Å; E109-N114 WeakPolarHBondContact OE2-CB 3.26Å; E109-N114 PolarHBondContact OE2-ND2 3.03Å; E109-E117 HydrophobicContact CG-CG 4.46Å; E109-A118 HydrophobicContact CB-CB 4.01Å; E109-L121 HydrophobicContact CB-CD1 4.47Å; E109-L121 HydrophobicContact CG-CD1 3.84Å
110	D	83.1	Confident	84	Confident	5 Å²	5	55.2 Å²	55.2	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-64.4	-32.5	172.4	-168.1	23.1	0	0	0	111.9	A106 Q108 A118 Y122 R156	A106-D110 WeakPolarHBondContact O-CB 3.41Å; A106-D110 PolarHBondContact O-N 2.82Å; Q108-D110 VanDerWaalsContact C-N 3.33Å; Q108-D110 PolarHBondContact O-N 3.11Å; D110-A118 HydrophobicContact CB-CB 4.07Å; D110-Y122 HydrophobicContact CB-CE2 4.23Å; D110-R156 VanDerWaalsContact CG-NH2 3.27Å; D110-R156 IonicContact OD1-CZ 3.91Å; D110-R156 IonicContact OD1-NE 3.99Å; D110-R156 IonicContact OD1-NH2 3.28Å; D110-R156 PolarHBondContact OD1-NH2 3Å; D110-R156 IonicContact OD2-CZ 3.64Å; D110-R156 VanDerWaalsContact OD2-CZ 3.27Å; D110-R156 IonicContact OD2-NE 2.72Å; D110-R156 PolarHBondContact OD2-NE 2.94Å; D110-R156 IonicContact OD2-NH2 3.04Å; D110-R156 PolarHBondContact OD2-NH2 3.48Å
111	K	82.9	Confident	84	Confident	125 Å²	125	55 Å²	55	54%	0.543	28%	0.283	S	S	.	.	H	α-helix	trans	-72.4	-36.8	171.4	-77.7	169.2	-177.8	-170.5	0	112.4	P77 S107 Q108 E109 G113	P77-K111 HydrophobicContact CB-CD 4.29Å; P77-K111 HydrophobicContact CB-CG 3.42Å; P77-K111 VanDerWaalsContact CB-CG 3.42Å; P77-K111 HydrophobicContact CG-CB 4.33Å; P77-K111 HydrophobicContact CG-CD 4.17Å; P77-K111 HydrophobicContact CG-CG 3.24Å; S107-K111 WeakPolarHBondContact O-CD 3.44Å; S107-K111 VanDerWaalsContact O-CG 3.31Å; S107-K111 WeakPolarHBondContact O-CG 3.31Å; S107-K111 PolarHBondContact O-N 3.12Å; Q108-K111 WeakPolarHBondContact O-CA 3.26Å; Q108-K111 VanDerWaalsContact O-CB 3.31Å; Q108-K111 WeakPolarHBondContact O-CB 3.41Å; Q108-K111 PolarHBondContact O-N 2.83Å; Q108-K111 VanDerWaalsContact O-N 3.11Å; E109-K111 VanDerWaalsContact C-N 3.27Å; E109-K111 PolarHBondContact O-N 3.41Å; K111-G113 PolarHBondContact O-N 3.05Å
112	A	81.1	Confident	84.1	Confident	65 Å²	65	51.3 Å²	51.3	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-74.1	-11.6	-179.9	0	0	0	0	0	113	Q108 E109	Q108-A112 PolarHBondContact O-N 3.29Å; E109-A112 PolarHBondContact O-N 3.37Å; E109-A112 VanDerWaalsContact O-N 3.16Å
113	G	78.9	Confident	83.9	Confident	32 Å²	32	50.2 Å²	50.2	33%	0.33	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	8	-178.9	0	0	0	0	0	114	E109 K111 Y115	E109-G113 PolarHBondContact O-N 3.35Å; E109-G113 VanDerWaalsContact O-N 3.08Å; K111-G113 PolarHBondContact O-N 3.05Å; G113-Y115 VanDerWaalsContact C-N 3.27Å; G113-Y115 WeakPolarHBondContact O-CD2 3.37Å; G113-Y115 PolarHBondContact O-N 2.97Å
114	N	83.4	Confident	83.9	Confident	81 Å²	81	54.4 Å²	54.4	43%	0.433	28%	0.276	S	S	.	.			trans	-83.8	68.9	177	-67.4	-25.2	0	0	0	110.2	E109 E116 E117 A118	E109-N114 HydrophobicContact CB-CB 4.34Å; E109-N114 PolarHBondContact O-N 3.46Å; E109-N114 WeakPolarHBondContact OE2-CB 3.26Å; E109-N114 PolarHBondContact OE2-ND2 3.03Å; N114-E116 VanDerWaalsContact C-N 3.31Å; N114-E116 PolarHBondContact O-N 2.99Å; N114-E117 PolarHBondContact O-N 3.29Å; N114-A118 WeakPolarHBondContact O-CB 3.46Å; N114-A118 PolarHBondContact O-N 3.33Å
115	Y	82.8	Confident	83.9	Confident	56 Å²	56	53.8 Å²	53.8	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-65.8	-27.8	-169.6	-58.6	-54.4	0	0	0	114.7	G113 L119 L160 Y163	G113-Y115 VanDerWaalsContact C-N 3.27Å; G113-Y115 WeakPolarHBondContact O-CD2 3.37Å; G113-Y115 PolarHBondContact O-N 2.97Å; Y115-L119 VanDerWaalsContact O-CB 3.31Å; Y115-L119 WeakPolarHBondContact O-CB 3.48Å; Y115-L119 PolarHBondContact O-N 3.44Å; Y115-L119 VanDerWaalsContact O-N 3.09Å; Y115-L160 HydrophobicContact CD1-CD2 3.38Å; Y115-L160 HydrophobicContact CE1-CD2 4.01Å; Y115-L160 HydrophobicContact CG-CD2 4.03Å; Y115-Y163 AromaticContact CD2-CD1 3.97Å; Y115-Y163 HydrophobicContact CD2-CD1 3.97Å; Y115-Y163 AromaticContact CD2-CE1 3.7Å; Y115-Y163 HydrophobicContact CD2-CE1 3.7Å; Y115-Y163 HydrophobicContact CE2-CD1 4.22Å; Y115-Y163 AromaticContact CE2-CE1 3.64Å; Y115-Y163 HydrophobicContact CE2-CE1 3.64Å
116	E	81.4	Confident	83.8	Confident	131 Å²	131	48.1 Å²	48.1	61%	0.612	24%	0.244	S	C	*	.	H	α-helix	trans	-70.1	-46.6	177.1	-71.2	175.2	-164	0	0	111.6	N114 L119 Q120 L164	N114-E116 VanDerWaalsContact C-N 3.31Å; N114-E116 PolarHBondContact O-N 2.99Å; E116-L119 PolarHBondContact O-N 3.35Å; E116-Q120 PolarHBondContact O-N 2.94Å; E116-L164 HydrophobicContact CG-CD1 3.85Å; E116-L164 HydrophobicContact CG-CD2 3.86Å
117	E	83.1	Confident	83.7	Confident	102 Å²	102	52 Å²	52	48%	0.477	26%	0.262	S	S	.	.	H	α-helix	trans	-70.5	-39.9	178	-168.8	167.4	-171.6	0	0	111.3	E109 N114 L119 Q120 L121	E109-E117 HydrophobicContact CG-CG 4.46Å; N114-E117 PolarHBondContact O-N 3.29Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 3.09Å; E117-Q120 PolarHBondContact O-N 2.82Å; E117-L121 HydrophobicContact CG-CD1 4.11Å; E117-L121 HydrophobicContact CG-CG 4.5Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 3.4Å
118	A	82.6	Confident	83.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-41.7	173.1	0	0	0	0	0	112.2	E109 D110 N114 L121 Y122 L160	E109-A118 HydrophobicContact CB-CB 4.01Å; D110-A118 HydrophobicContact CB-CB 4.07Å; N114-A118 WeakPolarHBondContact O-CB 3.46Å; N114-A118 PolarHBondContact O-N 3.33Å; A118-L121 PolarHBondContact O-N 3.08Å; A118-Y122 HydrophobicContact CB-CE2 4.5Å; A118-Y122 WeakPolarHBondContact O-CB 3.46Å; A118-Y122 WeakPolarHBondContact O-CD2 3.38Å; A118-Y122 PolarHBondContact O-N 3.04Å; A118-L160 HydrophobicContact CB-CD1 4.21Å
119	L	84.1	Confident	83.4	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.063	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-42.1	178	179.7	149.7	0	0	0	112	Y115 E116 E117 Q123 L160 K161 L164	Y115-L119 VanDerWaalsContact O-CB 3.31Å; Y115-L119 WeakPolarHBondContact O-CB 3.48Å; Y115-L119 PolarHBondContact O-N 3.44Å; Y115-L119 VanDerWaalsContact O-N 3.09Å; E116-L119 PolarHBondContact O-N 3.35Å; E117-L119 VanDerWaalsContact C-N 3.3Å; E117-L119 PolarHBondContact O-N 3.09Å; L119-Q123 WeakPolarHBondContact O-CG 3.42Å; L119-Q123 PolarHBondContact O-N 3.34Å; L119-Q123 VanDerWaalsContact O-N 3.14Å; L119-L160 HydrophobicContact CD1-CB 4.47Å; L119-K161 HydrophobicContact CD1-CB 3.77Å; L119-K161 HydrophobicContact CD1-CG 4.29Å; L119-L164 HydrophobicContact CD1-CD1 4.36Å
120	Q	84	Confident	83.2	Confident	101 Å²	101	49 Å²	49	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-44.6	176.3	-68.3	-176.7	2.4	0	0	111.7	E116 E117 Y122 Q123 H124	E116-Q120 PolarHBondContact O-N 2.94Å; E117-Q120 PolarHBondContact O-N 2.82Å; Q120-Y122 PolarHBondContact O-N 3.05Å; Q120-Q123 PolarHBondContact O-N 3.16Å; Q120-H124 PolarHBondContact O-N 3.05Å
121	L	85.9	Confident	83.1	Confident	28 Å²	28	52.6 Å²	52.6	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-38.7	178.9	-69.2	170.8	0	0	0	112.2	L102 K105 A106 E109 E117 A118 H124 A125	L102-L121 HydrophobicContact CD2-CD2 4.13Å; K105-L121 HydrophobicContact CB-CD1 4.21Å; A106-L121 HydrophobicContact CB-CB 3.59Å; E109-L121 HydrophobicContact CB-CD1 4.47Å; E109-L121 HydrophobicContact CG-CD1 3.84Å; E117-L121 HydrophobicContact CG-CD1 4.11Å; E117-L121 HydrophobicContact CG-CG 4.5Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 3.4Å; A118-L121 PolarHBondContact O-N 3.08Å; L121-H124 PolarHBondContact O-N 3.45Å; L121-A125 WeakPolarHBondContact O-CB 3.41Å; L121-A125 PolarHBondContact O-N 3.42Å
122	Y	85.9	Confident	82.9	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-40.8	173.4	-82.1	-53.7	0	0	0	112.3	A106 S107 D110 A118 Q120 A125 V126 Y153 R156 L160	A106-Y122 HydrophobicContact CB-CD1 3.59Å; A106-Y122 HydrophobicContact CB-CD2 4.02Å; A106-Y122 HydrophobicContact CB-CE1 3.59Å; A106-Y122 HydrophobicContact CB-CE2 4.06Å; A106-Y122 HydrophobicContact CB-CG 3.79Å; S107-Y122 WeakPolarHBondContact CA-OH 3.49Å; S107-Y122 PolarHBondContact OG-OH 3.4Å; D110-Y122 HydrophobicContact CB-CE2 4.23Å; A118-Y122 HydrophobicContact CB-CE2 4.5Å; A118-Y122 WeakPolarHBondContact O-CB 3.46Å; A118-Y122 WeakPolarHBondContact O-CD2 3.38Å; A118-Y122 PolarHBondContact O-N 3.04Å; Q120-Y122 PolarHBondContact O-N 3.05Å; Y122-A125 PolarHBondContact O-N 3.47Å; Y122-V126 VanDerWaalsContact O-CG2 3.29Å; Y122-V126 WeakPolarHBondContact O-CG2 3.43Å; Y122-V126 PolarHBondContact O-N 3.4Å; Y122-V126 VanDerWaalsContact O-N 3.09Å; Y122-Y153 AromaticContact CD1-CD1 3.67Å; Y122-Y153 HydrophobicContact CD1-CD1 3.67Å; Y122-Y153 HydrophobicContact CD1-CE1 4.44Å; Y122-Y153 AromaticContact CD1-CG 4Å; Y122-Y153 HydrophobicContact CD1-CG 4Å; Y122-Y153 AromaticContact CE1-CD1 3.36Å; Y122-Y153 HydrophobicContact CE1-CD1 3.36Å; Y122-Y153 AromaticContact CE1-CE1 3.82Å; Y122-Y153 HydrophobicContact CE1-CE1 3.82Å; Y122-Y153 HydrophobicContact CE1-CG 4.16Å; Y122-R156 HydrophobicContact CE2-CG 4Å; Y122-L160 HydrophobicContact CD2-CD1 4.15Å; Y122-L160 HydrophobicContact CE2-CD1 4.14Å
123	Q	83.8	Confident	82.8	Confident	12 Å²	12	43.9 Å²	43.9	6%	0.056	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-44.2	176.5	-72.5	175.9	9.3	0	0	112	V25 L119 Q120 V126 Q127	V25-Q123 HydrophobicContact CG2-CG 4.49Å; L119-Q123 WeakPolarHBondContact O-CG 3.42Å; L119-Q123 PolarHBondContact O-N 3.34Å; L119-Q123 VanDerWaalsContact O-N 3.14Å; Q120-Q123 PolarHBondContact O-N 3.16Å; Q123-V126 PolarHBondContact O-N 2.93Å; Q123-Q127 WeakPolarHBondContact O-CG 3.19Å; Q123-Q127 PolarHBondContact O-N 2.98Å; Q123-Q127 VanDerWaalsContact O-N 3.15Å
124	H	85.1	Confident	82.7	Confident	91 Å²	91	47.9 Å²	47.9	42%	0.421	22%	0.221	S	C	.	.	H	α-helix	trans	-64.3	-43.8	177.5	-78.1	-155.7	0	0	0	111.3	L102 Q120 L121 V126 Q127 Y128	L102-H124 HydrophobicContact CD1-CB 4.44Å; Q120-H124 PolarHBondContact O-N 3.05Å; L121-H124 PolarHBondContact O-N 3.45Å; H124-V126 VanDerWaalsContact C-N 3.34Å; H124-V126 PolarHBondContact O-N 3.02Å; H124-Q127 PolarHBondContact O-N 3.48Å; H124-Y128 VanDerWaalsContact O-CD2 3.26Å; H124-Y128 WeakPolarHBondContact O-CD2 3.47Å; H124-Y128 PolarHBondContact O-N 2.95Å; H124-Y128 VanDerWaalsContact O-N 3.15Å
125	A	85.1	Confident	82.1	Confident	0 Å²	0	51 Å²	51	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.1	-44.9	176.9	0	0	0	0	0	112.1	L102 A103 L121 Y122 Q127 Y128 F129	L102-A125 HydrophobicContact CB-CB 4.06Å; A103-A125 HydrophobicContact CB-CB 4.02Å; L121-A125 WeakPolarHBondContact O-CB 3.41Å; L121-A125 PolarHBondContact O-N 3.42Å; Y122-A125 PolarHBondContact O-N 3.47Å; A125-Q127 PolarHBondContact O-N 2.87Å; A125-Y128 PolarHBondContact O-N 3.42Å; A125-F129 HydrophobicContact CB-CE2 4.38Å; A125-F129 WeakPolarHBondContact O-CD2 3.27Å; A125-F129 PolarHBondContact O-N 2.84Å
126	V	85.8	Confident	81.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-38.5	178.6	173.1	0	0	0	0	112	V28 Y122 Q123 H124 F129 L130 L154	V28-V126 HydrophobicContact CG1-CG1 3.7Å; Y122-V126 VanDerWaalsContact O-CG2 3.29Å; Y122-V126 WeakPolarHBondContact O-CG2 3.43Å; Y122-V126 PolarHBondContact O-N 3.4Å; Y122-V126 VanDerWaalsContact O-N 3.09Å; Q123-V126 PolarHBondContact O-N 2.93Å; H124-V126 VanDerWaalsContact C-N 3.34Å; H124-V126 PolarHBondContact O-N 3.02Å; V126-F129 PolarHBondContact O-N 3.07Å; V126-L130 HydrophobicContact CG1-CD1 4.17Å; V126-L130 HydrophobicContact CG1-CG 4.45Å; V126-L130 WeakPolarHBondContact O-CB 3.45Å; V126-L130 WeakPolarHBondContact O-CG 3.21Å; V126-L130 PolarHBondContact O-N 3.1Å; V126-L154 HydrophobicContact CG1-CD1 4.13Å; V126-L154 HydrophobicContact CG1-CD2 4.07Å; V126-L154 HydrophobicContact CG1-CG 4.06Å; V126-L154 HydrophobicContact CG2-CD2 4.25Å; V126-L154 HydrophobicContact CG2-CG 4.08Å
127	Q	83.5	Confident	80.2	Confident	81 Å²	81	45.9 Å²	45.9	38%	0.379	21%	0.208	S	C	.	.	H	α-helix	trans	-61.7	-44.3	175.8	-72.9	179.1	6.2	0	0	111.9	V28 Q123 H124 A125 L130 H131	V28-Q127 HydrophobicContact CG2-CG 4.36Å; Q123-Q127 WeakPolarHBondContact O-CG 3.19Å; Q123-Q127 PolarHBondContact O-N 2.98Å; Q123-Q127 VanDerWaalsContact O-N 3.15Å; H124-Q127 PolarHBondContact O-N 3.48Å; A125-Q127 PolarHBondContact O-N 2.87Å; Q127-L130 PolarHBondContact O-N 3.25Å; Q127-H131 PolarHBondContact O-N 3.29Å
128	Y	82.4	Confident	78.8	Confident	90 Å²	90	50 Å²	50	35%	0.353	23%	0.227	S	C	.	.	H	α-helix	trans	-67.3	-40.4	176.4	-78.8	-75.2	0	0	0	112.3	L102 H124 A125 L130 H131 V132	L102-Y128 HydrophobicContact CD1-CD2 3.57Å; L102-Y128 HydrophobicContact CD1-CE2 3.76Å; H124-Y128 VanDerWaalsContact O-CD2 3.26Å; H124-Y128 WeakPolarHBondContact O-CD2 3.47Å; H124-Y128 PolarHBondContact O-N 2.95Å; H124-Y128 VanDerWaalsContact O-N 3.15Å; A125-Y128 PolarHBondContact O-N 3.42Å; Y128-L130 VanDerWaalsContact C-N 3.32Å; Y128-L130 PolarHBondContact O-N 2.89Å; Y128-H131 WeakPolarHBondContact O-CB 3.46Å; Y128-H131 PolarHBondContact O-N 3.08Å; Y128-V132 WeakPolarHBondContact O-CG2 3.41Å; Y128-V132 PolarHBondContact O-N 3.3Å
129	F	82.1	Confident	78.1	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.013	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-38.6	174.5	-78	-59.8	0	0	0	112.7	L96 A99 I100 A103 A125 V126 V132 V133 I146 C150 Y153	L96-F129 HydrophobicContact CD1-CD1 4.15Å; L96-F129 HydrophobicContact CD1-CE1 3.9Å; A99-F129 HydrophobicContact CB-CD1 3.67Å; A99-F129 HydrophobicContact CB-CD2 4.06Å; A99-F129 HydrophobicContact CB-CE1 3.63Å; A99-F129 HydrophobicContact CB-CE2 4.01Å; A99-F129 HydrophobicContact CB-CG 3.88Å; A99-F129 HydrophobicContact CB-CZ 3.8Å; I100-F129 HydrophobicContact CG1-CE1 4.18Å; I100-F129 HydrophobicContact CG1-CZ 4.17Å; A103-F129 HydrophobicContact CB-CE2 4.03Å; A103-F129 HydrophobicContact CB-CZ 4.43Å; A125-F129 HydrophobicContact CB-CE2 4.38Å; A125-F129 WeakPolarHBondContact O-CD2 3.27Å; A125-F129 PolarHBondContact O-N 2.84Å; V126-F129 PolarHBondContact O-N 3.07Å; F129-V132 PolarHBondContact O-N 2.96Å; F129-V133 WeakPolarHBondContact O-CG2 3.22Å; F129-V133 PolarHBondContact O-N 3.08Å; F129-I146 HydrophobicContact CB-CG2 3.92Å; F129-I146 HydrophobicContact CD1-CG2 3.65Å; F129-I146 HydrophobicContact CG-CG2 4.11Å; F129-C150 WeakPolarHBondContact CB-SG 3.33Å; F129-Y153 HydrophobicContact CE2-CD2 4.23Å; F129-Y153 AromaticContact CE2-CE2 3.88Å; F129-Y153 HydrophobicContact CE2-CE2 3.88Å
130	L	80.2	Confident	77.2	Confident	13 Å²	13	56 Å²	56	7%	0.068	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-39.2	174.8	-80.4	176.3	0	0	0	112.5	V28 L31 L32 V126 Q127 Y128 V132 V133 K134	V28-L130 HydrophobicContact CG1-CD1 4.11Å; L31-L130 HydrophobicContact CD2-CD1 4.42Å; L32-L130 HydrophobicContact CD1-CD1 4.26Å; L32-L130 HydrophobicContact CD1-CD2 3.81Å; L32-L130 HydrophobicContact CD1-CG 4.36Å; V126-L130 HydrophobicContact CG1-CD1 4.17Å; V126-L130 HydrophobicContact CG1-CG 4.45Å; V126-L130 WeakPolarHBondContact O-CB 3.45Å; V126-L130 WeakPolarHBondContact O-CG 3.21Å; V126-L130 PolarHBondContact O-N 3.1Å; Q127-L130 PolarHBondContact O-N 3.25Å; Y128-L130 VanDerWaalsContact C-N 3.32Å; Y128-L130 PolarHBondContact O-N 2.89Å; L130-V132 VanDerWaalsContact C-N 3.33Å; L130-V133 PolarHBondContact O-N 3.22Å; L130-K134 WeakPolarHBondContact O-CB 3.43Å; L130-K134 PolarHBondContact O-N 2.89Å
131	H	80.2	Confident	76.6	Confident	81 Å²	81	60 Å²	60	38%	0.375	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-46	173.5	-171.9	-79.5	0	0	0	111.1	Q127 Y128 V133 K134 Y135 E136	Q127-H131 PolarHBondContact O-N 3.29Å; Y128-H131 WeakPolarHBondContact O-CB 3.46Å; Y128-H131 PolarHBondContact O-N 3.08Å; H131-V133 PolarHBondContact O-N 3.43Å; H131-K134 PolarHBondContact O-N 2.85Å; H131-Y135 AromaticContact CD2-CD2 3.85Å; H131-Y135 AromaticContact CE1-CD2 3.94Å; H131-Y135 AromaticContact NE2-CD2 3.75Å; H131-Y135 WeakPolarHBondContact O-CD2 3.1Å; H131-Y135 PolarHBondContact O-N 2.94Å; H131-E136 IonicContact ND1-OE1 3.47Å
132	V	78.9	Confident	75.7	Confident	3 Å²	3	61 Å²	61	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-43.4	176.9	174.6	0	0	0	0	111.4	N95 L96 Y128 F129 L130 K134 E136 A137 I146	N95-V132 HydrophobicContact CB-CG2 4.03Å; L96-V132 HydrophobicContact CB-CG1 4.17Å; L96-V132 HydrophobicContact CB-CG2 4.02Å; L96-V132 HydrophobicContact CD1-CG1 4.24Å; Y128-V132 WeakPolarHBondContact O-CG2 3.41Å; Y128-V132 PolarHBondContact O-N 3.3Å; F129-V132 PolarHBondContact O-N 2.96Å; L130-V132 VanDerWaalsContact C-N 3.33Å; V132-K134 VanDerWaalsContact C-N 3.3Å; V132-K134 PolarHBondContact O-N 2.85Å; V132-E136 HydrophobicContact CG1-CB 4.23Å; V132-E136 CarbonylContact O-C 3.49Å; V132-E136 PolarHBondContact O-N 3.48Å; V132-A137 PolarHBondContact O-N 3.29Å; V132-I146 HydrophobicContact CG1-CD1 4.29Å
133	V	79.2	Confident	75.1	Confident	3 Å²	3	63.3 Å²	63.3	2%	0.018	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-36.8	178.1	168.1	0	0	0	0	112.3	F129 L130 H131 I146 R147	F129-V133 WeakPolarHBondContact O-CG2 3.22Å; F129-V133 PolarHBondContact O-N 3.08Å; L130-V133 PolarHBondContact O-N 3.22Å; H131-V133 PolarHBondContact O-N 3.43Å; V133-I146 HydrophobicContact CG2-CB 4Å; V133-I146 HydrophobicContact CG2-CG2 3.57Å; V133-R147 HydrophobicContact CG1-CG 4.38Å; V133-R147 HydrophobicContact CG2-CG 4.39Å
134	K	76.4	Confident	74.7	Confident	116 Å²	116	68.8 Å²	68.8	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-80.7	-39.3	-175.7	-170	172.6	178.9	-167.6	0	112.8	L130 H131 V132	L130-K134 WeakPolarHBondContact O-CB 3.43Å; L130-K134 PolarHBondContact O-N 2.89Å; H131-K134 PolarHBondContact O-N 2.85Å; V132-K134 VanDerWaalsContact C-N 3.3Å; V132-K134 PolarHBondContact O-N 2.85Å
135	Y	72.3	Confident	74.2	Confident	148 Å²	148	66.2 Å²	66.2	58%	0.58	33%	0.327	S	S	*	.	H	α-helix	trans	-116.3	-22.3	-168.3	-61.9	-73.8	0	0	0	115.2	H131	H131-Y135 AromaticContact CD2-CD2 3.85Å; H131-Y135 AromaticContact CE1-CD2 3.94Å; H131-Y135 AromaticContact NE2-CD2 3.75Å; H131-Y135 WeakPolarHBondContact O-CD2 3.1Å; H131-Y135 PolarHBondContact O-N 2.94Å
136	E	62.7	Low	73.9	Confident	61 Å²	61	66.7 Å²	66.7	29%	0.285	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-28.8	-166.8	-65.4	177.4	-168.8	0	0	114.9	S93 N95 H131 V132 Q138	S93-E136 WeakPolarHBondContact CB-OE2 3.22Å; S93-E136 PolarHBondContact OG-OE2 3.07Å; N95-E136 PolarHBondContact ND2-OE1 3.45Å; H131-E136 IonicContact ND1-OE1 3.47Å; V132-E136 HydrophobicContact CG1-CB 4.23Å; V132-E136 CarbonylContact O-C 3.49Å; V132-E136 PolarHBondContact O-N 3.48Å; E136-Q138 PolarHBondContact O-N 3.42Å
137	A	61	Low	73.6	Confident	17 Å²	17	69 Å²	69	14%	0.14	34%	0.338	C	S	.	.			trans	-71.9	120.3	-173.9	0	0	0	0	0	112.1	V132 K143	V132-A137 PolarHBondContact O-N 3.29Å; A137-K143 HydrophobicContact CB-CD 4.35Å; A137-K143 HydrophobicContact CB-CG 3.62Å; A137-K143 WeakPolarHBondContact O-CE 3.38Å; A137-K143 PolarHBondContact O-NZ 2.98Å
138	Q	54.4	Low	73.4	Confident	188 Å²	188	68 Å²	68	88%	0.879	34%	0.344	S	S	*	.			trans	-99.6	117.8	170.4	-67.5	-102.5	-14.9	0	0	108.8	E136	E136-Q138 PolarHBondContact O-N 3.42Å
139	G	67	Low	73.3	Confident	45 Å²	45	65.7 Å²	65.7	46%	0.464	34%	0.335	S	S	.	.	S	Bend	trans	107.2	134.1	177.7	0	0	0	0	0	115.6	K141 A142 K143	G139-K141 PolarHBondContact O-N 3.39Å; G139-A142 PolarHBondContact O-N 3.18Å; G139-K143 PolarHBondContact O-N 3.19Å
140	D	65.6	Low	73.2	Confident	94 Å²	94	65.6 Å²	65.6	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-67.5	-33.6	-174.3	-75.7	-30.1	0	0	0	113.5	K143 Q144	D140-K143 PolarHBondContact O-N 3.01Å; D140-Q144 WeakPolarHBondContact O-CB 3.41Å; D140-Q144 VanDerWaalsContact O-CG 3.27Å; D140-Q144 WeakPolarHBondContact O-CG 3.43Å; D140-Q144 PolarHBondContact O-N 3.49Å
141	K	70.3	Confident	73.2	Confident	186 Å²	186	67.9 Å²	67.9	81%	0.809	35%	0.35	S	S	*	.	H	α-helix	trans	-67.4	-40.1	179.2	-68.4	-174.9	179.7	179.9	0	112.5	G139 Q144 S145	G139-K141 PolarHBondContact O-N 3.39Å; K141-Q144 PolarHBondContact O-N 3.39Å; K141-S145 PolarHBondContact O-N 2.83Å
142	A	67.6	Low	73.3	Confident	49 Å²	49	65.7 Å²	65.7	41%	0.405	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-42.1	177.1	0	0	0	0	0	111.4	G139 Q144 S145 I146	G139-A142 PolarHBondContact O-N 3.18Å; A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.4Å; A142-S145 PolarHBondContact O-N 2.92Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 3.34Å
143	K	73.1	Confident	73.5	Confident	49 Å²	49	65.8 Å²	65.8	21%	0.213	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-41.7	174.2	-71.2	-177.1	-176.9	-177.9	0	112.3	A137 G139 D140 R147	A137-K143 HydrophobicContact CB-CD 4.35Å; A137-K143 HydrophobicContact CB-CG 3.62Å; A137-K143 WeakPolarHBondContact O-CE 3.38Å; A137-K143 PolarHBondContact O-NZ 2.98Å; G139-K143 PolarHBondContact O-N 3.19Å; D140-K143 PolarHBondContact O-N 3.01Å; K143-R147 VanDerWaalsContact O-CB 3.28Å; K143-R147 WeakPolarHBondContact O-CB 3.43Å; K143-R147 WeakPolarHBondContact O-CD 3.36Å; K143-R147 WeakPolarHBondContact O-CG 3.35Å; K143-R147 PolarHBondContact O-N 3.31Å
144	Q	75.7	Confident	73.7	Confident	126 Å²	126	66.5 Å²	66.5	59%	0.589	34%	0.343	S	S	*	.	H	α-helix	trans	-65.5	-41.7	177	-74.7	173	3.2	0	0	112	D140 K141 A142 R147 A148	D140-Q144 WeakPolarHBondContact O-CB 3.41Å; D140-Q144 VanDerWaalsContact O-CG 3.27Å; D140-Q144 WeakPolarHBondContact O-CG 3.43Å; D140-Q144 PolarHBondContact O-N 3.49Å; K141-Q144 PolarHBondContact O-N 3.39Å; A142-Q144 VanDerWaalsContact C-N 3.33Å; A142-Q144 PolarHBondContact O-N 3.4Å; Q144-R147 PolarHBondContact O-N 2.88Å; Q144-A148 WeakPolarHBondContact O-CB 3.41Å; Q144-A148 PolarHBondContact O-N 3.05Å
145	S	75.3	Confident	73.9	Confident	38 Å²	38	64.9 Å²	64.9	27%	0.266	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-44.7	177.1	-172.4	0	0	0	0	112.5	K141 A142 A148 K149	K141-S145 PolarHBondContact O-N 2.83Å; A142-S145 PolarHBondContact O-N 2.92Å; S145-A148 PolarHBondContact O-N 3.39Å; S145-K149 PolarHBondContact O-N 2.75Å
146	I	79.1	Confident	74.3	Confident	9 Å²	9	58.6 Å²	58.6	5%	0.046	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-40.4	177.3	-64	166.9	0	0	0	110.8	L96 F129 V132 V133 A142 K149 C150	L96-I146 HydrophobicContact CD1-CD1 4.34Å; F129-I146 HydrophobicContact CB-CG2 3.92Å; F129-I146 HydrophobicContact CD1-CG2 3.65Å; F129-I146 HydrophobicContact CG-CG2 4.11Å; V132-I146 HydrophobicContact CG1-CD1 4.29Å; V133-I146 HydrophobicContact CG2-CB 4Å; V133-I146 HydrophobicContact CG2-CG2 3.57Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 3.34Å; I146-K149 PolarHBondContact O-N 3.33Å; I146-C150 PolarHBondContact O-N 3.38Å; I146-C150 PolarHBondContact O-SG 3.37Å
147	R	78.6	Confident	75.2	Confident	49 Å²	49	55.9 Å²	55.9	19%	0.185	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-43.9	176.7	-77	171.1	-178.4	171.4	-0.6	112.4	V133 K143 Q144 K149 C150 T151	V133-R147 HydrophobicContact CG1-CG 4.38Å; V133-R147 HydrophobicContact CG2-CG 4.39Å; K143-R147 VanDerWaalsContact O-CB 3.28Å; K143-R147 WeakPolarHBondContact O-CB 3.43Å; K143-R147 WeakPolarHBondContact O-CD 3.36Å; K143-R147 WeakPolarHBondContact O-CG 3.35Å; K143-R147 PolarHBondContact O-N 3.31Å; Q144-R147 PolarHBondContact O-N 2.88Å; R147-K149 PolarHBondContact O-N 3.42Å; R147-C150 WeakPolarHBondContact O-CB 2.94Å; R147-C150 PolarHBondContact O-N 2.77Å; R147-C150 VanDerWaalsContact O-N 3.12Å; R147-T151 PolarHBondContact O-N 3.16Å; R147-T151 PolarHBondContact O-OG1 3.06Å
148	A	79.9	Confident	76.2	Confident	61 Å²	61	58.2 Å²	58.2	50%	0.504	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-39.3	176.4	0	0	0	0	0	111.6	Q144 S145 E152	Q144-A148 WeakPolarHBondContact O-CB 3.41Å; Q144-A148 PolarHBondContact O-N 3.05Å; S145-A148 PolarHBondContact O-N 3.39Å; A148-E152 PolarHBondContact O-N 3.15Å; A148-E152 VanDerWaalsContact O-N 3.17Å
149	K	78.8	Confident	77.6	Confident	41 Å²	41	53.8 Å²	53.8	18%	0.178	29%	0.289	C	S	.	.	H	α-helix	trans	-70.1	-35.9	175.3	-73.6	-75.9	155.5	-171	0	113.3	W81 S145 I146 R147 E152 Y153	W81-K149 HydrophobicContact CB-CD 4.13Å; W81-K149 HydrophobicContact CD2-CG 4.41Å; W81-K149 HydrophobicContact CG-CD 3.86Å; W81-K149 HydrophobicContact CG-CG 4.1Å; S145-K149 PolarHBondContact O-N 2.75Å; I146-K149 PolarHBondContact O-N 3.33Å; R147-K149 PolarHBondContact O-N 3.42Å; K149-E152 WeakPolarHBondContact CD-OE2 2.98Å; K149-E152 WeakPolarHBondContact CE-OE2 3.45Å; K149-E152 IonicContact NZ-OE1 3.59Å; K149-E152 PolarHBondContact NZ-OE1 3.23Å; K149-E152 IonicContact NZ-OE2 3.7Å; K149-E152 PolarHBondContact NZ-OE2 3Å; K149-E152 WeakPolarHBondContact O-CB 3.07Å; K149-E152 PolarHBondContact O-N 3.02Å; K149-Y153 HydrophobicContact CB-CE2 4.31Å; K149-Y153 WeakPolarHBondContact O-CD2 3.17Å; K149-Y153 PolarHBondContact O-N 3.48Å
150	C	80.6	Confident	78.3	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-44.8	173.6	-66.5	0	0	0	0	111.8	L32 F129 I146 R147 E152 Y153 L154	L32-C150 HydrophobicContact CD1-CB 4.29Å; F129-C150 WeakPolarHBondContact CB-SG 3.33Å; I146-C150 PolarHBondContact O-N 3.38Å; I146-C150 PolarHBondContact O-SG 3.37Å; R147-C150 WeakPolarHBondContact O-CB 2.94Å; R147-C150 PolarHBondContact O-N 2.77Å; R147-C150 VanDerWaalsContact O-N 3.12Å; C150-E152 VanDerWaalsContact C-N 3.31Å; C150-E152 PolarHBondContact O-N 3.12Å; C150-Y153 PolarHBondContact O-N 2.92Å; C150-L154 WeakPolarHBondContact O-CB 3.43Å; C150-L154 VanDerWaalsContact O-CG 3.31Å; C150-L154 WeakPolarHBondContact O-CG 3.45Å; C150-L154 PolarHBondContact O-N 2.84Å
151	T	80.7	Confident	79.1	Confident	61 Å²	61	50.8 Å²	50.8	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-43.5	176.9	-51.3	0	0	0	0	110.9	R147 Y153 L154 D155	R147-T151 PolarHBondContact O-N 3.16Å; R147-T151 PolarHBondContact O-OG1 3.06Å; T151-Y153 PolarHBondContact O-N 3.12Å; T151-L154 PolarHBondContact O-N 3.4Å; T151-D155 VanDerWaalsContact O-CG 3.3Å; T151-D155 PolarHBondContact O-N 2.99Å
152	E	81.5	Confident	79.6	Confident	34 Å²	34	48.2 Å²	48.2	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-41.8	177.5	178.9	177.3	-179.5	0	0	113.4	R78 A148 K149 C150 R156	R78-E152 WeakPolarHBondContact CD-OE1 3.49Å; R78-E152 IonicContact CZ-OE1 2.79Å; R78-E152 IonicContact NE-OE1 3.66Å; R78-E152 IonicContact NH1-OE1 2.69Å; R78-E152 PolarHBondContact NH1-OE1 3.36Å; R78-E152 IonicContact NH1-OE2 2.76Å; A148-E152 PolarHBondContact O-N 3.15Å; A148-E152 VanDerWaalsContact O-N 3.17Å; K149-E152 WeakPolarHBondContact CD-OE2 2.98Å; K149-E152 WeakPolarHBondContact CE-OE2 3.45Å; K149-E152 IonicContact NZ-OE1 3.59Å; K149-E152 PolarHBondContact NZ-OE1 3.23Å; K149-E152 IonicContact NZ-OE2 3.7Å; K149-E152 PolarHBondContact NZ-OE2 3Å; K149-E152 WeakPolarHBondContact O-CB 3.07Å; K149-E152 PolarHBondContact O-N 3.02Å; C150-E152 VanDerWaalsContact C-N 3.31Å; C150-E152 PolarHBondContact O-N 3.12Å; E152-R156 PolarHBondContact O-N 3.38Å
153	Y	84.1	Confident	80.1	Confident	6 Å²	6	50.4 Å²	50.4	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-72.1	-34.3	176.7	-66.1	-44.1	0	0	0	112.8	A103 Y122 F129 K149 C150 T151 R156 A157	A103-Y153 HydrophobicContact CB-CE2 3.91Å; Y122-Y153 AromaticContact CD1-CD1 3.67Å; Y122-Y153 HydrophobicContact CD1-CD1 3.67Å; Y122-Y153 HydrophobicContact CD1-CE1 4.44Å; Y122-Y153 AromaticContact CD1-CG 4Å; Y122-Y153 HydrophobicContact CD1-CG 4Å; Y122-Y153 AromaticContact CE1-CD1 3.36Å; Y122-Y153 HydrophobicContact CE1-CD1 3.36Å; Y122-Y153 AromaticContact CE1-CE1 3.82Å; Y122-Y153 HydrophobicContact CE1-CE1 3.82Å; Y122-Y153 HydrophobicContact CE1-CG 4.16Å; F129-Y153 HydrophobicContact CE2-CD2 4.23Å; F129-Y153 AromaticContact CE2-CE2 3.88Å; F129-Y153 HydrophobicContact CE2-CE2 3.88Å; K149-Y153 HydrophobicContact CB-CE2 4.31Å; K149-Y153 WeakPolarHBondContact O-CD2 3.17Å; K149-Y153 PolarHBondContact O-N 3.48Å; C150-Y153 PolarHBondContact O-N 2.92Å; T151-Y153 PolarHBondContact O-N 3.12Å; Y153-R156 PolarHBondContact O-N 3.23Å; Y153-A157 WeakPolarHBondContact O-CB 3.3Å; Y153-A157 PolarHBondContact O-N 3.44Å
154	L	83.1	Confident	80.5	Confident	17 Å²	17	49.4 Å²	49.4	9%	0.089	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-46.4	174.6	-75.8	170.6	0	0	0	111.8	V28 L32 V126 C150 T151 R156 A157 E158	V28-L154 HydrophobicContact CG1-CD2 4.04Å; L32-L154 HydrophobicContact CD1-CD1 4.03Å; V126-L154 HydrophobicContact CG1-CD1 4.13Å; V126-L154 HydrophobicContact CG1-CD2 4.07Å; V126-L154 HydrophobicContact CG1-CG 4.06Å; V126-L154 HydrophobicContact CG2-CD2 4.25Å; V126-L154 HydrophobicContact CG2-CG 4.08Å; C150-L154 WeakPolarHBondContact O-CB 3.43Å; C150-L154 VanDerWaalsContact O-CG 3.31Å; C150-L154 WeakPolarHBondContact O-CG 3.45Å; C150-L154 PolarHBondContact O-N 2.84Å; T151-L154 PolarHBondContact O-N 3.4Å; L154-R156 PolarHBondContact O-N 3.26Å; L154-A157 PolarHBondContact O-N 3.22Å; L154-A157 VanDerWaalsContact O-N 3.13Å; L154-E158 PolarHBondContact O-N 2.9Å
155	D	80.4	Confident	80.7	Confident	83 Å²	83	49.5 Å²	49.5	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-35.8	176.8	-71	-11.5	0	0	0	111.5	T151 K159	T151-D155 VanDerWaalsContact O-CG 3.3Å; T151-D155 PolarHBondContact O-N 2.99Å; D155-K159 WeakPolarHBondContact O-CG 3.5Å; D155-K159 PolarHBondContact O-N 3.27Å
156	R	82.1	Confident	80.8	Confident	16 Å²	16	52.4 Å²	52.4	6%	0.06	26%	0.256	C	S	.	.	H	α-helix	trans	-69.7	-44.1	175.2	-176.8	57.3	176.4	168.8	-0.4	111.7	L75 D110 Y122 E152 Y153 L154 E158 K159 L160	L75-R156 PolarHBondContact O-NH2 3.41Å; D110-R156 VanDerWaalsContact CG-NH2 3.27Å; D110-R156 IonicContact OD1-CZ 3.91Å; D110-R156 IonicContact OD1-NE 3.99Å; D110-R156 IonicContact OD1-NH2 3.28Å; D110-R156 PolarHBondContact OD1-NH2 3Å; D110-R156 IonicContact OD2-CZ 3.64Å; D110-R156 VanDerWaalsContact OD2-CZ 3.27Å; D110-R156 IonicContact OD2-NE 2.72Å; D110-R156 PolarHBondContact OD2-NE 2.94Å; D110-R156 IonicContact OD2-NH2 3.04Å; D110-R156 PolarHBondContact OD2-NH2 3.48Å; Y122-R156 HydrophobicContact CE2-CG 4Å; E152-R156 PolarHBondContact O-N 3.38Å; Y153-R156 PolarHBondContact O-N 3.23Å; L154-R156 PolarHBondContact O-N 3.26Å; R156-E158 VanDerWaalsContact C-N 3.3Å; R156-E158 PolarHBondContact O-N 2.99Å; R156-K159 PolarHBondContact O-N 3.18Å; R156-L160 HydrophobicContact CG-CD1 4.39Å; R156-L160 WeakPolarHBondContact O-CG 3.33Å; R156-L160 PolarHBondContact O-N 2.95Å
157	A	81.6	Confident	80.6	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-36.1	177.9	0	0	0	0	0	112.3	Y153 L154 L160 K161	Y153-A157 WeakPolarHBondContact O-CB 3.3Å; Y153-A157 PolarHBondContact O-N 3.44Å; L154-A157 PolarHBondContact O-N 3.22Å; L154-A157 VanDerWaalsContact O-N 3.13Å; A157-L160 PolarHBondContact O-N 3.35Å; A157-K161 WeakPolarHBondContact O-CB 3.47Å; A157-K161 PolarHBondContact O-N 2.9Å
158	E	81.1	Confident	80.1	Confident	66 Å²	66	61.9 Å²	61.9	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-64.7	-44.8	174.1	-73.3	-175.5	173.1	0	0	111.7	V25 R29 L154 R156 L160 K161 E162	V25-E158 HydrophobicContact CG1-CG 4.23Å; R29-E158 IonicContact NH1-OE1 3.6Å; L154-E158 PolarHBondContact O-N 2.9Å; R156-E158 VanDerWaalsContact C-N 3.3Å; R156-E158 PolarHBondContact O-N 2.99Å; E158-L160 PolarHBondContact O-N 3.25Å; E158-K161 WeakPolarHBondContact O-CB 3.48Å; E158-K161 PolarHBondContact O-N 3.11Å; E158-E162 PolarHBondContact O-N 3.47Å
159	K	83.8	Confident	79.4	Confident	95 Å²	95	65.4 Å²	65.4	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-40.7	175.8	-71.3	175.4	-177.9	-178.4	0	112.8	D155 R156 K161 E162 Y163	D155-K159 WeakPolarHBondContact O-CG 3.5Å; D155-K159 PolarHBondContact O-N 3.27Å; R156-K159 PolarHBondContact O-N 3.18Å; K159-K161 VanDerWaalsContact C-N 3.32Å; K159-E162 PolarHBondContact O-N 3.01Å; K159-Y163 WeakPolarHBondContact O-CB 3.26Å; K159-Y163 PolarHBondContact O-N 3.14Å
160	L	80.8	Confident	78.2	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-64.5	-39.1	175.4	-70.7	178.5	0	0	0	111.4	Y115 A118 L119 Y122 R156 A157 E158 Y163 L164	Y115-L160 HydrophobicContact CD1-CD2 3.38Å; Y115-L160 HydrophobicContact CE1-CD2 4.01Å; Y115-L160 HydrophobicContact CG-CD2 4.03Å; A118-L160 HydrophobicContact CB-CD1 4.21Å; L119-L160 HydrophobicContact CD1-CB 4.47Å; Y122-L160 HydrophobicContact CD2-CD1 4.15Å; Y122-L160 HydrophobicContact CE2-CD1 4.14Å; R156-L160 HydrophobicContact CG-CD1 4.39Å; R156-L160 WeakPolarHBondContact O-CG 3.33Å; R156-L160 PolarHBondContact O-N 2.95Å; A157-L160 PolarHBondContact O-N 3.35Å; E158-L160 PolarHBondContact O-N 3.25Å; L160-Y163 PolarHBondContact O-N 3.43Å; L160-L164 WeakPolarHBondContact O-CG 3.33Å; L160-L164 PolarHBondContact O-N 3.35Å
161	K	83.4	Confident	76.8	Confident	75 Å²	75	76.4 Å²	76.4	33%	0.326	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-43.8	176.2	-167.5	176.2	179.6	176.3	0	112.2	G22 L119 A157 E158 K159 Y163 L164 K165	G22-K161 PolarHBondContact O-NZ 3.07Å; L119-K161 HydrophobicContact CD1-CB 3.77Å; L119-K161 HydrophobicContact CD1-CG 4.29Å; A157-K161 WeakPolarHBondContact O-CB 3.47Å; A157-K161 PolarHBondContact O-N 2.9Å; E158-K161 WeakPolarHBondContact O-CB 3.48Å; E158-K161 PolarHBondContact O-N 3.11Å; K159-K161 VanDerWaalsContact C-N 3.32Å; K161-Y163 VanDerWaalsContact C-N 3.34Å; K161-L164 PolarHBondContact O-N 2.79Å; K161-K165 WeakPolarHBondContact O-CB 3.31Å; K161-K165 PolarHBondContact O-N 2.96Å
162	E	80.1	Confident	75.1	Confident	132 Å²	132	81.1 Å²	81.1	62%	0.617	39%	0.386	S	S	*	.	H	α-helix	trans	-64.6	-39.2	176.1	-72.6	-174.5	167.1	0	0	112.1	E158 K159 K165 N166	E158-E162 PolarHBondContact O-N 3.47Å; K159-E162 PolarHBondContact O-N 3.01Å; E162-K165 PolarHBondContact O-N 2.85Å; E162-N166 WeakPolarHBondContact O-CB 3.4Å; E162-N166 PolarHBondContact O-N 2.76Å
163	Y	79.5	Confident	72.8	Confident	96 Å²	96	88.2 Å²	88.2	38%	0.376	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-46.3	176	-178.1	-96.9	0	0	0	112.1	Y115 K159 L160 K161 N166 K167	Y115-Y163 AromaticContact CD2-CD1 3.97Å; Y115-Y163 HydrophobicContact CD2-CD1 3.97Å; Y115-Y163 AromaticContact CD2-CE1 3.7Å; Y115-Y163 HydrophobicContact CD2-CE1 3.7Å; Y115-Y163 HydrophobicContact CE2-CD1 4.22Å; Y115-Y163 AromaticContact CE2-CE1 3.64Å; Y115-Y163 HydrophobicContact CE2-CE1 3.64Å; K159-Y163 WeakPolarHBondContact O-CB 3.26Å; K159-Y163 PolarHBondContact O-N 3.14Å; L160-Y163 PolarHBondContact O-N 3.43Å; K161-Y163 VanDerWaalsContact C-N 3.34Å; Y163-N166 PolarHBondContact O-N 3.43Å; Y163-K167 WeakPolarHBondContact O-CB 3.38Å; Y163-K167 PolarHBondContact O-N 3.34Å
164	L	79.9	Confident	70.5	Confident	27 Å²	27	94.1 Å²	94.1	14%	0.141	46%	0.455	C	S	.	.	H	α-helix	trans	-62	-45	176.5	-70.5	170.5	0	0	0	111.7	E116 L119 L160 K161 N166 K167 E168	E116-L164 HydrophobicContact CG-CD1 3.85Å; E116-L164 HydrophobicContact CG-CD2 3.86Å; L119-L164 HydrophobicContact CD1-CD1 4.36Å; L160-L164 WeakPolarHBondContact O-CG 3.33Å; L160-L164 PolarHBondContact O-N 3.35Å; K161-L164 PolarHBondContact O-N 2.79Å; L164-N166 VanDerWaalsContact C-N 3.3Å; L164-N166 PolarHBondContact O-N 2.95Å; L164-K167 WeakPolarHBondContact O-CB 3.34Å; L164-K167 PolarHBondContact O-N 2.85Å; L164-K167 VanDerWaalsContact O-N 3.12Å; L164-E168 PolarHBondContact O-N 3.3Å
165	K	80.4	Confident	68.1	Low	128 Å²	128	99.5 Å²	99.5	56%	0.557	49%	0.488	S	S	*	.	H	α-helix	trans	-62.3	-35.6	177.3	-168.2	175.7	-175.6	177.8	0	112.8	K161 E162 K169	K161-K165 WeakPolarHBondContact O-CB 3.31Å; K161-K165 PolarHBondContact O-N 2.96Å; E162-K165 PolarHBondContact O-N 2.85Å; K165-K169 WeakPolarHBondContact O-CG 3.09Å; K165-K169 PolarHBondContact O-N 2.86Å
166	N	78.3	Confident	65.7	Low	99 Å²	99	105.6 Å²	105.6	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-75.6	-30	175.7	-76.5	-16.1	0	0	0	112.7	E162 Y163 L164 K170	E162-N166 WeakPolarHBondContact O-CB 3.4Å; E162-N166 PolarHBondContact O-N 2.76Å; Y163-N166 PolarHBondContact O-N 3.43Å; L164-N166 VanDerWaalsContact C-N 3.3Å; L164-N166 PolarHBondContact O-N 2.95Å; N166-K170 PolarHBondContact O-N 3.38Å
167	K	74.7	Confident	63.1	Low	130 Å²	130	113.5 Å²	113.5	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-68.2	-43.3	173.6	-168.7	-179.7	176.7	-173.5	0	111.2	Y163 L164 K169 K170 A171	Y163-K167 WeakPolarHBondContact O-CB 3.38Å; Y163-K167 PolarHBondContact O-N 3.34Å; L164-K167 WeakPolarHBondContact O-CB 3.34Å; L164-K167 PolarHBondContact O-N 2.85Å; L164-K167 VanDerWaalsContact O-N 3.12Å; K167-K169 PolarHBondContact O-N 3.19Å; K167-K170 PolarHBondContact O-N 3.04Å; K167-A171 PolarHBondContact O-N 3.48Å; K167-A171 VanDerWaalsContact O-N 3.16Å
168	E	68	Low	60.6	Low	127 Å²	127	117.2 Å²	117.2	59%	0.593	59%	0.587	S	S	*	*	H	α-helix	trans	-61.4	-41.4	174.5	-72.7	178.3	158.5	0	0	112.2	L164 K170 A171	L164-E168 PolarHBondContact O-N 3.3Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 2.89Å; E168-A171 PolarHBondContact O-N 3.15Å
169	K	63.6	Low	57.8	Low	135 Å²	135	123 Å²	123	59%	0.587	61%	0.614	S	S	*	*	H	α-helix	trans	-65.1	-30.6	175.8	-76.5	-178.7	176.4	-170.8	0	114	K165 K167	K165-K169 WeakPolarHBondContact O-CG 3.09Å; K165-K169 PolarHBondContact O-N 2.86Å; K167-K169 PolarHBondContact O-N 3.19Å
170	K	54.3	Low	55.4	Low	187 Å²	187	124 Å²	124	81%	0.813	63%	0.63	S	S	*	*	H	α-helix	trans	-78.2	-26.2	176.2	-81.7	-174.8	175.8	-177.1	0	113	N166 K167 E168 Q172	N166-K170 PolarHBondContact O-N 3.38Å; K167-K170 PolarHBondContact O-N 3.04Å; E168-K170 VanDerWaalsContact C-N 3.32Å; E168-K170 PolarHBondContact O-N 2.89Å; K170-Q172 VanDerWaalsContact C-N 3.26Å; K170-Q172 PolarHBondContact O-N 3.47Å
171	A	51.7	Low	52.7	Low	86 Å²	86	129.3 Å²	129.3	71%	0.711	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-8.5	178.2	0	0	0	0	0	114	K167 E168	K167-A171 PolarHBondContact O-N 3.48Å; K167-A171 VanDerWaalsContact O-N 3.16Å; E168-A171 PolarHBondContact O-N 3.15Å
172	Q	45.2	Very low	50.9	Low	161 Å²	161	131.7 Å²	131.7	75%	0.752	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	17.9	-174.3	-72.2	-176.7	-1.2	0	0	115.8	K170	K170-Q172 VanDerWaalsContact C-N 3.26Å; K170-Q172 PolarHBondContact O-N 3.47Å
173	K	32.6	Very low	48.2	Very low	183 Å²	183	129.7 Å²	129.7	80%	0.796	70%	0.696	S	S	*	*			trans	-105.5	118.4	170.5	-79.3	-171.1	175.7	-173.4	0	111.7
174	P	36.9	Very low	45.5	Very low	129 Å²	129	132.5 Å²	132.5	84%	0.838	72%	0.718	S	S	*	*			trans	-79.1	144.5	171.7	30.1	-30.1	0	0	0	111.9
175	V	32.3	Very low	42.9	Very low	130 Å²	130	140.3 Å²	140.3	79%	0.788	75%	0.753	S	S	*	*			trans	-76.9	132.7	-179.7	179.1	0	0	0	0	110.3	E177	V175-E177 HydrophobicContact CG1-CG 4.28Å
176	K	30.5	Very low	40.2	Very low	211 Å²	211	144 Å²	144	92%	0.917	77%	0.77	S	S	*	*			trans	-133.8	116.1	160.3	-129.3	-177.8	-176.6	-176	0	108.6
177	E	27	Very low	37.6	Very low	183 Å²	183	143 Å²	143	86%	0.855	78%	0.782	S	S	*	*			trans	-81.7	152.5	177.8	-69.1	176.1	143.8	0	0	111.9	V175	V175-E177 HydrophobicContact CG1-CG 4.28Å
178	G	28.3	Very low	35.3	Very low	81 Å²	81	144.7 Å²	144.7	84%	0.835	80%	0.797	S	S	*	*			trans	126.9	96.4	158.6	0	0	0	0	0	116.6
179	Q	23.6	Very low	33.3	Very low	188 Å²	188	145.9 Å²	145.9	88%	0.879	81%	0.808	S	S	*	*			trans	-83.3	177.6	164.8	-91.7	175.9	13.6	0	0	111.8
180	P	31.7	Very low	31.6	Very low	116 Å²	116	145.2 Å²	145.2	75%	0.753	82%	0.82	S	S	*	*			cis	-133.9	173.1	0.3	24.1	1.4	0	0	0	116.7
181	S	24.5	Very low	30.3	Very low	111 Å²	111	144 Å²	144	78%	0.776	82%	0.823	S	S	*	*			trans	-66.5	-165.4	174.3	-17.9	0	0	0	0	115.1
182	P	45.5	Very low	29.1	Very low	125 Å²	125	143.4 Å²	143.4	81%	0.812	82%	0.824	S	S	*	*			cis	-138.1	173.4	-27.2	35.2	-16.4	0	0	0	113.8
183	A	23.5	Very low	28.4	Very low	90 Å²	90	145 Å²	145	74%	0.744	83%	0.832	S	S	*	*			trans	-172.7	117.6	143.6	0	0	0	0	0	113.2
184	D	24	Very low	28.3	Very low	156 Å²	156	139.5 Å²	139.5	83%	0.834	83%	0.827	S	S	*	*			trans	13.2	128	147.9	-55.9	-52.8	0	0	0	121.2
185	E	24.7	Very low	28.5	Very low	190 Å²	190	142.4 Å²	142.4	89%	0.888	83%	0.83	S	S	*	*				-173.1	133.7	102.6	-101.4	-174.4	161.2	0	0	114.1
186	K	23.8	Very low	28.7	Very low	207 Å²	207	141 Å²	141	90%	0.9	83%	0.826	S	S	*	*			trans	-17.5	140.2	162.8	-73.6	164.8	170.4	170.4	0	118.8
187	G	23.7	Very low	29.7	Very low	77 Å²	77	137 Å²	137	79%	0.794	82%	0.815	S	S	*	*			trans	152.9	99.6	133.1	0	0	0	0	0	118.3
188	N	25.4	Very low	31	Very low	165 Å²	165	131.4 Å²	131.4	88%	0.882	79%	0.791	S	S	*	*			trans	96.4	125.4	138	-126.1	28.2	0	0	0	120.9
189	D	25.7	Very low	32.5	Very low	153 Å²	153	132 Å²	132	82%	0.818	78%	0.779	S	S	*	*			trans	-69.7	141.7	-174.8	-61.2	-60.7	0	0	0	114.7
190	S	28.2	Very low	34	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	76%	0.762	S	S	*	*			trans	-161.3	127.3	136.5	-156	0	0	0	0	110.2	G192	S190-G192 PolarHBondContact O-N 3.32Å
191	D	27.5	Very low	35.2	Very low	163 Å²	163	126.5 Å²	126.5	87%	0.872	74%	0.742	S	S	*	*			trans	-54.7	118.3	-172.4	-62.2	-64	0	0	0	114.2
192	G	26.1	Very low	37	Very low	72 Å²	72	125.8 Å²	125.8	74%	0.742	73%	0.726	S	S	*	*			trans	-122.1	94.9	162.1	0	0	0	0	0	108.5	S190 G194	S190-G192 PolarHBondContact O-N 3.32Å; G192-G194 PolarHBondContact O-N 3Å
193	E	31.8	Very low	37.6	Very low	194 Å²	194	127.1 Å²	127.1	91%	0.907	72%	0.718	S	S	*	*			trans	-55.1	121.9	178.5	-70.1	-173.9	156.4	0	0	110.8
194	G	29.2	Very low	39.2	Very low	68 Å²	68	124 Å²	124	70%	0.701	69%	0.689	S	S	*	*			trans	-62.4	132.6	-178.3	0	0	0	0	0	112.5	G192 S196	G192-G194 PolarHBondContact O-N 3Å; G194-S196 VanDerWaalsContact C-N 3.27Å; G194-S196 PolarHBondContact O-N 3.02Å
195	E	41.5	Very low	40.9	Very low	190 Å²	190	119.8 Å²	119.8	89%	0.888	67%	0.665	S	S	*	*			trans	-64.4	85.2	171.4	-140.2	177.9	-177.1	0	0	109.6	D197	E195-D197 PolarHBondContact O-N 2.84Å
196	S	37.3	Very low	42.7	Very low	102 Å²	102	115.9 Å²	115.9	71%	0.713	65%	0.65	S	S	*	*			trans	-73.4	121.6	167.4	62.6	0	0	0	0	108.7	G194 D198	G194-S196 VanDerWaalsContact C-N 3.27Å; G194-S196 PolarHBondContact O-N 3.02Å; S196-D198 PolarHBondContact O-N 3.15Å
197	D	49.9	Very low	44.3	Very low	126 Å²	126	110.4 Å²	110.4	67%	0.674	63%	0.627	S	S	*	*			trans	-71.4	75.9	179.7	-155.6	3.9	0	0	0	108.8	E195 K202	E195-D197 PolarHBondContact O-N 2.84Å; D197-K202 IonicContact OD1-NZ 2.79Å; D197-K202 PolarHBondContact OD1-NZ 2.77Å; D197-K202 IonicContact OD2-NZ 2.65Å; D197-K202 PolarHBondContact OD2-NZ 3.4Å
198	D	55.8	Low	46	Very low	66 Å²	66	107 Å²	107	35%	0.353	59%	0.591	S	S	.	*			trans	-61.4	121	-166.9	-173.3	2.9	0	0	0	112.1	S196 E200 K201 K202	S196-D198 PolarHBondContact O-N 3.15Å; D198-E200 PolarHBondContact O-N 2.88Å; D198-E200 VanDerWaalsContact O-N 3.12Å; D198-E200 PolarHBondContact OD1-N 3.03Å; D198-K201 HydrophobicContact CB-CB 4.21Å; D198-K201 WeakPolarHBondContact O-CB 3.45Å; D198-K201 PolarHBondContact O-N 3.11Å; D198-K202 PolarHBondContact O-N 3.38Å
199	P	58.8	Low	47.6	Very low	92 Å²	92	106 Å²	106	60%	0.597	58%	0.581	S	S	*	*	H	α-helix	trans	-57.8	-22.8	174.7	23.7	-34.5	0	0	0	113.1	K203	P199-K203 PolarHBondContact O-N 3.44Å; P199-K203 VanDerWaalsContact O-N 3.12Å
200	E	55.5	Low	49.4	Very low	110 Å²	110	101.9 Å²	101.9	51%	0.514	58%	0.575	S	S	.	*	H	α-helix	trans	-69.9	-40.8	172.2	-61.6	-164.3	167.2	0	0	112.2	D198 K202 K203 L204	D198-E200 PolarHBondContact O-N 2.88Å; D198-E200 VanDerWaalsContact O-N 3.12Å; D198-E200 PolarHBondContact OD1-N 3.03Å; E200-K202 VanDerWaalsContact C-N 3.3Å; E200-K202 PolarHBondContact O-N 2.97Å; E200-K203 PolarHBondContact O-N 3.16Å; E200-L204 WeakPolarHBondContact O-CB 3.39Å; E200-L204 WeakPolarHBondContact O-CD1 3.46Å; E200-L204 VanDerWaalsContact O-CG 3.26Å; E200-L204 WeakPolarHBondContact O-CG 3.48Å; E200-L204 PolarHBondContact O-N 3.46Å
201	K	57.3	Low	51	Low	79 Å²	79	96.6 Å²	96.6	34%	0.343	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-38.5	176.8	-166.6	176.9	-179.6	-176	0	111.5	D198 Q205	D198-K201 HydrophobicContact CB-CB 4.21Å; D198-K201 WeakPolarHBondContact O-CB 3.45Å; D198-K201 PolarHBondContact O-N 3.11Å; K201-Q205 VanDerWaalsContact O-CB 3.3Å; K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 VanDerWaalsContact O-CG 3.26Å; K201-Q205 WeakPolarHBondContact O-CG 3.25Å; K201-Q205 PolarHBondContact O-N 3.33Å
202	K	60.9	Low	53	Low	97 Å²	97	89.1 Å²	89.1	42%	0.422	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-37.5	175	-80.1	173.5	-176.7	146.1	0	113.5	D197 D198 E200 Q205 N206	D197-K202 IonicContact OD1-NZ 2.79Å; D197-K202 PolarHBondContact OD1-NZ 2.77Å; D197-K202 IonicContact OD2-NZ 2.65Å; D197-K202 PolarHBondContact OD2-NZ 3.4Å; D198-K202 PolarHBondContact O-N 3.38Å; E200-K202 VanDerWaalsContact C-N 3.3Å; E200-K202 PolarHBondContact O-N 2.97Å; K202-Q205 PolarHBondContact O-N 3.1Å; K202-N206 VanDerWaalsContact O-CG 3.27Å; K202-N206 PolarHBondContact O-N 2.64Å; K202-N206 PolarHBondContact O-ND2 3.2Å
203	K	59.7	Low	55.2	Low	152 Å²	152	89.2 Å²	89.2	66%	0.661	48%	0.484	S	S	*	.	H	α-helix	trans	-65.4	-44.5	172.9	-81.6	179.9	178.9	175.3	0	111.6	P199 E200 N206 Q207	P199-K203 PolarHBondContact O-N 3.44Å; P199-K203 VanDerWaalsContact O-N 3.12Å; E200-K203 PolarHBondContact O-N 3.16Å; K203-N206 PolarHBondContact O-N 3.03Å; K203-Q207 WeakPolarHBondContact O-CG 3.43Å; K203-Q207 PolarHBondContact O-N 2.85Å
204	L	57.2	Low	57.5	Low	26 Å²	26	84.6 Å²	84.6	14%	0.136	47%	0.465	C	S	.	.	H	α-helix	trans	-63.9	-42.2	175.2	-70.7	163.9	0	0	0	110.6	E200 N206 Q207 L208 K302	E200-L204 WeakPolarHBondContact O-CB 3.39Å; E200-L204 WeakPolarHBondContact O-CD1 3.46Å; E200-L204 VanDerWaalsContact O-CG 3.26Å; E200-L204 WeakPolarHBondContact O-CG 3.48Å; E200-L204 PolarHBondContact O-N 3.46Å; L204-N206 VanDerWaalsContact C-N 3.31Å; L204-N206 PolarHBondContact O-N 3.25Å; L204-Q207 CarbonylContact O-C 3.59Å; L204-Q207 WeakPolarHBondContact O-CB 3.31Å; L204-Q207 PolarHBondContact O-N 3.07Å; L204-Q207 VanDerWaalsContact O-N 3.12Å; L204-L208 WeakPolarHBondContact O-CB 3.42Å; L204-L208 WeakPolarHBondContact O-CG 3.31Å; L204-L208 PolarHBondContact O-N 3.41Å; L204-K302 HydrophobicContact CD1-CD 3.96Å; L204-K302 HydrophobicContact CD2-CD 4.42Å
205	Q	57.8	Low	59.7	Low	67 Å²	67	84 Å²	84	31%	0.313	44%	0.444	S	S	.	.	H	α-helix	trans	-58.4	-39.4	172.3	-82.1	179.6	-8.2	0	0	113.3	K201 K202 L208 Q209	K201-Q205 VanDerWaalsContact O-CB 3.3Å; K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 VanDerWaalsContact O-CG 3.26Å; K201-Q205 WeakPolarHBondContact O-CG 3.25Å; K201-Q205 PolarHBondContact O-N 3.33Å; K202-Q205 PolarHBondContact O-N 3.1Å; Q205-L208 HydrophobicContact CG-CD1 4.45Å; Q205-L208 WeakPolarHBondContact O-CB 3.48Å; Q205-L208 PolarHBondContact O-N 3.17Å; Q205-Q209 WeakPolarHBondContact O-CG 3.43Å; Q205-Q209 PolarHBondContact O-N 3.15Å
206	N	63	Low	61.6	Low	107 Å²	107	84.5 Å²	84.5	57%	0.572	44%	0.437	S	S	*	.	H	α-helix	trans	-70.6	-34.4	174.8	-70.2	-21.6	0	0	0	112.4	K202 K203 L204	K202-N206 VanDerWaalsContact O-CG 3.27Å; K202-N206 PolarHBondContact O-N 2.64Å; K202-N206 PolarHBondContact O-ND2 3.2Å; K203-N206 PolarHBondContact O-N 3.03Å; L204-N206 VanDerWaalsContact C-N 3.31Å; L204-N206 PolarHBondContact O-N 3.25Å
207	Q	58.9	Low	63.5	Low	92 Å²	92	80.3 Å²	80.3	43%	0.43	41%	0.408	S	S	.	.	H	α-helix	trans	-68.1	-36.9	171.7	-72.8	172.7	-45	0	0	111.8	K203 L204 G210 A211 E299	K203-Q207 WeakPolarHBondContact O-CG 3.43Å; K203-Q207 PolarHBondContact O-N 2.85Å; L204-Q207 CarbonylContact O-C 3.59Å; L204-Q207 WeakPolarHBondContact O-CB 3.31Å; L204-Q207 PolarHBondContact O-N 3.07Å; L204-Q207 VanDerWaalsContact O-N 3.12Å; Q207-G210 PolarHBondContact O-N 2.78Å; Q207-G210 VanDerWaalsContact O-N 3.15Å; Q207-A211 PolarHBondContact O-N 2.92Å; Q207-E299 PolarHBondContact NE2-OE2 3.29Å
208	L	58.1	Low	65.2	Low	5 Å²	5	80.5 Å²	80.5	3%	0.026	41%	0.409	C	S	.	.	H	α-helix	trans	-62.1	-42.6	174.2	-71.7	166	0	0	0	111.5	L204 Q205 G210 A211 I212 L303 N306 L310	L204-L208 WeakPolarHBondContact O-CB 3.42Å; L204-L208 WeakPolarHBondContact O-CG 3.31Å; L204-L208 PolarHBondContact O-N 3.41Å; Q205-L208 HydrophobicContact CG-CD1 4.45Å; Q205-L208 WeakPolarHBondContact O-CB 3.48Å; Q205-L208 PolarHBondContact O-N 3.17Å; L208-G210 PolarHBondContact O-N 2.9Å; L208-G210 VanDerWaalsContact O-N 3.16Å; L208-A211 PolarHBondContact O-N 3.2Å; L208-A211 VanDerWaalsContact O-N 3.14Å; L208-I212 HydrophobicContact CB-CD1 4.11Å; L208-I212 HydrophobicContact CD2-CD1 3.42Å; L208-I212 VanDerWaalsContact CD2-CD1 3.42Å; L208-I212 HydrophobicContact CD2-CG1 4.44Å; L208-I212 HydrophobicContact CG-CD1 4.33Å; L208-I212 WeakPolarHBondContact O-CB 3.38Å; L208-I212 PolarHBondContact O-N 3.41Å; L208-L303 HydrophobicContact CD2-CB 4.4Å; L208-L303 HydrophobicContact CD2-CD2 3.87Å; L208-L303 HydrophobicContact CD2-CG 3.67Å; L208-N306 HydrophobicContact CD1-CB 3.23Å; L208-N306 HydrophobicContact CD2-CB 3.89Å; L208-N306 HydrophobicContact CG-CB 4.17Å; L208-L310 HydrophobicContact CB-CD1 4.4Å; L208-L310 HydrophobicContact CD1-CD1 3.93Å
209	Q	60.2	Low	66.7	Low	146 Å²	146	78.1 Å²	78.1	68%	0.682	40%	0.397	S	S	*	.	H	α-helix	trans	-60.6	-23.4	175.6	-75.3	179.3	8.3	0	0	113.3	Q205	Q205-Q209 WeakPolarHBondContact O-CG 3.43Å; Q205-Q209 PolarHBondContact O-N 3.15Å
210	G	62.5	Low	68.1	Low	66 Å²	66	78.9 Å²	78.9	68%	0.68	39%	0.391	S	S	*	.	H	α-helix	trans	-87.3	-23.6	176.7	0	0	0	0	0	114.8	Q207 L208	Q207-G210 PolarHBondContact O-N 2.78Å; Q207-G210 VanDerWaalsContact O-N 3.15Å; L208-G210 PolarHBondContact O-N 2.9Å; L208-G210 VanDerWaalsContact O-N 3.16Å
211	A	62.6	Low	69.7	Low	9 Å²	9	74.8 Å²	74.8	7%	0.074	37%	0.37	C	S	.	.	H	α-helix	trans	-105.3	-30.2	-176.7	0	0	0	0	0	113.4	Q207 L208 L303	Q207-A211 PolarHBondContact O-N 2.92Å; L208-A211 PolarHBondContact O-N 3.2Å; L208-A211 VanDerWaalsContact O-N 3.14Å; A211-L303 HydrophobicContact CB-CD1 4.17Å
212	I	68.3	Low	71.1	Confident	5 Å²	5	75.7 Å²	75.7	3%	0.026	39%	0.386	C	S	.	.	S	Bend	trans	-101	114.6	179.3	-59.6	166.3	0	0	0	107.7	L208 I214 F285 I287 L303 L307	L208-I212 HydrophobicContact CB-CD1 4.11Å; L208-I212 HydrophobicContact CD2-CD1 3.42Å; L208-I212 VanDerWaalsContact CD2-CD1 3.42Å; L208-I212 HydrophobicContact CD2-CG1 4.44Å; L208-I212 HydrophobicContact CG-CD1 4.33Å; L208-I212 WeakPolarHBondContact O-CB 3.38Å; L208-I212 PolarHBondContact O-N 3.41Å; I212-I214 HydrophobicContact CG2-CG1 4.35Å; I212-I214 PolarHBondContact O-N 2.93Å; I212-F285 HydrophobicContact CG2-CB 4.16Å; I212-F285 HydrophobicContact CG2-CD1 3.69Å; I212-F285 HydrophobicContact CG2-CG 4.43Å; I212-I287 HydrophobicContact CG1-CD1 4.21Å; I212-L303 HydrophobicContact CD1-CD2 4.2Å; I212-L303 HydrophobicContact CG1-CD2 4.35Å; I212-L307 HydrophobicContact CD1-CB 3.91Å; I212-L307 HydrophobicContact CD1-CD1 3.67Å; I212-L307 HydrophobicContact CD1-CG 4.34Å; I212-L307 HydrophobicContact CG1-CD1 4.13Å; I212-L307 HydrophobicContact CG2-CD1 4.02Å
213	V	72.7	Confident	72.3	Confident	75 Å²	75	73.7 Å²	73.7	46%	0.455	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	106.9	174	-163.8	0	0	0	0	107.6	E215 S286	V213-E215 HydrophobicContact CB-CG 4.23Å; V213-E215 HydrophobicContact CG1-CG 3.44Å; V213-E215 VanDerWaalsContact CG1-CG 3.44Å; V213-E215 WeakPolarHBondContact CG1-OE1 3.45Å; V213-E215 PolarHBondContact O-N 2.73Å; V213-S286 PolarHBondContact N-O 3.47Å; V213-S286 VanDerWaalsContact N-O 3.15Å; V213-S286 PolarHBondContact O-N 3Å
214	I	80.1	Confident	73.6	Confident	97 Å²	97	67.1 Å²	67.1	50%	0.497	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	105.2	169.7	-54.7	178.3	0	0	0	106.7	I212 T283 F285	I212-I214 HydrophobicContact CG2-CG1 4.35Å; I212-I214 PolarHBondContact O-N 2.93Å; I214-T283 HydrophobicContact CG2-CG2 3.81Å; I214-F285 HydrophobicContact CD1-CD1 4.38Å; I214-F285 HydrophobicContact CD1-CE1 3.81Å; I214-F285 HydrophobicContact CG1-CD1 3.84Å; I214-F285 HydrophobicContact CG1-CE1 3.76Å
215	E	76.4	Confident	75.1	Confident	55 Å²	55	66.7 Å²	66.7	26%	0.257	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	150.3	179.4	-58	-172.7	171.7	0	0	110.7	V213 P217 K273 F284	V213-E215 HydrophobicContact CB-CG 4.23Å; V213-E215 HydrophobicContact CG1-CG 3.44Å; V213-E215 VanDerWaalsContact CG1-CG 3.44Å; V213-E215 WeakPolarHBondContact CG1-OE1 3.45Å; V213-E215 PolarHBondContact O-N 2.73Å; E215-P217 WeakPolarHBondContact O-CD 3.17Å; E215-K273 IonicContact OE1-NZ 3.27Å; E215-K273 PolarHBondContact OE1-NZ 3.02Å; E215-K273 WeakPolarHBondContact OE2-CE 3.39Å; E215-K273 IonicContact OE2-NZ 3.61Å; E215-K273 PolarHBondContact OE2-NZ 2.94Å; E215-F284 HydrophobicContact CB-CD1 4.24Å; E215-F284 PolarHBondContact N-O 3.39Å; E215-F284 WeakPolarHBondContact O-CB 3.31Å; E215-F284 PolarHBondContact O-N 3.45Å
216	R	79.8	Confident	76.5	Confident	200 Å²	200	64.6 Å²	64.6	76%	0.755	35%	0.349	S	S	*	.			trans	-113.3	83.9	157.5	-70.9	-175.8	179	175.2	0.1	106.6
217	P	78.4	Confident	77.6	Confident	14 Å²	14	61 Å²	61	9%	0.091	33%	0.33	C	S	.	.			trans	-60.5	148.9	-179.7	24.5	-31.3	0	0	0	109.8	E215 K273 A276 T277 F284	E215-P217 WeakPolarHBondContact O-CD 3.17Å; P217-K273 HydrophobicContact CB-CB 3.82Å; P217-K273 HydrophobicContact CB-CG 4.18Å; P217-K273 HydrophobicContact CG-CB 4.15Å; P217-K273 HydrophobicContact CG-CG 4.46Å; P217-K273 WeakPolarHBondContact CG-O 3.44Å; P217-A276 HydrophobicContact CG-CB 3.85Å; P217-T277 PolarHBondContact O-OG1 3.2Å; P217-F284 HydrophobicContact CG-CB 4.48Å
218	N	84.9	Confident	79.1	Confident	131 Å²	131	62.1 Å²	62.1	70%	0.701	34%	0.335	S	S	*	.			trans	-119.1	56.8	172.1	-173.5	25.4	0	0	0	108.8
219	V	87.6	Confident	80.5	Confident	16 Å²	16	64.5 Å²	64.5	10%	0.097	36%	0.361	C	S	.	.			trans	-110.4	123.7	178.2	180	0	0	0	0	107.1	D223 Y270 K273 A274 T277	V219-D223 HydrophobicContact CG1-CB 4.31Å; V219-Y270 HydrophobicContact CG1-CD1 4.14Å; V219-Y270 HydrophobicContact CG1-CE1 3.54Å; V219-Y270 HydrophobicContact CG1-CE2 4.05Å; V219-Y270 VanDerWaalsContact CG1-CZ 3.49Å; V219-Y270 HydrophobicContact CG2-CE2 3.97Å; V219-K273 HydrophobicContact CB-CB 4.49Å; V219-K273 HydrophobicContact CG2-CB 4.25Å; V219-A274 HydrophobicContact CB-CB 4.4Å; V219-A274 HydrophobicContact CG1-CB 3.88Å; V219-A274 WeakPolarHBondContact O-CA 3.41Å; V219-T277 PolarHBondContact N-OG1 2.78Å; V219-T277 VanDerWaalsContact N-OG1 3.1Å; V219-T277 WeakPolarHBondContact O-CB 3.27Å; V219-T277 WeakPolarHBondContact O-CG2 3.41Å; V219-T277 PolarHBondContact O-OG1 3.09Å
220	K	88.9	Confident	82	Confident	108 Å²	108	57.9 Å²	57.9	47%	0.47	33%	0.332	S	S	.	.			trans	-96.8	164	-178.6	-63.3	-177.9	-179.2	-178.7	0	111.5	S222 D223	K220-S222 WeakPolarHBondContact CB-OG 3.48Å; K220-S222 PolarHBondContact O-N 3.26Å; K220-D223 PolarHBondContact N-OD2 3.05Å; K220-D223 WeakPolarHBondContact O-CB 3.47Å; K220-D223 PolarHBondContact O-N 2.86Å
221	W	88.4	Confident	83.3	Confident	24 Å²	24	55.3 Å²	55.3	9%	0.091	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-58	-29.2	171.9	-70.3	120.4	0	0	0	113.8	D223 V224 K231 L234 K235 I239 L271 A274 V275 E278	W221-D223 VanDerWaalsContact C-N 3.26Å; W221-D223 PolarHBondContact O-N 2.99Å; W221-V224 PolarHBondContact O-N 3.38Å; W221-K231 HydrophobicContact CE3-CB 4.26Å; W221-K231 HydrophobicContact CE3-CD 4.16Å; W221-K231 HydrophobicContact CE3-CG 3.8Å; W221-K231 HydrophobicContact CZ3-CB 4.14Å; W221-K231 HydrophobicContact CZ3-CG 3.82Å; W221-K231 PolarHBondContact O-NZ 3.15Å; W221-L234 HydrophobicContact CH2-CB 4Å; W221-L234 HydrophobicContact CH2-CD1 4.37Å; W221-K235 HydrophobicContact CZ2-CG 4.11Å; W221-I239 HydrophobicContact CZ2-CD1 4.02Å; W221-L271 HydrophobicContact CZ3-CD1 3.74Å; W221-A274 HydrophobicContact CE3-CB 4.36Å; W221-A274 HydrophobicContact CZ3-CB 4.47Å; W221-V275 HydrophobicContact CH2-CB 4.42Å; W221-V275 HydrophobicContact CH2-CG2 3.46Å; W221-V275 VanDerWaalsContact CH2-CG2 3.46Å; W221-V275 HydrophobicContact CZ2-CG2 4.07Å; W221-V275 HydrophobicContact CZ3-CG2 4.32Å; W221-E278 HydrophobicContact CD2-CG 4.35Å; W221-E278 HydrophobicContact CG-CG 4.04Å; W221-E278 HydrophobicContact CZ2-CB 4.45Å; W221-E278 PolarHBondContact N-OE1 2.81Å; W221-E278 VanDerWaalsContact NE1-CB 3.32Å
222	S	86.4	Confident	84.7	Confident	97 Å²	97	61.4 Å²	61.4	68%	0.678	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-67.3	-26.5	176.5	53	0	0	0	0	113.3	K220 V224	K220-S222 WeakPolarHBondContact CB-OG 3.48Å; K220-S222 PolarHBondContact O-N 3.26Å; S222-V224 VanDerWaalsContact C-N 3.29Å
223	D	85.9	Confident	85.8	Confident	56 Å²	56	62 Å²	62	30%	0.299	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-83.5	-15	-175.2	-51.2	-23.5	0	0	0	111	V219 K220 W221	V219-D223 HydrophobicContact CG1-CB 4.31Å; K220-D223 PolarHBondContact N-OD2 3.05Å; K220-D223 WeakPolarHBondContact O-CB 3.47Å; K220-D223 PolarHBondContact O-N 2.86Å; W221-D223 VanDerWaalsContact C-N 3.26Å; W221-D223 PolarHBondContact O-N 2.99Å
224	V	88.1	Confident	86.7	Confident	13 Å²	13	58.4 Å²	58.4	8%	0.079	31%	0.312	C	S	.	.	S	Bend	trans	-92.1	110.1	174.5	-174.7	0	0	0	0	109.2	W221 S222 L227 K231 Y270 L271 A274	W221-V224 PolarHBondContact O-N 3.38Å; S222-V224 VanDerWaalsContact C-N 3.29Å; V224-L227 HydrophobicContact CG1-CD1 4.49Å; V224-K231 VanDerWaalsContact O-CE 3.27Å; V224-K231 WeakPolarHBondContact O-CE 3.29Å; V224-K231 PolarHBondContact O-NZ 2.81Å; V224-Y270 HydrophobicContact CG2-CD1 3.97Å; V224-Y270 HydrophobicContact CG2-CE1 4.08Å; V224-L271 HydrophobicContact CG1-CD1 4.08Å; V224-A274 HydrophobicContact CG2-CB 3.87Å
225	A	87.5	Confident	87.3	Confident	18 Å²	18	57.9 Å²	57.9	15%	0.149	31%	0.306	C	S	.	.			trans	-76.8	126.8	178.8	0	0	0	0	0	112.3	A396 M397	A225-A396 HydrophobicContact CB-CB 4.21Å; A225-M397 HydrophobicContact CB-CE 4.07Å; A225-M397 HydrophobicContact CB-CG 3.86Å
226	G	87.4	Confident	87.9	Confident	22 Å²	22	60.8 Å²	60.8	23%	0.227	32%	0.32	C	S	.	.	S	Bend	trans	73.8	-151	177.4	0	0	0	0	0	113.9	E228 K231	G226-E228 VanDerWaalsContact C-N 3.3Å; G226-E228 PolarHBondContact O-N 3.46Å; G226-K231 WeakPolarHBondContact O-CE 3.36Å; G226-K231 PolarHBondContact O-NZ 3.26Å
227	L	87.3	Confident	88.3	Confident	32 Å²	32	51.4 Å²	51.4	17%	0.168	29%	0.286	C	S	.	.			trans	58.6	33.5	178.6	-60	174.9	0	0	0	114.4	V224 G229 A230 K231 I386 P387	V224-L227 HydrophobicContact CG1-CD1 4.49Å; L227-G229 VanDerWaalsContact C-N 3.32Å; L227-G229 PolarHBondContact O-N 3.44Å; L227-A230 HydrophobicContact CB-CB 4.3Å; L227-A230 PolarHBondContact O-N 3.21Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 2.96Å; L227-I386 HydrophobicContact CD1-CG2 3.85Å; L227-I386 HydrophobicContact CD2-CG2 3.94Å; L227-P387 HydrophobicContact CD2-CG 4Å
228	E	88.8	Confident	88.8	Confident	115 Å²	115	51.2 Å²	51.2	54%	0.537	28%	0.284	S	S	.	.	H	α-helix	trans	-57.5	-41.7	-173.5	-63.3	-52.8	139.8	0	0	113.1	G226 A230 K231 E232	G226-E228 VanDerWaalsContact C-N 3.3Å; G226-E228 PolarHBondContact O-N 3.46Å; E228-A230 PolarHBondContact O-N 2.86Å; E228-K231 PolarHBondContact O-N 3.31Å; E228-K231 IonicContact OE1-NZ 3.21Å; E228-K231 PolarHBondContact OE1-NZ 2.87Å; E228-E232 WeakPolarHBondContact O-CB 3.34Å; E228-E232 PolarHBondContact O-N 3.13Å
229	G	88.5	Confident	88.9	Confident	55 Å²	55	46.8 Å²	46.8	57%	0.567	26%	0.26	S	S	*	.	H	α-helix	trans	-62.2	-39.1	175.1	0	0	0	0	0	113.6	L227 A233	L227-G229 VanDerWaalsContact C-N 3.32Å; L227-G229 PolarHBondContact O-N 3.44Å; G229-A233 WeakPolarHBondContact O-CB 3.44Å; G229-A233 PolarHBondContact O-N 3.15Å
230	A	90.6	Very high	89.1	Confident	8 Å²	8	48.9 Å²	48.9	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-72.6	-36.8	176.7	0	0	0	0	0	112.1	L227 E228 L234 I384 I386	L227-A230 HydrophobicContact CB-CB 4.3Å; L227-A230 PolarHBondContact O-N 3.21Å; E228-A230 PolarHBondContact O-N 2.86Å; A230-L234 WeakPolarHBondContact O-CB 3.49Å; A230-L234 WeakPolarHBondContact O-CG 3.37Å; A230-L234 PolarHBondContact O-N 3.14Å; A230-I384 HydrophobicContact CB-CG2 3.82Å; A230-I386 HydrophobicContact CB-CD1 3.52Å
231	K	91.5	Very high	89	Confident	11 Å²	11	44.7 Å²	44.7	5%	0.048	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-44	173.3	-69.7	176.4	180	168.1	0	111	W221 V224 G226 L227 E228 L234 K235 L271	W221-K231 HydrophobicContact CE3-CB 4.26Å; W221-K231 HydrophobicContact CE3-CD 4.16Å; W221-K231 HydrophobicContact CE3-CG 3.8Å; W221-K231 HydrophobicContact CZ3-CB 4.14Å; W221-K231 HydrophobicContact CZ3-CG 3.82Å; W221-K231 PolarHBondContact O-NZ 3.15Å; V224-K231 VanDerWaalsContact O-CE 3.27Å; V224-K231 WeakPolarHBondContact O-CE 3.29Å; V224-K231 PolarHBondContact O-NZ 2.81Å; G226-K231 WeakPolarHBondContact O-CE 3.36Å; G226-K231 PolarHBondContact O-NZ 3.26Å; L227-K231 WeakPolarHBondContact O-CG 3.33Å; L227-K231 PolarHBondContact O-N 2.96Å; E228-K231 PolarHBondContact O-N 3.31Å; E228-K231 IonicContact OE1-NZ 3.21Å; E228-K231 PolarHBondContact OE1-NZ 2.87Å; K231-L234 PolarHBondContact O-N 3.3Å; K231-K235 WeakPolarHBondContact O-CB 3.48Å; K231-K235 WeakPolarHBondContact O-CG 3.46Å; K231-K235 PolarHBondContact O-N 2.96Å; K231-L271 HydrophobicContact CG-CD1 4.37Å
232	E	92	Very high	88.8	Confident	138 Å²	138	46.3 Å²	46.3	65%	0.645	26%	0.264	S	S	*	.	H	α-helix	trans	-63.1	-47.3	178	-171.9	166.4	-155.1	0	0	111.2	E228 L234 K235 E236	E228-E232 WeakPolarHBondContact O-CB 3.34Å; E228-E232 PolarHBondContact O-N 3.13Å; E232-L234 VanDerWaalsContact C-N 3.28Å; E232-L234 PolarHBondContact O-N 3.36Å; E232-K235 PolarHBondContact O-N 3.29Å; E232-K235 VanDerWaalsContact O-N 3.15Å; E232-E236 PolarHBondContact O-N 3.16Å
233	A	91.1	Very high	88.8	Confident	17 Å²	17	48.6 Å²	48.6	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-58.1	-39.1	174.7	0	0	0	0	0	112.6	G229 A237 I384	G229-A233 WeakPolarHBondContact O-CB 3.44Å; G229-A233 PolarHBondContact O-N 3.15Å; A233-A237 WeakPolarHBondContact O-CB 3.49Å; A233-A237 PolarHBondContact O-N 3.38Å; A233-I384 HydrophobicContact CB-CD1 3.92Å; A233-I384 HydrophobicContact CB-CG1 4.36Å
234	L	91.6	Very high	89	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-72.4	-37.8	175.8	-77.6	167	0	0	0	113.1	W221 A230 K231 E232 E236 A237 V238 I258 L260 L271 V275 I384	W221-L234 HydrophobicContact CH2-CB 4Å; W221-L234 HydrophobicContact CH2-CD1 4.37Å; A230-L234 WeakPolarHBondContact O-CB 3.49Å; A230-L234 WeakPolarHBondContact O-CG 3.37Å; A230-L234 PolarHBondContact O-N 3.14Å; K231-L234 PolarHBondContact O-N 3.3Å; E232-L234 VanDerWaalsContact C-N 3.28Å; E232-L234 PolarHBondContact O-N 3.36Å; L234-E236 VanDerWaalsContact C-N 3.33Å; L234-A237 PolarHBondContact O-N 3.46Å; L234-V238 HydrophobicContact CD2-CG2 4.41Å; L234-V238 WeakPolarHBondContact O-CB 3.38Å; L234-V238 WeakPolarHBondContact O-CG2 3.4Å; L234-V238 PolarHBondContact O-N 3.27Å; L234-I258 HydrophobicContact CD2-CD1 4.45Å; L234-I258 HydrophobicContact CD2-CG2 4.45Å; L234-L260 HydrophobicContact CD1-CD2 4.43Å; L234-L260 HydrophobicContact CD2-CD2 4.27Å; L234-L271 HydrophobicContact CD1-CD1 4.1Å; L234-L271 HydrophobicContact CD1-CD2 3.5Å; L234-L271 HydrophobicContact CD1-CG 3.6Å; L234-V275 HydrophobicContact CB-CG2 4.09Å; L234-V275 HydrophobicContact CD1-CG2 3.73Å; L234-V275 HydrophobicContact CD2-CG2 4.05Å; L234-V275 HydrophobicContact CG-CG2 4.18Å; L234-I384 HydrophobicContact CD2-CD1 3.71Å; L234-I384 HydrophobicContact CG-CD1 3.71Å
235	K	91.6	Very high	88.9	Confident	85 Å²	85	53 Å²	53	37%	0.37	29%	0.286	S	S	.	.	I	π-helix	trans	-61.7	-44	174.2	-74.7	169.7	179.8	176.7	0	110.5	W221 K231 E232 I239 L240	W221-K235 HydrophobicContact CZ2-CG 4.11Å; K231-K235 WeakPolarHBondContact O-CB 3.48Å; K231-K235 WeakPolarHBondContact O-CG 3.46Å; K231-K235 PolarHBondContact O-N 2.96Å; E232-K235 PolarHBondContact O-N 3.29Å; E232-K235 VanDerWaalsContact O-N 3.15Å; K235-I239 HydrophobicContact CG-CD1 4.05Å; K235-I239 CarbonylContact O-C 3.57Å; K235-I239 WeakPolarHBondContact O-CA 3.48Å; K235-I239 WeakPolarHBondContact O-CB 3.47Å; K235-I239 PolarHBondContact O-N 3.28Å; K235-L240 PolarHBondContact O-N 3.06Å
236	E	90.5	Very high	89	Confident	116 Å²	116	57.9 Å²	57.9	54%	0.542	31%	0.305	S	S	.	.	I	π-helix	trans	-65.3	-45.4	175.7	-171.1	-175.2	175.9	0	0	111.7	E232 L234 L240	E232-E236 PolarHBondContact O-N 3.16Å; L234-E236 VanDerWaalsContact C-N 3.33Å; E236-L240 HydrophobicContact CG-CD2 4.19Å; E236-L240 VanDerWaalsContact O-CB 3.23Å; E236-L240 WeakPolarHBondContact O-CB 3.32Å
237	A	88.1	Confident	89.2	Confident	4 Å²	4	60.3 Å²	60.3	3%	0.033	31%	0.313	C	S	.	.	I	π-helix	trans	-74.7	-32.3	-174.8	0	0	0	0	0	113.9	A233 L234 I258	A233-A237 WeakPolarHBondContact O-CB 3.49Å; A233-A237 PolarHBondContact O-N 3.38Å; L234-A237 PolarHBondContact O-N 3.46Å; A237-I258 HydrophobicContact CB-CD1 3.55Å
238	V	88.3	Confident	89.2	Confident	9 Å²	9	61.3 Å²	61.3	6%	0.055	32%	0.316	C	S	.	.	I	π-helix	trans	-113.3	-47.3	-171.2	-174	0	0	0	0	112.8	L234 P241 I242 I258 V275 A279 I318 L361	L234-V238 HydrophobicContact CD2-CG2 4.41Å; L234-V238 WeakPolarHBondContact O-CB 3.38Å; L234-V238 WeakPolarHBondContact O-CG2 3.4Å; L234-V238 PolarHBondContact O-N 3.27Å; V238-P241 WeakPolarHBondContact O-CD 3.5Å; V238-I242 HydrophobicContact CG1-CD1 4.32Å; V238-I242 VanDerWaalsContact O-CD1 3.28Å; V238-I242 WeakPolarHBondContact O-CD1 3.39Å; V238-I242 VanDerWaalsContact O-CG1 3.3Å; V238-I242 WeakPolarHBondContact O-CG1 3.26Å; V238-I258 HydrophobicContact CG2-CD1 3.68Å; V238-V275 HydrophobicContact CB-CG1 4.05Å; V238-V275 HydrophobicContact CG1-CG1 3.74Å; V238-V275 HydrophobicContact CG2-CG1 3.99Å; V238-A279 HydrophobicContact CG1-CB 4.18Å; V238-I318 HydrophobicContact CG1-CD1 4.43Å; V238-L361 HydrophobicContact CB-CD2 4.13Å; V238-L361 HydrophobicContact CG1-CD2 3.68Å; V238-L361 HydrophobicContact CG2-CD2 3.39Å
239	I	87.9	Confident	89	Confident	38 Å²	38	60.2 Å²	60.2	20%	0.195	32%	0.317	C	S	.	.	I	π-helix	trans	-81.2	-39	-173.1	-56.1	-173.2	0	0	0	110.9	W221 K235 I242 K243 E278	W221-I239 HydrophobicContact CZ2-CD1 4.02Å; K235-I239 HydrophobicContact CG-CD1 4.05Å; K235-I239 CarbonylContact O-C 3.57Å; K235-I239 WeakPolarHBondContact O-CA 3.48Å; K235-I239 WeakPolarHBondContact O-CB 3.47Å; K235-I239 PolarHBondContact O-N 3.28Å; I239-I242 PolarHBondContact O-N 3.27Å; I239-K243 WeakPolarHBondContact O-CB 3.33Å; I239-K243 PolarHBondContact O-N 3.5Å; I239-E278 HydrophobicContact CD1-CB 3.99Å
240	L	90	Very high	89	Confident	61 Å²	61	61.3 Å²	61.3	32%	0.319	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-45.1	-178	-166	74.5	0	0	0	112.9	K235 E236 I242 K243 F244 F248	K235-L240 PolarHBondContact O-N 3.06Å; E236-L240 HydrophobicContact CG-CD2 4.19Å; E236-L240 VanDerWaalsContact O-CB 3.23Å; E236-L240 WeakPolarHBondContact O-CB 3.32Å; L240-I242 PolarHBondContact O-N 3.33Å; L240-K243 PolarHBondContact O-N 2.98Å; L240-F244 HydrophobicContact CD1-CD2 3.77Å; L240-F244 HydrophobicContact CD1-CE2 4.24Å; L240-F244 PolarHBondContact O-N 3Å; L240-F248 HydrophobicContact CD2-CE2 4.36Å; L240-F248 HydrophobicContact CD2-CZ 4.08Å; L240-F248 HydrophobicContact CG-CE2 4.19Å; L240-F248 HydrophobicContact CG-CZ 4.31Å
241	P	87.3	Confident	88.8	Confident	19 Å²	19	71 Å²	71	12%	0.123	37%	0.369	C	S	.	.	H	α-helix	trans	-64.8	-36.3	176.2	-19.3	31	0	0	0	114.1	V238 P245 F248 P254	V238-P241 WeakPolarHBondContact O-CD 3.5Å; P241-P245 WeakPolarHBondContact O-CA 3.47Å; P241-F248 HydrophobicContact CB-CD2 3.91Å; P241-F248 HydrophobicContact CB-CE1 4.48Å; P241-F248 HydrophobicContact CB-CE2 3.83Å; P241-F248 HydrophobicContact CB-CG 4.29Å; P241-F248 HydrophobicContact CB-CZ 4.12Å; P241-F248 HydrophobicContact CG-CD1 4.49Å; P241-F248 HydrophobicContact CG-CD2 4.32Å; P241-F248 HydrophobicContact CG-CE1 3.98Å; P241-F248 HydrophobicContact CG-CE2 3.81Å; P241-F248 HydrophobicContact CG-CZ 3.61Å; P241-P254 HydrophobicContact CB-CB 3.77Å; P241-P254 HydrophobicContact CG-CB 3.79Å
242	I	85.1	Confident	88.6	Confident	59 Å²	59	79 Å²	79	30%	0.303	40%	0.399	S	S	.	.	H	α-helix	trans	-69.2	-41.5	179.1	-63.8	172.4	0	0	0	110.2	V238 I239 L240 A279 N280	V238-I242 HydrophobicContact CG1-CD1 4.32Å; V238-I242 VanDerWaalsContact O-CD1 3.28Å; V238-I242 WeakPolarHBondContact O-CD1 3.39Å; V238-I242 VanDerWaalsContact O-CG1 3.3Å; V238-I242 WeakPolarHBondContact O-CG1 3.26Å; I239-I242 PolarHBondContact O-N 3.27Å; L240-I242 PolarHBondContact O-N 3.33Å; I242-A279 HydrophobicContact CD1-CB 3.8Å; I242-N280 VanDerWaalsContact CG2-ND2 3.31Å; I242-N280 WeakPolarHBondContact CG2-ND2 3.39Å
243	K	86.7	Confident	88.4	Confident	144 Å²	144	77 Å²	77	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-76.7	-37.6	-177.2	-169.5	173.5	-179.3	177.6	0	112.8	I239 L240	I239-K243 WeakPolarHBondContact O-CB 3.33Å; I239-K243 PolarHBondContact O-N 3.5Å; L240-K243 PolarHBondContact O-N 2.98Å
244	F	89.3	Confident	88.3	Confident	79 Å²	79	78.4 Å²	78.4	35%	0.346	40%	0.404	S	S	.	.			trans	-131.2	66.6	-175.2	-56.1	-63.5	0	0	0	111.8	L240 H246 L247	L240-F244 HydrophobicContact CD1-CD2 3.77Å; L240-F244 HydrophobicContact CD1-CE2 4.24Å; L240-F244 PolarHBondContact O-N 3Å; F244-H246 AromaticContact CD1-CE1 3.81Å; F244-H246 PolarHBondContact O-N 2.95Å; F244-H246 VanDerWaalsContact O-N 3.11Å; F244-L247 HydrophobicContact CB-CD1 3.68Å; F244-L247 HydrophobicContact CB-CG 3.94Å; F244-L247 HydrophobicContact CD2-CD1 4.43Å; F244-L247 HydrophobicContact CG-CD1 4.29Å; F244-L247 WeakPolarHBondContact O-CB 3.34Å; F244-L247 PolarHBondContact O-N 3.49Å
245	P	87	Confident	88.2	Confident	84 Å²	84	83 Å²	83	55%	0.545	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-60.5	-26.9	-176.5	23.4	-34.4	0	0	0	113.3	P241 L247 F248	P241-P245 WeakPolarHBondContact O-CA 3.47Å; P245-L247 PolarHBondContact O-N 3.24Å; P245-F248 CarbonylContact O-C 3.59Å; P245-F248 PolarHBondContact O-N 3.41Å
246	H	88.9	Confident	88	Confident	120 Å²	120	83 Å²	83	56%	0.556	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-62.7	-25	177.4	65.7	-89.2	0	0	0	113.9	F244 F248 T249	F244-H246 AromaticContact CD1-CE1 3.81Å; F244-H246 PolarHBondContact O-N 2.95Å; F244-H246 VanDerWaalsContact O-N 3.11Å; H246-F248 PolarHBondContact O-N 3.42Å; H246-T249 WeakPolarHBondContact O-CG2 3.35Å; H246-T249 PolarHBondContact O-OG1 2.9Å; H246-T249 VanDerWaalsContact O-OG1 3.07Å
247	L	90.6	Very high	88.1	Confident	73 Å²	73	77.5 Å²	77.5	38%	0.382	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-70.8	-22.2	175.1	-63.3	179.7	0	0	0	112.2	F244 P245 R252	F244-L247 HydrophobicContact CB-CD1 3.68Å; F244-L247 HydrophobicContact CB-CG 3.94Å; F244-L247 HydrophobicContact CD2-CD1 4.43Å; F244-L247 HydrophobicContact CG-CD1 4.29Å; F244-L247 WeakPolarHBondContact O-CB 3.34Å; F244-L247 PolarHBondContact O-N 3.49Å; P245-L247 PolarHBondContact O-N 3.24Å; L247-R252 WeakPolarHBondContact O-CD 3.43Å
248	F	87.4	Confident	88.4	Confident	53 Å²	53	77.3 Å²	77.3	23%	0.232	39%	0.391	C	S	.	.	S	Bend	trans	-105.2	55.5	-176.9	-62.1	-90.3	0	0	0	110.7	L240 P241 P245 H246 R252 P254	L240-F248 HydrophobicContact CD2-CE2 4.36Å; L240-F248 HydrophobicContact CD2-CZ 4.08Å; L240-F248 HydrophobicContact CG-CE2 4.19Å; L240-F248 HydrophobicContact CG-CZ 4.31Å; P241-F248 HydrophobicContact CB-CD2 3.91Å; P241-F248 HydrophobicContact CB-CE1 4.48Å; P241-F248 HydrophobicContact CB-CE2 3.83Å; P241-F248 HydrophobicContact CB-CG 4.29Å; P241-F248 HydrophobicContact CB-CZ 4.12Å; P241-F248 HydrophobicContact CG-CD1 4.49Å; P241-F248 HydrophobicContact CG-CD2 4.32Å; P241-F248 HydrophobicContact CG-CE1 3.98Å; P241-F248 HydrophobicContact CG-CE2 3.81Å; P241-F248 HydrophobicContact CG-CZ 3.61Å; P245-F248 CarbonylContact O-C 3.59Å; P245-F248 PolarHBondContact O-N 3.41Å; H246-F248 PolarHBondContact O-N 3.42Å; F248-R252 CarbonylContact C-O 3.59Å; F248-R252 WeakPolarHBondContact CA-O 3.39Å; F248-P254 HydrophobicContact CD1-CB 4.33Å
249	T	85.6	Confident	88.7	Confident	92 Å²	92	76.9 Å²	76.9	56%	0.564	39%	0.389	S	S	*	.			trans	-114	154.9	176.9	54	0	0	0	0	111.3	H246 K251 R252	H246-T249 WeakPolarHBondContact O-CG2 3.35Å; H246-T249 PolarHBondContact O-OG1 2.9Å; H246-T249 VanDerWaalsContact O-OG1 3.07Å; T249-K251 PolarHBondContact O-N 3.13Å; T249-R252 PolarHBondContact N-O 3.14Å; T249-R252 PolarHBondContact O-N 3.28Å
250	G	87.6	Confident	89.1	Confident	78 Å²	78	75.1 Å²	75.1	80%	0.804	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	-120.3	-177.9	0	0	0	0	0	112.2
251	K	86.8	Confident	89.3	Confident	212 Å²	212	72.2 Å²	72.2	92%	0.922	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.5	-179.9	-66.4	-173.3	178.6	-178.8	0	113.9	T249 T253	T249-K251 PolarHBondContact O-N 3.13Å; K251-T253 PolarHBondContact O-N 3.41Å
252	R	88.2	Confident	89.6	Confident	179 Å²	179	71.3 Å²	71.3	68%	0.675	36%	0.359	S	S	*	.			trans	-86.5	101.2	178.7	-64.7	176.1	-175.3	168.7	1	107.8	L247 F248 T249	L247-R252 WeakPolarHBondContact O-CD 3.43Å; F248-R252 CarbonylContact C-O 3.59Å; F248-R252 WeakPolarHBondContact CA-O 3.39Å; T249-R252 PolarHBondContact N-O 3.14Å; T249-R252 PolarHBondContact O-N 3.28Å
253	T	86.4	Confident	90.1	Very high	95 Å²	95	68.6 Å²	68.6	58%	0.583	35%	0.345	S	S	*	.			trans	-109.1	144.7	178.7	51.8	0	0	0	0	110.3	K251	K251-T253 PolarHBondContact O-N 3.41Å
254	P	89	Confident	90.3	Very high	46 Å²	46	64.3 Å²	64.3	30%	0.299	33%	0.332	S	S	.	.			trans	-65.2	153.7	172.4	29.4	-34.3	0	0	0	110.7	P241 F248 R256	P241-P254 HydrophobicContact CB-CB 3.77Å; P241-P254 HydrophobicContact CG-CB 3.79Å; F248-P254 HydrophobicContact CD1-CB 4.33Å; P254-R256 PolarHBondContact O-N 2.97Å
255	W	89	Confident	90.4	Very high	97 Å²	97	62 Å²	62	37%	0.367	33%	0.331	S	S	.	.			trans	-65.3	130.9	175.1	-55.4	110.2	0	0	0	110.4	I258 L361 E381 K382	W255-I258 HydrophobicContact CB-CG1 4.37Å; W255-L361 WeakPolarHBondContact O-CD1 3.46Å; W255-E381 HydrophobicContact CE3-CB 3.47Å; W255-E381 VanDerWaalsContact CE3-CB 3.47Å; W255-E381 HydrophobicContact CE3-CG 4.4Å; W255-E381 HydrophobicContact CZ3-CB 3.77Å; W255-K382 HydrophobicContact CD2-CB 4.4Å; W255-K382 HydrophobicContact CG-CB 4.39Å
256	R	88.6	Confident	90.6	Very high	85 Å²	85	58.8 Å²	58.8	32%	0.321	31%	0.309	S	S	.	.	S	Bend	trans	-94.2	-25.1	179.6	-67	-175.6	171.8	-160.4	-2.7	112.9	P254 D358 V362 E381	P254-R256 PolarHBondContact O-N 2.97Å; R256-D358 IonicContact CZ-OD1 2.69Å; R256-D358 IonicContact NH2-OD1 3.34Å; R256-D358 PolarHBondContact NH2-OD1 2.94Å; R256-V362 PolarHBondContact O-N 3.45Å; R256-E381 PolarHBondContact N-OE2 2.89Å; R256-E381 VanDerWaalsContact N-OE2 3.08Å
257	G	92.4	Very high	90.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.3	-180	0	0	0	0	0	112	V362 F380 E381 K382	G257-V362 WeakPolarHBondContact CA-O 3.2Å; G257-F380 CarbonylContact O-C 3.56Å; G257-E381 PolarHBondContact O-N 2.91Å; G257-K382 PolarHBondContact O-N 3.49Å
258	I	94.1	Very high	90.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.7	173.7	-52.4	170.1	0	0	0	109.3	L234 A237 V238 W255 L260 L361 V362 L363 G364 F380 K382 I384	L234-I258 HydrophobicContact CD2-CD1 4.45Å; L234-I258 HydrophobicContact CD2-CG2 4.45Å; A237-I258 HydrophobicContact CB-CD1 3.55Å; V238-I258 HydrophobicContact CG2-CD1 3.68Å; W255-I258 HydrophobicContact CB-CG1 4.37Å; I258-L260 HydrophobicContact CG2-CD2 4.39Å; I258-L361 HydrophobicContact CD1-CD1 3.89Å; I258-L361 HydrophobicContact CD1-CD2 4.34Å; I258-L361 HydrophobicContact CG1-CD1 4.03Å; I258-V362 PolarHBondContact N-O 3.33Å; I258-L363 HydrophobicContact CB-CD2 3.67Å; I258-L363 HydrophobicContact CD1-CD2 4.01Å; I258-L363 HydrophobicContact CG1-CD2 4.26Å; I258-L363 HydrophobicContact CG2-CD2 4.31Å; I258-L363 WeakPolarHBondContact O-CA 3.41Å; I258-G364 PolarHBondContact O-N 3.43Å; I258-F380 VanDerWaalsContact C-CD1 3.46Å; I258-F380 WeakPolarHBondContact O-CD1 3.19Å; I258-K382 CarbonylContact C-O 3.36Å; I258-K382 WeakPolarHBondContact CA-O 3.44Å; I258-K382 HydrophobicContact CG1-CB 4.2Å; I258-K382 HydrophobicContact CG2-CB 4.37Å; I258-I384 HydrophobicContact CG2-CD1 3.7Å; I258-I384 HydrophobicContact CG2-CG1 4Å
259	L	94.7	Very high	91	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.8	175.1	-179	68.8	0	0	0	110.2	I324 T366 L372 F380 K382 R383 I384	L259-I324 HydrophobicContact CD1-CG2 3.96Å; L259-T366 HydrophobicContact CD1-CG2 4.03Å; L259-T366 HydrophobicContact CD2-CG2 4.47Å; L259-T366 HydrophobicContact CG-CG2 4.46Å; L259-L372 HydrophobicContact CD1-CD1 4.18Å; L259-L372 HydrophobicContact CD2-CD1 3.62Å; L259-F380 HydrophobicContact CB-CB 3.7Å; L259-F380 HydrophobicContact CB-CD1 3.95Å; L259-F380 HydrophobicContact CB-CD2 4.41Å; L259-F380 HydrophobicContact CB-CG 3.76Å; L259-F380 HydrophobicContact CD1-CD2 4.48Å; L259-K382 PolarHBondContact N-O 3.05Å; L259-R383 HydrophobicContact CB-CG 4.45Å; L259-R383 CarbonylContact O-C 3.44Å; L259-R383 WeakPolarHBondContact O-CA 3.38Å; L259-I384 PolarHBondContact O-N 3.23Å
260	L	95.4	Very high	91.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.8	167.3	-54.6	-176.4	0	0	0	108.8	L234 I258 K268 A272 G364 A365 T366 I384	L234-L260 HydrophobicContact CD1-CD2 4.43Å; L234-L260 HydrophobicContact CD2-CD2 4.27Å; I258-L260 HydrophobicContact CG2-CD2 4.39Å; L260-K268 HydrophobicContact CB-CD 4.35Å; L260-K268 HydrophobicContact CB-CG 4.44Å; L260-A272 HydrophobicContact CD1-CB 4.47Å; L260-G364 PolarHBondContact N-O 3.23Å; L260-A365 VanDerWaalsContact O-CA 3.31Å; L260-A365 WeakPolarHBondContact O-CA 3.35Å; L260-T366 PolarHBondContact O-N 3.06Å; L260-I384 HydrophobicContact CD2-CB 3.92Å; L260-I384 HydrophobicContact CD2-CD1 4.29Å; L260-I384 HydrophobicContact CD2-CG2 4.43Å
261	F	94.9	Very high	91.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.2	176.9	75.2	-84.3	0	0	0	111.6	T366 P369 R383 I384 Y385 I386 L521 F524 T525	F261-T366 WeakPolarHBondContact CA-O 3.45Å; F261-T366 HydrophobicContact CB-CG2 3.79Å; F261-P369 HydrophobicContact CB-CB 4.06Å; F261-P369 HydrophobicContact CB-CG 4.25Å; F261-P369 HydrophobicContact CD2-CB 4.24Å; F261-P369 HydrophobicContact CD2-CG 3.78Å; F261-P369 HydrophobicContact CG-CB 4.25Å; F261-P369 HydrophobicContact CG-CG 4.27Å; F261-R383 HydrophobicContact CD1-CB 4.37Å; F261-R383 HydrophobicContact CE1-CB 3.97Å; F261-I384 PolarHBondContact N-O 2.87Å; F261-Y385 AromaticContact CD2-CD2 3.88Å; F261-Y385 HydrophobicContact CD2-CD2 3.88Å; F261-Y385 AromaticContact CE2-CD2 3.49Å; F261-Y385 HydrophobicContact CE2-CD2 3.49Å; F261-Y385 VanDerWaalsContact CE2-CD2 3.49Å; F261-Y385 HydrophobicContact CE2-CE2 4.37Å; F261-Y385 HydrophobicContact CE2-CG 4.13Å; F261-Y385 HydrophobicContact CZ-CD2 4.03Å; F261-Y385 HydrophobicContact CZ-CG 4.22Å; F261-Y385 CarbonylContact O-C 3.59Å; F261-Y385 WeakPolarHBondContact O-CA 3.37Å; F261-I386 PolarHBondContact O-N 3.18Å; F261-L521 HydrophobicContact CD2-CD2 4.11Å; F261-F524 HydrophobicContact CD2-CD1 4.27Å; F261-F524 AromaticContact CE2-CD1 3.83Å; F261-F524 HydrophobicContact CE2-CD1 3.83Å; F261-F524 HydrophobicContact CE2-CE1 4.31Å; F261-F524 HydrophobicContact CZ-CD1 4.09Å; F261-F524 HydrophobicContact CZ-CE1 4.29Å; F261-T525 WeakPolarHBondContact CE2-OG1 3.24Å
262	G	94.4	Very high	91.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.			trans	159.5	177.1	-178.3	0	0	0	0	0	111.5	K268 T366 N367	G262-K268 PolarHBondContact O-NZ 3.44Å; G262-T366 PolarHBondContact N-O 2.92Å; G262-N367 WeakPolarHBondContact O-CA 3.32Å; G262-N367 PolarHBondContact O-OD1 3.32Å
263	P	94.4	Very high	91.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.013	18%	0.175	C	C	.	.	S	Bend	trans	-63	156.9	-176.3	23.7	-22.4	0	0	0	111.6	T266 K268 I386 L388 V513 L518 L521	P263-T266 HydrophobicContact CG-CG2 3.77Å; P263-T266 WeakPolarHBondContact O-CG2 3.34Å; P263-T266 PolarHBondContact O-OG1 3.05Å; P263-K268 PolarHBondContact O-NZ 2.97Å; P263-I386 WeakPolarHBondContact CD-O 3.43Å; P263-L388 HydrophobicContact CB-CD2 4.43Å; P263-L388 HydrophobicContact CG-CD2 3.84Å; P263-L388 HydrophobicContact CG-CG 3.9Å; P263-V513 HydrophobicContact CB-CB 4.46Å; P263-V513 HydrophobicContact CB-CG1 3.75Å; P263-V513 HydrophobicContact CB-CG2 3.85Å; P263-L518 HydrophobicContact CB-CD2 4.46Å; P263-L518 HydrophobicContact CG-CD2 4.17Å; P263-L521 HydrophobicContact CB-CD1 4.08Å; P263-L521 HydrophobicContact CG-CD1 4.24Å
264	P	92.5	Very high	92	Very high	55 Å²	55	27.3 Å²	27.3	36%	0.357	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	155.6	177.9	28	-35.4	0	0	0	111.2	T266 N367 V513	P264-T266 VanDerWaalsContact C-N 3.28Å; P264-T266 PolarHBondContact O-N 3.37Å; P264-N367 WeakPolarHBondContact CA-OD1 3.48Å; P264-V513 HydrophobicContact CG-CG2 4.28Å
265	G	90.3	Very high	92.1	Very high	31 Å²	31	25.1 Å²	25.1	32%	0.32	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	9.3	175.6	0	0	0	0	0	116	G426 A427	G265-G426 WeakPolarHBondContact O-CA 3.47Å; G265-G426 PolarHBondContact O-N 3.12Å; G265-A427 PolarHBondContact O-N 2.88Å; G265-A427 VanDerWaalsContact O-N 3.1Å
266	T	91.9	Very high	92	Very high	15 Å²	15	20.5 Å²	20.5	9%	0.092	12%	0.116	C	C	.	.	S	Bend	trans	-88.4	0.9	177.3	49	0	0	0	0	114.5	P263 P264 L388	P263-T266 HydrophobicContact CG-CG2 3.77Å; P263-T266 WeakPolarHBondContact O-CG2 3.34Å; P263-T266 PolarHBondContact O-OG1 3.05Å; P264-T266 VanDerWaalsContact C-N 3.28Å; P264-T266 PolarHBondContact O-N 3.37Å; T266-L388 HydrophobicContact CG2-CD2 4.08Å
267	G	90.2	Very high	92	Very high	35 Å²	35	17.2 Å²	17.2	36%	0.361	11%	0.105	S	C	.	.			trans	80.4	26.7	175.3	0	0	0	0	0	115.3	S269 Y270 L271	G267-S269 VanDerWaalsContact C-N 3.32Å; G267-S269 PolarHBondContact O-N 3.08Å; G267-Y270 CarbonylContact O-C 3.48Å; G267-Y270 WeakPolarHBondContact O-CA 3.41Å; G267-Y270 WeakPolarHBondContact O-CB 3.42Å; G267-Y270 PolarHBondContact O-N 3.26Å; G267-L271 WeakPolarHBondContact O-CB 3.36Å; G267-L271 PolarHBondContact O-N 3.41Å
268	K	93.6	Very high	91.6	Very high	9 Å²	9	20.4 Å²	20.4	4%	0.039	12%	0.12	C	C	.	.	H	α-helix	trans	-50.1	-48.4	174.9	-67.5	-177	-71.9	-76.5	0	112.9	L260 G262 P263 Y270 L271 A272 A365 T366 N367 I386	L260-K268 HydrophobicContact CB-CD 4.35Å; L260-K268 HydrophobicContact CB-CG 4.44Å; G262-K268 PolarHBondContact O-NZ 3.44Å; P263-K268 PolarHBondContact O-NZ 2.97Å; K268-Y270 VanDerWaalsContact C-N 3.31Å; K268-Y270 PolarHBondContact O-N 3.28Å; K268-L271 PolarHBondContact O-N 3.34Å; K268-A272 PolarHBondContact O-N 2.72Å; K268-A365 HydrophobicContact CB-CB 4.19Å; K268-A365 HydrophobicContact CD-CB 4.45Å; K268-T366 WeakPolarHBondContact CE-O 3.44Å; K268-N367 VanDerWaalsContact CE-OD1 3.25Å; K268-N367 WeakPolarHBondContact CE-OD1 3.36Å; K268-N367 PolarHBondContact NZ-OD1 3.01Å; K268-I386 HydrophobicContact CG-CB 4.26Å; K268-I386 HydrophobicContact CG-CG1 4.07Å; K268-I386 HydrophobicContact CG-CG2 4.43Å
269	S	90.9	Very high	91.1	Very high	38 Å²	38	20.5 Å²	20.5	27%	0.266	12%	0.12	S	C	.	.	H	α-helix	trans	-68	-31.1	178	-28.4	0	0	0	0	112	G267 K273 D322	G267-S269 VanDerWaalsContact C-N 3.32Å; G267-S269 PolarHBondContact O-N 3.08Å; S269-K273 WeakPolarHBondContact O-CG 3.42Å; S269-K273 PolarHBondContact O-N 2.87Å; S269-D322 PolarHBondContact OG-OD2 2.9Å
270	Y	90.8	Very high	90.1	Very high	103 Å²	103	26.1 Å²	26.1	40%	0.404	15%	0.151	S	C	.	.	H	α-helix	trans	-72.1	-39.3	175.2	-163	-105.1	0	0	0	111.8	V219 V224 G267 K268 K273 A274	V219-Y270 HydrophobicContact CG1-CD1 4.14Å; V219-Y270 HydrophobicContact CG1-CE1 3.54Å; V219-Y270 HydrophobicContact CG1-CE2 4.05Å; V219-Y270 VanDerWaalsContact CG1-CZ 3.49Å; V219-Y270 HydrophobicContact CG2-CE2 3.97Å; V224-Y270 HydrophobicContact CG2-CD1 3.97Å; V224-Y270 HydrophobicContact CG2-CE1 4.08Å; G267-Y270 CarbonylContact O-C 3.48Å; G267-Y270 WeakPolarHBondContact O-CA 3.41Å; G267-Y270 WeakPolarHBondContact O-CB 3.42Å; G267-Y270 PolarHBondContact O-N 3.26Å; K268-Y270 VanDerWaalsContact C-N 3.31Å; K268-Y270 PolarHBondContact O-N 3.28Å; Y270-K273 WeakPolarHBondContact O-CB 2.83Å; Y270-K273 PolarHBondContact O-N 2.81Å; Y270-A274 PolarHBondContact O-N 3.04Å
271	L	92.4	Very high	89	Confident	1 Å²	1	31 Å²	31	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-42	174.1	-173.5	68.3	0	0	0	111.4	W221 V224 K231 L234 G267 K268 K273 A274 V275 I386	W221-L271 HydrophobicContact CZ3-CD1 3.74Å; V224-L271 HydrophobicContact CG1-CD1 4.08Å; K231-L271 HydrophobicContact CG-CD1 4.37Å; L234-L271 HydrophobicContact CD1-CD1 4.1Å; L234-L271 HydrophobicContact CD1-CD2 3.5Å; L234-L271 HydrophobicContact CD1-CG 3.6Å; G267-L271 WeakPolarHBondContact O-CB 3.36Å; G267-L271 PolarHBondContact O-N 3.41Å; K268-L271 PolarHBondContact O-N 3.34Å; L271-K273 VanDerWaalsContact C-N 3.32Å; L271-K273 PolarHBondContact O-N 3.02Å; L271-A274 WeakPolarHBondContact O-CB 3.17Å; L271-A274 PolarHBondContact O-N 2.99Å; L271-A274 VanDerWaalsContact O-N 3.16Å; L271-V275 WeakPolarHBondContact O-CG2 2.97Å; L271-V275 PolarHBondContact O-N 3.34Å; L271-I386 HydrophobicContact CD2-CD1 3.63Å; L271-I386 HydrophobicContact CD2-CG1 4.46Å
272	A	91.4	Very high	88.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.7	-39.2	174.9	0	0	0	0	0	112.3	L260 K268 V275 A276 F284 F320 L363	L260-A272 HydrophobicContact CD1-CB 4.47Å; K268-A272 PolarHBondContact O-N 2.72Å; A272-V275 PolarHBondContact O-N 2.8Å; A272-A276 PolarHBondContact O-N 3.45Å; A272-A276 VanDerWaalsContact O-N 3.1Å; A272-F284 HydrophobicContact CB-CE2 4.34Å; A272-F284 HydrophobicContact CB-CZ 4.27Å; A272-F320 HydrophobicContact CB-CD2 3.39Å; A272-F320 HydrophobicContact CB-CE2 3.43Å; A272-F320 VanDerWaalsContact CB-CE2 3.43Å; A272-F320 HydrophobicContact CB-CG 4.02Å; A272-F320 HydrophobicContact CB-CZ 4.1Å; A272-L363 HydrophobicContact CB-CD1 4.19Å
273	K	90.1	Very high	87.9	Confident	55 Å²	55	32.4 Å²	32.4	24%	0.239	19%	0.185	C	C	.	.	H	α-helix	trans	-63.4	-40.6	173	-71.4	-179	-171.5	-137.6	0	111.8	E215 P217 V219 S269 Y270 L271 A276 T277 F284	E215-K273 IonicContact OE1-NZ 3.27Å; E215-K273 PolarHBondContact OE1-NZ 3.02Å; E215-K273 WeakPolarHBondContact OE2-CE 3.39Å; E215-K273 IonicContact OE2-NZ 3.61Å; E215-K273 PolarHBondContact OE2-NZ 2.94Å; P217-K273 HydrophobicContact CB-CB 3.82Å; P217-K273 HydrophobicContact CB-CG 4.18Å; P217-K273 HydrophobicContact CG-CB 4.15Å; P217-K273 HydrophobicContact CG-CG 4.46Å; P217-K273 WeakPolarHBondContact CG-O 3.44Å; V219-K273 HydrophobicContact CB-CB 4.49Å; V219-K273 HydrophobicContact CG2-CB 4.25Å; S269-K273 WeakPolarHBondContact O-CG 3.42Å; S269-K273 PolarHBondContact O-N 2.87Å; Y270-K273 WeakPolarHBondContact O-CB 2.83Å; Y270-K273 PolarHBondContact O-N 2.81Å; L271-K273 VanDerWaalsContact C-N 3.32Å; L271-K273 PolarHBondContact O-N 3.02Å; K273-A276 PolarHBondContact O-N 2.99Å; K273-T277 PolarHBondContact O-N 2.87Å; K273-T277 VanDerWaalsContact O-N 3.07Å; K273-T277 PolarHBondContact O-OG1 2.94Å; K273-F284 HydrophobicContact CG-CE1 4.02Å; K273-F284 HydrophobicContact CG-CZ 4.18Å
274	A	90.7	Very high	87.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.6	-43.4	176.2	0	0	0	0	0	112.4	V219 W221 V224 Y270 L271 A276 T277 E278	V219-A274 HydrophobicContact CB-CB 4.4Å; V219-A274 HydrophobicContact CG1-CB 3.88Å; V219-A274 WeakPolarHBondContact O-CA 3.41Å; W221-A274 HydrophobicContact CE3-CB 4.36Å; W221-A274 HydrophobicContact CZ3-CB 4.47Å; V224-A274 HydrophobicContact CG2-CB 3.87Å; Y270-A274 PolarHBondContact O-N 3.04Å; L271-A274 WeakPolarHBondContact O-CB 3.17Å; L271-A274 PolarHBondContact O-N 2.99Å; L271-A274 VanDerWaalsContact O-N 3.16Å; A274-A276 VanDerWaalsContact C-N 3.28Å; A274-A276 PolarHBondContact O-N 2.75Å; A274-T277 PolarHBondContact O-N 2.82Å; A274-E278 WeakPolarHBondContact O-CB 3.19Å; A274-E278 VanDerWaalsContact O-CG 3.22Å; A274-E278 WeakPolarHBondContact O-CG 3.44Å; A274-E278 PolarHBondContact O-N 2.99Å; A274-E278 VanDerWaalsContact O-N 3.11Å
275	V	90.8	Very high	87.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.6	-44.7	173.9	173.2	0	0	0	0	110.9	W221 L234 V238 L271 A272 E278 A279 I318 L363	W221-V275 HydrophobicContact CH2-CB 4.42Å; W221-V275 HydrophobicContact CH2-CG2 3.46Å; W221-V275 VanDerWaalsContact CH2-CG2 3.46Å; W221-V275 HydrophobicContact CZ2-CG2 4.07Å; W221-V275 HydrophobicContact CZ3-CG2 4.32Å; L234-V275 HydrophobicContact CB-CG2 4.09Å; L234-V275 HydrophobicContact CD1-CG2 3.73Å; L234-V275 HydrophobicContact CD2-CG2 4.05Å; L234-V275 HydrophobicContact CG-CG2 4.18Å; V238-V275 HydrophobicContact CB-CG1 4.05Å; V238-V275 HydrophobicContact CG1-CG1 3.74Å; V238-V275 HydrophobicContact CG2-CG1 3.99Å; L271-V275 WeakPolarHBondContact O-CG2 2.97Å; L271-V275 PolarHBondContact O-N 3.34Å; A272-V275 PolarHBondContact O-N 2.8Å; V275-E278 PolarHBondContact O-N 3.13Å; V275-A279 WeakPolarHBondContact O-CB 3.47Å; V275-A279 PolarHBondContact O-N 3.46Å; V275-I318 HydrophobicContact CG1-CD1 4.13Å; V275-L363 HydrophobicContact CG1-CD1 4.37Å
276	A	87.9	Confident	87.7	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-37.6	-178.1	0	0	0	0	0	113.7	P217 A272 K273 A274 E278 F284 I318	P217-A276 HydrophobicContact CG-CB 3.85Å; A272-A276 PolarHBondContact O-N 3.45Å; A272-A276 VanDerWaalsContact O-N 3.1Å; K273-A276 PolarHBondContact O-N 2.99Å; A274-A276 VanDerWaalsContact C-N 3.28Å; A274-A276 PolarHBondContact O-N 2.75Å; A276-E278 VanDerWaalsContact C-N 3.32Å; A276-F284 HydrophobicContact CB-CB 3.88Å; A276-F284 HydrophobicContact CB-CD2 3.34Å; A276-F284 HydrophobicContact CB-CE2 4.02Å; A276-F284 HydrophobicContact CB-CG 3.82Å; A276-I318 HydrophobicContact CB-CD1 4.17Å
277	T	87.6	Confident	87.5	Confident	15 Å²	15	28.6 Å²	28.6	9%	0.092	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-43.1	173	-57.5	0	0	0	0	111.2	P217 V219 K273 A274 N281	P217-T277 PolarHBondContact O-OG1 3.2Å; V219-T277 PolarHBondContact N-OG1 2.78Å; V219-T277 VanDerWaalsContact N-OG1 3.1Å; V219-T277 WeakPolarHBondContact O-CB 3.27Å; V219-T277 WeakPolarHBondContact O-CG2 3.41Å; V219-T277 PolarHBondContact O-OG1 3.09Å; K273-T277 PolarHBondContact O-N 2.87Å; K273-T277 VanDerWaalsContact O-N 3.07Å; K273-T277 PolarHBondContact O-OG1 2.94Å; A274-T277 PolarHBondContact O-N 2.82Å; T277-N281 PolarHBondContact O-N 3.17Å
278	E	85.6	Confident	87.3	Confident	68 Å²	68	28.6 Å²	28.6	32%	0.318	15%	0.15	S	C	.	.	H	α-helix	trans	-84.3	-19.3	-172	-64.4	-86.4	177.6	0	0	113.1	W221 I239 A274 V275 A276 N280	W221-E278 HydrophobicContact CD2-CG 4.35Å; W221-E278 HydrophobicContact CG-CG 4.04Å; W221-E278 HydrophobicContact CZ2-CB 4.45Å; W221-E278 PolarHBondContact N-OE1 2.81Å; W221-E278 VanDerWaalsContact NE1-CB 3.32Å; I239-E278 HydrophobicContact CD1-CB 3.99Å; A274-E278 WeakPolarHBondContact O-CB 3.19Å; A274-E278 VanDerWaalsContact O-CG 3.22Å; A274-E278 WeakPolarHBondContact O-CG 3.44Å; A274-E278 PolarHBondContact O-N 2.99Å; A274-E278 VanDerWaalsContact O-N 3.11Å; V275-E278 PolarHBondContact O-N 3.13Å; A276-E278 VanDerWaalsContact C-N 3.32Å; E278-N280 PolarHBondContact O-N 3.2Å
279	A	82.2	Confident	86.7	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.008	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	55.5	172.1	0	0	0	0	0	111.9	V238 I242 V275 N281 S282 I318	V238-A279 HydrophobicContact CG1-CB 4.18Å; I242-A279 HydrophobicContact CD1-CB 3.8Å; V275-A279 WeakPolarHBondContact O-CB 3.47Å; V275-A279 PolarHBondContact O-N 3.46Å; A279-N281 VanDerWaalsContact C-N 3.3Å; A279-N281 PolarHBondContact O-N 3.02Å; A279-S282 VanDerWaalsContact O-CB 3.3Å; A279-S282 WeakPolarHBondContact O-CB 3.44Å; A279-S282 PolarHBondContact O-N 2.9Å; A279-S282 PolarHBondContact O-OG 3.45Å; A279-I318 HydrophobicContact CB-CD1 4.07Å
280	N	73.9	Confident	86	Confident	119 Å²	119	29.1 Å²	29.1	64%	0.636	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	38.5	178.5	-67.5	-13.2	0	0	0	114.6	I242 E278 S282	I242-N280 VanDerWaalsContact CG2-ND2 3.31Å; I242-N280 WeakPolarHBondContact CG2-ND2 3.39Å; E278-N280 PolarHBondContact O-N 3.2Å; N280-S282 PolarHBondContact O-N 3.11Å
281	N	72.7	Confident	85.3	Confident	104 Å²	104	27.2 Å²	27.2	56%	0.556	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	36.7	-174.9	-67	89.6	0	0	0	113.4	T277 A279	T277-N281 PolarHBondContact O-N 3.17Å; A279-N281 VanDerWaalsContact C-N 3.3Å; A279-N281 PolarHBondContact O-N 3.02Å
282	S	78.4	Confident	84.3	Confident	6 Å²	6	27.3 Å²	27.3	4%	0.042	15%	0.152	C	C	.	.			trans	-52.9	150.2	174.3	-70.7	0	0	0	0	111.6	A279 N280 F284 P316	A279-S282 VanDerWaalsContact O-CB 3.3Å; A279-S282 WeakPolarHBondContact O-CB 3.44Å; A279-S282 PolarHBondContact O-N 2.9Å; A279-S282 PolarHBondContact O-OG 3.45Å; N280-S282 PolarHBondContact O-N 3.11Å; S282-F284 PolarHBondContact O-N 2.66Å; S282-P316 WeakPolarHBondContact CB-O 3.38Å; S282-P316 WeakPolarHBondContact OG-CG 3.29Å
283	T	86.6	Confident	83.2	Confident	22 Å²	22	30.8 Å²	30.8	14%	0.135	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	120.3	178.8	-52.5	0	0	0	0	109.6	I214 F285 N314 P316 S317 I318	I214-T283 HydrophobicContact CG2-CG2 3.81Å; T283-F285 HydrophobicContact CG2-CD2 4.19Å; T283-F285 HydrophobicContact CG2-CE1 4.17Å; T283-F285 HydrophobicContact CG2-CE2 3.53Å; T283-F285 HydrophobicContact CG2-CZ 3.54Å; T283-N314 HydrophobicContact CG2-CB 4.17Å; T283-N314 PolarHBondContact OG1-O 2.69Å; T283-P316 PolarHBondContact N-O 3.26Å; T283-S317 WeakPolarHBondContact O-CA 3.09Å; T283-I318 PolarHBondContact O-N 2.76Å
284	F	90.9	Very high	81.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.6	179.9	-172.2	-107.8	0	0	0	110.6	E215 P217 A272 K273 A276 S282 I318 F320	E215-F284 HydrophobicContact CB-CD1 4.24Å; E215-F284 PolarHBondContact N-O 3.39Å; E215-F284 WeakPolarHBondContact O-CB 3.31Å; E215-F284 PolarHBondContact O-N 3.45Å; P217-F284 HydrophobicContact CG-CB 4.48Å; A272-F284 HydrophobicContact CB-CE2 4.34Å; A272-F284 HydrophobicContact CB-CZ 4.27Å; K273-F284 HydrophobicContact CG-CE1 4.02Å; K273-F284 HydrophobicContact CG-CZ 4.18Å; A276-F284 HydrophobicContact CB-CB 3.88Å; A276-F284 HydrophobicContact CB-CD2 3.34Å; A276-F284 HydrophobicContact CB-CE2 4.02Å; A276-F284 HydrophobicContact CB-CG 3.82Å; S282-F284 PolarHBondContact O-N 2.66Å; F284-I318 HydrophobicContact CD2-CB 4.19Å; F284-I318 HydrophobicContact CD2-CG2 4.1Å; F284-I318 HydrophobicContact CE2-CG2 4.24Å; F284-F320 HydrophobicContact CD2-CB 4.39Å; F284-F320 HydrophobicContact CE1-CB 4.17Å; F284-F320 HydrophobicContact CE1-CD1 4.48Å; F284-F320 HydrophobicContact CE2-CB 3.43Å; F284-F320 VanDerWaalsContact CE2-CB 3.43Å; F284-F320 HydrophobicContact CE2-CG 4.1Å; F284-F320 HydrophobicContact CZ-CB 3.29Å; F284-F320 AromaticContact CZ-CD1 3.85Å; F284-F320 HydrophobicContact CZ-CD1 3.85Å; F284-F320 HydrophobicContact CZ-CD2 4.48Å; F284-F320 AromaticContact CZ-CG 3.63Å; F284-F320 HydrophobicContact CZ-CG 3.63Å
285	F	91.8	Very high	80	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.8	173.7	-62.9	-81.3	0	0	0	108.8	I212 I214 T283 L307 L310 A311 N314 I318 I319 F320	I212-F285 HydrophobicContact CG2-CB 4.16Å; I212-F285 HydrophobicContact CG2-CD1 3.69Å; I212-F285 HydrophobicContact CG2-CG 4.43Å; I214-F285 HydrophobicContact CD1-CD1 4.38Å; I214-F285 HydrophobicContact CD1-CE1 3.81Å; I214-F285 HydrophobicContact CG1-CD1 3.84Å; I214-F285 HydrophobicContact CG1-CE1 3.76Å; T283-F285 HydrophobicContact CG2-CD2 4.19Å; T283-F285 HydrophobicContact CG2-CE1 4.17Å; T283-F285 HydrophobicContact CG2-CE2 3.53Å; T283-F285 HydrophobicContact CG2-CZ 3.54Å; F285-L307 HydrophobicContact CB-CD1 3.94Å; F285-L307 HydrophobicContact CD1-CD1 4.34Å; F285-L307 HydrophobicContact CG-CD1 4.26Å; F285-L310 HydrophobicContact CE1-CB 4.19Å; F285-L310 HydrophobicContact CZ-CB 4.31Å; F285-A311 HydrophobicContact CD2-CB 4.21Å; F285-A311 HydrophobicContact CE2-CB 4.01Å; F285-N314 HydrophobicContact CE2-CB 4.32Å; F285-N314 HydrophobicContact CZ-CB 4.05Å; F285-I318 PolarHBondContact N-O 2.88Å; F285-I319 HydrophobicContact CB-CG1 4.48Å; F285-I319 HydrophobicContact CD2-CG1 4.5Å; F285-F320 PolarHBondContact O-N 2.9Å
286	S	90.4	Very high	78.1	Confident	22 Å²	22	47.2 Å²	47.2	15%	0.154	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.5	176.3	-168.8	0	0	0	0	110.3	V213	V213-S286 PolarHBondContact N-O 3.47Å; V213-S286 VanDerWaalsContact N-O 3.15Å; V213-S286 PolarHBondContact O-N 3Å
287	I	89.1	Confident	76.5	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	135.9	174.8	-169.1	159.9	0	0	0	110.8	I212 L292 L303 L307 F320 I321 D322	I212-I287 HydrophobicContact CG1-CD1 4.21Å; I287-L292 HydrophobicContact CD1-CD1 3.81Å; I287-L292 HydrophobicContact CD1-CD2 3.42Å; I287-L292 VanDerWaalsContact CD1-CD2 3.42Å; I287-L292 HydrophobicContact CD1-CG 3.47Å; I287-L292 VanDerWaalsContact CD1-CG 3.47Å; I287-L292 HydrophobicContact CG1-CD1 4.14Å; I287-L292 HydrophobicContact CG1-CD2 4.44Å; I287-L292 HydrophobicContact CG1-CG 3.97Å; I287-L292 HydrophobicContact CG2-CD1 4.47Å; I287-L303 HydrophobicContact CD1-CD2 3.84Å; I287-L307 HydrophobicContact CD1-CD2 4.35Å; I287-L307 HydrophobicContact CG2-CD2 4.17Å; I287-F320 PolarHBondContact N-O 2.79Å; I287-I321 HydrophobicContact CG2-CB 4.47Å; I287-I321 HydrophobicContact CG2-CG1 3.81Å; I287-I321 WeakPolarHBondContact O-CA 3.41Å; I287-D322 PolarHBondContact O-N 2.72Å; I287-D322 VanDerWaalsContact O-N 3.11Å
288	S	85.6	Confident	75.3	Confident	34 Å²	34	55.8 Å²	55.8	24%	0.238	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	140.1	168.1	179	0	0	0	0	109.6	S290 D291	S288-S290 PolarHBondContact O-N 3.43Å; S288-S290 PolarHBondContact OG-N 3.04Å; S288-D291 WeakPolarHBondContact CB-OD2 3.34Å; S288-D291 WeakPolarHBondContact O-CB 3.48Å; S288-D291 PolarHBondContact O-N 3.28Å
289	S	79.9	Confident	74.7	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.6	-28	175.6	-65.3	0	0	0	0	113	L292 I321 D322 E323 I324 S326 L327	S289-L292 PolarHBondContact O-N 3.29Å; S289-I321 VanDerWaalsContact OG-CG2 3.28Å; S289-I321 WeakPolarHBondContact OG-CG2 3.37Å; S289-D322 WeakPolarHBondContact CB-O 3.13Å; S289-D322 PolarHBondContact N-O 2.95Å; S289-D322 VanDerWaalsContact N-O 3.16Å; S289-D322 PolarHBondContact OG-O 3.37Å; S289-E323 WeakPolarHBondContact CB-O 3.48Å; S289-E323 PolarHBondContact OG-O 3.02Å; S289-E323 VanDerWaalsContact OG-O 3.09Å; S289-I324 WeakPolarHBondContact OG-CA 3.36Å; S289-I324 PolarHBondContact OG-N 2.87Å; S289-S326 WeakPolarHBondContact CB-OG 3.43Å; S289-L327 WeakPolarHBondContact OG-CD1 3.4Å
290	S	76.6	Confident	74.4	Confident	59 Å²	59	56.5 Å²	56.5	41%	0.413	31%	0.308	S	S	.	.	H	α-helix	trans	-71.6	-29.9	174.9	-66	0	0	0	0	113.9	S288 L292 V293 S294	S288-S290 PolarHBondContact O-N 3.43Å; S288-S290 PolarHBondContact OG-N 3.04Å; S290-L292 VanDerWaalsContact C-N 3.26Å; S290-L292 PolarHBondContact O-N 3.04Å; S290-V293 PolarHBondContact O-N 3.27Å; S290-S294 PolarHBondContact O-OG 2.94Å
291	D	76.3	Confident	74.8	Confident	63 Å²	63	53.4 Å²	53.4	34%	0.337	29%	0.29	S	S	.	.	H	α-helix	trans	-70.1	-27.4	177.1	-69.2	-42.8	0	0	0	111.7	S288	S288-D291 WeakPolarHBondContact CB-OD2 3.34Å; S288-D291 WeakPolarHBondContact O-CB 3.48Å; S288-D291 PolarHBondContact O-N 3.28Å
292	L	72.8	Confident	75.3	Confident	3 Å²	3	53 Å²	53	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-74.2	-26.9	178.2	-75.4	170.8	0	0	0	113.2	I287 S289 S290 S300 L303 V304 L327	I287-L292 HydrophobicContact CD1-CD1 3.81Å; I287-L292 HydrophobicContact CD1-CD2 3.42Å; I287-L292 VanDerWaalsContact CD1-CD2 3.42Å; I287-L292 HydrophobicContact CD1-CG 3.47Å; I287-L292 VanDerWaalsContact CD1-CG 3.47Å; I287-L292 HydrophobicContact CG1-CD1 4.14Å; I287-L292 HydrophobicContact CG1-CD2 4.44Å; I287-L292 HydrophobicContact CG1-CG 3.97Å; I287-L292 HydrophobicContact CG2-CD1 4.47Å; S289-L292 PolarHBondContact O-N 3.29Å; S290-L292 VanDerWaalsContact C-N 3.26Å; S290-L292 PolarHBondContact O-N 3.04Å; L292-S300 WeakPolarHBondContact O-CB 3.28Å; L292-S300 PolarHBondContact O-OG 3.49Å; L292-L303 HydrophobicContact CD2-CD1 4.24Å; L292-L303 HydrophobicContact CD2-CD2 3.49Å; L292-L303 VanDerWaalsContact CD2-CD2 3.49Å; L292-L303 HydrophobicContact CD2-CG 4.27Å; L292-V304 HydrophobicContact CD2-CG2 3.93Å; L292-L327 HydrophobicContact CB-CD1 4.11Å; L292-L327 HydrophobicContact CB-CD2 3.99Å; L292-L327 HydrophobicContact CD1-CD1 3.38Å; L292-L327 HydrophobicContact CG-CD1 4.32Å
293	V	67.7	Low	75.5	Confident	72 Å²	72	54 Å²	54	44%	0.436	29%	0.288	S	S	.	.	H	α-helix	trans	-96	-24.9	-172.2	-177.9	0	0	0	0	113.4	S290 L327	S290-V293 PolarHBondContact O-N 3.27Å; V293-L327 HydrophobicContact CG2-CD2 3.44Å; V293-L327 VanDerWaalsContact CG2-CD2 3.44Å; V293-L327 HydrophobicContact CG2-CG 4.39Å
294	S	58.2	Low	75.5	Confident	83 Å²	83	53 Å²	53	58%	0.58	28%	0.281	S	S	*	.	S	Bend	trans	-94.3	-7.4	-156.9	56.6	0	0	0	0	117.4	S290	S290-S294 PolarHBondContact O-OG 2.94Å
295	K	56	Low	75.3	Confident	109 Å²	109	57.4 Å²	57.4	47%	0.474	30%	0.301	S	S	.	.	S	Bend	trans	-123	64.3	-166.6	-66.1	179.7	-176.5	166.3	0	114.3
296	W	49.3	Very low	75.1	Confident	209 Å²	209	58.5 Å²	58.5	79%	0.792	31%	0.307	S	S	*	.			trans	90.5	123.6	173.3	-54.3	89	0	0	0	115.8	G298 E299	W296-G298 PolarHBondContact O-N 3.02Å; W296-G298 VanDerWaalsContact O-N 3.08Å; W296-E299 HydrophobicContact CB-CG 4.46Å; W296-E299 PolarHBondContact O-N 3.34Å
297	L	54.3	Low	75	Confident	154 Å²	154	57.6 Å²	57.6	81%	0.806	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	107.2	176.8	-68.2	158.6	0	0	0	109.8	A338	L297-A338 HydrophobicContact CD2-CB 3.49Å; L297-A338 VanDerWaalsContact CD2-CB 3.49Å
298	G	63.8	Low	75.1	Confident	41 Å²	41	57.5 Å²	57.5	42%	0.423	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.6	-25.2	176.4	0	0	0	0	0	115.6	W296	W296-G298 PolarHBondContact O-N 3.02Å; W296-G298 VanDerWaalsContact O-N 3.08Å
299	E	72.1	Confident	75.2	Confident	74 Å²	74	59 Å²	59	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-75	-28.5	175.5	-70.8	-168.9	173.1	0	0	112.1	Q207 W296 E301 K302 L303	Q207-E299 PolarHBondContact NE2-OE2 3.29Å; W296-E299 HydrophobicContact CB-CG 4.46Å; W296-E299 PolarHBondContact O-N 3.34Å; E299-E301 PolarHBondContact O-N 3.31Å; E299-K302 PolarHBondContact O-N 2.94Å; E299-L303 PolarHBondContact O-N 2.91Å
300	S	76.9	Confident	75.6	Confident	11 Å²	11	60.3 Å²	60.3	8%	0.077	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-36.4	-178.1	-58.5	0	0	0	0	114.7	L292 L303 V304	L292-S300 WeakPolarHBondContact O-CB 3.28Å; L292-S300 PolarHBondContact O-OG 3.49Å; S300-L303 WeakPolarHBondContact O-CB 3.42Å; S300-L303 PolarHBondContact O-N 3.49Å; S300-V304 PolarHBondContact O-N 3.47Å; S300-V304 VanDerWaalsContact O-N 3.13Å
301	E	81.6	Confident	76.2	Confident	54 Å²	54	57.5 Å²	57.5	25%	0.252	29%	0.29	S	S	.	.	H	α-helix	trans	-67.3	-44.4	177.1	-67.5	170.7	-150.2	0	0	111	E299 L303 V304 K305 R341 I342	E299-E301 PolarHBondContact O-N 3.31Å; E301-L303 PolarHBondContact O-N 3.08Å; E301-V304 PolarHBondContact O-N 3.15Å; E301-K305 PolarHBondContact O-N 3.23Å; E301-R341 HydrophobicContact CG-CB 4.25Å; E301-R341 WeakPolarHBondContact OE1-CB 3.46Å; E301-R341 WeakPolarHBondContact OE1-CD 3.31Å; E301-I342 HydrophobicContact CG-CG1 4.42Å
302	K	82.6	Confident	76.8	Confident	95 Å²	95	57 Å²	57	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-60.4	-36.9	174	-66.1	-173.8	178.9	-175.4	0	110.5	L204 E299 K305 N306	L204-K302 HydrophobicContact CD1-CD 3.96Å; L204-K302 HydrophobicContact CD2-CD 4.42Å; E299-K302 PolarHBondContact O-N 2.94Å; K302-K305 PolarHBondContact O-N 3.39Å; K302-N306 WeakPolarHBondContact O-CB 3.47Å; K302-N306 PolarHBondContact O-N 3.44Å; K302-N306 PolarHBondContact O-ND2 3.09Å; K302-N306 VanDerWaalsContact O-ND2 3.16Å
303	L	83.2	Confident	77.5	Confident	26 Å²	26	62.1 Å²	62.1	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-47.9	177	-161.4	168.4	0	0	0	111.4	L208 A211 I212 I287 L292 E299 S300 E301 N306 L307	L208-L303 HydrophobicContact CD2-CB 4.4Å; L208-L303 HydrophobicContact CD2-CD2 3.87Å; L208-L303 HydrophobicContact CD2-CG 3.67Å; A211-L303 HydrophobicContact CB-CD1 4.17Å; I212-L303 HydrophobicContact CD1-CD2 4.2Å; I212-L303 HydrophobicContact CG1-CD2 4.35Å; I287-L303 HydrophobicContact CD1-CD2 3.84Å; L292-L303 HydrophobicContact CD2-CD1 4.24Å; L292-L303 HydrophobicContact CD2-CD2 3.49Å; L292-L303 VanDerWaalsContact CD2-CD2 3.49Å; L292-L303 HydrophobicContact CD2-CG 4.27Å; E299-L303 PolarHBondContact O-N 2.91Å; S300-L303 WeakPolarHBondContact O-CB 3.42Å; S300-L303 PolarHBondContact O-N 3.49Å; E301-L303 PolarHBondContact O-N 3.08Å; L303-N306 PolarHBondContact O-N 3.15Å; L303-L307 WeakPolarHBondContact O-CB 3.3Å; L303-L307 PolarHBondContact O-N 2.93Å
304	V	87.1	Confident	78.4	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-45.5	176.7	177.9	0	0	0	0	111.4	L292 S300 E301 N306 L307 F308 I342 E345 F346 Q349	L292-V304 HydrophobicContact CD2-CG2 3.93Å; S300-V304 PolarHBondContact O-N 3.47Å; S300-V304 VanDerWaalsContact O-N 3.13Å; E301-V304 PolarHBondContact O-N 3.15Å; V304-N306 VanDerWaalsContact C-N 3.33Å; V304-N306 PolarHBondContact O-N 3.42Å; V304-L307 PolarHBondContact O-N 3.28Å; V304-F308 HydrophobicContact CG1-CD2 4.23Å; V304-F308 HydrophobicContact CG1-CE2 4.28Å; V304-F308 WeakPolarHBondContact O-CD2 3.44Å; V304-F308 PolarHBondContact O-N 3.01Å; V304-I342 HydrophobicContact CG2-CG2 4.12Å; V304-E345 HydrophobicContact CB-CG 4.28Å; V304-E345 HydrophobicContact CG1-CG 4.25Å; V304-F346 HydrophobicContact CG1-CB 4.18Å; V304-F346 HydrophobicContact CG1-CD2 4.08Å; V304-Q349 HydrophobicContact CG1-CG 4.28Å
305	K	87.2	Confident	79.8	Confident	93 Å²	93	61.9 Å²	61.9	40%	0.404	29%	0.293	S	S	.	.	H	α-helix	trans	-55.7	-49.2	175	-74.7	-176.9	-178.9	-178.6	0	111.8	E301 K302 F308 Q309 E345	E301-K305 PolarHBondContact O-N 3.23Å; K302-K305 PolarHBondContact O-N 3.39Å; K305-F308 PolarHBondContact O-N 3Å; K305-Q309 PolarHBondContact O-N 3.34Å; K305-E345 WeakPolarHBondContact CE-OE1 3.37Å; K305-E345 WeakPolarHBondContact CE-OE2 3.48Å; K305-E345 HydrophobicContact CG-CG 4.04Å; K305-E345 WeakPolarHBondContact CG-OE1 3.44Å; K305-E345 IonicContact NZ-OE2 2.83Å
306	N	86.4	Confident	81.2	Confident	24 Å²	24	59.8 Å²	59.8	13%	0.128	29%	0.291	C	S	.	.	H	α-helix	trans	-71.1	-32.9	-176.9	-63.3	-24.3	0	0	0	112.4	L208 K302 L303 V304 Q309 L310	L208-N306 HydrophobicContact CD1-CB 3.23Å; L208-N306 HydrophobicContact CD2-CB 3.89Å; L208-N306 HydrophobicContact CG-CB 4.17Å; K302-N306 WeakPolarHBondContact O-CB 3.47Å; K302-N306 PolarHBondContact O-N 3.44Å; K302-N306 PolarHBondContact O-ND2 3.09Å; K302-N306 VanDerWaalsContact O-ND2 3.16Å; L303-N306 PolarHBondContact O-N 3.15Å; V304-N306 VanDerWaalsContact C-N 3.33Å; V304-N306 PolarHBondContact O-N 3.42Å; N306-Q309 PolarHBondContact O-N 2.95Å; N306-L310 WeakPolarHBondContact O-CB 3.23Å; N306-L310 VanDerWaalsContact O-CG 3.31Å; N306-L310 WeakPolarHBondContact O-CG 3.09Å; N306-L310 PolarHBondContact O-N 3.27Å
307	L	89.2	Confident	83.1	Confident	2 Å²	2	50 Å²	50	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-49.8	172.7	170.3	63.9	0	0	0	110.7	I212 F285 I287 L303 V304 Q309 L310 A311 I319	I212-L307 HydrophobicContact CD1-CB 3.91Å; I212-L307 HydrophobicContact CD1-CD1 3.67Å; I212-L307 HydrophobicContact CD1-CG 4.34Å; I212-L307 HydrophobicContact CG1-CD1 4.13Å; I212-L307 HydrophobicContact CG2-CD1 4.02Å; F285-L307 HydrophobicContact CB-CD1 3.94Å; F285-L307 HydrophobicContact CD1-CD1 4.34Å; F285-L307 HydrophobicContact CG-CD1 4.26Å; I287-L307 HydrophobicContact CD1-CD2 4.35Å; I287-L307 HydrophobicContact CG2-CD2 4.17Å; L303-L307 WeakPolarHBondContact O-CB 3.3Å; L303-L307 PolarHBondContact O-N 2.93Å; V304-L307 PolarHBondContact O-N 3.28Å; L307-Q309 VanDerWaalsContact C-N 3.34Å; L307-L310 PolarHBondContact O-N 3.47Å; L307-A311 WeakPolarHBondContact O-CB 3.02Å; L307-A311 PolarHBondContact O-N 3.32Å; L307-I319 HydrophobicContact CD1-CG2 4.46Å; L307-I319 HydrophobicContact CD2-CG2 3.96Å; L307-I319 HydrophobicContact CG-CD1 4.46Å; L307-I319 HydrophobicContact CG-CG2 4.38Å
308	F	90.3	Very high	84.9	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-34.2	177.2	-84.4	-98.3	0	0	0	112.3	V304 K305 A311 R312 I319 F346 Q349 M350 V362	V304-F308 HydrophobicContact CG1-CD2 4.23Å; V304-F308 HydrophobicContact CG1-CE2 4.28Å; V304-F308 WeakPolarHBondContact O-CD2 3.44Å; V304-F308 PolarHBondContact O-N 3.01Å; K305-F308 PolarHBondContact O-N 3Å; F308-A311 PolarHBondContact O-N 3.02Å; F308-R312 VanDerWaalsContact O-CG 3.26Å; F308-R312 WeakPolarHBondContact O-CG 3.47Å; F308-R312 PolarHBondContact O-N 3.05Å; F308-I319 HydrophobicContact CD1-CD1 3.94Å; F308-I319 HydrophobicContact CD2-CD1 4.25Å; F308-I319 HydrophobicContact CE1-CD1 3.9Å; F308-I319 HydrophobicContact CE2-CD1 4.2Å; F308-I319 HydrophobicContact CG-CD1 4.13Å; F308-I319 HydrophobicContact CZ-CD1 4.04Å; F308-F346 AromaticContact CE2-CD2 3.85Å; F308-F346 HydrophobicContact CE2-CD2 3.85Å; F308-F346 AromaticContact CE2-CE2 3.75Å; F308-F346 HydrophobicContact CE2-CE2 3.75Å; F308-F346 HydrophobicContact CZ-CD2 4.26Å; F308-F346 AromaticContact CZ-CE2 3.85Å; F308-F346 HydrophobicContact CZ-CE2 3.85Å; F308-Q349 HydrophobicContact CB-CB 4.28Å; F308-Q349 HydrophobicContact CB-CG 4.36Å; F308-Q349 HydrophobicContact CD1-CB 3.91Å; F308-Q349 HydrophobicContact CD2-CB 3.63Å; F308-Q349 HydrophobicContact CD2-CG 4.09Å; F308-Q349 HydrophobicContact CE1-CB 4.09Å; F308-Q349 HydrophobicContact CE2-CB 3.83Å; F308-Q349 HydrophobicContact CG-CB 3.67Å; F308-Q349 HydrophobicContact CG-CG 4.2Å; F308-Q349 HydrophobicContact CZ-CB 4.05Å; F308-M350 HydrophobicContact CZ-CG 4.05Å; F308-V362 HydrophobicContact CE1-CG2 4.05Å; F308-V362 HydrophobicContact CZ-CG2 4.05Å
309	Q	88.6	Confident	86.3	Confident	64 Å²	64	40.9 Å²	40.9	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-62.2	-48.8	172.6	179.4	168.4	11.3	0	0	112	K305 N306 L307 A311 R312 E313	K305-Q309 PolarHBondContact O-N 3.34Å; N306-Q309 PolarHBondContact O-N 2.95Å; L307-Q309 VanDerWaalsContact C-N 3.34Å; Q309-A311 VanDerWaalsContact C-N 3.28Å; Q309-A311 PolarHBondContact O-N 3.44Å; Q309-R312 WeakPolarHBondContact O-CB 3.38Å; Q309-R312 PolarHBondContact O-N 3.45Å; Q309-R312 VanDerWaalsContact O-N 3.11Å; Q309-E313 WeakPolarHBondContact CG-OE1 3.44Å; Q309-E313 PolarHBondContact NE2-OE1 2.95Å; Q309-E313 WeakPolarHBondContact O-CG 3.35Å; Q309-E313 PolarHBondContact O-N 3.17Å
310	L	87.9	Confident	87.4	Confident	29 Å²	29	37.4 Å²	37.4	15%	0.152	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-38.3	176.4	-72.3	173.2	0	0	0	111.6	L208 F285 N306 L307 E313 N314	L208-L310 HydrophobicContact CB-CD1 4.4Å; L208-L310 HydrophobicContact CD1-CD1 3.93Å; F285-L310 HydrophobicContact CE1-CB 4.19Å; F285-L310 HydrophobicContact CZ-CB 4.31Å; N306-L310 WeakPolarHBondContact O-CB 3.23Å; N306-L310 VanDerWaalsContact O-CG 3.31Å; N306-L310 WeakPolarHBondContact O-CG 3.09Å; N306-L310 PolarHBondContact O-N 3.27Å; L307-L310 PolarHBondContact O-N 3.47Å; L310-E313 PolarHBondContact O-N 3.33Å; L310-N314 WeakPolarHBondContact O-CB 3.42Å; L310-N314 PolarHBondContact O-N 2.71Å; L310-N314 PolarHBondContact O-ND2 3.44Å
311	A	89.6	Confident	88.1	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-41.5	173.8	0	0	0	0	0	112	F285 L307 F308 Q309 E313 N314 K315 S317 I319 I360	F285-A311 HydrophobicContact CD2-CB 4.21Å; F285-A311 HydrophobicContact CE2-CB 4.01Å; L307-A311 WeakPolarHBondContact O-CB 3.02Å; L307-A311 PolarHBondContact O-N 3.32Å; F308-A311 PolarHBondContact O-N 3.02Å; Q309-A311 VanDerWaalsContact C-N 3.28Å; Q309-A311 PolarHBondContact O-N 3.44Å; A311-E313 VanDerWaalsContact C-N 3.35Å; A311-E313 PolarHBondContact O-N 2.86Å; A311-N314 CarbonylContact O-C 3.57Å; A311-N314 PolarHBondContact O-N 3.34Å; A311-K315 PolarHBondContact O-N 2.79Å; A311-S317 WeakPolarHBondContact CB-OG 3.31Å; A311-S317 PolarHBondContact O-OG 2.89Å; A311-S317 VanDerWaalsContact O-OG 3.1Å; A311-I319 HydrophobicContact CB-CD1 3.7Å; A311-I319 HydrophobicContact CB-CG1 3.94Å; A311-I360 HydrophobicContact CB-CD1 4.22Å; A311-I360 HydrophobicContact CB-CG2 4.28Å
312	R	88.4	Confident	88.6	Confident	53 Å²	53	36.4 Å²	36.4	20%	0.2	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-38	174	-71	170.3	-166.8	130	6.5	112.8	F308 Q309 N314 K315 N357 I360	F308-R312 VanDerWaalsContact O-CG 3.26Å; F308-R312 WeakPolarHBondContact O-CG 3.47Å; F308-R312 PolarHBondContact O-N 3.05Å; Q309-R312 WeakPolarHBondContact O-CB 3.38Å; Q309-R312 PolarHBondContact O-N 3.45Å; Q309-R312 VanDerWaalsContact O-N 3.11Å; R312-N314 VanDerWaalsContact C-N 3.28Å; R312-N314 PolarHBondContact O-N 3.33Å; R312-K315 WeakPolarHBondContact O-CG 3.26Å; R312-N357 PolarHBondContact NE-OD1 3.25Å; R312-N357 PolarHBondContact NH2-OD1 3.04Å; R312-N357 VanDerWaalsContact NH2-OD1 3.16Å; R312-I360 HydrophobicContact CB-CD1 4.16Å; R312-I360 HydrophobicContact CG-CD1 3.34Å
313	E	87.8	Confident	89	Confident	109 Å²	109	35.9 Å²	35.9	51%	0.509	18%	0.175	S	C	.	.	H	α-helix	trans	-70.3	-24.9	177.1	-70.3	169.9	-168.7	0	0	112.3	Q309 L310 A311	Q309-E313 WeakPolarHBondContact CG-OE1 3.44Å; Q309-E313 PolarHBondContact NE2-OE1 2.95Å; Q309-E313 WeakPolarHBondContact O-CG 3.35Å; Q309-E313 PolarHBondContact O-N 3.17Å; L310-E313 PolarHBondContact O-N 3.33Å; A311-E313 VanDerWaalsContact C-N 3.35Å; A311-E313 PolarHBondContact O-N 2.86Å
314	N	86.8	Confident	89.3	Confident	67 Å²	67	34.6 Å²	34.6	36%	0.358	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.8	36.7	-175.3	-66.9	-85.2	0	0	0	113.4	T283 F285 L310 A311 R312 P316	T283-N314 HydrophobicContact CG2-CB 4.17Å; T283-N314 PolarHBondContact OG1-O 2.69Å; F285-N314 HydrophobicContact CE2-CB 4.32Å; F285-N314 HydrophobicContact CZ-CB 4.05Å; L310-N314 WeakPolarHBondContact O-CB 3.42Å; L310-N314 PolarHBondContact O-N 2.71Å; L310-N314 PolarHBondContact O-ND2 3.44Å; A311-N314 CarbonylContact O-C 3.57Å; A311-N314 PolarHBondContact O-N 3.34Å; R312-N314 VanDerWaalsContact C-N 3.28Å; R312-N314 PolarHBondContact O-N 3.33Å; N314-P316 CarbonylContact O-C 3.43Å; N314-P316 VanDerWaalsContact O-O 3.09Å
315	K	86.4	Confident	89.3	Confident	83 Å²	83	36 Å²	36	36%	0.361	18%	0.175	S	C	.	.	S	Bend	trans	-65.1	139.8	176.5	-70	174	-177.6	-161.4	0	111.5	A311 R312 D356 D358 I360	A311-K315 PolarHBondContact O-N 2.79Å; R312-K315 WeakPolarHBondContact O-CG 3.26Å; K315-D356 PolarHBondContact NZ-O 2.86Å; K315-D358 VanDerWaalsContact CD-O 3.24Å; K315-D358 WeakPolarHBondContact CD-O 3.25Å; K315-D358 WeakPolarHBondContact CE-O 3.48Å; K315-D358 PolarHBondContact NZ-O 3.17Å; K315-I360 HydrophobicContact CG-CG1 4.2Å
316	P	86.4	Confident	89.1	Confident	66 Å²	66	34.4 Å²	34.4	43%	0.429	18%	0.176	S	C	.	.	S	Bend	cis	-72.6	138.8	-5.4	30.9	-34.8	0	0	0	112.1	S282 T283 N314	S282-P316 WeakPolarHBondContact CB-O 3.38Å; S282-P316 WeakPolarHBondContact OG-CG 3.29Å; T283-P316 PolarHBondContact N-O 3.26Å; N314-P316 CarbonylContact O-C 3.43Å; N314-P316 VanDerWaalsContact O-O 3.09Å
317	S	89.2	Confident	88.7	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.021	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	148.6	-175.6	68.8	0	0	0	0	112.8	T283 A311 G359 L361	T283-S317 WeakPolarHBondContact O-CA 3.09Å; A311-S317 WeakPolarHBondContact CB-OG 3.31Å; A311-S317 PolarHBondContact O-OG 2.89Å; A311-S317 VanDerWaalsContact O-OG 3.1Å; S317-G359 PolarHBondContact N-O 3.28Å; S317-G359 VanDerWaalsContact N-O 3.13Å; S317-L361 PolarHBondContact O-N 2.95Å; S317-L361 VanDerWaalsContact O-N 3.08Å
318	I	91.5	Very high	87.7	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.2	175.4	-57.4	-179.1	0	0	0	108.2	V238 V275 A276 A279 T283 F284 F285 L361 L363	V238-I318 HydrophobicContact CG1-CD1 4.43Å; V275-I318 HydrophobicContact CG1-CD1 4.13Å; A276-I318 HydrophobicContact CB-CD1 4.17Å; A279-I318 HydrophobicContact CB-CD1 4.07Å; T283-I318 PolarHBondContact O-N 2.76Å; F284-I318 HydrophobicContact CD2-CB 4.19Å; F284-I318 HydrophobicContact CD2-CG2 4.1Å; F284-I318 HydrophobicContact CE2-CG2 4.24Å; F285-I318 PolarHBondContact N-O 2.88Å; I318-L361 WeakPolarHBondContact CA-O 3.44Å; I318-L361 HydrophobicContact CD1-CD2 4.47Å; I318-L361 HydrophobicContact CG1-CB 4.42Å; I318-L361 HydrophobicContact CG1-CD2 4.42Å; I318-L363 HydrophobicContact CG2-CB 4.47Å; I318-L363 HydrophobicContact CG2-CD1 3.6Å; I318-L363 HydrophobicContact CG2-CG 3.8Å
319	I	93.4	Very high	86.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	112.6	172.7	-57.1	173.8	0	0	0	107.6	F285 L307 F308 A311 I321 I360 L361 V362 L363	F285-I319 HydrophobicContact CB-CG1 4.48Å; F285-I319 HydrophobicContact CD2-CG1 4.5Å; L307-I319 HydrophobicContact CD1-CG2 4.46Å; L307-I319 HydrophobicContact CD2-CG2 3.96Å; L307-I319 HydrophobicContact CG-CD1 4.46Å; L307-I319 HydrophobicContact CG-CG2 4.38Å; F308-I319 HydrophobicContact CD1-CD1 3.94Å; F308-I319 HydrophobicContact CD2-CD1 4.25Å; F308-I319 HydrophobicContact CE1-CD1 3.9Å; F308-I319 HydrophobicContact CE2-CD1 4.2Å; F308-I319 HydrophobicContact CG-CD1 4.13Å; F308-I319 HydrophobicContact CZ-CD1 4.04Å; A311-I319 HydrophobicContact CB-CD1 3.7Å; A311-I319 HydrophobicContact CB-CG1 3.94Å; I319-I321 HydrophobicContact CG2-CD1 4.39Å; I319-I321 HydrophobicContact CG2-CG1 4.13Å; I319-I360 HydrophobicContact CD1-CG2 3.92Å; I319-I360 HydrophobicContact CG1-CG2 4.29Å; I319-L361 PolarHBondContact N-O 3.28Å; I319-V362 CarbonylContact O-C 3.56Å; I319-V362 WeakPolarHBondContact O-CA 3.46Å; I319-L363 PolarHBondContact O-N 3.18Å
320	F	94.6	Very high	85.3	Confident	1 Å²	1	35 Å²	35	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.1	175.5	179	-106.7	0	0	0	111.1	A272 F284 F285 I287 D322 L363 A365	A272-F320 HydrophobicContact CB-CD2 3.39Å; A272-F320 HydrophobicContact CB-CE2 3.43Å; A272-F320 VanDerWaalsContact CB-CE2 3.43Å; A272-F320 HydrophobicContact CB-CG 4.02Å; A272-F320 HydrophobicContact CB-CZ 4.1Å; F284-F320 HydrophobicContact CD2-CB 4.39Å; F284-F320 HydrophobicContact CE1-CB 4.17Å; F284-F320 HydrophobicContact CE1-CD1 4.48Å; F284-F320 HydrophobicContact CE2-CB 3.43Å; F284-F320 VanDerWaalsContact CE2-CB 3.43Å; F284-F320 HydrophobicContact CE2-CG 4.1Å; F284-F320 HydrophobicContact CZ-CB 3.29Å; F284-F320 AromaticContact CZ-CD1 3.85Å; F284-F320 HydrophobicContact CZ-CD1 3.85Å; F284-F320 HydrophobicContact CZ-CD2 4.48Å; F284-F320 AromaticContact CZ-CG 3.63Å; F284-F320 HydrophobicContact CZ-CG 3.63Å; F285-F320 PolarHBondContact O-N 2.9Å; I287-F320 PolarHBondContact N-O 2.79Å; F320-D322 HydrophobicContact CE1-CB 3.78Å; F320-D322 HydrophobicContact CZ-CB 4.16Å; F320-L363 CarbonylContact C-O 3.56Å; F320-L363 VanDerWaalsContact CA-O 3.32Å; F320-L363 WeakPolarHBondContact CA-O 3.28Å; F320-L363 HydrophobicContact CD2-CB 3.87Å; F320-A365 HydrophobicContact CE2-CB 3.76Å; F320-A365 HydrophobicContact CZ-CB 3.71Å
321	I	92.7	Very high	83.8	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	108.7	-179.9	-56.1	172.6	0	0	0	108.2	I287 S289 I319 I324 F346 V362 L363 A365	I287-I321 HydrophobicContact CG2-CB 4.47Å; I287-I321 HydrophobicContact CG2-CG1 3.81Å; I287-I321 WeakPolarHBondContact O-CA 3.41Å; S289-I321 VanDerWaalsContact OG-CG2 3.28Å; S289-I321 WeakPolarHBondContact OG-CG2 3.37Å; I319-I321 HydrophobicContact CG2-CD1 4.39Å; I319-I321 HydrophobicContact CG2-CG1 4.13Å; I321-I324 HydrophobicContact CB-CD1 4.46Å; I321-I324 HydrophobicContact CD1-CD1 4.47Å; I321-I324 HydrophobicContact CG2-CB 4.07Å; I321-I324 HydrophobicContact CG2-CD1 4.25Å; I321-I324 HydrophobicContact CG2-CG1 4.11Å; I321-F346 HydrophobicContact CD1-CD2 4.34Å; I321-F346 HydrophobicContact CD1-CE1 4.29Å; I321-F346 HydrophobicContact CD1-CE2 3.25Å; I321-F346 HydrophobicContact CD1-CZ 3.22Å; I321-V362 HydrophobicContact CD1-CG1 4.21Å; I321-L363 PolarHBondContact N-O 3.22Å; I321-A365 PolarHBondContact O-N 3.33Å
322	D	91.6	Very high	82.3	Confident	43 Å²	43	45.8 Å²	45.8	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	149.5	174.7	-146	-14.2	0	0	0	111	S269 I287 S289 F320 I324	S269-D322 PolarHBondContact OG-OD2 2.9Å; I287-D322 PolarHBondContact O-N 2.72Å; I287-D322 VanDerWaalsContact O-N 3.11Å; S289-D322 WeakPolarHBondContact CB-O 3.13Å; S289-D322 PolarHBondContact N-O 2.95Å; S289-D322 VanDerWaalsContact N-O 3.16Å; S289-D322 PolarHBondContact OG-O 3.37Å; F320-D322 HydrophobicContact CE1-CB 3.78Å; F320-D322 HydrophobicContact CZ-CB 4.16Å; D322-I324 VanDerWaalsContact C-N 3.3Å; D322-I324 PolarHBondContact O-N 3.06Å
323	E	89.9	Confident	80.8	Confident	83 Å²	83	52.4 Å²	52.4	39%	0.388	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	44.9	-179.5	-57.8	-179.2	159.9	0	0	113.1	S289 D325 S326 A365	S289-E323 WeakPolarHBondContact CB-O 3.48Å; S289-E323 PolarHBondContact OG-O 3.02Å; S289-E323 VanDerWaalsContact OG-O 3.09Å; E323-D325 PolarHBondContact O-N 3.4Å; E323-S326 WeakPolarHBondContact O-CB 3.18Å; E323-S326 PolarHBondContact O-N 3.28Å; E323-S326 PolarHBondContact O-OG 3.41Å; E323-A365 WeakPolarHBondContact CA-O 3.43Å; E323-A365 PolarHBondContact N-O 3.35Å; E323-A365 VanDerWaalsContact N-O 3.09Å
324	I	90.3	Very high	79.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-58.1	-20.6	-174.6	-167.5	163.3	0	0	0	113.7	L259 S289 I321 D322 S326 L327 C328 F346 A365 L372 F380	L259-I324 HydrophobicContact CD1-CG2 3.96Å; S289-I324 WeakPolarHBondContact OG-CA 3.36Å; S289-I324 PolarHBondContact OG-N 2.87Å; I321-I324 HydrophobicContact CB-CD1 4.46Å; I321-I324 HydrophobicContact CD1-CD1 4.47Å; I321-I324 HydrophobicContact CG2-CB 4.07Å; I321-I324 HydrophobicContact CG2-CD1 4.25Å; I321-I324 HydrophobicContact CG2-CG1 4.11Å; D322-I324 VanDerWaalsContact C-N 3.3Å; D322-I324 PolarHBondContact O-N 3.06Å; I324-S326 PolarHBondContact O-N 2.67Å; I324-L327 PolarHBondContact O-N 3.32Å; I324-C328 HydrophobicContact CG1-CB 4.44Å; I324-C328 VanDerWaalsContact O-CB 3.26Å; I324-C328 WeakPolarHBondContact O-CB 3.33Å; I324-C328 PolarHBondContact O-N 3Å; I324-F346 HydrophobicContact CD1-CE1 4.19Å; I324-F346 HydrophobicContact CD1-CZ 4.44Å; I324-A365 PolarHBondContact N-O 3.04Å; I324-L372 HydrophobicContact CG2-CD2 4.06Å; I324-F380 HydrophobicContact CD1-CE2 3.4Å; I324-F380 VanDerWaalsContact CD1-CE2 3.4Å; I324-F380 HydrophobicContact CD1-CZ 3.33Å
325	D	87.4	Confident	78.7	Confident	30 Å²	30	53.1 Å²	53.1	16%	0.16	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-61	-27.6	171.5	49.2	-63.5	0	0	0	113.9	E323 L327 C328 G329 T366 L372	E323-D325 PolarHBondContact O-N 3.4Å; D325-L327 VanDerWaalsContact C-N 3.29Å; D325-L327 PolarHBondContact O-N 2.66Å; D325-C328 PolarHBondContact O-N 3.02Å; D325-G329 PolarHBondContact O-N 3.07Å; D325-T366 WeakPolarHBondContact CB-OG1 3.32Å; D325-T366 WeakPolarHBondContact OD1-CB 3.41Å; D325-T366 PolarHBondContact OD1-OG1 3.43Å; D325-L372 HydrophobicContact CB-CD2 4.11Å
326	S	82.8	Confident	78.1	Confident	60 Å²	60	52.4 Å²	52.4	42%	0.42	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-72	-24.7	177.9	90.2	0	0	0	0	112.9	S289 E323 I324	S289-S326 WeakPolarHBondContact CB-OG 3.43Å; E323-S326 WeakPolarHBondContact O-CB 3.18Å; E323-S326 PolarHBondContact O-N 3.28Å; E323-S326 PolarHBondContact O-OG 3.41Å; I324-S326 PolarHBondContact O-N 2.67Å
327	L	77.2	Confident	77.7	Confident	13 Å²	13	55.1 Å²	55.1	7%	0.068	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-32	173	-81.1	168.7	0	0	0	113.1	S289 L292 V293 I324 D325 I342	S289-L327 WeakPolarHBondContact OG-CD1 3.4Å; L292-L327 HydrophobicContact CB-CD1 4.11Å; L292-L327 HydrophobicContact CB-CD2 3.99Å; L292-L327 HydrophobicContact CD1-CD1 3.38Å; L292-L327 HydrophobicContact CG-CD1 4.32Å; V293-L327 HydrophobicContact CG2-CD2 3.44Å; V293-L327 VanDerWaalsContact CG2-CD2 3.44Å; V293-L327 HydrophobicContact CG2-CG 4.39Å; I324-L327 PolarHBondContact O-N 3.32Å; D325-L327 VanDerWaalsContact C-N 3.29Å; D325-L327 PolarHBondContact O-N 2.66Å; L327-I342 HydrophobicContact CD2-CG2 3.91Å
328	C	69.9	Low	77.1	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.007	30%	0.3	C	S	.	.	S	Bend	trans	-113.7	26.6	-164.6	-62.9	0	0	0	0	113.5	I324 D325 L372 D373 I376	I324-C328 HydrophobicContact CG1-CB 4.44Å; I324-C328 VanDerWaalsContact O-CB 3.26Å; I324-C328 WeakPolarHBondContact O-CB 3.33Å; I324-C328 PolarHBondContact O-N 3Å; D325-C328 PolarHBondContact O-N 3.02Å; C328-L372 HydrophobicContact CB-CD2 3.82Å; C328-D373 PolarHBondContact O-N 3.26Å; C328-I376 HydrophobicContact CB-CB 4.26Å; C328-I376 HydrophobicContact CB-CD1 4.44Å; C328-I376 HydrophobicContact CB-CG1 3.89Å; C328-I376 HydrophobicContact CB-CG2 4.05Å; C328-I376 VanDerWaalsContact SG-CD1 3.57Å
329	G	66.5	Low	76.4	Confident	18 Å²	18	56.8 Å²	56.8	19%	0.186	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-53.4	152.3	177.2	0	0	0	0	0	113.5	D325 R331 K343 V371	D325-G329 PolarHBondContact O-N 3.07Å; G329-R331 PolarHBondContact O-N 3.09Å; G329-K343 PolarHBondContact O-NZ 2.83Å; G329-V371 CarbonylContact C-O 3.59Å
330	S	60.3	Low	75.8	Confident	71 Å²	71	61.7 Å²	61.7	50%	0.497	32%	0.324	S	S	.	.			trans	-57	129.2	171.7	55.7	0	0	0	0	108.9	S332 V371	S330-S332 PolarHBondContact O-N 3.4Å; S330-V371 PolarHBondContact N-O 2.98Å
331	R	58	Low	75.3	Confident	192 Å²	192	68.2 Å²	68.2	73%	0.725	35%	0.349	S	S	*	.			trans	-48.1	101.5	179.9	-67.6	177.8	-179.8	-171.4	-3.7	109.9	G329 D373	G329-R331 PolarHBondContact O-N 3.09Å; R331-D373 IonicContact NE-OD1 3.5Å
332	S	58	Low	75	Confident	64 Å²	64	68.3 Å²	68.3	45%	0.448	35%	0.35	S	S	.	.			trans	-99.2	151.6	170.7	62.7	0	0	0	0	108.4	S330 N334 E335 R340	S330-S332 PolarHBondContact O-N 3.4Å; S332-N334 PolarHBondContact O-N 3.44Å; S332-N334 VanDerWaalsContact O-N 3.11Å; S332-E335 VanDerWaalsContact O-CB 3.31Å; S332-E335 WeakPolarHBondContact O-CB 3.2Å; S332-E335 PolarHBondContact O-N 3.25Å; S332-R340 PolarHBondContact O-NH2 3.47Å
333	E	56.2	Low	74.7	Confident	192 Å²	192	66.9 Å²	66.9	90%	0.897	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.3	179.4	-73.3	-175.1	150.1	0	0	112.6
334	N	61.5	Low	74.6	Confident	161 Å²	161	66.9 Å²	66.9	86%	0.861	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	8.5	177.5	-67.6	-21.2	0	0	0	114.3	S332 S336	S332-N334 PolarHBondContact O-N 3.44Å; S332-N334 VanDerWaalsContact O-N 3.11Å; N334-S336 PolarHBondContact O-N 3.03Å
335	E	68.9	Low	74.5	Confident	30 Å²	30	68 Å²	68	14%	0.14	35%	0.352	C	S	.	.			trans	-68.6	123.9	177	-169.4	-178.2	-159.8	0	0	110.3	S332 E337 A339 R340	S332-E335 VanDerWaalsContact O-CB 3.31Å; S332-E335 WeakPolarHBondContact O-CB 3.2Å; S332-E335 PolarHBondContact O-N 3.25Å; E335-E337 PolarHBondContact O-N 2.69Å; E335-A339 HydrophobicContact CG-CB 4.17Å; E335-R340 HydrophobicContact CG-CG 4.07Å; E335-R340 WeakPolarHBondContact OE2-CG 3.41Å; E335-R340 IonicContact OE2-NE 3.59Å; E335-R340 PolarHBondContact OE2-NE 3.16Å
336	S	72.9	Confident	74.6	Confident	68 Å²	68	67.1 Å²	67.1	48%	0.476	35%	0.347	S	S	.	.			trans	-55.5	135.6	177.5	-178.6	0	0	0	0	110.8	N334 A338 A339 R340	N334-S336 PolarHBondContact O-N 3.03Å; S336-A338 PolarHBondContact O-N 2.86Å; S336-A338 VanDerWaalsContact O-N 3.09Å; S336-A338 PolarHBondContact OG-N 3.49Å; S336-A339 WeakPolarHBondContact O-CB 3.46Å; S336-A339 PolarHBondContact O-N 2.88Å; S336-R340 PolarHBondContact O-N 2.72Å
337	E	77.9	Confident	74.8	Confident	123 Å²	123	65.7 Å²	65.7	58%	0.575	33%	0.334	S	S	*	.	H	α-helix	trans	-52.8	-33.9	174.3	-72.5	-156.5	169.9	0	0	112.4	E335 R340 R341	E335-E337 PolarHBondContact O-N 2.69Å; E337-R340 PolarHBondContact O-N 3.32Å; E337-R341 WeakPolarHBondContact O-CG 3.44Å; E337-R341 PolarHBondContact O-N 2.97Å; E337-R341 IonicContact OE2-CZ 2.96Å; E337-R341 IonicContact OE2-NH2 2.76Å; E337-R341 PolarHBondContact OE2-NH2 3.35Å
338	A	76.8	Confident	75.4	Confident	23 Å²	23	68 Å²	68	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-62.8	-43.4	177.6	0	0	0	0	0	112.2	L297 S336 R340 R341 I342	L297-A338 HydrophobicContact CD2-CB 3.49Å; L297-A338 VanDerWaalsContact CD2-CB 3.49Å; S336-A338 PolarHBondContact O-N 2.86Å; S336-A338 VanDerWaalsContact O-N 3.09Å; S336-A338 PolarHBondContact OG-N 3.49Å; A338-R340 VanDerWaalsContact C-N 3.31Å; A338-R340 PolarHBondContact O-N 3.33Å; A338-R341 PolarHBondContact O-N 3.09Å; A338-I342 WeakPolarHBondContact O-CD1 3.36Å; A338-I342 VanDerWaalsContact O-CG1 3.23Å; A338-I342 WeakPolarHBondContact O-CG1 3.46Å; A338-I342 PolarHBondContact O-N 3.43Å
339	A	78.1	Confident	76.3	Confident	17 Å²	17	69.1 Å²	69.1	14%	0.14	35%	0.354	C	S	.	.	H	α-helix	trans	-62.4	-40.5	176.7	0	0	0	0	0	111.3	E335 S336 R341 I342 K343	E335-A339 HydrophobicContact CG-CB 4.17Å; S336-A339 WeakPolarHBondContact O-CB 3.46Å; S336-A339 PolarHBondContact O-N 2.88Å; A339-R341 PolarHBondContact O-N 2.97Å; A339-I342 PolarHBondContact O-N 3.23Å; A339-K343 VanDerWaalsContact O-CB 3.3Å; A339-K343 WeakPolarHBondContact O-CB 3.38Å; A339-K343 PolarHBondContact O-N 3.25Å
340	R	81.1	Confident	77.3	Confident	104 Å²	104	69.1 Å²	69.1	39%	0.392	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-41.5	176.2	-68.8	-175.8	-178.3	163.3	7.4	112.7	S332 E335 S336 E337 A338 T344	S332-R340 PolarHBondContact O-NH2 3.47Å; E335-R340 HydrophobicContact CG-CG 4.07Å; E335-R340 WeakPolarHBondContact OE2-CG 3.41Å; E335-R340 IonicContact OE2-NE 3.59Å; E335-R340 PolarHBondContact OE2-NE 3.16Å; S336-R340 PolarHBondContact O-N 2.72Å; E337-R340 PolarHBondContact O-N 3.32Å; A338-R340 VanDerWaalsContact C-N 3.31Å; A338-R340 PolarHBondContact O-N 3.33Å; R340-T344 WeakPolarHBondContact O-CB 3.38Å; R340-T344 PolarHBondContact O-N 3.38Å; R340-T344 PolarHBondContact O-OG1 3.21Å
341	R	84.4	Confident	78.4	Confident	137 Å²	137	70.6 Å²	70.6	52%	0.517	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-43.8	177.8	-64.3	175.3	-164.9	-176.2	5.2	111.6	E301 E337 A338 A339 K343 T344 E345	E301-R341 HydrophobicContact CG-CB 4.25Å; E301-R341 WeakPolarHBondContact OE1-CB 3.46Å; E301-R341 WeakPolarHBondContact OE1-CD 3.31Å; E337-R341 WeakPolarHBondContact O-CG 3.44Å; E337-R341 PolarHBondContact O-N 2.97Å; E337-R341 IonicContact OE2-CZ 2.96Å; E337-R341 IonicContact OE2-NH2 2.76Å; E337-R341 PolarHBondContact OE2-NH2 3.35Å; A338-R341 PolarHBondContact O-N 3.09Å; A339-R341 PolarHBondContact O-N 2.97Å; R341-K343 PolarHBondContact O-N 2.99Å; R341-T344 PolarHBondContact O-N 3.45Å; R341-E345 WeakPolarHBondContact O-CB 3.25Å; R341-E345 PolarHBondContact O-N 3.43Å
342	I	84.6	Confident	79.3	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-47.2	174.6	-64.8	162.1	0	0	0	110.9	E301 V304 L327 A338 A339 T344 E345 F346	E301-I342 HydrophobicContact CG-CG1 4.42Å; V304-I342 HydrophobicContact CG2-CG2 4.12Å; L327-I342 HydrophobicContact CD2-CG2 3.91Å; A338-I342 WeakPolarHBondContact O-CD1 3.36Å; A338-I342 VanDerWaalsContact O-CG1 3.23Å; A338-I342 WeakPolarHBondContact O-CG1 3.46Å; A338-I342 PolarHBondContact O-N 3.43Å; A339-I342 PolarHBondContact O-N 3.23Å; I342-T344 VanDerWaalsContact C-N 3.33Å; I342-T344 PolarHBondContact O-N 3.28Å; I342-E345 PolarHBondContact O-N 3.02Å; I342-F346 WeakPolarHBondContact O-CB 3.4Å; I342-F346 PolarHBondContact O-N 2.99Å
343	K	85.6	Confident	79.7	Confident	12 Å²	12	63.8 Å²	63.8	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-60.5	-41.7	177.2	178.8	176.5	173.7	-179.7	0	112.2	G329 A339 R341 L347 D373	G329-K343 PolarHBondContact O-NZ 2.83Å; A339-K343 VanDerWaalsContact O-CB 3.3Å; A339-K343 WeakPolarHBondContact O-CB 3.38Å; A339-K343 PolarHBondContact O-N 3.25Å; R341-K343 PolarHBondContact O-N 2.99Å; K343-L347 HydrophobicContact CG-CD1 4.47Å; K343-L347 WeakPolarHBondContact O-CG 3.48Å; K343-L347 PolarHBondContact O-N 3.09Å; K343-D373 VanDerWaalsContact NZ-CG 3.27Å; K343-D373 IonicContact NZ-OD1 2.73Å; K343-D373 PolarHBondContact NZ-OD1 3.36Å
344	T	87.6	Confident	79.8	Confident	83 Å²	83	58.6 Å²	58.6	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-46.8	177	-56.7	0	0	0	0	110.7	R340 R341 I342 F346 L347 V348	R340-T344 WeakPolarHBondContact O-CB 3.38Å; R340-T344 PolarHBondContact O-N 3.38Å; R340-T344 PolarHBondContact O-OG1 3.21Å; R341-T344 PolarHBondContact O-N 3.45Å; I342-T344 VanDerWaalsContact C-N 3.33Å; I342-T344 PolarHBondContact O-N 3.28Å; T344-F346 VanDerWaalsContact C-N 3.35Å; T344-F346 PolarHBondContact O-N 3.43Å; T344-L347 PolarHBondContact O-N 3.45Å; T344-V348 WeakPolarHBondContact O-CG2 3.39Å; T344-V348 PolarHBondContact O-N 3.34Å
345	E	88.3	Confident	80.3	Confident	24 Å²	24	54.2 Å²	54.2	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-45	177.2	-176.8	55.9	-139.4	0	0	111.6	V304 K305 R341 I342 L347 V348 Q349	V304-E345 HydrophobicContact CB-CG 4.28Å; V304-E345 HydrophobicContact CG1-CG 4.25Å; K305-E345 WeakPolarHBondContact CE-OE1 3.37Å; K305-E345 WeakPolarHBondContact CE-OE2 3.48Å; K305-E345 HydrophobicContact CG-CG 4.04Å; K305-E345 WeakPolarHBondContact CG-OE1 3.44Å; K305-E345 IonicContact NZ-OE2 2.83Å; R341-E345 WeakPolarHBondContact O-CB 3.25Å; R341-E345 PolarHBondContact O-N 3.43Å; I342-E345 PolarHBondContact O-N 3.02Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 3.24Å; E345-V348 PolarHBondContact O-N 3.36Å; E345-Q349 WeakPolarHBondContact O-CG 3.35Å; E345-Q349 PolarHBondContact O-N 3.1Å; E345-Q349 WeakPolarHBondContact OE1-CG 3.5Å; E345-Q349 PolarHBondContact OE1-NE2 3.49Å
346	F	89.3	Confident	80.6	Confident	11 Å²	11	56.9 Å²	56.9	5%	0.048	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-44.1	176.6	-177.3	-110.7	0	0	0	112.3	V304 F308 I321 I324 I342 T344 V348 Q349 M350 V362 I376	V304-F346 HydrophobicContact CG1-CB 4.18Å; V304-F346 HydrophobicContact CG1-CD2 4.08Å; F308-F346 AromaticContact CE2-CD2 3.85Å; F308-F346 HydrophobicContact CE2-CD2 3.85Å; F308-F346 AromaticContact CE2-CE2 3.75Å; F308-F346 HydrophobicContact CE2-CE2 3.75Å; F308-F346 HydrophobicContact CZ-CD2 4.26Å; F308-F346 AromaticContact CZ-CE2 3.85Å; F308-F346 HydrophobicContact CZ-CE2 3.85Å; I321-F346 HydrophobicContact CD1-CD2 4.34Å; I321-F346 HydrophobicContact CD1-CE1 4.29Å; I321-F346 HydrophobicContact CD1-CE2 3.25Å; I321-F346 HydrophobicContact CD1-CZ 3.22Å; I324-F346 HydrophobicContact CD1-CE1 4.19Å; I324-F346 HydrophobicContact CD1-CZ 4.44Å; I342-F346 WeakPolarHBondContact O-CB 3.4Å; I342-F346 PolarHBondContact O-N 2.99Å; T344-F346 VanDerWaalsContact C-N 3.35Å; T344-F346 PolarHBondContact O-N 3.43Å; F346-V348 PolarHBondContact O-N 2.95Å; F346-Q349 PolarHBondContact O-N 3.01Å; F346-M350 HydrophobicContact CD1-CG 4.47Å; F346-M350 HydrophobicContact CD1-SD 3.96Å; F346-M350 HydrophobicContact CE1-CG 4.07Å; F346-M350 HydrophobicContact CE1-SD 3.26Å; F346-M350 WeakPolarHBondContact CE1-SD 3.32Å; F346-M350 HydrophobicContact CE2-CG 4.2Å; F346-M350 HydrophobicContact CE2-SD 4.37Å; F346-M350 HydrophobicContact CZ-CG 3.9Å; F346-M350 HydrophobicContact CZ-SD 3.5Å; F346-M350 WeakPolarHBondContact CZ-SD 3.26Å; F346-M350 WeakPolarHBondContact O-CG 3.15Å; F346-M350 PolarHBondContact O-N 2.88Å; F346-V362 HydrophobicContact CZ-CG1 4.12Å; F346-I376 HydrophobicContact CD1-CD1 3.86Å; F346-I376 HydrophobicContact CE1-CD1 4.2Å
347	L	88.3	Confident	80.9	Confident	30 Å²	30	53.9 Å²	53.9	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-41.5	175.5	-76	169.6	0	0	0	112.8	K343 T344 E345 M350 Q351 A375 I376 R379	K343-L347 HydrophobicContact CG-CD1 4.47Å; K343-L347 WeakPolarHBondContact O-CG 3.48Å; K343-L347 PolarHBondContact O-N 3.09Å; T344-L347 PolarHBondContact O-N 3.45Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 3.24Å; L347-M350 PolarHBondContact O-N 2.94Å; L347-Q351 WeakPolarHBondContact O-CB 3.38Å; L347-Q351 PolarHBondContact O-N 3.38Å; L347-A375 HydrophobicContact CD1-CB 4.03Å; L347-A375 HydrophobicContact CD2-CB 4.45Å; L347-I376 HydrophobicContact CD1-CD1 4.31Å; L347-I376 HydrophobicContact CD2-CD1 3.41Å; L347-I376 VanDerWaalsContact CD2-CD1 3.41Å; L347-I376 HydrophobicContact CD2-CG1 4.05Å; L347-I376 HydrophobicContact CG-CD1 3.68Å; L347-I376 HydrophobicContact CG-CG1 4.44Å; L347-R379 HydrophobicContact CD2-CG 3.68Å
348	V	89.3	Confident	81.1	Confident	62 Å²	62	51.9 Å²	51.9	38%	0.376	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-45.3	176.9	170.8	0	0	0	0	110.4	T344 E345 F346 Q351 G352	T344-V348 WeakPolarHBondContact O-CG2 3.39Å; T344-V348 PolarHBondContact O-N 3.34Å; E345-V348 PolarHBondContact O-N 3.36Å; F346-V348 PolarHBondContact O-N 2.95Å; V348-Q351 PolarHBondContact O-N 3.01Å; V348-G352 PolarHBondContact O-N 3.23Å
349	Q	89.3	Confident	81.3	Confident	24 Å²	24	53.1 Å²	53.1	11%	0.112	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-41.7	178.1	-67.9	-56.2	-35.7	0	0	112.6	V304 F308 E345 F346 Q351 G352 N357	V304-Q349 HydrophobicContact CG1-CG 4.28Å; F308-Q349 HydrophobicContact CB-CB 4.28Å; F308-Q349 HydrophobicContact CB-CG 4.36Å; F308-Q349 HydrophobicContact CD1-CB 3.91Å; F308-Q349 HydrophobicContact CD2-CB 3.63Å; F308-Q349 HydrophobicContact CD2-CG 4.09Å; F308-Q349 HydrophobicContact CE1-CB 4.09Å; F308-Q349 HydrophobicContact CE2-CB 3.83Å; F308-Q349 HydrophobicContact CG-CB 3.67Å; F308-Q349 HydrophobicContact CG-CG 4.2Å; F308-Q349 HydrophobicContact CZ-CB 4.05Å; E345-Q349 WeakPolarHBondContact O-CG 3.35Å; E345-Q349 PolarHBondContact O-N 3.1Å; E345-Q349 WeakPolarHBondContact OE1-CG 3.5Å; E345-Q349 PolarHBondContact OE1-NE2 3.49Å; F346-Q349 PolarHBondContact O-N 3.01Å; Q349-Q351 VanDerWaalsContact C-N 3.3Å; Q349-Q351 PolarHBondContact O-N 3.46Å; Q349-G352 PolarHBondContact O-N 3.42Å; Q349-N357 PolarHBondContact O-ND2 3.23Å
350	M	87.8	Confident	81.9	Confident	18 Å²	18	52.9 Å²	52.9	9%	0.089	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-38.1	175.1	-74.7	-173.1	80.7	0	0	112.3	F308 F346 L347 G352 N357 V362 R379 F380	F308-M350 HydrophobicContact CZ-CG 4.05Å; F346-M350 HydrophobicContact CD1-CG 4.47Å; F346-M350 HydrophobicContact CD1-SD 3.96Å; F346-M350 HydrophobicContact CE1-CG 4.07Å; F346-M350 HydrophobicContact CE1-SD 3.26Å; F346-M350 WeakPolarHBondContact CE1-SD 3.32Å; F346-M350 HydrophobicContact CE2-CG 4.2Å; F346-M350 HydrophobicContact CE2-SD 4.37Å; F346-M350 HydrophobicContact CZ-CG 3.9Å; F346-M350 HydrophobicContact CZ-SD 3.5Å; F346-M350 WeakPolarHBondContact CZ-SD 3.26Å; F346-M350 WeakPolarHBondContact O-CG 3.15Å; F346-M350 PolarHBondContact O-N 2.88Å; L347-M350 PolarHBondContact O-N 2.94Å; M350-G352 VanDerWaalsContact C-N 3.27Å; M350-G352 PolarHBondContact O-N 3.38Å; M350-N357 PolarHBondContact O-ND2 3.07Å; M350-V362 HydrophobicContact CE-CB 4.23Å; M350-V362 HydrophobicContact CE-CG1 4.18Å; M350-R379 HydrophobicContact CE-CB 3.72Å; M350-R379 HydrophobicContact SD-CB 3.97Å; M350-F380 HydrophobicContact CE-CD1 4.47Å; M350-F380 HydrophobicContact CE-CE1 4.13Å; M350-F380 HydrophobicContact CE-CE2 4.41Å; M350-F380 HydrophobicContact CE-CZ 4.08Å
351	Q	82.3	Confident	82.3	Confident	103 Å²	103	48.7 Å²	48.7	48%	0.481	29%	0.288	S	S	.	.	H	α-helix	trans	-71.1	-23.8	-179.9	-169.8	161.9	0.1	0	0	112.7	L347 V348 Q349 V353 R379	L347-Q351 WeakPolarHBondContact O-CB 3.38Å; L347-Q351 PolarHBondContact O-N 3.38Å; V348-Q351 PolarHBondContact O-N 3.01Å; Q349-Q351 VanDerWaalsContact C-N 3.3Å; Q349-Q351 PolarHBondContact O-N 3.46Å; Q351-V353 VanDerWaalsContact C-N 3.33Å; Q351-V353 HydrophobicContact CB-CG2 4.05Å; Q351-V353 HydrophobicContact CG-CG2 3.77Å; Q351-R379 VanDerWaalsContact CD-NH2 3.28Å
352	G	77.8	Confident	82.8	Confident	13 Å²	13	42.4 Å²	42.4	13%	0.134	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	33.9	179.9	0	0	0	0	0	112.4	V348 Q349 M350 G354 V355 N357	V348-G352 PolarHBondContact O-N 3.23Å; Q349-G352 PolarHBondContact O-N 3.42Å; M350-G352 VanDerWaalsContact C-N 3.27Å; M350-G352 PolarHBondContact O-N 3.38Å; G352-G354 PolarHBondContact O-N 2.93Å; G352-V355 CarbonylContact C-O 2.96Å; G352-V355 WeakPolarHBondContact CA-O 2.93Å; G352-V355 PolarHBondContact O-N 3.38Å; G352-V355 VanDerWaalsContact O-N 3.14Å; G352-N357 VanDerWaalsContact CA-ND2 3.28Å; G352-N357 WeakPolarHBondContact CA-ND2 3.4Å; G352-N357 PolarHBondContact N-ND2 3.17Å
353	V	66	Low	83.3	Confident	99 Å²	99	42.2 Å²	42.2	60%	0.6	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	114	177.8	-177.5	0	0	0	0	108.7	Q351	Q351-V353 VanDerWaalsContact C-N 3.33Å; Q351-V353 HydrophobicContact CB-CG2 4.05Å; Q351-V353 HydrophobicContact CG-CG2 3.77Å
354	G	58	Low	83.7	Confident	83 Å²	83	41.6 Å²	41.6	86%	0.856	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	1.4	-180	0	0	0	0	0	115.9	G352	G352-G354 PolarHBondContact O-N 2.93Å
355	V	72.9	Confident	84.1	Confident	69 Å²	69	37.7 Å²	37.7	42%	0.418	24%	0.237	S	C	.	.	S	Bend	trans	-146.4	137.6	-178.5	-167.2	0	0	0	0	111.3	G352 N357	G352-V355 CarbonylContact C-O 2.96Å; G352-V355 WeakPolarHBondContact CA-O 2.93Å; G352-V355 PolarHBondContact O-N 3.38Å; G352-V355 VanDerWaalsContact O-N 3.14Å; V355-N357 PolarHBondContact O-N 3.01Å
356	D	74.7	Confident	84.3	Confident	86 Å²	86	36.6 Å²	36.6	46%	0.46	23%	0.232	S	C	.	.			trans	-75.4	115.7	177.9	-177.9	24.5	0	0	0	112.8	K315 D358	K315-D356 PolarHBondContact NZ-O 2.86Å; D356-D358 VanDerWaalsContact OD1-CB 3.31Å; D356-D358 WeakPolarHBondContact OD1-CB 3.46Å; D356-D358 PolarHBondContact OD1-N 3.34Å; D356-D358 WeakPolarHBondContact OD2-CB 3.25Å
357	N	79.4	Confident	84.5	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.032	24%	0.241	C	C	.	.			trans	-92.2	10.8	175.9	-75	-14.8	0	0	0	113	R312 Q349 M350 G352 V355 G359 I360	R312-N357 PolarHBondContact NE-OD1 3.25Å; R312-N357 PolarHBondContact NH2-OD1 3.04Å; R312-N357 VanDerWaalsContact NH2-OD1 3.16Å; Q349-N357 PolarHBondContact O-ND2 3.23Å; M350-N357 PolarHBondContact O-ND2 3.07Å; G352-N357 VanDerWaalsContact CA-ND2 3.28Å; G352-N357 WeakPolarHBondContact CA-ND2 3.4Å; G352-N357 PolarHBondContact N-ND2 3.17Å; V355-N357 PolarHBondContact O-N 3.01Å; N357-G359 PolarHBondContact O-N 3.12Å; N357-I360 PolarHBondContact O-N 3.17Å; N357-I360 VanDerWaalsContact O-N 3.1Å
358	D	81.2	Confident	84.7	Confident	81 Å²	81	39.8 Å²	39.8	43%	0.433	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	134.1	175.1	-74.6	-13.3	0	0	0	111.1	R256 K315 D356	R256-D358 IonicContact CZ-OD1 2.69Å; R256-D358 IonicContact NH2-OD1 3.34Å; R256-D358 PolarHBondContact NH2-OD1 2.94Å; K315-D358 VanDerWaalsContact CD-O 3.24Å; K315-D358 WeakPolarHBondContact CD-O 3.25Å; K315-D358 WeakPolarHBondContact CE-O 3.48Å; K315-D358 PolarHBondContact NZ-O 3.17Å; D356-D358 VanDerWaalsContact OD1-CB 3.31Å; D356-D358 WeakPolarHBondContact OD1-CB 3.46Å; D356-D358 PolarHBondContact OD1-N 3.34Å; D356-D358 WeakPolarHBondContact OD2-CB 3.25Å
359	G	81.6	Confident	84.8	Confident	48 Å²	48	36.8 Å²	36.8	50%	0.495	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	8.7	-175.7	0	0	0	0	0	115.5	S317 N357	S317-G359 PolarHBondContact N-O 3.28Å; S317-G359 VanDerWaalsContact N-O 3.13Å; N357-G359 PolarHBondContact O-N 3.12Å
360	I	89.8	Confident	84.8	Confident	12 Å²	12	40.2 Å²	40.2	6%	0.062	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.8	172.2	-53.1	177.7	0	0	0	109.4	A311 R312 K315 I319 N357	A311-I360 HydrophobicContact CB-CD1 4.22Å; A311-I360 HydrophobicContact CB-CG2 4.28Å; R312-I360 HydrophobicContact CB-CD1 4.16Å; R312-I360 HydrophobicContact CG-CD1 3.34Å; K315-I360 HydrophobicContact CG-CG1 4.2Å; I319-I360 HydrophobicContact CD1-CG2 3.92Å; I319-I360 HydrophobicContact CG1-CG2 4.29Å; N357-I360 PolarHBondContact O-N 3.17Å; N357-I360 VanDerWaalsContact O-N 3.1Å
361	L	91.3	Very high	84.9	Confident	16 Å²	16	41.6 Å²	41.6	8%	0.084	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.6	174.4	176	67.5	0	0	0	110.2	V238 W255 I258 S317 I318 I319 L363	V238-L361 HydrophobicContact CB-CD2 4.13Å; V238-L361 HydrophobicContact CG1-CD2 3.68Å; V238-L361 HydrophobicContact CG2-CD2 3.39Å; W255-L361 WeakPolarHBondContact O-CD1 3.46Å; I258-L361 HydrophobicContact CD1-CD1 3.89Å; I258-L361 HydrophobicContact CD1-CD2 4.34Å; I258-L361 HydrophobicContact CG1-CD1 4.03Å; S317-L361 PolarHBondContact O-N 2.95Å; S317-L361 VanDerWaalsContact O-N 3.08Å; I318-L361 WeakPolarHBondContact CA-O 3.44Å; I318-L361 HydrophobicContact CD1-CD2 4.47Å; I318-L361 HydrophobicContact CG1-CB 4.42Å; I318-L361 HydrophobicContact CG1-CD2 4.42Å; I319-L361 PolarHBondContact N-O 3.28Å; L361-L363 HydrophobicContact CD2-CD2 3.88Å; L361-L363 HydrophobicContact CD2-CG 4.12Å; L361-L363 HydrophobicContact CG-CD2 4.11Å; L361-L363 HydrophobicContact CG-CG 4.27Å
362	V	93.6	Very high	85.2	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.036	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.5	172.6	-174.6	0	0	0	0	109.7	R256 G257 I258 F308 I319 I321 F346 M350 F380	R256-V362 PolarHBondContact O-N 3.45Å; G257-V362 WeakPolarHBondContact CA-O 3.2Å; I258-V362 PolarHBondContact N-O 3.33Å; F308-V362 HydrophobicContact CE1-CG2 4.05Å; F308-V362 HydrophobicContact CZ-CG2 4.05Å; I319-V362 CarbonylContact O-C 3.56Å; I319-V362 WeakPolarHBondContact O-CA 3.46Å; I321-V362 HydrophobicContact CD1-CG1 4.21Å; F346-V362 HydrophobicContact CZ-CG1 4.12Å; M350-V362 HydrophobicContact CE-CB 4.23Å; M350-V362 HydrophobicContact CE-CG1 4.18Å; V362-F380 HydrophobicContact CG1-CE1 4.08Å; V362-F380 HydrophobicContact CG1-CZ 4.26Å
363	L	94.5	Very high	85.6	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.2	173.1	-65.9	-175.2	0	0	0	109.6	I258 A272 V275 I318 I319 F320 I321 L361	I258-L363 HydrophobicContact CB-CD2 3.67Å; I258-L363 HydrophobicContact CD1-CD2 4.01Å; I258-L363 HydrophobicContact CG1-CD2 4.26Å; I258-L363 HydrophobicContact CG2-CD2 4.31Å; I258-L363 WeakPolarHBondContact O-CA 3.41Å; A272-L363 HydrophobicContact CB-CD1 4.19Å; V275-L363 HydrophobicContact CG1-CD1 4.37Å; I318-L363 HydrophobicContact CG2-CB 4.47Å; I318-L363 HydrophobicContact CG2-CD1 3.6Å; I318-L363 HydrophobicContact CG2-CG 3.8Å; I319-L363 PolarHBondContact O-N 3.18Å; F320-L363 CarbonylContact C-O 3.56Å; F320-L363 VanDerWaalsContact CA-O 3.32Å; F320-L363 WeakPolarHBondContact CA-O 3.28Å; F320-L363 HydrophobicContact CD2-CB 3.87Å; I321-L363 PolarHBondContact N-O 3.22Å; L361-L363 HydrophobicContact CD2-CD2 3.88Å; L361-L363 HydrophobicContact CD2-CG 4.12Å; L361-L363 HydrophobicContact CG-CD2 4.11Å; L361-L363 HydrophobicContact CG-CG 4.27Å
364	G	94.9	Very high	86.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143	171.6	0	0	0	0	0	111.2	I258 L260	I258-G364 PolarHBondContact O-N 3.43Å; L260-G364 PolarHBondContact N-O 3.23Å
365	A	95.1	Very high	87.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.1	167.5	0	0	0	0	0	111.1	L260 K268 F320 I321 E323 I324	L260-A365 VanDerWaalsContact O-CA 3.31Å; L260-A365 WeakPolarHBondContact O-CA 3.35Å; K268-A365 HydrophobicContact CB-CB 4.19Å; K268-A365 HydrophobicContact CD-CB 4.45Å; F320-A365 HydrophobicContact CE2-CB 3.76Å; F320-A365 HydrophobicContact CZ-CB 3.71Å; I321-A365 PolarHBondContact O-N 3.33Å; E323-A365 WeakPolarHBondContact CA-O 3.43Å; E323-A365 PolarHBondContact N-O 3.35Å; E323-A365 VanDerWaalsContact N-O 3.09Å; I324-A365 PolarHBondContact N-O 3.04Å
366	T	93.8	Very high	88.5	Confident	1 Å²	1	29 Å²	29	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152	173.5	-174.1	0	0	0	0	112.1	L259 L260 F261 G262 K268 D325 I368 P369 L372	L259-T366 HydrophobicContact CD1-CG2 4.03Å; L259-T366 HydrophobicContact CD2-CG2 4.47Å; L259-T366 HydrophobicContact CG-CG2 4.46Å; L260-T366 PolarHBondContact O-N 3.06Å; F261-T366 WeakPolarHBondContact CA-O 3.45Å; F261-T366 HydrophobicContact CB-CG2 3.79Å; G262-T366 PolarHBondContact N-O 2.92Å; K268-T366 WeakPolarHBondContact CE-O 3.44Å; D325-T366 WeakPolarHBondContact CB-OG1 3.32Å; D325-T366 WeakPolarHBondContact OD1-CB 3.41Å; D325-T366 PolarHBondContact OD1-OG1 3.43Å; T366-I368 PolarHBondContact OG1-N 2.96Å; T366-P369 HydrophobicContact CG2-CB 3.96Å; T366-L372 HydrophobicContact CG2-CD1 4Å
367	N	93.5	Very high	89.2	Confident	44 Å²	44	27 Å²	27	24%	0.235	15%	0.154	C	C	.	.	S	Bend	trans	-95.5	-17.5	168.9	-58.8	-47.6	0	0	0	112.3	G262 P264 K268 P369	G262-N367 WeakPolarHBondContact O-CA 3.32Å; G262-N367 PolarHBondContact O-OD1 3.32Å; P264-N367 WeakPolarHBondContact CA-OD1 3.48Å; K268-N367 VanDerWaalsContact CE-OD1 3.25Å; K268-N367 WeakPolarHBondContact CE-OD1 3.36Å; K268-N367 PolarHBondContact NZ-OD1 3.01Å; N367-P369 WeakPolarHBondContact O-CD 3.32Å
368	I	92	Very high	89.6	Confident	64 Å²	64	34.9 Å²	34.9	33%	0.328	18%	0.184	S	C	.	.			trans	-132.1	65.7	-165.3	-48.4	-177.8	0	0	0	109.2	T366 W370 V371	T366-I368 PolarHBondContact OG1-N 2.96Å; I368-W370 HydrophobicContact CB-CZ2 4.29Å; I368-W370 HydrophobicContact CG2-CD2 4.01Å; I368-W370 HydrophobicContact CG2-CG 4.36Å; I368-W370 HydrophobicContact CG2-CH2 4.33Å; I368-W370 HydrophobicContact CG2-CZ2 3.47Å; I368-W370 VanDerWaalsContact CG2-CZ2 3.47Å; I368-W370 PolarHBondContact O-N 3.35Å; I368-W370 VanDerWaalsContact O-N 3.14Å; I368-V371 HydrophobicContact CG2-CB 4.05Å; I368-V371 HydrophobicContact CG2-CG2 3.51Å; I368-V371 PolarHBondContact O-N 3.15Å; I368-V371 VanDerWaalsContact O-N 3.15Å
369	P	91.5	Very high	90	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-66.5	-21.6	-169	30.4	-39.9	0	0	0	114.1	F261 T366 N367 V371 L372 L521 F524	F261-P369 HydrophobicContact CB-CB 4.06Å; F261-P369 HydrophobicContact CB-CG 4.25Å; F261-P369 HydrophobicContact CD2-CB 4.24Å; F261-P369 HydrophobicContact CD2-CG 3.78Å; F261-P369 HydrophobicContact CG-CB 4.25Å; F261-P369 HydrophobicContact CG-CG 4.27Å; T366-P369 HydrophobicContact CG2-CB 3.96Å; N367-P369 WeakPolarHBondContact O-CD 3.32Å; P369-V371 VanDerWaalsContact C-N 3.27Å; P369-V371 PolarHBondContact O-N 2.9Å; P369-L372 WeakPolarHBondContact O-CB 3.49Å; P369-L372 PolarHBondContact O-N 2.77Å; P369-L521 HydrophobicContact CG-CD2 3.97Å; P369-F524 HydrophobicContact CB-CD1 3.87Å; P369-F524 HydrophobicContact CB-CD2 4.16Å; P369-F524 HydrophobicContact CB-CE1 3.6Å; P369-F524 HydrophobicContact CB-CE2 3.89Å; P369-F524 HydrophobicContact CB-CG 4.16Å; P369-F524 HydrophobicContact CB-CZ 3.62Å; P369-F524 HydrophobicContact CG-CB 4.4Å; P369-F524 HydrophobicContact CG-CD1 3.69Å; P369-F524 HydrophobicContact CG-CD2 4.1Å; P369-F524 HydrophobicContact CG-CE1 3.98Å; P369-F524 HydrophobicContact CG-CE2 4.34Å; P369-F524 HydrophobicContact CG-CG 3.78Å; P369-F524 HydrophobicContact CG-CZ 4.3Å; P369-F524 WeakPolarHBondContact O-CE2 3.32Å
370	W	89.7	Confident	90.4	Very high	95 Å²	95	32.9 Å²	32.9	36%	0.36	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-70.6	-19.3	177.2	53.7	83.5	0	0	0	114	I368 L372 K520 L521 F524	I368-W370 HydrophobicContact CB-CZ2 4.29Å; I368-W370 HydrophobicContact CG2-CD2 4.01Å; I368-W370 HydrophobicContact CG2-CG 4.36Å; I368-W370 HydrophobicContact CG2-CH2 4.33Å; I368-W370 HydrophobicContact CG2-CZ2 3.47Å; I368-W370 VanDerWaalsContact CG2-CZ2 3.47Å; I368-W370 PolarHBondContact O-N 3.35Å; I368-W370 VanDerWaalsContact O-N 3.14Å; W370-L372 VanDerWaalsContact C-N 3.28Å; W370-K520 HydrophobicContact CE3-CB 4.08Å; W370-K520 HydrophobicContact CH2-CB 3.78Å; W370-K520 HydrophobicContact CH2-CD 3.94Å; W370-K520 HydrophobicContact CZ2-CB 4.39Å; W370-K520 HydrophobicContact CZ2-CD 3.8Å; W370-K520 HydrophobicContact CZ3-CB 3.6Å; W370-K520 HydrophobicContact CZ3-CD 4.48Å; W370-L521 HydrophobicContact CZ3-CD2 3.93Å; W370-L521 HydrophobicContact CZ3-CG 4.09Å; W370-F524 HydrophobicContact CB-CD2 4.18Å
371	V	89.7	Confident	90.4	Very high	47 Å²	47	35.6 Å²	35.6	29%	0.285	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-78.9	-15.9	175.4	169.4	0	0	0	0	111.5	G329 S330 I368 P369 D373	G329-V371 CarbonylContact C-O 3.59Å; S330-V371 PolarHBondContact N-O 2.98Å; I368-V371 HydrophobicContact CG2-CB 4.05Å; I368-V371 HydrophobicContact CG2-CG2 3.51Å; I368-V371 PolarHBondContact O-N 3.15Å; I368-V371 VanDerWaalsContact O-N 3.15Å; P369-V371 VanDerWaalsContact C-N 3.27Å; P369-V371 PolarHBondContact O-N 2.9Å; V371-D373 PolarHBondContact O-N 3.46Å
372	L	88.1	Confident	90.3	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-68.2	131.1	-177.6	-65.4	176.3	0	0	0	112.6	L259 I324 D325 C328 T366 P369 W370 R377	L259-L372 HydrophobicContact CD1-CD1 4.18Å; L259-L372 HydrophobicContact CD2-CD1 3.62Å; I324-L372 HydrophobicContact CG2-CD2 4.06Å; D325-L372 HydrophobicContact CB-CD2 4.11Å; C328-L372 HydrophobicContact CB-CD2 3.82Å; T366-L372 HydrophobicContact CG2-CD1 4Å; P369-L372 WeakPolarHBondContact O-CB 3.49Å; P369-L372 PolarHBondContact O-N 2.77Å; W370-L372 VanDerWaalsContact C-N 3.28Å; L372-R377 HydrophobicContact CB-CG 3.65Å; L372-R377 HydrophobicContact CD1-CG 4.45Å; L372-R377 PolarHBondContact O-NE 2.9Å
373	D	85.4	Confident	90.3	Very high	18 Å²	18	35.9 Å²	35.9	10%	0.096	17%	0.167	C	C	.	.			trans	-56.5	141.6	173.5	-168	109.6	0	0	0	112.1	C328 R331 K343 V371 A375 I376 R377	C328-D373 PolarHBondContact O-N 3.26Å; R331-D373 IonicContact NE-OD1 3.5Å; K343-D373 VanDerWaalsContact NZ-CG 3.27Å; K343-D373 IonicContact NZ-OD1 2.73Å; K343-D373 PolarHBondContact NZ-OD1 3.36Å; V371-D373 PolarHBondContact O-N 3.46Å; D373-A375 PolarHBondContact O-N 3.34Å; D373-A375 VanDerWaalsContact OD2-CB 3.31Å; D373-A375 WeakPolarHBondContact OD2-CB 3.36Å; D373-A375 PolarHBondContact OD2-N 3.48Å; D373-I376 HydrophobicContact CB-CG1 4.48Å; D373-I376 PolarHBondContact O-N 3.01Å; D373-I376 VanDerWaalsContact O-N 3.13Å; D373-R377 WeakPolarHBondContact O-CG 3.43Å; D373-R377 PolarHBondContact O-N 3.19Å
374	S	85.8	Confident	90.2	Very high	51 Å²	51	36.1 Å²	36.1	36%	0.357	17%	0.169	S	C	.	.	H	α-helix	trans	-56.3	-33.3	178.8	67.6	0	0	0	0	113.8	R378	S374-R378 VanDerWaalsContact O-CG 3.29Å; S374-R378 WeakPolarHBondContact O-CG 3.39Å; S374-R378 PolarHBondContact O-N 3.46Å; S374-R378 VanDerWaalsContact O-N 3.09Å
375	A	86.4	Confident	90.1	Very high	30 Å²	30	38.2 Å²	38.2	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-67	-41.5	178.5	0	0	0	0	0	111.6	L347 D373 R379	L347-A375 HydrophobicContact CD1-CB 4.03Å; L347-A375 HydrophobicContact CD2-CB 4.45Å; D373-A375 PolarHBondContact O-N 3.34Å; D373-A375 VanDerWaalsContact OD2-CB 3.31Å; D373-A375 WeakPolarHBondContact OD2-CB 3.36Å; D373-A375 PolarHBondContact OD2-N 3.48Å; A375-R379 WeakPolarHBondContact O-CG 3.28Å; A375-R379 PolarHBondContact O-N 3.41Å
376	I	87.3	Confident	90.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-71	-44.2	177.4	-65.8	-77.4	0	0	0	109.9	C328 F346 L347 D373 R378 R379 F380	C328-I376 HydrophobicContact CB-CB 4.26Å; C328-I376 HydrophobicContact CB-CD1 4.44Å; C328-I376 HydrophobicContact CB-CG1 3.89Å; C328-I376 HydrophobicContact CB-CG2 4.05Å; C328-I376 VanDerWaalsContact SG-CD1 3.57Å; F346-I376 HydrophobicContact CD1-CD1 3.86Å; F346-I376 HydrophobicContact CE1-CD1 4.2Å; L347-I376 HydrophobicContact CD1-CD1 4.31Å; L347-I376 HydrophobicContact CD2-CD1 3.41Å; L347-I376 VanDerWaalsContact CD2-CD1 3.41Å; L347-I376 HydrophobicContact CD2-CG1 4.05Å; L347-I376 HydrophobicContact CG-CD1 3.68Å; L347-I376 HydrophobicContact CG-CG1 4.44Å; D373-I376 HydrophobicContact CB-CG1 4.48Å; D373-I376 PolarHBondContact O-N 3.01Å; D373-I376 VanDerWaalsContact O-N 3.13Å; I376-R378 PolarHBondContact O-N 3.26Å; I376-R379 PolarHBondContact O-N 2.92Å; I376-F380 HydrophobicContact CG2-CD2 3.82Å; I376-F380 HydrophobicContact CG2-CE2 3.6Å; I376-F380 WeakPolarHBondContact O-CD2 3.25Å; I376-F380 PolarHBondContact O-N 3.49Å
377	R	88.1	Confident	90	Very high	45 Å²	45	40.6 Å²	40.6	17%	0.17	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-34.7	176.3	-73.1	-172.1	-73.1	145.2	-2.3	113	L372 D373 F380 R383	L372-R377 HydrophobicContact CB-CG 3.65Å; L372-R377 HydrophobicContact CD1-CG 4.45Å; L372-R377 PolarHBondContact O-NE 2.9Å; D373-R377 WeakPolarHBondContact O-CG 3.43Å; D373-R377 PolarHBondContact O-N 3.19Å; R377-F380 VanDerWaalsContact O-O 3.13Å; R377-R383 PolarHBondContact O-NH2 2.85Å
378	R	87.4	Confident	90	Very high	171 Å²	171	39.8 Å²	39.8	65%	0.645	19%	0.188	S	C	*	.	H	α-helix	trans	-73.5	-22.6	175.1	-74.1	172.9	-177.8	142.4	-0.5	114.3	S374 I376	S374-R378 VanDerWaalsContact O-CG 3.29Å; S374-R378 WeakPolarHBondContact O-CG 3.39Å; S374-R378 PolarHBondContact O-N 3.46Å; S374-R378 VanDerWaalsContact O-N 3.09Å; I376-R378 PolarHBondContact O-N 3.26Å
379	R	89.6	Confident	90.1	Very high	87 Å²	87	37.3 Å²	37.3	33%	0.328	18%	0.176	S	C	.	.	H	α-helix	trans	-84.9	-19.2	176.9	-67.4	-70.1	177.9	-103.9	2.3	112.6	L347 M350 Q351 A375 I376 E381	L347-R379 HydrophobicContact CD2-CG 3.68Å; M350-R379 HydrophobicContact CE-CB 3.72Å; M350-R379 HydrophobicContact SD-CB 3.97Å; Q351-R379 VanDerWaalsContact CD-NH2 3.28Å; A375-R379 WeakPolarHBondContact O-CG 3.28Å; A375-R379 PolarHBondContact O-N 3.41Å; I376-R379 PolarHBondContact O-N 2.92Å; R379-E381 PolarHBondContact O-N 3.37Å
380	F	91.3	Very high	90.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.208	C	C	.	.			trans	-90.1	87.4	165.7	-69.6	-71	0	0	0	109.9	G257 I258 L259 I324 M350 V362 I376 R377 K382	G257-F380 CarbonylContact O-C 3.56Å; I258-F380 VanDerWaalsContact C-CD1 3.46Å; I258-F380 WeakPolarHBondContact O-CD1 3.19Å; L259-F380 HydrophobicContact CB-CB 3.7Å; L259-F380 HydrophobicContact CB-CD1 3.95Å; L259-F380 HydrophobicContact CB-CD2 4.41Å; L259-F380 HydrophobicContact CB-CG 3.76Å; L259-F380 HydrophobicContact CD1-CD2 4.48Å; I324-F380 HydrophobicContact CD1-CE2 3.4Å; I324-F380 VanDerWaalsContact CD1-CE2 3.4Å; I324-F380 HydrophobicContact CD1-CZ 3.33Å; M350-F380 HydrophobicContact CE-CD1 4.47Å; M350-F380 HydrophobicContact CE-CE1 4.13Å; M350-F380 HydrophobicContact CE-CE2 4.41Å; M350-F380 HydrophobicContact CE-CZ 4.08Å; V362-F380 HydrophobicContact CG1-CE1 4.08Å; V362-F380 HydrophobicContact CG1-CZ 4.26Å; I376-F380 HydrophobicContact CG2-CD2 3.82Å; I376-F380 HydrophobicContact CG2-CE2 3.6Å; I376-F380 WeakPolarHBondContact O-CD2 3.25Å; I376-F380 PolarHBondContact O-N 3.49Å; R377-F380 VanDerWaalsContact O-O 3.13Å; F380-K382 VanDerWaalsContact C-N 3.31Å; F380-K382 PolarHBondContact O-N 3.28Å
381	E	88.6	Confident	90.3	Very high	69 Å²	69	42.7 Å²	42.7	32%	0.322	21%	0.211	S	C	.	.			trans	-65.3	-32.2	-175.4	-60.6	165.8	162.7	0	0	112.4	W255 R256 G257 R379 G532	W255-E381 HydrophobicContact CE3-CB 3.47Å; W255-E381 VanDerWaalsContact CE3-CB 3.47Å; W255-E381 HydrophobicContact CE3-CG 4.4Å; W255-E381 HydrophobicContact CZ3-CB 3.77Å; R256-E381 PolarHBondContact N-OE2 2.89Å; R256-E381 VanDerWaalsContact N-OE2 3.08Å; G257-E381 PolarHBondContact O-N 2.91Å; R379-E381 PolarHBondContact O-N 3.37Å; E381-G532 WeakPolarHBondContact O-CA 3.47Å; E381-G532 PolarHBondContact O-N 3.02Å
382	K	90.9	Very high	90.5	Very high	21 Å²	21	47.7 Å²	47.7	9%	0.091	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.9	173.7	-166.3	71.5	175.7	-177.9	0	110.1	W255 G257 I258 L259 F380 I384 E531	W255-K382 HydrophobicContact CD2-CB 4.4Å; W255-K382 HydrophobicContact CG-CB 4.39Å; G257-K382 PolarHBondContact O-N 3.49Å; I258-K382 CarbonylContact C-O 3.36Å; I258-K382 WeakPolarHBondContact CA-O 3.44Å; I258-K382 HydrophobicContact CG1-CB 4.2Å; I258-K382 HydrophobicContact CG2-CB 4.37Å; L259-K382 PolarHBondContact N-O 3.05Å; F380-K382 VanDerWaalsContact C-N 3.31Å; F380-K382 PolarHBondContact O-N 3.28Å; K382-I384 HydrophobicContact CG-CG1 4.22Å; K382-E531 IonicContact NZ-OE1 3.57Å; K382-E531 PolarHBondContact NZ-OE1 3.45Å
383	R	92.4	Very high	90.8	Very high	7 Å²	7	47.9 Å²	47.9	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	115	179.8	-57.6	178	-170.2	126.4	10.6	108.9	L259 F261 R377 F528 Q530 G532	L259-R383 HydrophobicContact CB-CG 4.45Å; L259-R383 CarbonylContact O-C 3.44Å; L259-R383 WeakPolarHBondContact O-CA 3.38Å; F261-R383 HydrophobicContact CD1-CB 4.37Å; F261-R383 HydrophobicContact CE1-CB 3.97Å; R377-R383 PolarHBondContact O-NH2 2.85Å; R383-F528 PolarHBondContact NH1-O 2.96Å; R383-Q530 PolarHBondContact N-O 3.28Å; R383-Q530 CarbonylContact O-C 3.45Å; R383-Q530 WeakPolarHBondContact O-CA 3.44Å; R383-Q530 WeakPolarHBondContact O-CB 3.19Å; R383-G532 PolarHBondContact NH1-OXT 3.08Å; R383-G532 VanDerWaalsContact NH1-OXT 3.15Å; R383-G532 PolarHBondContact NH2-OXT 3.1Å
384	I	93.1	Very high	91.3	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.7	-176.5	-55.3	178.5	0	0	0	108.4	A230 A233 L234 I258 L259 L260 F261 K382 I386	A230-I384 HydrophobicContact CB-CG2 3.82Å; A233-I384 HydrophobicContact CB-CD1 3.92Å; A233-I384 HydrophobicContact CB-CG1 4.36Å; L234-I384 HydrophobicContact CD2-CD1 3.71Å; L234-I384 HydrophobicContact CG-CD1 3.71Å; I258-I384 HydrophobicContact CG2-CD1 3.7Å; I258-I384 HydrophobicContact CG2-CG1 4Å; L259-I384 PolarHBondContact O-N 3.23Å; L260-I384 HydrophobicContact CD2-CB 3.92Å; L260-I384 HydrophobicContact CD2-CD1 4.29Å; L260-I384 HydrophobicContact CD2-CG2 4.43Å; F261-I384 PolarHBondContact N-O 2.87Å; K382-I384 HydrophobicContact CG-CG1 4.22Å; I384-I386 HydrophobicContact CG2-CD1 3.89Å
385	Y	93.1	Very high	91.7	Very high	45 Å²	45	45.3 Å²	45.3	18%	0.176	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.5	173.2	178.3	-124.6	0	0	0	110.1	F261 P387 L521	F261-Y385 AromaticContact CD2-CD2 3.88Å; F261-Y385 HydrophobicContact CD2-CD2 3.88Å; F261-Y385 AromaticContact CE2-CD2 3.49Å; F261-Y385 HydrophobicContact CE2-CD2 3.49Å; F261-Y385 VanDerWaalsContact CE2-CD2 3.49Å; F261-Y385 HydrophobicContact CE2-CE2 4.37Å; F261-Y385 HydrophobicContact CE2-CG 4.13Å; F261-Y385 HydrophobicContact CZ-CD2 4.03Å; F261-Y385 HydrophobicContact CZ-CG 4.22Å; F261-Y385 CarbonylContact O-C 3.59Å; F261-Y385 WeakPolarHBondContact O-CA 3.37Å; Y385-P387 HydrophobicContact CD1-CB 4.31Å; Y385-P387 HydrophobicContact CE1-CB 3.7Å; Y385-P387 WeakPolarHBondContact O-CD 3.28Å; Y385-L521 HydrophobicContact CE2-CB 4.14Å; Y385-L521 HydrophobicContact CE2-CD1 4.42Å
386	I	93.8	Very high	92	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.218	C	C	.	.			trans	-105.1	100	175.6	-53.7	-55.3	0	0	0	107.9	L227 A230 F261 P263 K268 L271 I384	L227-I386 HydrophobicContact CD1-CG2 3.85Å; L227-I386 HydrophobicContact CD2-CG2 3.94Å; A230-I386 HydrophobicContact CB-CD1 3.52Å; F261-I386 PolarHBondContact O-N 3.18Å; P263-I386 WeakPolarHBondContact CD-O 3.43Å; K268-I386 HydrophobicContact CG-CB 4.26Å; K268-I386 HydrophobicContact CG-CG1 4.07Å; K268-I386 HydrophobicContact CG-CG2 4.43Å; L271-I386 HydrophobicContact CD2-CD1 3.63Å; L271-I386 HydrophobicContact CD2-CG1 4.46Å; I384-I386 HydrophobicContact CG2-CD1 3.89Å
387	P	92.8	Very high	92.3	Very high	50 Å²	50	47 Å²	47	33%	0.325	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-73.4	172.6	-179.3	30.5	-36.6	0	0	0	112.6	L227 Y385	L227-P387 HydrophobicContact CD2-CG 4Å; Y385-P387 HydrophobicContact CD1-CB 4.31Å; Y385-P387 HydrophobicContact CE1-CB 3.7Å; Y385-P387 WeakPolarHBondContact O-CD 3.28Å
388	L	93.8	Very high	92.7	Very high	28 Å²	28	45 Å²	45	15%	0.147	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-62.7	148.6	163.7	-71	174.3	0	0	0	110.6	P263 T266 V513 L518	P263-L388 HydrophobicContact CB-CD2 4.43Å; P263-L388 HydrophobicContact CG-CD2 3.84Å; P263-L388 HydrophobicContact CG-CG 3.9Å; T266-L388 HydrophobicContact CG2-CD2 4.08Å; L388-V513 HydrophobicContact CD2-CG2 4.26Å; L388-L518 HydrophobicContact CD1-CD1 3.9Å; L388-L518 HydrophobicContact CD1-CD2 3.92Å; L388-L518 HydrophobicContact CG-CD2 4.31Å
389	P	93.4	Very high	92.9	Very high	11 Å²	11	41.9 Å²	41.9	7%	0.071	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-67.9	140.2	-176.8	27.2	-34.8	0	0	0	112.4	A393 R394 M397 Y424	P389-A393 HydrophobicContact CB-CB 4.05Å; P389-R394 HydrophobicContact CB-CG 3.85Å; P389-R394 HydrophobicContact CG-CG 3.68Å; P389-R394 PolarHBondContact O-NH1 3.48Å; P389-M397 HydrophobicContact CB-CE 3.78Å; P389-M397 HydrophobicContact CB-SD 4.16Å; P389-M397 HydrophobicContact CG-CE 4.26Å; P389-M397 HydrophobicContact CG-SD 4.18Å; P389-Y424 WeakPolarHBondContact CD-O 3.19Å; P389-Y424 WeakPolarHBondContact CG-O 3.48Å
390	E	92.5	Very high	93	Very high	146 Å²	146	42 Å²	42	68%	0.682	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-67.8	161	173.2	-69.1	-172.4	174	0	0	112.7	H392 A393 R394	E390-H392 VanDerWaalsContact C-N 3.29Å; E390-H392 PolarHBondContact O-N 2.9Å; E390-H392 VanDerWaalsContact O-N 3.15Å; E390-A393 WeakPolarHBondContact O-CA 3.48Å; E390-A393 WeakPolarHBondContact O-CB 3.42Å; E390-A393 PolarHBondContact O-N 3.16Å; E390-R394 WeakPolarHBondContact O-CG 3.45Å; E390-R394 PolarHBondContact O-N 3.09Å
391	P	93.8	Very high	93	Very high	63 Å²	63	45.3 Å²	45.3	41%	0.409	23%	0.23	S	C	.	.	H	α-helix	trans	-52.3	-40.9	-177.8	-26.4	32.5	0	0	0	114.7	R394 A395	P391-R394 PolarHBondContact O-N 3.46Å; P391-A395 PolarHBondContact O-N 3.01Å
392	H	93.6	Very high	93.1	Very high	152 Å²	152	42.2 Å²	42.2	70%	0.704	22%	0.216	S	C	*	.	H	α-helix	trans	-68.1	-40.4	177.2	-177.9	-84	0	0	0	112	E390 R394 A395 A396	E390-H392 VanDerWaalsContact C-N 3.29Å; E390-H392 PolarHBondContact O-N 2.9Å; E390-H392 VanDerWaalsContact O-N 3.15Å; H392-R394 VanDerWaalsContact C-N 3.34Å; H392-A395 PolarHBondContact O-N 3.31Å; H392-A396 PolarHBondContact O-N 3.32Å
393	A	93.6	Very high	93.1	Very high	7 Å²	7	43.7 Å²	43.7	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-40.4	175.4	0	0	0	0	0	111.3	P389 E390 A396 M397	P389-A393 HydrophobicContact CB-CB 4.05Å; E390-A393 WeakPolarHBondContact O-CA 3.48Å; E390-A393 WeakPolarHBondContact O-CB 3.42Å; E390-A393 PolarHBondContact O-N 3.16Å; A393-A396 PolarHBondContact O-N 3.39Å; A393-M397 VanDerWaalsContact O-CG 3.28Å; A393-M397 WeakPolarHBondContact O-CG 3.47Å; A393-M397 PolarHBondContact O-N 3Å
394	R	95.2	Very high	92.9	Very high	6 Å²	6	50.5 Å²	50.5	2%	0.023	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-42.8	175.1	-64.7	-170.8	-60.1	-115.2	15.8	112.2	P389 E390 P391 H392 A396 M397 F398 G418 T421 D422 I429	P389-R394 HydrophobicContact CB-CG 3.85Å; P389-R394 HydrophobicContact CG-CG 3.68Å; P389-R394 PolarHBondContact O-NH1 3.48Å; E390-R394 WeakPolarHBondContact O-CG 3.45Å; E390-R394 PolarHBondContact O-N 3.09Å; P391-R394 PolarHBondContact O-N 3.46Å; H392-R394 VanDerWaalsContact C-N 3.34Å; R394-A396 VanDerWaalsContact C-N 3.33Å; R394-A396 PolarHBondContact O-N 2.92Å; R394-M397 WeakPolarHBondContact O-CB 3.42Å; R394-M397 PolarHBondContact O-N 3.42Å; R394-F398 WeakPolarHBondContact O-CD2 3.41Å; R394-F398 PolarHBondContact O-N 3.15Å; R394-G418 PolarHBondContact NE-O 3.08Å; R394-G418 PolarHBondContact NH2-O 3.25Å; R394-T421 WeakPolarHBondContact CD-O 3.14Å; R394-T421 WeakPolarHBondContact CD-OG1 3.45Å; R394-T421 VanDerWaalsContact CZ-O 3.3Å; R394-T421 PolarHBondContact NE-O 3.35Å; R394-T421 PolarHBondContact NE-OG1 3.1Å; R394-D422 IonicContact CZ-OD1 3.54Å; R394-D422 IonicContact NH1-OD1 3.46Å; R394-D422 PolarHBondContact NH1-OD1 3.44Å; R394-D422 IonicContact NH2-OD1 2.9Å; R394-D422 PolarHBondContact NH2-OD1 2.99Å; R394-I429 HydrophobicContact CB-CD1 3.73Å; R394-I429 HydrophobicContact CG-CD1 3.66Å
395	A	94.9	Very high	92.8	Very high	8 Å²	8	53.2 Å²	53.2	7%	0.066	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-44.7	174.2	0	0	0	0	0	111.8	P391 H392 M397 F398 K399 F414	P391-A395 PolarHBondContact O-N 3.01Å; H392-A395 PolarHBondContact O-N 3.31Å; A395-M397 PolarHBondContact O-N 2.77Å; A395-F398 PolarHBondContact O-N 2.89Å; A395-K399 PolarHBondContact O-N 3.39Å; A395-F414 HydrophobicContact CB-CB 4.45Å; A395-F414 VanDerWaalsContact CB-O 3.25Å; A395-F414 WeakPolarHBondContact CB-O 3.33Å
396	A	93.3	Very high	92.5	Very high	38 Å²	38	57.7 Å²	57.7	31%	0.314	32%	0.319	S	S	.	.	H	α-helix	trans	-63.5	-38.7	175.1	0	0	0	0	0	112.4	A225 H392 A393 R394 K399 L400	A225-A396 HydrophobicContact CB-CB 4.21Å; H392-A396 PolarHBondContact O-N 3.32Å; A393-A396 PolarHBondContact O-N 3.39Å; R394-A396 VanDerWaalsContact C-N 3.33Å; R394-A396 PolarHBondContact O-N 2.92Å; A396-K399 PolarHBondContact O-N 3.14Å; A396-L400 WeakPolarHBondContact O-CB 3.44Å; A396-L400 PolarHBondContact O-N 2.81Å
397	M	93.6	Very high	92.5	Very high	29 Å²	29	60.1 Å²	60.1	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-40	175.9	-71	174.6	-175.1	0	0	112.4	A225 P389 A393 R394 A395 K399 L400 H401 I429	A225-M397 HydrophobicContact CB-CE 4.07Å; A225-M397 HydrophobicContact CB-CG 3.86Å; P389-M397 HydrophobicContact CB-CE 3.78Å; P389-M397 HydrophobicContact CB-SD 4.16Å; P389-M397 HydrophobicContact CG-CE 4.26Å; P389-M397 HydrophobicContact CG-SD 4.18Å; A393-M397 VanDerWaalsContact O-CG 3.28Å; A393-M397 WeakPolarHBondContact O-CG 3.47Å; A393-M397 PolarHBondContact O-N 3Å; R394-M397 WeakPolarHBondContact O-CB 3.42Å; R394-M397 PolarHBondContact O-N 3.42Å; A395-M397 PolarHBondContact O-N 2.77Å; M397-K399 VanDerWaalsContact C-N 3.33Å; M397-K399 PolarHBondContact O-N 2.82Å; M397-L400 PolarHBondContact O-N 3.03Å; M397-H401 WeakPolarHBondContact O-CB 3.44Å; M397-H401 PolarHBondContact O-CD2 3.2Å; M397-H401 PolarHBondContact O-N 2.75Å; M397-I429 HydrophobicContact CB-CD1 4.3Å; M397-I429 HydrophobicContact CB-CG2 4.14Å; M397-I429 HydrophobicContact SD-CD1 4.1Å
398	F	95.1	Very high	92.5	Very high	1 Å²	1	61 Å²	61	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-58.3	-45.9	173.7	-83.7	-70.2	0	0	0	111.7	R394 A395 H401 L402 F414 L417 T421 I429 I432 V433 M502	R394-F398 WeakPolarHBondContact O-CD2 3.41Å; R394-F398 PolarHBondContact O-N 3.15Å; A395-F398 PolarHBondContact O-N 2.89Å; F398-H401 PolarHBondContact O-N 3.17Å; F398-L402 WeakPolarHBondContact O-CG 3.49Å; F398-L402 PolarHBondContact O-N 3.45Å; F398-L402 VanDerWaalsContact O-N 3.09Å; F398-F414 HydrophobicContact CB-CD1 3.8Å; F398-F414 HydrophobicContact CB-CE1 4.17Å; F398-L417 HydrophobicContact CD1-CD1 4.25Å; F398-L417 HydrophobicContact CD2-CB 3.85Å; F398-L417 HydrophobicContact CE2-CB 3.77Å; F398-L417 HydrophobicContact CG-CB 4.38Å; F398-L417 HydrophobicContact CG-CD1 4.31Å; F398-L417 HydrophobicContact CZ-CB 4.22Å; F398-T421 HydrophobicContact CE2-CG2 3.76Å; F398-T421 HydrophobicContact CZ-CG2 3.63Å; F398-I429 HydrophobicContact CD1-CG2 3.87Å; F398-I429 HydrophobicContact CD2-CG2 4.15Å; F398-I429 HydrophobicContact CE1-CG2 3.84Å; F398-I429 HydrophobicContact CE2-CD1 4.45Å; F398-I429 HydrophobicContact CE2-CG1 4.3Å; F398-I429 HydrophobicContact CE2-CG2 4.11Å; F398-I429 HydrophobicContact CG-CG2 4.02Å; F398-I429 HydrophobicContact CZ-CG1 4.27Å; F398-I429 HydrophobicContact CZ-CG2 3.96Å; F398-I432 HydrophobicContact CE1-CB 4.44Å; F398-I432 HydrophobicContact CE1-CG2 3.96Å; F398-I432 HydrophobicContact CZ-CG2 4.49Å; F398-V433 HydrophobicContact CD1-CG2 3.49Å; F398-V433 VanDerWaalsContact CD1-CG2 3.49Å; F398-V433 HydrophobicContact CE1-CG2 3.92Å; F398-M502 HydrophobicContact CD1-CE 3.3Å; F398-M502 HydrophobicContact CE1-CE 3.41Å; F398-M502 VanDerWaalsContact CE1-CE 3.41Å; F398-M502 HydrophobicContact CG-CE 4.43Å
399	K	92.6	Very high	92.4	Very high	107 Å²	107	60.5 Å²	60.5	47%	0.465	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-43.5	177.6	-168.1	171.3	-172.4	165.9	0	111.8	A395 A396 M397 L402 G403 E411	A395-K399 PolarHBondContact O-N 3.39Å; A396-K399 PolarHBondContact O-N 3.14Å; M397-K399 VanDerWaalsContact C-N 3.33Å; M397-K399 PolarHBondContact O-N 2.82Å; K399-L402 PolarHBondContact O-N 2.96Å; K399-G403 PolarHBondContact O-N 2.58Å; K399-E411 IonicContact NZ-OE2 2.86Å; K399-E411 PolarHBondContact NZ-OE2 3.11Å
400	L	91.1	Very high	92.5	Very high	89 Å²	89	63.7 Å²	63.7	47%	0.466	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-45.7	178	-174.8	151.8	0	0	0	111.7	A396 M397 G403	A396-L400 WeakPolarHBondContact O-CB 3.44Å; A396-L400 PolarHBondContact O-N 2.81Å; M397-L400 PolarHBondContact O-N 3.03Å; L400-G403 PolarHBondContact O-N 3.36Å
401	H	91.7	Very high	92.5	Very high	69 Å²	69	61 Å²	61	32%	0.319	34%	0.344	S	S	.	.	H	α-helix	trans	-73.5	-25.4	-178	-75.8	-55.4	0	0	0	114	M397 F398 V433	M397-H401 WeakPolarHBondContact O-CB 3.44Å; M397-H401 PolarHBondContact O-CD2 3.2Å; M397-H401 PolarHBondContact O-N 2.75Å; F398-H401 PolarHBondContact O-N 3.17Å; H401-V433 HydrophobicContact CB-CB 3.97Å; H401-V433 HydrophobicContact CB-CG1 3.82Å; H401-V433 HydrophobicContact CB-CG2 3.94Å
402	L	91.9	Very high	92.6	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-72.8	-30.5	170.9	-76.9	169.8	0	0	0	112.5	F398 K399 T404 T405 L409 F414 V433 L437	F398-L402 WeakPolarHBondContact O-CG 3.49Å; F398-L402 PolarHBondContact O-N 3.45Å; F398-L402 VanDerWaalsContact O-N 3.09Å; K399-L402 PolarHBondContact O-N 2.96Å; L402-T404 PolarHBondContact O-N 3.27Å; L402-T405 WeakPolarHBondContact O-CB 3.48Å; L402-T405 PolarHBondContact O-N 3.28Å; L402-T405 PolarHBondContact O-OG1 2.71Å; L402-L409 HydrophobicContact CD1-CD1 3.57Å; L402-F414 HydrophobicContact CD1-CE1 3.4Å; L402-F414 HydrophobicContact CD1-CZ 3.56Å; L402-V433 HydrophobicContact CD2-CG1 3.84Å; L402-V433 HydrophobicContact CG-CG1 3.98Å; L402-L437 HydrophobicContact CD2-CD2 4.06Å; L402-L437 HydrophobicContact CD2-CG 4.44Å
403	G	89.8	Confident	92.7	Very high	52 Å²	52	55.5 Å²	55.5	54%	0.536	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-129.6	178.7	0	0	0	0	0	112.1	K399 L400	K399-G403 PolarHBondContact O-N 2.58Å; L400-G403 PolarHBondContact O-N 3.36Å
404	T	88.5	Confident	92.8	Very high	151 Å²	151	55.8 Å²	55.8	93%	0.926	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	8.8	-179.6	58.1	0	0	0	0	113.5	L402 Q406	L402-T404 PolarHBondContact O-N 3.27Å; T404-Q406 PolarHBondContact O-N 3.47Å
405	T	90.7	Very high	92.8	Very high	61 Å²	61	63 Å²	63	37%	0.374	35%	0.352	S	S	.	.			trans	-66.2	133.2	-178.1	-48.2	0	0	0	0	110.2	L402 N407 L437	L402-T405 WeakPolarHBondContact O-CB 3.48Å; L402-T405 PolarHBondContact O-N 3.28Å; L402-T405 PolarHBondContact O-OG1 2.71Å; T405-N407 PolarHBondContact O-N 3.01Å; T405-N407 PolarHBondContact O-ND2 3.38Å; T405-L437 HydrophobicContact CG2-CD2 3.66Å
406	Q	87.2	Confident	92.9	Very high	139 Å²	139	66.5 Å²	66.5	65%	0.65	37%	0.367	S	S	*	.			trans	-60.5	126.7	175.8	-65.6	-173.1	-3.3	0	0	110.5	T404 V496	T404-Q406 PolarHBondContact O-N 3.47Å; Q406-V496 HydrophobicContact CB-CG1 3.98Å
407	N	92.8	Very high	93	Very high	52 Å²	52	64.7 Å²	64.7	28%	0.278	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-147.9	157.6	-177.6	66.3	86.2	0	0	0	109.6	T405 L409 V497	T405-N407 PolarHBondContact O-N 3.01Å; T405-N407 PolarHBondContact O-ND2 3.38Å; N407-L409 HydrophobicContact CB-CG 4.43Å; N407-L409 WeakPolarHBondContact OD1-CB 3.48Å; N407-L409 PolarHBondContact OD1-N 2.97Å; N407-L409 VanDerWaalsContact OD1-N 3.11Å; N407-V497 VanDerWaalsContact CA-O 3.31Å; N407-V497 WeakPolarHBondContact CA-O 3.42Å; N407-V497 HydrophobicContact CB-CB 4.31Å; N407-V497 WeakPolarHBondContact CB-O 3.46Å
408	S	92.9	Very high	93.1	Very high	67 Å²	67	63.3 Å²	63.3	47%	0.469	35%	0.346	S	S	.	.			trans	-98.1	19.3	177.3	77.2	0	0	0	0	112.5	V497 S498	S408-V497 PolarHBondContact N-O 3.32Å; S408-S498 WeakPolarHBondContact OG-CA 3.48Å
409	L	93.1	Very high	93.1	Very high	19 Å²	19	70.8 Å²	70.8	10%	0.099	38%	0.378	C	S	.	.			trans	-87.5	134.9	-173.8	-58.5	173.1	0	0	0	110.6	L402 N407 D413 F414 M499 M502	L402-L409 HydrophobicContact CD1-CD1 3.57Å; N407-L409 HydrophobicContact CB-CG 4.43Å; N407-L409 WeakPolarHBondContact OD1-CB 3.48Å; N407-L409 PolarHBondContact OD1-N 2.97Å; N407-L409 VanDerWaalsContact OD1-N 3.11Å; L409-D413 HydrophobicContact CB-CB 4.4Å; L409-D413 HydrophobicContact CD2-CB 4.18Å; L409-F414 HydrophobicContact CB-CE1 4.27Å; L409-F414 HydrophobicContact CB-CE2 4.04Å; L409-F414 HydrophobicContact CB-CZ 3.73Å; L409-F414 HydrophobicContact CD1-CE1 3.73Å; L409-F414 HydrophobicContact CD1-CZ 3.86Å; L409-F414 HydrophobicContact CG-CZ 4.46Å; L409-M499 VanDerWaalsContact CD2-CA 3.46Å; L409-M499 HydrophobicContact CD2-CB 3.7Å; L409-M499 VanDerWaalsContact CD2-N 3.34Å; L409-M499 HydrophobicContact CD2-SD 4.2Å; L409-M502 HydrophobicContact CD1-CG 4Å; L409-M502 HydrophobicContact CD2-CG 4.41Å
410	T	94.6	Very high	93.2	Very high	77 Å²	77	70.7 Å²	70.7	47%	0.472	38%	0.378	S	S	.	.			trans	-93.2	166.6	174.3	68.2	0	0	0	0	111.2	A412 D413 F414	T410-A412 PolarHBondContact O-N 3.11Å; T410-A412 PolarHBondContact OG1-N 3.03Å; T410-D413 WeakPolarHBondContact CB-OD2 3.46Å; T410-D413 PolarHBondContact N-OD2 3.27Å; T410-D413 WeakPolarHBondContact O-CB 3.47Å; T410-D413 PolarHBondContact O-N 3.43Å; T410-D413 VanDerWaalsContact O-N 3.08Å; T410-D413 VanDerWaalsContact OG1-CG 3.22Å; T410-D413 PolarHBondContact OG1-N 2.98Å; T410-D413 PolarHBondContact OG1-OD2 3.05Å; T410-F414 VanDerWaalsContact O-CD2 3.28Å; T410-F414 WeakPolarHBondContact O-CD2 3.42Å; T410-F414 PolarHBondContact O-N 3.34Å
411	E	93.5	Very high	93.4	Very high	91 Å²	91	66.5 Å²	66.5	43%	0.425	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-27.6	174	-166.4	64.3	-152.6	0	0	112.4	K399 R415	K399-E411 IonicContact NZ-OE2 2.86Å; K399-E411 PolarHBondContact NZ-OE2 3.11Å; E411-R415 WeakPolarHBondContact O-CG 3.13Å; E411-R415 PolarHBondContact O-N 3.04Å
412	A	95.1	Very high	93.5	Very high	66 Å²	66	68.8 Å²	68.8	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-68.6	-39.5	174	0	0	0	0	0	111.8	T410 F414 R415 E416	T410-A412 PolarHBondContact O-N 3.11Å; T410-A412 PolarHBondContact OG1-N 3.03Å; A412-F414 PolarHBondContact O-N 3.3Å; A412-R415 WeakPolarHBondContact O-CB 3.4Å; A412-R415 PolarHBondContact O-N 2.95Å; A412-E416 PolarHBondContact O-N 3.4Å
413	D	95.3	Very high	93.5	Very high	33 Å²	33	69.6 Å²	69.6	18%	0.176	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-41.5	178.2	-59.1	-45.3	0	0	0	111.2	L409 T410 R415 E416 L417 M499	L409-D413 HydrophobicContact CB-CB 4.4Å; L409-D413 HydrophobicContact CD2-CB 4.18Å; T410-D413 WeakPolarHBondContact CB-OD2 3.46Å; T410-D413 PolarHBondContact N-OD2 3.27Å; T410-D413 WeakPolarHBondContact O-CB 3.47Å; T410-D413 PolarHBondContact O-N 3.43Å; T410-D413 VanDerWaalsContact O-N 3.08Å; T410-D413 VanDerWaalsContact OG1-CG 3.22Å; T410-D413 PolarHBondContact OG1-N 2.98Å; T410-D413 PolarHBondContact OG1-OD2 3.05Å; D413-R415 VanDerWaalsContact C-N 3.31Å; D413-R415 PolarHBondContact O-N 3.47Å; D413-E416 PolarHBondContact O-N 3.23Å; D413-E416 VanDerWaalsContact O-N 3.16Å; D413-L417 WeakPolarHBondContact O-CG 3.31Å; D413-L417 PolarHBondContact O-N 2.95Å; D413-M499 HydrophobicContact CB-SD 4.17Å
414	F	95.8	Very high	93.8	Very high	12 Å²	12	68 Å²	68	5%	0.053	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-39.7	175.3	-69.8	-56.2	0	0	0	112.8	A395 F398 L402 L409 T410 A412 E416 L417 G418	A395-F414 HydrophobicContact CB-CB 4.45Å; A395-F414 VanDerWaalsContact CB-O 3.25Å; A395-F414 WeakPolarHBondContact CB-O 3.33Å; F398-F414 HydrophobicContact CB-CD1 3.8Å; F398-F414 HydrophobicContact CB-CE1 4.17Å; L402-F414 HydrophobicContact CD1-CE1 3.4Å; L402-F414 HydrophobicContact CD1-CZ 3.56Å; L409-F414 HydrophobicContact CB-CE1 4.27Å; L409-F414 HydrophobicContact CB-CE2 4.04Å; L409-F414 HydrophobicContact CB-CZ 3.73Å; L409-F414 HydrophobicContact CD1-CE1 3.73Å; L409-F414 HydrophobicContact CD1-CZ 3.86Å; L409-F414 HydrophobicContact CG-CZ 4.46Å; T410-F414 VanDerWaalsContact O-CD2 3.28Å; T410-F414 WeakPolarHBondContact O-CD2 3.42Å; T410-F414 PolarHBondContact O-N 3.34Å; A412-F414 PolarHBondContact O-N 3.3Å; F414-E416 VanDerWaalsContact C-N 3.35Å; F414-L417 HydrophobicContact CD1-CD1 4.43Å; F414-L417 PolarHBondContact O-N 3.21Å; F414-G418 PolarHBondContact O-N 3.3Å
415	R	95.8	Very high	94.1	Very high	158 Å²	158	61 Å²	61	60%	0.596	31%	0.314	S	S	*	.	H	α-helix	trans	-66.4	-38.4	175	-67.9	173.9	-172.7	-178.5	1.6	111.5	E411 A412 D413 K419	E411-R415 WeakPolarHBondContact O-CG 3.13Å; E411-R415 PolarHBondContact O-N 3.04Å; A412-R415 WeakPolarHBondContact O-CB 3.4Å; A412-R415 PolarHBondContact O-N 2.95Å; D413-R415 VanDerWaalsContact C-N 3.31Å; D413-R415 PolarHBondContact O-N 3.47Å; R415-K419 WeakPolarHBondContact O-CG 3.34Å; R415-K419 PolarHBondContact O-N 2.85Å; R415-K419 VanDerWaalsContact O-N 3.13Å
416	E	96.2	Very high	94.2	Very high	81 Å²	81	58.7 Å²	58.7	38%	0.379	30%	0.303	S	S	.	.	H	α-helix	trans	-65.8	-45.4	175.6	-171.6	179	170.4	0	0	111.6	A412 D413 F414 G418 K419 K420 M499	A412-E416 PolarHBondContact O-N 3.4Å; D413-E416 PolarHBondContact O-N 3.23Å; D413-E416 VanDerWaalsContact O-N 3.16Å; F414-E416 VanDerWaalsContact C-N 3.35Å; E416-G418 VanDerWaalsContact C-N 3.34Å; E416-G418 PolarHBondContact O-N 3.33Å; E416-K419 WeakPolarHBondContact O-CB 3.21Å; E416-K419 PolarHBondContact O-N 3.16Å; E416-K419 VanDerWaalsContact O-N 3.13Å; E416-K420 HydrophobicContact CG-CD 4.29Å; E416-K420 PolarHBondContact O-N 2.97Å; E416-K420 WeakPolarHBondContact OE1-CE 3.33Å; E416-K420 IonicContact OE1-NZ 2.71Å; E416-M499 HydrophobicContact CB-CE 4.36Å; E416-M499 HydrophobicContact CG-CE 4.32Å
417	L	95.8	Very high	94.5	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-57.7	-46.6	175	-71.4	172.2	0	0	0	111.2	F398 D413 F414 K419 K420 T421 M499 M502	F398-L417 HydrophobicContact CD1-CD1 4.25Å; F398-L417 HydrophobicContact CD2-CB 3.85Å; F398-L417 HydrophobicContact CE2-CB 3.77Å; F398-L417 HydrophobicContact CG-CB 4.38Å; F398-L417 HydrophobicContact CG-CD1 4.31Å; F398-L417 HydrophobicContact CZ-CB 4.22Å; D413-L417 WeakPolarHBondContact O-CG 3.31Å; D413-L417 PolarHBondContact O-N 2.95Å; F414-L417 HydrophobicContact CD1-CD1 4.43Å; F414-L417 PolarHBondContact O-N 3.21Å; L417-K419 VanDerWaalsContact C-N 3.26Å; L417-K419 PolarHBondContact O-N 3.4Å; L417-K420 PolarHBondContact O-N 3.47Å; L417-K420 VanDerWaalsContact O-N 3.12Å; L417-T421 VanDerWaalsContact O-CG2 3.31Å; L417-T421 WeakPolarHBondContact O-CG2 3.45Å; L417-T421 PolarHBondContact O-N 2.74Å; L417-T421 PolarHBondContact O-OG1 2.75Å; L417-M499 HydrophobicContact CD1-SD 4.16Å; L417-M499 HydrophobicContact CD2-CE 3.83Å; L417-M499 HydrophobicContact CD2-SD 3.86Å; L417-M499 HydrophobicContact CG-CE 3.92Å; L417-M499 HydrophobicContact CG-SD 3.93Å; L417-M502 HydrophobicContact CD1-CB 4.21Å; L417-M502 HydrophobicContact CD1-CE 3.82Å; L417-M502 HydrophobicContact CD1-CG 4.22Å; L417-M502 HydrophobicContact CD2-CB 3.99Å
418	G	95.3	Very high	94.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-34.8	176.4	0	0	0	0	0	113.7	R394 F414 E416 T421	R394-G418 PolarHBondContact NE-O 3.08Å; R394-G418 PolarHBondContact NH2-O 3.25Å; F414-G418 PolarHBondContact O-N 3.3Å; E416-G418 VanDerWaalsContact C-N 3.34Å; E416-G418 PolarHBondContact O-N 3.33Å; G418-T421 PolarHBondContact O-OG1 3.47Å
419	K	95.8	Very high	94.7	Very high	158 Å²	158	48.6 Å²	48.6	69%	0.687	25%	0.254	S	S	*	.	H	α-helix	trans	-71.9	-38.5	174.2	-72.1	175.1	-178.5	-178.1	0	112.6	R415 E416 L417 T421	R415-K419 WeakPolarHBondContact O-CG 3.34Å; R415-K419 PolarHBondContact O-N 2.85Å; R415-K419 VanDerWaalsContact O-N 3.13Å; E416-K419 WeakPolarHBondContact O-CB 3.21Å; E416-K419 PolarHBondContact O-N 3.16Å; E416-K419 VanDerWaalsContact O-N 3.13Å; L417-K419 VanDerWaalsContact C-N 3.26Å; L417-K419 PolarHBondContact O-N 3.4Å; K419-T421 VanDerWaalsContact C-N 3.34Å
420	K	95.3	Very high	94.8	Very high	105 Å²	105	48.9 Å²	48.9	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-76.3	-18.5	-178.9	-70.8	-179.4	-174.9	-78.1	0	113.9	E416 L417 D422 L503 L506	E416-K420 HydrophobicContact CG-CD 4.29Å; E416-K420 PolarHBondContact O-N 2.97Å; E416-K420 WeakPolarHBondContact OE1-CE 3.33Å; E416-K420 IonicContact OE1-NZ 2.71Å; L417-K420 PolarHBondContact O-N 3.47Å; L417-K420 VanDerWaalsContact O-N 3.12Å; K420-D422 PolarHBondContact O-N 3.13Å; K420-L503 HydrophobicContact CD-CD2 3.95Å; K420-L506 HydrophobicContact CB-CD2 3.84Å; K420-L506 HydrophobicContact CD-CD2 4.35Å
421	T	95.3	Very high	94.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.256	C	S	.	.			trans	-97.6	42.4	-177.2	58.2	0	0	0	0	113.4	R394 F398 L417 G418 K419 Y424 I432 L506	R394-T421 WeakPolarHBondContact CD-O 3.14Å; R394-T421 WeakPolarHBondContact CD-OG1 3.45Å; R394-T421 VanDerWaalsContact CZ-O 3.3Å; R394-T421 PolarHBondContact NE-O 3.35Å; R394-T421 PolarHBondContact NE-OG1 3.1Å; F398-T421 HydrophobicContact CE2-CG2 3.76Å; F398-T421 HydrophobicContact CZ-CG2 3.63Å; L417-T421 VanDerWaalsContact O-CG2 3.31Å; L417-T421 WeakPolarHBondContact O-CG2 3.45Å; L417-T421 PolarHBondContact O-N 2.74Å; L417-T421 PolarHBondContact O-OG1 2.75Å; G418-T421 PolarHBondContact O-OG1 3.47Å; K419-T421 VanDerWaalsContact C-N 3.34Å; T421-Y424 HydrophobicContact CG2-CD2 4.47Å; T421-Y424 HydrophobicContact CG2-CG 4.45Å; T421-Y424 WeakPolarHBondContact O-CB 3.48Å; T421-Y424 WeakPolarHBondContact O-CD2 3.28Å; T421-Y424 PolarHBondContact O-N 3.29Å; T421-I432 HydrophobicContact CG2-CD1 4.49Å; T421-L506 HydrophobicContact CG2-CD1 3.54Å; T421-L506 HydrophobicContact CG2-CD2 4.46Å
422	D	93.5	Very high	94.9	Very high	117 Å²	117	44.8 Å²	44.8	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	136.8	176.8	-159.8	40.6	0	0	0	112.7	R394 K420 Y424	R394-D422 IonicContact CZ-OD1 3.54Å; R394-D422 IonicContact NH1-OD1 3.46Å; R394-D422 PolarHBondContact NH1-OD1 3.44Å; R394-D422 IonicContact NH2-OD1 2.9Å; R394-D422 PolarHBondContact NH2-OD1 2.99Å; K420-D422 PolarHBondContact O-N 3.13Å; D422-Y424 VanDerWaalsContact C-N 3.27Å; D422-Y424 WeakPolarHBondContact O-CD2 3.37Å; D422-Y424 PolarHBondContact O-N 3.13Å
423	G	92.1	Very high	95	Very high	21 Å²	21	41.7 Å²	41.7	22%	0.216	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	-2.1	-172.9	0	0	0	0	0	115.8
424	Y	94.7	Very high	95	Very high	20 Å²	20	47.9 Å²	47.9	8%	0.078	23%	0.23	C	C	.	.			trans	-79.7	138.7	179	-73.9	-112.6	0	0	0	111.5	P389 T421 D422 D428 I432 L506 T509 P511	P389-Y424 WeakPolarHBondContact CD-O 3.19Å; P389-Y424 WeakPolarHBondContact CG-O 3.48Å; T421-Y424 HydrophobicContact CG2-CD2 4.47Å; T421-Y424 HydrophobicContact CG2-CG 4.45Å; T421-Y424 WeakPolarHBondContact O-CB 3.48Å; T421-Y424 WeakPolarHBondContact O-CD2 3.28Å; T421-Y424 PolarHBondContact O-N 3.29Å; D422-Y424 VanDerWaalsContact C-N 3.27Å; D422-Y424 WeakPolarHBondContact O-CD2 3.37Å; D422-Y424 PolarHBondContact O-N 3.13Å; Y424-D428 HydrophobicContact CD1-CB 3.61Å; Y424-D428 HydrophobicContact CE1-CB 4.46Å; Y424-D428 HydrophobicContact CG-CB 4.33Å; Y424-I432 HydrophobicContact CD1-CD1 3.67Å; Y424-I432 HydrophobicContact CE1-CD1 3.62Å; Y424-L506 HydrophobicContact CE1-CD1 4.1Å; Y424-L506 HydrophobicContact CE2-CD1 4.37Å; Y424-T509 HydrophobicContact CE1-CG2 4.39Å; Y424-T509 PolarHBondContact OH-O 3.43Å; Y424-P511 HydrophobicContact CD2-CB 4.47Å; Y424-P511 HydrophobicContact CD2-CG 3.93Å; Y424-P511 HydrophobicContact CE1-CG 4.44Å; Y424-P511 HydrophobicContact CE2-CG 3.57Å
425	S	94.9	Very high	95	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	24%	0.236	C	C	.	.			trans	-82.4	167.5	170.4	72	0	0	0	0	111.7	A427 D428 I429	S425-A427 PolarHBondContact O-N 2.99Å; S425-D428 WeakPolarHBondContact CB-OD2 3.31Å; S425-D428 PolarHBondContact N-OD2 2.95Å; S425-D428 PolarHBondContact O-N 3.45Å; S425-D428 VanDerWaalsContact O-N 3.17Å; S425-D428 PolarHBondContact OG-N 3.21Å; S425-D428 PolarHBondContact OG-OD2 3.25Å; S425-I429 WeakPolarHBondContact O-CG1 3.34Å; S425-I429 PolarHBondContact O-N 2.92Å; S425-I429 VanDerWaalsContact O-N 3.08Å
426	G	92.9	Very high	94.9	Very high	13 Å²	13	41.4 Å²	41.4	13%	0.134	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-33.6	174.1	0	0	0	0	0	112.5	G265 I429 S430	G265-G426 WeakPolarHBondContact O-CA 3.47Å; G265-G426 PolarHBondContact O-N 3.12Å; G426-I429 PolarHBondContact O-N 3.06Å; G426-S430 PolarHBondContact O-N 3.02Å
427	A	93.3	Very high	94.9	Very high	43 Å²	43	39.9 Å²	39.9	36%	0.355	20%	0.202	S	C	.	.	H	α-helix	trans	-63.9	-43	173.4	0	0	0	0	0	112.2	G265 S425 I429 S430 I431	G265-A427 PolarHBondContact O-N 2.88Å; G265-A427 VanDerWaalsContact O-N 3.1Å; S425-A427 PolarHBondContact O-N 2.99Å; A427-I429 VanDerWaalsContact C-N 3.35Å; A427-I429 PolarHBondContact O-N 3.39Å; A427-S430 WeakPolarHBondContact O-CB 3.4Å; A427-S430 PolarHBondContact O-N 3.35Å; A427-I431 WeakPolarHBondContact O-CG1 3.44Å; A427-I431 PolarHBondContact O-N 2.76Å
428	D	95.4	Very high	94.9	Very high	3 Å²	3	44 Å²	44	2%	0.016	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-42.2	177.9	-55.7	-46	0	0	0	111	Y424 S425 S430 I431 I432 T512	Y424-D428 HydrophobicContact CD1-CB 3.61Å; Y424-D428 HydrophobicContact CE1-CB 4.46Å; Y424-D428 HydrophobicContact CG-CB 4.33Å; S425-D428 WeakPolarHBondContact CB-OD2 3.31Å; S425-D428 PolarHBondContact N-OD2 2.95Å; S425-D428 PolarHBondContact O-N 3.45Å; S425-D428 VanDerWaalsContact O-N 3.17Å; S425-D428 PolarHBondContact OG-N 3.21Å; S425-D428 PolarHBondContact OG-OD2 3.25Å; D428-S430 VanDerWaalsContact C-N 3.34Å; D428-S430 PolarHBondContact O-N 3.12Å; D428-I431 WeakPolarHBondContact O-CB 3.45Å; D428-I431 PolarHBondContact O-N 3.17Å; D428-I432 WeakPolarHBondContact O-CG1 3.45Å; D428-I432 PolarHBondContact O-N 3.37Å; D428-T512 VanDerWaalsContact OD1-CB 3.29Å; D428-T512 WeakPolarHBondContact OD1-CB 3.36Å; D428-T512 PolarHBondContact OD1-N 3.06Å; D428-T512 PolarHBondContact OD1-OG1 3.11Å; D428-T512 PolarHBondContact OD2-N 3.43Å
429	I	95.4	Very high	94.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.8	-42.1	175.8	-66.2	170.3	0	0	0	111	R394 M397 F398 S425 G426 A427 I431 I432 V433	R394-I429 HydrophobicContact CB-CD1 3.73Å; R394-I429 HydrophobicContact CG-CD1 3.66Å; M397-I429 HydrophobicContact CB-CD1 4.3Å; M397-I429 HydrophobicContact CB-CG2 4.14Å; M397-I429 HydrophobicContact SD-CD1 4.1Å; F398-I429 HydrophobicContact CD1-CG2 3.87Å; F398-I429 HydrophobicContact CD2-CG2 4.15Å; F398-I429 HydrophobicContact CE1-CG2 3.84Å; F398-I429 HydrophobicContact CE2-CD1 4.45Å; F398-I429 HydrophobicContact CE2-CG1 4.3Å; F398-I429 HydrophobicContact CE2-CG2 4.11Å; F398-I429 HydrophobicContact CG-CG2 4.02Å; F398-I429 HydrophobicContact CZ-CG1 4.27Å; F398-I429 HydrophobicContact CZ-CG2 3.96Å; S425-I429 WeakPolarHBondContact O-CG1 3.34Å; S425-I429 PolarHBondContact O-N 2.92Å; S425-I429 VanDerWaalsContact O-N 3.08Å; G426-I429 PolarHBondContact O-N 3.06Å; A427-I429 VanDerWaalsContact C-N 3.35Å; A427-I429 PolarHBondContact O-N 3.39Å; I429-I431 VanDerWaalsContact C-N 3.28Å; I429-I431 PolarHBondContact O-N 3.15Å; I429-I432 PolarHBondContact O-N 3.28Å; I429-V433 HydrophobicContact CG2-CG2 4.4Å; I429-V433 WeakPolarHBondContact O-CG2 3.15Å; I429-V433 PolarHBondContact O-N 2.96Å
430	S	94.5	Very high	94.7	Very high	26 Å²	26	37.2 Å²	37.2	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-37.9	176.1	-176.5	0	0	0	0	112.2	G426 A427 D428 R434	G426-S430 PolarHBondContact O-N 3.02Å; A427-S430 WeakPolarHBondContact O-CB 3.4Å; A427-S430 PolarHBondContact O-N 3.35Å; D428-S430 VanDerWaalsContact C-N 3.34Å; D428-S430 PolarHBondContact O-N 3.12Å; S430-R434 VanDerWaalsContact O-CB 3.26Å; S430-R434 WeakPolarHBondContact O-CB 3.32Å; S430-R434 PolarHBondContact O-N 3.38Å
431	I	95.5	Very high	94.7	Very high	82 Å²	82	35.1 Å²	35.1	42%	0.421	19%	0.19	S	C	.	.	H	α-helix	trans	-66	-46.4	176.3	-67.8	165.3	0	0	0	110.6	A427 D428 I429 V433 R434 D435 T509	A427-I431 WeakPolarHBondContact O-CG1 3.44Å; A427-I431 PolarHBondContact O-N 2.76Å; D428-I431 WeakPolarHBondContact O-CB 3.45Å; D428-I431 PolarHBondContact O-N 3.17Å; I429-I431 VanDerWaalsContact C-N 3.28Å; I429-I431 PolarHBondContact O-N 3.15Å; I431-V433 PolarHBondContact O-N 3.46Å; I431-R434 PolarHBondContact O-N 3.08Å; I431-D435 WeakPolarHBondContact O-CB 3.38Å; I431-D435 PolarHBondContact O-N 3.01Å; I431-T509 HydrophobicContact CG2-CG2 4.43Å
432	I	96.1	Very high	94.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-50.1	177.8	-67	164.4	0	0	0	110.5	F398 T421 Y424 D428 I429 R434 D435 A436 M502 S505 L506 T509	F398-I432 HydrophobicContact CE1-CB 4.44Å; F398-I432 HydrophobicContact CE1-CG2 3.96Å; F398-I432 HydrophobicContact CZ-CG2 4.49Å; T421-I432 HydrophobicContact CG2-CD1 4.49Å; Y424-I432 HydrophobicContact CD1-CD1 3.67Å; Y424-I432 HydrophobicContact CE1-CD1 3.62Å; D428-I432 WeakPolarHBondContact O-CG1 3.45Å; D428-I432 PolarHBondContact O-N 3.37Å; I429-I432 PolarHBondContact O-N 3.28Å; I432-R434 VanDerWaalsContact C-N 3.34Å; I432-R434 PolarHBondContact O-N 3.48Å; I432-D435 PolarHBondContact O-N 3.18Å; I432-A436 WeakPolarHBondContact O-CB 2.97Å; I432-A436 PolarHBondContact O-N 3.25Å; I432-M502 HydrophobicContact CG2-CE 4.37Å; I432-S505 WeakPolarHBondContact CA-OG 3.4Å; I432-S505 PolarHBondContact O-OG 2.82Å; I432-L506 HydrophobicContact CD1-CD1 3.79Å; I432-T509 HydrophobicContact CD1-CG2 4.45Å; I432-T509 HydrophobicContact CG1-CG2 3.93Å
433	V	96	Very high	94.6	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-43.3	-179.6	175.4	0	0	0	0	110.8	F398 H401 L402 I429 I431 D435 A436 L437 M502	F398-V433 HydrophobicContact CD1-CG2 3.49Å; F398-V433 VanDerWaalsContact CD1-CG2 3.49Å; F398-V433 HydrophobicContact CE1-CG2 3.92Å; H401-V433 HydrophobicContact CB-CB 3.97Å; H401-V433 HydrophobicContact CB-CG1 3.82Å; H401-V433 HydrophobicContact CB-CG2 3.94Å; L402-V433 HydrophobicContact CD2-CG1 3.84Å; L402-V433 HydrophobicContact CG-CG1 3.98Å; I429-V433 HydrophobicContact CG2-CG2 4.4Å; I429-V433 WeakPolarHBondContact O-CG2 3.15Å; I429-V433 PolarHBondContact O-N 2.96Å; I431-V433 PolarHBondContact O-N 3.46Å; V433-D435 VanDerWaalsContact C-N 3.34Å; V433-D435 PolarHBondContact O-N 3.25Å; V433-A436 PolarHBondContact O-N 3.45Å; V433-L437 HydrophobicContact CG1-CD1 3.9Å; V433-L437 HydrophobicContact CG1-CG 4.2Å; V433-L437 WeakPolarHBondContact O-CB 3.31Å; V433-L437 VanDerWaalsContact O-CG 3.23Å; V433-L437 WeakPolarHBondContact O-CG 3.38Å; V433-L437 PolarHBondContact O-N 3.27Å; V433-M502 HydrophobicContact CG2-CE 3.95Å
434	R	95.2	Very high	94.7	Very high	162 Å²	162	37.1 Å²	37.1	61%	0.611	19%	0.186	S	C	*	.	H	α-helix	trans	-61.2	-41.9	178.2	-173	-177.2	-58.7	161.6	6	112.2	S430 I431 I432 M438	S430-R434 VanDerWaalsContact O-CB 3.26Å; S430-R434 WeakPolarHBondContact O-CB 3.32Å; S430-R434 PolarHBondContact O-N 3.38Å; I431-R434 PolarHBondContact O-N 3.08Å; I432-R434 VanDerWaalsContact C-N 3.34Å; I432-R434 PolarHBondContact O-N 3.48Å; R434-M438 WeakPolarHBondContact O-CG 3.41Å; R434-M438 PolarHBondContact O-N 2.69Å
435	D	95.3	Very high	94.6	Very high	34 Å²	34	41.8 Å²	41.8	18%	0.182	21%	0.208	C	C	.	.	H	α-helix	trans	-70.5	-36.5	177.8	176.9	66.8	0	0	0	112.1	I431 I432 V433 M438 R442 S505	I431-D435 WeakPolarHBondContact O-CB 3.38Å; I431-D435 PolarHBondContact O-N 3.01Å; I432-D435 PolarHBondContact O-N 3.18Å; V433-D435 VanDerWaalsContact C-N 3.34Å; V433-D435 PolarHBondContact O-N 3.25Å; D435-M438 PolarHBondContact O-N 2.87Å; D435-R442 IonicContact OD1-CZ 3.22Å; D435-R442 VanDerWaalsContact OD1-CZ 3.22Å; D435-R442 IonicContact OD1-NH1 3.89Å; D435-R442 PolarHBondContact OD1-NH1 3.42Å; D435-R442 IonicContact OD1-NH2 2.83Å; D435-R442 PolarHBondContact OD1-NH2 3.17Å; D435-R442 IonicContact OD2-NH1 2.71Å; D435-S505 WeakPolarHBondContact CB-OG 3.37Å; D435-S505 VanDerWaalsContact OD2-CB 3.3Å; D435-S505 WeakPolarHBondContact OD2-CB 3.17Å; D435-S505 PolarHBondContact OD2-OG 3.35Å
436	A	95.7	Very high	94.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-40.4	172.8	0	0	0	0	0	112.8	I432 V433 M438 Q439 V497 M502	I432-A436 WeakPolarHBondContact O-CB 2.97Å; I432-A436 PolarHBondContact O-N 3.25Å; V433-A436 PolarHBondContact O-N 3.45Å; A436-M438 PolarHBondContact O-N 3.42Å; A436-Q439 WeakPolarHBondContact O-CB 3.08Å; A436-Q439 WeakPolarHBondContact O-CG 3.5Å; A436-Q439 PolarHBondContact O-N 2.58Å; A436-V497 HydrophobicContact CB-CG1 4.38Å; A436-M502 HydrophobicContact CB-CG 4.41Å; A436-M502 HydrophobicContact CB-SD 3.31Å; A436-M502 WeakPolarHBondContact CB-SD 3.36Å
437	L	95.5	Very high	94.6	Very high	50 Å²	50	46.2 Å²	46.2	26%	0.262	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-25	174.8	-74.1	169	0	0	0	112.7	L402 T405 V433 V497	L402-L437 HydrophobicContact CD2-CD2 4.06Å; L402-L437 HydrophobicContact CD2-CG 4.44Å; T405-L437 HydrophobicContact CG2-CD2 3.66Å; V433-L437 HydrophobicContact CG1-CD1 3.9Å; V433-L437 HydrophobicContact CG1-CG 4.2Å; V433-L437 WeakPolarHBondContact O-CB 3.31Å; V433-L437 VanDerWaalsContact O-CG 3.23Å; V433-L437 WeakPolarHBondContact O-CG 3.38Å; V433-L437 PolarHBondContact O-N 3.27Å; L437-V497 HydrophobicContact CD2-CG2 4.2Å
438	M	94.6	Very high	94.6	Very high	86 Å²	86	47.9 Å²	47.9	42%	0.424	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-8.6	175.9	-67.9	-57.1	-58.4	0	0	113.7	R434 D435 A436 V441 R442	R434-M438 WeakPolarHBondContact O-CG 3.41Å; R434-M438 PolarHBondContact O-N 2.69Å; D435-M438 PolarHBondContact O-N 2.87Å; A436-M438 PolarHBondContact O-N 3.42Å; M438-V441 HydrophobicContact CE-CB 4.05Å; M438-V441 HydrophobicContact CE-CG1 4.11Å; M438-V441 HydrophobicContact CE-CG2 4.18Å; M438-V441 PolarHBondContact O-N 2.98Å; M438-R442 WeakPolarHBondContact O-CG 3.48Å; M438-R442 PolarHBondContact O-N 3.5Å
439	Q	93.9	Very high	94.6	Very high	7 Å²	7	49.1 Å²	49.1	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-43.1	-179.3	-64.5	-68.6	-36.5	0	0	113.2	A436 V441 R442 K443 D501	A436-Q439 WeakPolarHBondContact O-CB 3.08Å; A436-Q439 WeakPolarHBondContact O-CG 3.5Å; A436-Q439 PolarHBondContact O-N 2.58Å; Q439-V441 VanDerWaalsContact C-N 3.3Å; Q439-V441 PolarHBondContact O-N 2.94Å; Q439-R442 PolarHBondContact O-N 2.81Å; Q439-K443 VanDerWaalsContact O-CG 3.32Å; Q439-K443 WeakPolarHBondContact O-CG 3.38Å; Q439-K443 PolarHBondContact O-N 3.44Å; Q439-D501 HydrophobicContact CB-CB 3.91Å; Q439-D501 WeakPolarHBondContact CB-OD1 3.28Å; Q439-D501 HydrophobicContact CG-CB 3.85Å
440	P	94.2	Very high	94.5	Very high	10 Å²	10	49.1 Å²	49.1	7%	0.065	25%	0.249	C	C	.	.	H	α-helix	trans	-54	-45.3	172.5	-31.7	39.4	0	0	0	113.6	R442 K443 V444 P495 V497	P440-R442 PolarHBondContact O-N 3.28Å; P440-K443 PolarHBondContact O-N 3.06Å; P440-V444 WeakPolarHBondContact O-CG2 3.23Å; P440-V444 PolarHBondContact O-N 2.76Å; P440-P495 WeakPolarHBondContact CB-O 3.32Å; P440-P495 WeakPolarHBondContact CG-O 3.49Å; P440-V497 HydrophobicContact CG-CG2 3.84Å
441	V	94	Very high	94.5	Very high	61 Å²	61	51.1 Å²	51.1	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-45.3	178.8	-178.4	0	0	0	0	110.6	M438 Q439 K443 V444 Q445	M438-V441 HydrophobicContact CE-CB 4.05Å; M438-V441 HydrophobicContact CE-CG1 4.11Å; M438-V441 HydrophobicContact CE-CG2 4.18Å; M438-V441 PolarHBondContact O-N 2.98Å; Q439-V441 VanDerWaalsContact C-N 3.3Å; Q439-V441 PolarHBondContact O-N 2.94Å; V441-K443 PolarHBondContact O-N 3.3Å; V441-V444 PolarHBondContact O-N 3.2Å; V441-Q445 WeakPolarHBondContact O-CG 3.48Å; V441-Q445 PolarHBondContact O-N 3.13Å
442	R	94.1	Very high	94.3	Very high	107 Å²	107	53.6 Å²	53.6	40%	0.404	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-41.7	176.6	-69.4	171.9	-176	163	1.7	111.7	D435 M438 Q439 P440 Q445 S446	D435-R442 IonicContact OD1-CZ 3.22Å; D435-R442 VanDerWaalsContact OD1-CZ 3.22Å; D435-R442 IonicContact OD1-NH1 3.89Å; D435-R442 PolarHBondContact OD1-NH1 3.42Å; D435-R442 IonicContact OD1-NH2 2.83Å; D435-R442 PolarHBondContact OD1-NH2 3.17Å; D435-R442 IonicContact OD2-NH1 2.71Å; M438-R442 WeakPolarHBondContact O-CG 3.48Å; M438-R442 PolarHBondContact O-N 3.5Å; Q439-R442 PolarHBondContact O-N 2.81Å; P440-R442 PolarHBondContact O-N 3.28Å; R442-Q445 PolarHBondContact O-N 2.96Å; R442-S446 WeakPolarHBondContact O-CB 3.37Å; R442-S446 PolarHBondContact O-N 2.86Å; R442-S446 PolarHBondContact O-OG 3.27Å
443	K	93.1	Very high	94.1	Very high	60 Å²	60	55.3 Å²	55.3	26%	0.261	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-44.7	176.6	-73.2	172.8	-172.7	172.1	0	111.5	Q439 P440 V441 S446 A447 D501	Q439-K443 VanDerWaalsContact O-CG 3.32Å; Q439-K443 WeakPolarHBondContact O-CG 3.38Å; Q439-K443 PolarHBondContact O-N 3.44Å; P440-K443 PolarHBondContact O-N 3.06Å; V441-K443 PolarHBondContact O-N 3.3Å; K443-S446 PolarHBondContact O-OG 3.24Å; K443-A447 WeakPolarHBondContact O-CB 3.45Å; K443-A447 PolarHBondContact O-N 2.85Å; K443-D501 WeakPolarHBondContact CE-OD1 3.29Å; K443-D501 IonicContact NZ-OD1 3.6Å; K443-D501 PolarHBondContact NZ-OD1 2.69Å; K443-D501 IonicContact NZ-OD2 3.94Å; K443-D501 PolarHBondContact NZ-OD2 2.78Å
444	V	93.8	Very high	93.8	Very high	13 Å²	13	63.3 Å²	63.3	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-44.6	175.9	172.8	0	0	0	0	111.1	P440 V441 S446 A447 F450 P471 W484 L492	P440-V444 WeakPolarHBondContact O-CG2 3.23Å; P440-V444 PolarHBondContact O-N 2.76Å; V441-V444 PolarHBondContact O-N 3.2Å; V444-S446 PolarHBondContact O-N 2.96Å; V444-A447 WeakPolarHBondContact O-CB 3.19Å; V444-A447 PolarHBondContact O-N 3.16Å; V444-F450 HydrophobicContact CG1-CE1 4.44Å; V444-F450 HydrophobicContact CG1-CZ 4.31Å; V444-P471 HydrophobicContact CB-CG 4.24Å; V444-P471 HydrophobicContact CG2-CG 3.6Å; V444-W484 HydrophobicContact CG1-CB 3.93Å; V444-L492 HydrophobicContact CG1-CD1 3.97Å; V444-L492 HydrophobicContact CG1-CD2 4.11Å; V444-L492 HydrophobicContact CG2-CD1 4.32Å
445	Q	93.8	Very high	93.3	Very high	118 Å²	118	55.8 Å²	55.8	55%	0.551	28%	0.276	S	S	*	.	H	α-helix	trans	-65.9	-37.4	-179.5	-74.5	178.6	6.1	0	0	113.2	V441 R442 A447	V441-Q445 WeakPolarHBondContact O-CG 3.48Å; V441-Q445 PolarHBondContact O-N 3.13Å; R442-Q445 PolarHBondContact O-N 2.96Å; Q445-A447 VanDerWaalsContact C-N 3.34Å
446	S	94.1	Very high	92.9	Very high	92 Å²	92	56.9 Å²	56.9	64%	0.643	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.9	178.4	66	0	0	0	0	113.8	R442 K443 V444	R442-S446 WeakPolarHBondContact O-CB 3.37Å; R442-S446 PolarHBondContact O-N 2.86Å; R442-S446 PolarHBondContact O-OG 3.27Å; K443-S446 PolarHBondContact O-OG 3.24Å; V444-S446 PolarHBondContact O-N 2.96Å
447	A	93.4	Very high	92.3	Very high	16 Å²	16	58.3 Å²	58.3	13%	0.132	30%	0.295	C	S	.	.			trans	-72	132.4	-178	0	0	0	0	0	110.7	K443 V444 Q445 F450 P471	K443-A447 WeakPolarHBondContact O-CB 3.45Å; K443-A447 PolarHBondContact O-N 2.85Å; V444-A447 WeakPolarHBondContact O-CB 3.19Å; V444-A447 PolarHBondContact O-N 3.16Å; Q445-A447 VanDerWaalsContact C-N 3.34Å; A447-F450 HydrophobicContact CB-CE2 3.74Å; A447-F450 HydrophobicContact CB-CZ 3.75Å; A447-P471 HydrophobicContact CB-CB 3.83Å; A447-P471 HydrophobicContact CB-CG 4.21Å
448	T	93.7	Very high	91.6	Very high	78 Å²	78	62.9 Å²	62.9	48%	0.479	31%	0.309	S	S	.	.	S	Bend	trans	-100.6	-18.5	172.2	55.5	0	0	0	0	112.2	M482	T448-M482 CarbonylContact C-O 3.35Å; T448-M482 PolarHBondContact O-N 3.49Å; T448-M482 VanDerWaalsContact O-N 3.1Å
449	H	94.5	Very high	91	Very high	29 Å²	29	62.5 Å²	62.5	13%	0.134	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	139.9	-176.6	-66.1	68.4	0	0	0	110.6	C472 A479 I480	H449-C472 PolarHBondContact O-N 3.02Å; H449-A479 HydrophobicContact CB-CB 4.3Å; H449-I480 CarbonylContact C-O 3.57Å; H449-I480 WeakPolarHBondContact CA-O 3.44Å
450	F	94.6	Very high	90.4	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	150.2	175.9	-71.4	-102.7	0	0	0	110.5	V444 A447 L469 T470 P471 I480 M482 W484 V487 L492	V444-F450 HydrophobicContact CG1-CE1 4.44Å; V444-F450 HydrophobicContact CG1-CZ 4.31Å; A447-F450 HydrophobicContact CB-CE2 3.74Å; A447-F450 HydrophobicContact CB-CZ 3.75Å; F450-L469 HydrophobicContact CB-CB 4.44Å; F450-L469 HydrophobicContact CB-CD2 4.31Å; F450-L469 HydrophobicContact CD1-CB 4.35Å; F450-T470 CarbonylContact C-O 3.56Å; F450-T470 VanDerWaalsContact CA-O 3.3Å; F450-T470 WeakPolarHBondContact CA-O 3.3Å; F450-P471 HydrophobicContact CD1-CG 4.3Å; F450-P471 HydrophobicContact CE1-CB 4.48Å; F450-P471 HydrophobicContact CE1-CG 3.76Å; F450-P471 HydrophobicContact CZ-CG 4.34Å; F450-I480 PolarHBondContact N-O 3.24Å; F450-I480 PolarHBondContact O-N 3.28Å; F450-M482 HydrophobicContact CB-CG 3.9Å; F450-M482 HydrophobicContact CB-SD 4.01Å; F450-M482 HydrophobicContact CD2-CG 3.55Å; F450-M482 WeakPolarHBondContact CD2-O 3.26Å; F450-M482 HydrophobicContact CD2-SD 4.4Å; F450-M482 HydrophobicContact CE2-CG 4.43Å; F450-M482 WeakPolarHBondContact CE2-O 3.39Å; F450-M482 HydrophobicContact CG-CG 4.03Å; F450-M482 HydrophobicContact CG-SD 4.37Å; F450-W484 HydrophobicContact CZ-CB 4.24Å; F450-V487 HydrophobicContact CD1-CG2 4Å; F450-V487 HydrophobicContact CD2-CG2 4.25Å; F450-V487 HydrophobicContact CE1-CG2 3.96Å; F450-V487 HydrophobicContact CE2-CG2 4.21Å; F450-V487 HydrophobicContact CG-CG2 4.14Å; F450-V487 HydrophobicContact CZ-CG2 4.07Å; F450-L492 HydrophobicContact CE1-CD1 3.98Å
451	K	93.4	Very high	89.8	Confident	68 Å²	68	71.4 Å²	71.4	30%	0.296	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.8	178.5	175.8	171.9	175.4	163.7	0	110.3	V453 L469 T470 C472 P477	K451-V453 HydrophobicContact CG-CG1 4.24Å; K451-L469 WeakPolarHBondContact O-CA 2.94Å; K451-T470 PolarHBondContact N-O 3.27Å; K451-T470 PolarHBondContact O-N 3.05Å; K451-C472 HydrophobicContact CB-CB 3.85Å; K451-P477 WeakPolarHBondContact CD-O 3.48Å; K451-P477 WeakPolarHBondContact CE-O 3.25Å; K451-P477 PolarHBondContact NZ-O 3.01Å
452	K	92.3	Very high	89.3	Confident	134 Å²	134	76.5 Å²	76.5	58%	0.583	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.5	171.6	-67.9	-178.6	-178.3	-179.7	0	110.2	L468 L469 I480	K452-L468 CarbonylContact C-O 3.56Å; K452-L468 VanDerWaalsContact CA-O 3.25Å; K452-L468 WeakPolarHBondContact CA-O 3.31Å; K452-L469 HydrophobicContact CG-CD2 3.6Å; K452-I480 HydrophobicContact CD-CD1 4.46Å; K452-I480 HydrophobicContact CG-CD1 4.33Å
453	V	90.9	Very high	88.9	Confident	36 Å²	36	76.9 Å²	76.9	22%	0.218	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.2	-178.4	-66.9	0	0	0	0	110.5	K451 L468 T470 L493	K451-V453 HydrophobicContact CG-CG1 4.24Å; V453-L468 HydrophobicContact CG2-CB 4.29Å; V453-L468 PolarHBondContact N-O 3.26Å; V453-L468 WeakPolarHBondContact O-CB 3.39Å; V453-L468 PolarHBondContact O-N 3.01Å; V453-T470 HydrophobicContact CB-CG2 4.32Å; V453-T470 HydrophobicContact CG1-CG2 3.64Å; V453-T470 HydrophobicContact CG2-CG2 3.67Å; V453-L493 HydrophobicContact CG2-CD2 3.69Å
454	R	89	Confident	88.5	Confident	168 Å²	168	77.9 Å²	77.9	63%	0.634	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	127.5	170.3	-179.9	174	-159.3	-159.9	-2.4	109.4	L464 V465 D466	R454-L464 HydrophobicContact CG-CB 4.38Å; R454-V465 CarbonylContact C-O 3.57Å; R454-V465 VanDerWaalsContact CA-O 3.31Å; R454-V465 WeakPolarHBondContact CA-O 3.24Å; R454-D466 WeakPolarHBondContact CD-OD1 3.27Å; R454-D466 WeakPolarHBondContact CG-OD1 2.83Å; R454-D466 IonicContact CZ-OD1 3.91Å; R454-D466 IonicContact NE-OD1 2.94Å; R454-D466 PolarHBondContact NE-OD1 3.45Å
455	G	86.4	Confident	88.2	Confident	5 Å²	5	78.8 Å²	78.8	5%	0.052	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	171.6	-179.8	0	0	0	0	0	113.1	L464 V465	G455-L464 CarbonylContact O-C 3.49Å; G455-L464 WeakPolarHBondContact O-CA 3.45Å; G455-V465 PolarHBondContact N-O 2.93Å; G455-V465 PolarHBondContact O-N 3.35Å
456	P	85.3	Confident	87.8	Confident	56 Å²	56	78.1 Å²	78.1	36%	0.364	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	141.2	177.5	27.1	-33.1	0	0	0	111.3
457	S	83.6	Confident	87.5	Confident	30 Å²	30	76.9 Å²	76.9	21%	0.21	40%	0.403	C	S	.	.			trans	-64.1	145.4	171.9	-177.6	0	0	0	0	110.6	A459 D460 H463	S457-A459 VanDerWaalsContact C-N 3.26Å; S457-A459 PolarHBondContact O-N 3.48Å; S457-A459 PolarHBondContact OG-N 3.3Å; S457-D460 WeakPolarHBondContact CB-O 3.48Å; S457-D460 CarbonylContact O-C 3.6Å; S457-H463 WeakPolarHBondContact CB-O 2.83Å; S457-H463 PolarHBondContact N-O 3.42Å
458	R	81.6	Confident	87.4	Confident	146 Å²	146	76.5 Å²	76.5	55%	0.551	40%	0.399	S	S	*	.	S	Bend	trans	-65	-31.2	174.2	-68.2	-174.8	175.6	-142.9	-4.7	112.7	L492 E494	R458-L492 PolarHBondContact NE-O 3.48Å; R458-L492 PolarHBondContact NH2-O 3.44Å; R458-E494 IonicContact CZ-OE2 2.97Å; R458-E494 IonicContact NH2-OE2 2.68Å; R458-E494 PolarHBondContact NH2-OE2 3.29Å
459	A	81.4	Confident	87.3	Confident	79 Å²	79	73.4 Å²	73.4	65%	0.653	38%	0.379	S	S	*	.	S	Bend	trans	-78.9	-42.9	-179.7	0	0	0	0	0	111.6	S457	S457-A459 VanDerWaalsContact C-N 3.26Å; S457-A459 PolarHBondContact O-N 3.48Å; S457-A459 PolarHBondContact OG-N 3.3Å
460	D	81.8	Confident	87.2	Confident	104 Å²	104	73.3 Å²	73.3	56%	0.556	38%	0.381	S	S	*	.			trans	-134.4	106.6	-175.6	-72	-56.2	0	0	0	110.5	S457 N462 H463	S457-D460 WeakPolarHBondContact CB-O 3.48Å; S457-D460 CarbonylContact O-C 3.6Å; D460-N462 PolarHBondContact O-N 3.09Å; D460-H463 HydrophobicContact CB-CB 4.09Å; D460-H463 PolarHBondContact O-N 2.96Å
461	P	80.4	Confident	87.2	Confident	100 Å²	100	74.5 Å²	74.5	65%	0.649	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.5	179.6	-26.6	35	0	0	0	114.7
462	N	84.4	Confident	87.2	Confident	167 Å²	167	72.5 Å²	72.5	89%	0.893	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-11.2	179	-68	-17.7	0	0	0	113.4	D460	D460-N462 PolarHBondContact O-N 3.09Å
463	H	86.2	Confident	87.2	Confident	116 Å²	116	69.4 Å²	69.4	54%	0.537	38%	0.378	S	S	.	.	S	Bend	trans	-101.2	120.6	178.3	-172.6	69.8	0	0	0	110	S457 D460	S457-H463 WeakPolarHBondContact CB-O 2.83Å; S457-H463 PolarHBondContact N-O 3.42Å; D460-H463 HydrophobicContact CB-CB 4.09Å; D460-H463 PolarHBondContact O-N 2.96Å
464	L	84.9	Confident	87.1	Confident	81 Å²	81	71.9 Å²	71.9	42%	0.424	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	129.3	178.2	-65.7	175.8	0	0	0	110.5	R454 G455	R454-L464 HydrophobicContact CG-CB 4.38Å; G455-L464 CarbonylContact O-C 3.49Å; G455-L464 WeakPolarHBondContact O-CA 3.45Å
465	V	87.1	Confident	87.1	Confident	32 Å²	32	67.4 Å²	67.4	19%	0.194	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	133.1	177.8	178.3	0	0	0	0	108.5	R454 G455 D467 L468	R454-V465 CarbonylContact C-O 3.57Å; R454-V465 VanDerWaalsContact CA-O 3.31Å; R454-V465 WeakPolarHBondContact CA-O 3.24Å; G455-V465 PolarHBondContact N-O 2.93Å; G455-V465 PolarHBondContact O-N 3.35Å; V465-D467 WeakPolarHBondContact CG1-OD1 3.5Å; V465-L468 HydrophobicContact CB-CD1 4.5Å; V465-L468 HydrophobicContact CB-CD2 4.5Å; V465-L468 HydrophobicContact CB-CG 4.24Å; V465-L468 HydrophobicContact CG1-CD2 4.22Å; V465-L468 HydrophobicContact CG1-CG 4.18Å
466	D	84.8	Confident	87.3	Confident	104 Å²	104	70.3 Å²	70.3	56%	0.556	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	-8.1	-171.1	-63.4	-30	0	0	0	113.9	R454	R454-D466 WeakPolarHBondContact CD-OD1 3.27Å; R454-D466 WeakPolarHBondContact CG-OD1 2.83Å; R454-D466 IonicContact CZ-OD1 3.91Å; R454-D466 IonicContact NE-OD1 2.94Å; R454-D466 PolarHBondContact NE-OD1 3.45Å
467	D	87.8	Confident	87.4	Confident	65 Å²	65	72.5 Å²	72.5	35%	0.348	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	22.7	-171.8	75.8	-29.4	0	0	0	114.7	V465 K491	V465-D467 WeakPolarHBondContact CG1-OD1 3.5Å; D467-K491 VanDerWaalsContact OD2-CE 3.25Å; D467-K491 WeakPolarHBondContact OD2-CE 3.35Å; D467-K491 IonicContact OD2-NZ 2.7Å; D467-K491 PolarHBondContact OD2-NZ 3.25Å
468	L	91.1	Very high	87.6	Confident	8 Å²	8	73.6 Å²	73.6	4%	0.042	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	148	176.1	-60.5	175.2	0	0	0	111.5	K452 V453 V465 K491 L493	K452-L468 CarbonylContact C-O 3.56Å; K452-L468 VanDerWaalsContact CA-O 3.25Å; K452-L468 WeakPolarHBondContact CA-O 3.31Å; V453-L468 HydrophobicContact CG2-CB 4.29Å; V453-L468 PolarHBondContact N-O 3.26Å; V453-L468 WeakPolarHBondContact O-CB 3.39Å; V453-L468 PolarHBondContact O-N 3.01Å; V465-L468 HydrophobicContact CB-CD1 4.5Å; V465-L468 HydrophobicContact CB-CD2 4.5Å; V465-L468 HydrophobicContact CB-CG 4.24Å; V465-L468 HydrophobicContact CG1-CD2 4.22Å; V465-L468 HydrophobicContact CG1-CG 4.18Å; L468-K491 CarbonylContact C-O 3.59Å; L468-K491 VanDerWaalsContact CA-O 3.28Å; L468-K491 WeakPolarHBondContact CA-O 3.37Å; L468-L493 HydrophobicContact CB-CB 4.05Å; L468-L493 HydrophobicContact CD1-CB 4.38Å; L468-L493 HydrophobicContact CD1-CD1 4.36Å; L468-L493 HydrophobicContact CD1-CD2 4.3Å
469	L	92.1	Very high	88.1	Confident	13 Å²	13	68.1 Å²	68.1	7%	0.068	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.8	-179.2	-70.8	168.4	0	0	0	110.2	F450 K451 K452 M482 V487 K491 L493	F450-L469 HydrophobicContact CB-CB 4.44Å; F450-L469 HydrophobicContact CB-CD2 4.31Å; F450-L469 HydrophobicContact CD1-CB 4.35Å; K451-L469 WeakPolarHBondContact O-CA 2.94Å; K452-L469 HydrophobicContact CG-CD2 3.6Å; L469-M482 HydrophobicContact CD1-SD 3.99Å; L469-V487 HydrophobicContact CB-CG1 4.1Å; L469-V487 HydrophobicContact CD1-CG1 4.01Å; L469-V487 HydrophobicContact CD1-CG2 4.32Å; L469-K491 PolarHBondContact N-O 2.92Å; L469-L493 PolarHBondContact O-N 2.93Å
470	T	92.7	Very high	88.6	Confident	28 Å²	28	67.3 Å²	67.3	17%	0.172	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	145.7	173.9	-177.9	0	0	0	0	110.6	F450 K451 V453	F450-T470 CarbonylContact C-O 3.56Å; F450-T470 VanDerWaalsContact CA-O 3.3Å; F450-T470 WeakPolarHBondContact CA-O 3.3Å; K451-T470 PolarHBondContact N-O 3.27Å; K451-T470 PolarHBondContact O-N 3.05Å; V453-T470 HydrophobicContact CB-CG2 4.32Å; V453-T470 HydrophobicContact CG1-CG2 3.64Å; V453-T470 HydrophobicContact CG2-CG2 3.67Å
471	P	94.2	Very high	89.2	Confident	25 Å²	25	69.8 Å²	69.8	16%	0.162	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.1	138	168.4	-27.4	35.8	0	0	0	112.1	V444 A447 F450 P495	V444-P471 HydrophobicContact CB-CG 4.24Å; V444-P471 HydrophobicContact CG2-CG 3.6Å; A447-P471 HydrophobicContact CB-CB 3.83Å; A447-P471 HydrophobicContact CB-CG 4.21Å; F450-P471 HydrophobicContact CD1-CG 4.3Å; F450-P471 HydrophobicContact CE1-CB 4.48Å; F450-P471 HydrophobicContact CE1-CG 3.76Å; F450-P471 HydrophobicContact CZ-CG 4.34Å; P471-P495 HydrophobicContact CG-CG 4.18Å
472	C	92.6	Very high	89.7	Confident	25 Å²	25	66.9 Å²	66.9	17%	0.169	40%	0.402	C	S	.	.			trans	-142.9	169.6	179.2	69.2	0	0	0	0	111.8	H449 K451 D476	H449-C472 PolarHBondContact O-N 3.02Å; K451-C472 HydrophobicContact CB-CB 3.85Å; C472-D476 HydrophobicContact CB-CB 4.31Å; C472-D476 WeakPolarHBondContact CB-OD2 3.42Å
473	S	92.1	Very high	90.1	Very high	69 Å²	69	62 Å²	62	48%	0.483	38%	0.378	S	S	.	.			trans	-76.8	149.8	175.3	-57.8	0	0	0	0	110.5	G475 D476	S473-G475 PolarHBondContact O-N 3.28Å; S473-G475 VanDerWaalsContact O-N 3.08Å; S473-D476 WeakPolarHBondContact CB-OD2 3.33Å; S473-D476 PolarHBondContact N-OD2 3.41Å; S473-D476 WeakPolarHBondContact O-CB 3.31Å; S473-D476 PolarHBondContact O-N 3.35Å
474	P	90.7	Very high	90.4	Very high	88 Å²	88	62.3 Å²	62.3	57%	0.571	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.8	179.6	-26.2	34.1	0	0	0	115
475	G	88.4	Confident	90.7	Very high	75 Å²	75	65 Å²	65	77%	0.773	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	1.5	179	0	0	0	0	0	115.2	S473	S473-G475 PolarHBondContact O-N 3.28Å; S473-G475 VanDerWaalsContact O-N 3.08Å
476	D	89.9	Confident	91	Very high	66 Å²	66	68.4 Å²	68.4	35%	0.353	40%	0.404	S	S	.	.	S	Bend	trans	-74.7	141.5	-174.8	-75.5	-31.9	0	0	0	112.1	C472 S473 G478 A479	C472-D476 HydrophobicContact CB-CB 4.31Å; C472-D476 WeakPolarHBondContact CB-OD2 3.42Å; S473-D476 WeakPolarHBondContact CB-OD2 3.33Å; S473-D476 PolarHBondContact N-OD2 3.41Å; S473-D476 WeakPolarHBondContact O-CB 3.31Å; S473-D476 PolarHBondContact O-N 3.35Å; D476-G478 PolarHBondContact O-N 2.69Å; D476-G478 VanDerWaalsContact O-N 3.13Å; D476-A479 HydrophobicContact CB-CB 4.42Å; D476-A479 WeakPolarHBondContact O-CB 3.4Å; D476-A479 PolarHBondContact O-N 3.1Å
477	P	88.5	Confident	91.3	Very high	101 Å²	101	64.2 Å²	64.2	66%	0.656	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	119.3	175.7	-21.7	31.5	0	0	0	110.9	K451	K451-P477 WeakPolarHBondContact CD-O 3.48Å; K451-P477 WeakPolarHBondContact CE-O 3.25Å; K451-P477 PolarHBondContact NZ-O 3.01Å
478	G	86.6	Confident	91.4	Very high	54 Å²	54	63.9 Å²	63.9	56%	0.557	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	17.2	-176.3	0	0	0	0	0	114.6	D476 I480	D476-G478 PolarHBondContact O-N 2.69Å; D476-G478 VanDerWaalsContact O-N 3.13Å; G478-I480 PolarHBondContact O-N 2.97Å
479	A	92.7	Very high	91.2	Very high	30 Å²	30	66.2 Å²	66.2	25%	0.248	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	127.3	168	0	0	0	0	0	110.3	H449 D476	H449-A479 HydrophobicContact CB-CB 4.3Å; D476-A479 HydrophobicContact CB-CB 4.42Å; D476-A479 WeakPolarHBondContact O-CB 3.4Å; D476-A479 PolarHBondContact O-N 3.1Å
480	I	92.1	Very high	91	Very high	63 Å²	63	71 Å²	71	32%	0.323	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.3	175.8	-54	167.3	0	0	0	106.4	H449 F450 K452 G478 M482	H449-I480 CarbonylContact C-O 3.57Å; H449-I480 WeakPolarHBondContact CA-O 3.44Å; F450-I480 PolarHBondContact N-O 3.24Å; F450-I480 PolarHBondContact O-N 3.28Å; K452-I480 HydrophobicContact CD-CD1 4.46Å; K452-I480 HydrophobicContact CG-CD1 4.33Å; G478-I480 PolarHBondContact O-N 2.97Å; I480-M482 HydrophobicContact CB-CE 3.81Å; I480-M482 HydrophobicContact CD1-CE 4.29Å; I480-M482 HydrophobicContact CG2-CE 3.36Å; I480-M482 PolarHBondContact O-N 2.89Å
481	E	93.3	Very high	90.8	Very high	156 Å²	156	72.7 Å²	72.7	73%	0.729	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.9	112.5	175	-169.2	176.1	-169.5	0	0	109.2
482	M	91.2	Very high	90.7	Very high	38 Å²	38	73.3 Å²	73.3	19%	0.187	44%	0.442	C	S	.	.			trans	-161.9	155.6	176.9	64.5	176.5	67.6	0	0	109.6	T448 F450 L469 I480 D486 V487	T448-M482 CarbonylContact C-O 3.35Å; T448-M482 PolarHBondContact O-N 3.49Å; T448-M482 VanDerWaalsContact O-N 3.1Å; F450-M482 HydrophobicContact CB-CG 3.9Å; F450-M482 HydrophobicContact CB-SD 4.01Å; F450-M482 HydrophobicContact CD2-CG 3.55Å; F450-M482 WeakPolarHBondContact CD2-O 3.26Å; F450-M482 HydrophobicContact CD2-SD 4.4Å; F450-M482 HydrophobicContact CE2-CG 4.43Å; F450-M482 WeakPolarHBondContact CE2-O 3.39Å; F450-M482 HydrophobicContact CG-CG 4.03Å; F450-M482 HydrophobicContact CG-SD 4.37Å; L469-M482 HydrophobicContact CD1-SD 3.99Å; I480-M482 HydrophobicContact CB-CE 3.81Å; I480-M482 HydrophobicContact CD1-CE 4.29Å; I480-M482 HydrophobicContact CG2-CE 3.36Å; I480-M482 PolarHBondContact O-N 2.89Å; M482-D486 HydrophobicContact CB-CB 4.27Å; M482-V487 HydrophobicContact SD-CG2 3.91Å
483	T	93.4	Very high	90.6	Very high	64 Å²	64	74.2 Å²	74.2	39%	0.393	45%	0.445	S	S	.	.			trans	-95	164.2	176.4	71.9	0	0	0	0	110.7	M485 D486	T483-M485 PolarHBondContact O-N 2.79Å; T483-M485 VanDerWaalsContact O-N 3.1Å; T483-M485 PolarHBondContact OG1-N 3.25Å; T483-D486 PolarHBondContact N-OD2 2.83Å; T483-D486 WeakPolarHBondContact O-CB 3.15Å; T483-D486 PolarHBondContact O-N 3.02Å; T483-D486 PolarHBondContact OG1-OD2 3.49Å
484	W	91.9	Very high	90.5	Very high	123 Å²	123	75.3 Å²	75.3	47%	0.466	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-59.2	-22.5	175.5	70.4	-92.2	0	0	0	113.3	V444 F450 D486 V487	V444-W484 HydrophobicContact CG1-CB 3.93Å; F450-W484 HydrophobicContact CZ-CB 4.24Å; W484-D486 PolarHBondContact O-N 3.37Å; W484-V487 PolarHBondContact O-N 2.99Å
485	M	92.6	Very high	90.6	Very high	139 Å²	139	72.5 Å²	72.5	69%	0.685	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-69.1	-25.4	176.6	-64	-173.8	-179.8	0	0	112.3	T483	T483-M485 PolarHBondContact O-N 2.79Å; T483-M485 VanDerWaalsContact O-N 3.1Å; T483-M485 PolarHBondContact OG1-N 3.25Å
486	D	92.6	Very high	90.8	Very high	102 Å²	102	72 Å²	72	55%	0.545	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-88.4	-11.3	-178.2	-51.2	-56.5	0	0	0	112.1	M482 T483 W484 P488	M482-D486 HydrophobicContact CB-CB 4.27Å; T483-D486 PolarHBondContact N-OD2 2.83Å; T483-D486 WeakPolarHBondContact O-CB 3.15Å; T483-D486 PolarHBondContact O-N 3.02Å; T483-D486 PolarHBondContact OG1-OD2 3.49Å; W484-D486 PolarHBondContact O-N 3.37Å; D486-P488 WeakPolarHBondContact O-CD 3.15Å
487	V	90.7	Very high	91	Very high	16 Å²	16	69 Å²	69	10%	0.097	39%	0.39	C	S	.	.	S	Bend	trans	-84.8	122.2	-178.3	-179.2	0	0	0	0	110.2	F450 L469 M482 W484 G489 L492	F450-V487 HydrophobicContact CD1-CG2 4Å; F450-V487 HydrophobicContact CD2-CG2 4.25Å; F450-V487 HydrophobicContact CE1-CG2 3.96Å; F450-V487 HydrophobicContact CE2-CG2 4.21Å; F450-V487 HydrophobicContact CG-CG2 4.14Å; F450-V487 HydrophobicContact CZ-CG2 4.07Å; L469-V487 HydrophobicContact CB-CG1 4.1Å; L469-V487 HydrophobicContact CD1-CG1 4.01Å; L469-V487 HydrophobicContact CD1-CG2 4.32Å; M482-V487 HydrophobicContact SD-CG2 3.91Å; W484-V487 PolarHBondContact O-N 2.99Å; V487-G489 PolarHBondContact O-N 3.2Å; V487-L492 HydrophobicContact CG1-CB 3.94Å; V487-L492 HydrophobicContact CG1-CD1 4.04Å
488	P	90.5	Very high	91.3	Very high	58 Å²	58	65.2 Å²	65.2	38%	0.377	37%	0.366	S	S	.	.			trans	-60	136	172.7	-23.6	34.9	0	0	0	111.7	D486 D490 K491 L492	D486-P488 WeakPolarHBondContact O-CD 3.15Å; P488-D490 VanDerWaalsContact CB-OD1 3.24Å; P488-D490 WeakPolarHBondContact CB-OD1 3.46Å; P488-D490 PolarHBondContact O-N 3.26Å; P488-K491 HydrophobicContact CB-CB 4.31Å; P488-K491 HydrophobicContact CB-CD 4.29Å; P488-K491 HydrophobicContact CB-CG 4.12Å; P488-K491 HydrophobicContact CG-CD 4.23Å; P488-K491 PolarHBondContact O-N 3.38Å; P488-L492 PolarHBondContact O-N 3.32Å
489	G	87.1	Confident	91.7	Very high	58 Å²	58	64 Å²	64	60%	0.598	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-26.2	-172.3	0	0	0	0	0	114.9	V487	V487-G489 PolarHBondContact O-N 3.2Å
490	D	87.1	Confident	91.8	Very high	113 Å²	113	66.1 Å²	66.1	60%	0.604	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-22.4	174.9	58.9	-46.2	0	0	0	113.2	P488	P488-D490 VanDerWaalsContact CB-OD1 3.24Å; P488-D490 WeakPolarHBondContact CB-OD1 3.46Å; P488-D490 PolarHBondContact O-N 3.26Å
491	K	89.2	Confident	91.9	Very high	64 Å²	64	63.1 Å²	63.1	28%	0.278	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-10.5	-175.6	-57.3	-168.9	-173.7	-161.2	0	114	D467 L468 L469 P488 L493	D467-K491 VanDerWaalsContact OD2-CE 3.25Å; D467-K491 WeakPolarHBondContact OD2-CE 3.35Å; D467-K491 IonicContact OD2-NZ 2.7Å; D467-K491 PolarHBondContact OD2-NZ 3.25Å; L468-K491 CarbonylContact C-O 3.59Å; L468-K491 VanDerWaalsContact CA-O 3.28Å; L468-K491 WeakPolarHBondContact CA-O 3.37Å; L469-K491 PolarHBondContact N-O 2.92Å; P488-K491 HydrophobicContact CB-CB 4.31Å; P488-K491 HydrophobicContact CB-CD 4.29Å; P488-K491 HydrophobicContact CB-CG 4.12Å; P488-K491 HydrophobicContact CG-CD 4.23Å; P488-K491 PolarHBondContact O-N 3.38Å; K491-L493 PolarHBondContact O-N 2.68Å
492	L	91.6	Very high	92	Very high	38 Å²	38	55.7 Å²	55.7	20%	0.199	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-67.1	123.2	177.3	-178.8	66.6	0	0	0	110.1	V444 F450 R458 V487 P488	V444-L492 HydrophobicContact CG1-CD1 3.97Å; V444-L492 HydrophobicContact CG1-CD2 4.11Å; V444-L492 HydrophobicContact CG2-CD1 4.32Å; F450-L492 HydrophobicContact CE1-CD1 3.98Å; R458-L492 PolarHBondContact NE-O 3.48Å; R458-L492 PolarHBondContact NH2-O 3.44Å; V487-L492 HydrophobicContact CG1-CB 3.94Å; V487-L492 HydrophobicContact CG1-CD1 4.04Å; P488-L492 PolarHBondContact O-N 3.32Å
493	L	90.6	Very high	92.2	Very high	44 Å²	44	57 Å²	57	23%	0.23	32%	0.317	C	S	.	.			trans	-107.3	107.2	166.8	-177.1	65.9	0	0	0	108.6	V453 L468 L469 K491	V453-L493 HydrophobicContact CG2-CD2 3.69Å; L468-L493 HydrophobicContact CB-CB 4.05Å; L468-L493 HydrophobicContact CD1-CB 4.38Å; L468-L493 HydrophobicContact CD1-CD1 4.36Å; L468-L493 HydrophobicContact CD1-CD2 4.3Å; L469-L493 PolarHBondContact O-N 2.93Å; K491-L493 PolarHBondContact O-N 2.68Å
494	E	90.4	Very high	92.2	Very high	92 Å²	92	60 Å²	60	43%	0.43	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-70.1	143.1	176.6	61.4	-88.7	-152.7	0	0	111.9	R458	R458-E494 IonicContact CZ-OE2 2.97Å; R458-E494 IonicContact NH2-OE2 2.68Å; R458-E494 PolarHBondContact NH2-OE2 3.29Å
495	P	91.6	Very high	92.4	Very high	29 Å²	29	54.2 Å²	54.2	19%	0.188	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-60.5	141.3	169	-22	33.2	0	0	0	111	P440 P471	P440-P495 WeakPolarHBondContact CB-O 3.32Å; P440-P495 WeakPolarHBondContact CG-O 3.49Å; P471-P495 HydrophobicContact CG-CG 4.18Å
496	V	92.8	Very high	92.5	Very high	63 Å²	63	48.7 Å²	48.7	38%	0.382	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-72.3	155.7	173.1	-63.5	0	0	0	0	111.4	Q406 S498	Q406-V496 HydrophobicContact CB-CG1 3.98Å; V496-S498 PolarHBondContact O-N 2.86Å
497	V	94.6	Very high	92.5	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.018	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-68.8	128.1	174.7	179.8	0	0	0	0	109.7	N407 S408 A436 L437 P440 D501 M502	N407-V497 VanDerWaalsContact CA-O 3.31Å; N407-V497 WeakPolarHBondContact CA-O 3.42Å; N407-V497 HydrophobicContact CB-CB 4.31Å; N407-V497 WeakPolarHBondContact CB-O 3.46Å; S408-V497 PolarHBondContact N-O 3.32Å; A436-V497 HydrophobicContact CB-CG1 4.38Å; L437-V497 HydrophobicContact CD2-CG2 4.2Å; P440-V497 HydrophobicContact CG-CG2 3.84Å; V497-D501 HydrophobicContact CG1-CB 4.31Å; V497-M502 HydrophobicContact CG1-SD 4.42Å
498	S	94.4	Very high	92.6	Very high	23 Å²	23	52 Å²	52	16%	0.161	30%	0.295	C	S	.	.			trans	-114.6	167.6	-177.1	71	0	0	0	0	112.7	S408 V496 S500 D501 M502	S408-S498 WeakPolarHBondContact OG-CA 3.48Å; V496-S498 PolarHBondContact O-N 2.86Å; S498-S500 PolarHBondContact O-N 3.24Å; S498-S500 PolarHBondContact OG-OG 2.78Å; S498-D501 PolarHBondContact N-OD2 2.95Å; S498-D501 WeakPolarHBondContact O-CB 3.47Å; S498-D501 PolarHBondContact O-N 2.78Å; S498-D501 PolarHBondContact OG-OD2 3.33Å; S498-M502 PolarHBondContact O-N 3.32Å
499	M	94.8	Very high	92.7	Very high	29 Å²	29	50.2 Å²	50.2	14%	0.143	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-33.7	174.4	-176	55.4	168.7	0	0	112	L409 D413 E416 L417 D501 M502 L503	L409-M499 VanDerWaalsContact CD2-CA 3.46Å; L409-M499 HydrophobicContact CD2-CB 3.7Å; L409-M499 VanDerWaalsContact CD2-N 3.34Å; L409-M499 HydrophobicContact CD2-SD 4.2Å; D413-M499 HydrophobicContact CB-SD 4.17Å; E416-M499 HydrophobicContact CB-CE 4.36Å; E416-M499 HydrophobicContact CG-CE 4.32Å; L417-M499 HydrophobicContact CD1-SD 4.16Å; L417-M499 HydrophobicContact CD2-CE 3.83Å; L417-M499 HydrophobicContact CD2-SD 3.86Å; L417-M499 HydrophobicContact CG-CE 3.92Å; L417-M499 HydrophobicContact CG-SD 3.93Å; M499-D501 VanDerWaalsContact C-N 3.27Å; M499-D501 PolarHBondContact O-N 3.01Å; M499-M502 PolarHBondContact O-N 2.98Å; M499-M502 HydrophobicContact SD-CB 4.38Å; M499-L503 HydrophobicContact CE-CD1 4.32Å; M499-L503 HydrophobicContact CE-CD2 3.99Å; M499-L503 HydrophobicContact CE-CG 4.11Å; M499-L503 HydrophobicContact CG-CD1 4.19Å; M499-L503 HydrophobicContact CG-CG 4.35Å; M499-L503 WeakPolarHBondContact O-CG 3.25Å; M499-L503 PolarHBondContact O-N 3.47Å; M499-L503 HydrophobicContact SD-CG 4.3Å
500	S	94.6	Very high	92.9	Very high	73 Å²	73	55.1 Å²	55.1	51%	0.51	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-34.9	176.2	74.4	0	0	0	0	112.8	S498 R504	S498-S500 PolarHBondContact O-N 3.24Å; S498-S500 PolarHBondContact OG-OG 2.78Å; S500-R504 WeakPolarHBondContact O-CB 3.41Å; S500-R504 PolarHBondContact O-N 3.41Å
501	D	95	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.9	-40.2	178.2	-61.9	-51.3	0	0	0	110.9	Q439 K443 V497 S498 M499 R504 S505	Q439-D501 HydrophobicContact CB-CB 3.91Å; Q439-D501 WeakPolarHBondContact CB-OD1 3.28Å; Q439-D501 HydrophobicContact CG-CB 3.85Å; K443-D501 WeakPolarHBondContact CE-OD1 3.29Å; K443-D501 IonicContact NZ-OD1 3.6Å; K443-D501 PolarHBondContact NZ-OD1 2.69Å; K443-D501 IonicContact NZ-OD2 3.94Å; K443-D501 PolarHBondContact NZ-OD2 2.78Å; V497-D501 HydrophobicContact CG1-CB 4.31Å; S498-D501 PolarHBondContact N-OD2 2.95Å; S498-D501 WeakPolarHBondContact O-CB 3.47Å; S498-D501 PolarHBondContact O-N 2.78Å; S498-D501 PolarHBondContact OG-OD2 3.33Å; M499-D501 VanDerWaalsContact C-N 3.27Å; M499-D501 PolarHBondContact O-N 3.01Å; D501-R504 PolarHBondContact O-N 3.27Å; D501-S505 PolarHBondContact O-N 3.4Å
502	M	94.9	Very high	93.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-45.9	174.2	-63.5	-61.2	-69.4	0	0	111.7	F398 L409 L417 I432 V433 A436 V497 S498 M499 S505 L506	F398-M502 HydrophobicContact CD1-CE 3.3Å; F398-M502 HydrophobicContact CE1-CE 3.41Å; F398-M502 VanDerWaalsContact CE1-CE 3.41Å; F398-M502 HydrophobicContact CG-CE 4.43Å; L409-M502 HydrophobicContact CD1-CG 4Å; L409-M502 HydrophobicContact CD2-CG 4.41Å; L417-M502 HydrophobicContact CD1-CB 4.21Å; L417-M502 HydrophobicContact CD1-CE 3.82Å; L417-M502 HydrophobicContact CD1-CG 4.22Å; L417-M502 HydrophobicContact CD2-CB 3.99Å; I432-M502 HydrophobicContact CG2-CE 4.37Å; V433-M502 HydrophobicContact CG2-CE 3.95Å; A436-M502 HydrophobicContact CB-CG 4.41Å; A436-M502 HydrophobicContact CB-SD 3.31Å; A436-M502 WeakPolarHBondContact CB-SD 3.36Å; V497-M502 HydrophobicContact CG1-SD 4.42Å; S498-M502 PolarHBondContact O-N 3.32Å; M499-M502 PolarHBondContact O-N 2.98Å; M499-M502 HydrophobicContact SD-CB 4.38Å; M502-S505 PolarHBondContact O-N 2.71Å; M502-L506 WeakPolarHBondContact O-CB 3.3Å; M502-L506 PolarHBondContact O-N 3.03Å
503	L	95.4	Very high	93.4	Very high	66 Å²	66	52 Å²	52	35%	0.346	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-38.3	178.9	-70.3	176.2	0	0	0	112.4	K420 M499 S505 L506 S507	K420-L503 HydrophobicContact CD-CD2 3.95Å; M499-L503 HydrophobicContact CE-CD1 4.32Å; M499-L503 HydrophobicContact CE-CD2 3.99Å; M499-L503 HydrophobicContact CE-CG 4.11Å; M499-L503 HydrophobicContact CG-CD1 4.19Å; M499-L503 HydrophobicContact CG-CG 4.35Å; M499-L503 WeakPolarHBondContact O-CG 3.25Å; M499-L503 PolarHBondContact O-N 3.47Å; M499-L503 HydrophobicContact SD-CG 4.3Å; L503-S505 VanDerWaalsContact C-N 3.33Å; L503-L506 HydrophobicContact CD2-CD2 4.48Å; L503-L506 PolarHBondContact O-N 3.5Å; L503-S507 PolarHBondContact O-N 2.99Å
504	R	94.8	Very high	93.4	Very high	128 Å²	128	54.7 Å²	54.7	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-42.4	172.6	177.6	-175.4	-70.4	-178.2	-5.5	111.5	S500 D501 L506 S507 N508	S500-R504 WeakPolarHBondContact O-CB 3.41Å; S500-R504 PolarHBondContact O-N 3.41Å; D501-R504 PolarHBondContact O-N 3.27Å; R504-L506 VanDerWaalsContact C-N 3.32Å; R504-S507 PolarHBondContact O-N 2.87Å; R504-S507 PolarHBondContact O-OG 3.39Å; R504-N508 PolarHBondContact O-N 3.22Å; R504-N508 PolarHBondContact O-ND2 3.48Å
505	S	95.2	Very high	93.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-38.2	177.6	-168.6	0	0	0	0	111.9	I432 D435 D501 M502 L503 S507 N508 T509	I432-S505 WeakPolarHBondContact CA-OG 3.4Å; I432-S505 PolarHBondContact O-OG 2.82Å; D435-S505 WeakPolarHBondContact CB-OG 3.37Å; D435-S505 VanDerWaalsContact OD2-CB 3.3Å; D435-S505 WeakPolarHBondContact OD2-CB 3.17Å; D435-S505 PolarHBondContact OD2-OG 3.35Å; D501-S505 PolarHBondContact O-N 3.4Å; M502-S505 PolarHBondContact O-N 2.71Å; L503-S505 VanDerWaalsContact C-N 3.33Å; S505-S507 PolarHBondContact O-N 3.04Å; S505-N508 PolarHBondContact O-N 2.86Å; S505-T509 WeakPolarHBondContact O-CB 3.45Å; S505-T509 PolarHBondContact O-N 2.93Å; S505-T509 PolarHBondContact O-OG1 3.04Å
506	L	94.5	Very high	93.5	Very high	23 Å²	23	61.9 Å²	61.9	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-36.9	174.9	-175	66.4	0	0	0	112.7	K420 T421 Y424 I432 M502 L503 R504 N508 T509	K420-L506 HydrophobicContact CB-CD2 3.84Å; K420-L506 HydrophobicContact CD-CD2 4.35Å; T421-L506 HydrophobicContact CG2-CD1 3.54Å; T421-L506 HydrophobicContact CG2-CD2 4.46Å; Y424-L506 HydrophobicContact CE1-CD1 4.1Å; Y424-L506 HydrophobicContact CE2-CD1 4.37Å; I432-L506 HydrophobicContact CD1-CD1 3.79Å; M502-L506 WeakPolarHBondContact O-CB 3.3Å; M502-L506 PolarHBondContact O-N 3.03Å; L503-L506 HydrophobicContact CD2-CD2 4.48Å; L503-L506 PolarHBondContact O-N 3.5Å; R504-L506 VanDerWaalsContact C-N 3.32Å; L506-N508 VanDerWaalsContact C-N 3.26Å; L506-N508 PolarHBondContact O-N 3.36Å; L506-T509 VanDerWaalsContact O-O 3.06Å
507	S	93.6	Very high	93.4	Very high	76 Å²	76	61.4 Å²	61.4	53%	0.531	32%	0.322	S	S	.	.	H	α-helix	trans	-67.7	-29.3	177.5	62.3	0	0	0	0	113	L503 R504 S505	L503-S507 PolarHBondContact O-N 2.99Å; R504-S507 PolarHBondContact O-N 2.87Å; R504-S507 PolarHBondContact O-OG 3.39Å; S505-S507 PolarHBondContact O-N 3.04Å
508	N	92.1	Very high	93.3	Very high	112 Å²	112	63 Å²	63	60%	0.599	33%	0.33	S	S	*	.	H	α-helix	trans	-87.6	-25.2	-177.4	-65.4	-14.3	0	0	0	112.8	R504 S505 L506	R504-N508 PolarHBondContact O-N 3.22Å; R504-N508 PolarHBondContact O-ND2 3.48Å; S505-N508 PolarHBondContact O-N 2.86Å; L506-N508 VanDerWaalsContact C-N 3.26Å; L506-N508 PolarHBondContact O-N 3.36Å
509	T	92.6	Very high	93.2	Very high	21 Å²	21	66.5 Å²	66.5	13%	0.129	35%	0.346	C	S	.	.			trans	-94.9	136.4	-178.2	-50.8	0	0	0	0	110	Y424 I431 I432 S505 L506	Y424-T509 HydrophobicContact CE1-CG2 4.39Å; Y424-T509 PolarHBondContact OH-O 3.43Å; I431-T509 HydrophobicContact CG2-CG2 4.43Å; I432-T509 HydrophobicContact CD1-CG2 4.45Å; I432-T509 HydrophobicContact CG1-CG2 3.93Å; S505-T509 WeakPolarHBondContact O-CB 3.45Å; S505-T509 PolarHBondContact O-N 2.93Å; S505-T509 PolarHBondContact O-OG1 3.04Å; L506-T509 VanDerWaalsContact O-O 3.06Å
510	K	92.1	Very high	93.2	Very high	160 Å²	160	68.9 Å²	68.9	70%	0.696	36%	0.356	S	S	*	.			trans	-110.7	151.8	173	-63.2	-63.5	-177.5	-175.4	0	109.8	T512	K510-T512 PolarHBondContact O-N 2.7Å
511	P	93.3	Very high	93.1	Very high	48 Å²	48	65.5 Å²	65.5	31%	0.312	33%	0.332	S	S	.	.			trans	-58.1	137.4	173.5	-18	28.1	0	0	0	111	Y424 V513	Y424-P511 HydrophobicContact CD2-CB 4.47Å; Y424-P511 HydrophobicContact CD2-CG 3.93Å; Y424-P511 HydrophobicContact CE1-CG 4.44Å; Y424-P511 HydrophobicContact CE2-CG 3.57Å; P511-V513 VanDerWaalsContact C-N 3.34Å
512	T	91.6	Very high	92.9	Very high	87 Å²	87	71 Å²	71	53%	0.534	36%	0.356	S	S	.	.	S	Bend	trans	-76.6	-25.4	177.3	-63.6	0	0	0	0	112.2	D428 K510	D428-T512 VanDerWaalsContact OD1-CB 3.29Å; D428-T512 WeakPolarHBondContact OD1-CB 3.36Å; D428-T512 PolarHBondContact OD1-N 3.06Å; D428-T512 PolarHBondContact OD1-OG1 3.11Å; D428-T512 PolarHBondContact OD2-N 3.43Å; K510-T512 PolarHBondContact O-N 2.7Å
513	V	91.9	Very high	92.9	Very high	14 Å²	14	77.1 Å²	77.1	9%	0.085	38%	0.383	C	S	.	.	S	Bend	trans	-98.2	122.6	-172.4	-174.9	0	0	0	0	110.4	P263 P264 L388 P511 L518	P263-V513 HydrophobicContact CB-CB 4.46Å; P263-V513 HydrophobicContact CB-CG1 3.75Å; P263-V513 HydrophobicContact CB-CG2 3.85Å; P264-V513 HydrophobicContact CG-CG2 4.28Å; L388-V513 HydrophobicContact CD2-CG2 4.26Å; P511-V513 VanDerWaalsContact C-N 3.34Å; V513-L518 HydrophobicContact CG1-CD2 3.77Å; V513-L518 HydrophobicContact CG1-CG 3.96Å
514	N	92.3	Very high	92.6	Very high	102 Å²	102	74.2 Å²	74.2	55%	0.545	37%	0.367	S	S	.	.			trans	-85	153.2	178.1	-64.9	-35.3	0	0	0	111.8	H516 D517 L518	N514-H516 PolarHBondContact O-N 2.97Å; N514-D517 PolarHBondContact O-N 2.83Å; N514-D517 VanDerWaalsContact O-N 3.1Å; N514-L518 PolarHBondContact O-N 3.48Å
515	E	90.9	Very high	92.4	Very high	155 Å²	155	69.5 Å²	69.5	72%	0.724	35%	0.353	S	S	*	.	H	α-helix	trans	-59.4	-36.3	176.8	-171.9	175	-169.8	0	0	112.4	D517 L518 L519	E515-D517 VanDerWaalsContact C-N 3.3Å; E515-D517 PolarHBondContact O-N 3.3Å; E515-L518 WeakPolarHBondContact O-CB 3.37Å; E515-L518 PolarHBondContact O-N 3.35Å; E515-L518 VanDerWaalsContact O-N 3.15Å; E515-L519 WeakPolarHBondContact O-CG 3.41Å; E515-L519 PolarHBondContact O-N 2.97Å
516	H	91.6	Very high	92.2	Very high	116 Å²	116	76.9 Å²	76.9	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-35.8	176.7	179.9	-105.5	0	0	0	113.1	N514 L519 K520	N514-H516 PolarHBondContact O-N 2.97Å; H516-L519 PolarHBondContact O-N 3.48Å; H516-K520 WeakPolarHBondContact CE1-CE 3.48Å; H516-K520 PolarHBondContact CE1-NZ 3Å; H516-K520 PolarHBondContact O-N 3.26Å; H516-K520 VanDerWaalsContact O-N 3.12Å
517	D	91	Very high	91.9	Very high	54 Å²	54	80.5 Å²	80.5	29%	0.289	41%	0.407	S	S	.	.	H	α-helix	trans	-71.8	-35.4	177	-61.2	-37.8	0	0	0	110.9	N514 E515 K520 L521	N514-D517 PolarHBondContact O-N 2.83Å; N514-D517 VanDerWaalsContact O-N 3.1Å; E515-D517 VanDerWaalsContact C-N 3.3Å; E515-D517 PolarHBondContact O-N 3.3Å; D517-K520 PolarHBondContact O-N 3.3Å; D517-L521 WeakPolarHBondContact O-CG 3.32Å; D517-L521 PolarHBondContact O-N 2.95Å
518	L	91.9	Very high	91.5	Very high	37 Å²	37	80.5 Å²	80.5	19%	0.194	40%	0.397	C	S	.	.	H	α-helix	trans	-64.3	-39.9	172.4	-61.9	177.6	0	0	0	111.9	P263 L388 V513 N514 E515 L521 K522	P263-L518 HydrophobicContact CB-CD2 4.46Å; P263-L518 HydrophobicContact CG-CD2 4.17Å; L388-L518 HydrophobicContact CD1-CD1 3.9Å; L388-L518 HydrophobicContact CD1-CD2 3.92Å; L388-L518 HydrophobicContact CG-CD2 4.31Å; V513-L518 HydrophobicContact CG1-CD2 3.77Å; V513-L518 HydrophobicContact CG1-CG 3.96Å; N514-L518 PolarHBondContact O-N 3.48Å; E515-L518 WeakPolarHBondContact O-CB 3.37Å; E515-L518 PolarHBondContact O-N 3.35Å; E515-L518 VanDerWaalsContact O-N 3.15Å; L518-L521 HydrophobicContact CD2-CD1 4.5Å; L518-L521 PolarHBondContact O-N 3.48Å; L518-K522 WeakPolarHBondContact O-CG 3.19Å; L518-K522 PolarHBondContact O-N 3.44Å
519	L	93.5	Very high	90.9	Very high	95 Å²	95	76.5 Å²	76.5	50%	0.497	38%	0.382	S	S	.	.	H	α-helix	trans	-62.9	-41.3	175.5	-70.8	173.6	0	0	0	111.8	E515 H516 L521 K522 K523	E515-L519 WeakPolarHBondContact O-CG 3.41Å; E515-L519 PolarHBondContact O-N 2.97Å; H516-L519 PolarHBondContact O-N 3.48Å; L519-L521 VanDerWaalsContact C-N 3.34Å; L519-L521 PolarHBondContact O-N 3.42Å; L519-K522 PolarHBondContact O-N 3.1Å; L519-K523 WeakPolarHBondContact O-CB 3.47Å; L519-K523 PolarHBondContact O-N 2.86Å
520	K	93.6	Very high	89.8	Confident	79 Å²	79	80.2 Å²	80.2	34%	0.343	40%	0.398	S	S	.	.	H	α-helix	trans	-62.1	-41.7	174.1	-72.7	177.4	176.2	168.7	0	112.4	W370 H516 D517 K523 F524	W370-K520 HydrophobicContact CE3-CB 4.08Å; W370-K520 HydrophobicContact CH2-CB 3.78Å; W370-K520 HydrophobicContact CH2-CD 3.94Å; W370-K520 HydrophobicContact CZ2-CB 4.39Å; W370-K520 HydrophobicContact CZ2-CD 3.8Å; W370-K520 HydrophobicContact CZ3-CB 3.6Å; W370-K520 HydrophobicContact CZ3-CD 4.48Å; H516-K520 WeakPolarHBondContact CE1-CE 3.48Å; H516-K520 PolarHBondContact CE1-NZ 3Å; H516-K520 PolarHBondContact O-N 3.26Å; H516-K520 VanDerWaalsContact O-N 3.12Å; D517-K520 PolarHBondContact O-N 3.3Å; K520-K523 PolarHBondContact O-N 2.84Å; K520-F524 WeakPolarHBondContact O-CB 3.5Å; K520-F524 PolarHBondContact O-N 3.5Å
521	L	92.8	Very high	88.2	Confident	3 Å²	3	79 Å²	79	2%	0.016	40%	0.395	C	S	.	.	H	α-helix	trans	-65.8	-41.7	177.2	-72.7	166.8	0	0	0	112	F261 P263 P369 W370 Y385 D517 L518 L519 F524 T525	F261-L521 HydrophobicContact CD2-CD2 4.11Å; P263-L521 HydrophobicContact CB-CD1 4.08Å; P263-L521 HydrophobicContact CG-CD1 4.24Å; P369-L521 HydrophobicContact CG-CD2 3.97Å; W370-L521 HydrophobicContact CZ3-CD2 3.93Å; W370-L521 HydrophobicContact CZ3-CG 4.09Å; Y385-L521 HydrophobicContact CE2-CB 4.14Å; Y385-L521 HydrophobicContact CE2-CD1 4.42Å; D517-L521 WeakPolarHBondContact O-CG 3.32Å; D517-L521 PolarHBondContact O-N 2.95Å; L518-L521 HydrophobicContact CD2-CD1 4.5Å; L518-L521 PolarHBondContact O-N 3.48Å; L519-L521 VanDerWaalsContact C-N 3.34Å; L519-L521 PolarHBondContact O-N 3.42Å; L521-F524 PolarHBondContact O-N 2.81Å; L521-T525 WeakPolarHBondContact O-CB 3.33Å; L521-T525 PolarHBondContact O-N 2.88Å; L521-T525 PolarHBondContact O-OG1 3.36Å
522	K	91.4	Very high	86	Confident	116 Å²	116	80.2 Å²	80.2	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-60.3	-50.9	174	-75.2	178.1	-178.4	179.9	0	111	L518 L519 F524 T525 E526	L518-K522 WeakPolarHBondContact O-CG 3.19Å; L518-K522 PolarHBondContact O-N 3.44Å; L519-K522 PolarHBondContact O-N 3.1Å; K522-F524 VanDerWaalsContact C-N 3.32Å; K522-F524 PolarHBondContact O-N 3.45Å; K522-T525 CarbonylContact O-C 3.59Å; K522-T525 WeakPolarHBondContact O-CA 3.37Å; K522-T525 WeakPolarHBondContact O-CB 3.47Å; K522-T525 PolarHBondContact O-N 3.13Å; K522-E526 WeakPolarHBondContact O-CG 3.41Å; K522-E526 PolarHBondContact O-N 3Å
523	K	93.6	Very high	85.7	Confident	127 Å²	127	79.9 Å²	79.9	55%	0.552	41%	0.41	S	S	*	.	H	α-helix	trans	-56.6	-45.4	176.9	-174.1	176.7	-179.1	178.2	0	112	L519 K520 T525 E526 D527	L519-K523 WeakPolarHBondContact O-CB 3.47Å; L519-K523 PolarHBondContact O-N 2.86Å; K520-K523 PolarHBondContact O-N 2.84Å; K523-T525 VanDerWaalsContact C-N 3.28Å; K523-T525 PolarHBondContact O-N 3.2Å; K523-E526 PolarHBondContact O-N 2.96Å; K523-D527 WeakPolarHBondContact O-CB 3.33Å; K523-D527 PolarHBondContact O-N 2.72Å
524	F	91.1	Very high	85.4	Confident	6 Å²	6	83.3 Å²	83.3	3%	0.026	43%	0.428	C	S	.	.	H	α-helix	trans	-60.5	-39.2	175.2	-177.5	-87	0	0	0	112.3	F261 P369 W370 K520 L521 K522 F528	F261-F524 HydrophobicContact CD2-CD1 4.27Å; F261-F524 AromaticContact CE2-CD1 3.83Å; F261-F524 HydrophobicContact CE2-CD1 3.83Å; F261-F524 HydrophobicContact CE2-CE1 4.31Å; F261-F524 HydrophobicContact CZ-CD1 4.09Å; F261-F524 HydrophobicContact CZ-CE1 4.29Å; P369-F524 HydrophobicContact CB-CD1 3.87Å; P369-F524 HydrophobicContact CB-CD2 4.16Å; P369-F524 HydrophobicContact CB-CE1 3.6Å; P369-F524 HydrophobicContact CB-CE2 3.89Å; P369-F524 HydrophobicContact CB-CG 4.16Å; P369-F524 HydrophobicContact CB-CZ 3.62Å; P369-F524 HydrophobicContact CG-CB 4.4Å; P369-F524 HydrophobicContact CG-CD1 3.69Å; P369-F524 HydrophobicContact CG-CD2 4.1Å; P369-F524 HydrophobicContact CG-CE1 3.98Å; P369-F524 HydrophobicContact CG-CE2 4.34Å; P369-F524 HydrophobicContact CG-CG 3.78Å; P369-F524 HydrophobicContact CG-CZ 4.3Å; P369-F524 WeakPolarHBondContact O-CE2 3.32Å; W370-F524 HydrophobicContact CB-CD2 4.18Å; K520-F524 WeakPolarHBondContact O-CB 3.5Å; K520-F524 PolarHBondContact O-N 3.5Å; L521-F524 PolarHBondContact O-N 2.81Å; K522-F524 VanDerWaalsContact C-N 3.32Å; K522-F524 PolarHBondContact O-N 3.45Å; F524-F528 HydrophobicContact CD1-CD2 4.43Å; F524-F528 AromaticContact CD2-CD2 3.5Å; F524-F528 HydrophobicContact CD2-CD2 3.5Å; F524-F528 AromaticContact CD2-CE2 3.85Å; F524-F528 HydrophobicContact CD2-CE2 3.85Å; F524-F528 HydrophobicContact CE1-CB 4.33Å; F524-F528 HydrophobicContact CE1-CD2 4.34Å; F524-F528 AromaticContact CE2-CD2 3.42Å; F524-F528 HydrophobicContact CE2-CD2 3.42Å; F524-F528 VanDerWaalsContact CE2-CD2 3.42Å; F524-F528 AromaticContact CE2-CE2 3.82Å; F524-F528 HydrophobicContact CE2-CE2 3.82Å; F524-F528 HydrophobicContact CE2-CG 4.21Å; F524-F528 HydrophobicContact CG-CD2 4.02Å; F524-F528 HydrophobicContact CZ-CB 4.28Å; F524-F528 AromaticContact CZ-CD2 3.85Å; F524-F528 HydrophobicContact CZ-CD2 3.85Å; F524-F528 HydrophobicContact CZ-CG 4.24Å; F524-F528 WeakPolarHBondContact O-CB 3.44Å; F524-F528 WeakPolarHBondContact O-CD2 3.43Å; F524-F528 PolarHBondContact O-N 2.98Å
525	T	89.8	Confident	85	Confident	29 Å²	29	82.3 Å²	82.3	18%	0.178	42%	0.421	C	S	.	.	H	α-helix	trans	-68.7	-36.6	178.3	-51.9	0	0	0	0	111.7	F261 L521 K522 K523 G529	F261-T525 WeakPolarHBondContact CE2-OG1 3.24Å; L521-T525 WeakPolarHBondContact O-CB 3.33Å; L521-T525 PolarHBondContact O-N 2.88Å; L521-T525 PolarHBondContact O-OG1 3.36Å; K522-T525 CarbonylContact O-C 3.59Å; K522-T525 WeakPolarHBondContact O-CA 3.37Å; K522-T525 WeakPolarHBondContact O-CB 3.47Å; K522-T525 PolarHBondContact O-N 3.13Å; K523-T525 VanDerWaalsContact C-N 3.28Å; K523-T525 PolarHBondContact O-N 3.2Å; T525-G529 WeakPolarHBondContact O-CA 3.48Å; T525-G529 PolarHBondContact O-N 3.05Å
526	E	89.9	Confident	84.6	Confident	154 Å²	154	78 Å²	78	72%	0.72	40%	0.403	S	S	*	.	H	α-helix	trans	-69.3	-44	174.9	-71.1	166.4	-170.9	0	0	111.6	K522 K523	K522-E526 WeakPolarHBondContact O-CG 3.41Å; K522-E526 PolarHBondContact O-N 3Å; K523-E526 PolarHBondContact O-N 2.96Å
527	D	88.5	Confident	84.2	Confident	99 Å²	99	75.6 Å²	75.6	53%	0.529	40%	0.395	S	S	.	.	H	α-helix	trans	-70.4	-35.8	-177.3	-70.5	-18.2	0	0	0	112.7	K523	K523-D527 WeakPolarHBondContact O-CB 3.33Å; K523-D527 PolarHBondContact O-N 2.72Å
528	F	85.3	Confident	83.7	Confident	77 Å²	77	77.1 Å²	77.1	34%	0.338	40%	0.402	S	S	.	.	H	α-helix	trans	-121.5	-2.2	-169.9	-61.6	-70.2	0	0	0	115.1	R383 F524	R383-F528 PolarHBondContact NH1-O 2.96Å; F524-F528 HydrophobicContact CD1-CD2 4.43Å; F524-F528 AromaticContact CD2-CD2 3.5Å; F524-F528 HydrophobicContact CD2-CD2 3.5Å; F524-F528 AromaticContact CD2-CE2 3.85Å; F524-F528 HydrophobicContact CD2-CE2 3.85Å; F524-F528 HydrophobicContact CE1-CB 4.33Å; F524-F528 HydrophobicContact CE1-CD2 4.34Å; F524-F528 AromaticContact CE2-CD2 3.42Å; F524-F528 HydrophobicContact CE2-CD2 3.42Å; F524-F528 VanDerWaalsContact CE2-CD2 3.42Å; F524-F528 AromaticContact CE2-CE2 3.82Å; F524-F528 HydrophobicContact CE2-CE2 3.82Å; F524-F528 HydrophobicContact CE2-CG 4.21Å; F524-F528 HydrophobicContact CG-CD2 4.02Å; F524-F528 HydrophobicContact CZ-CB 4.28Å; F524-F528 AromaticContact CZ-CD2 3.85Å; F524-F528 HydrophobicContact CZ-CD2 3.85Å; F524-F528 HydrophobicContact CZ-CG 4.24Å; F524-F528 WeakPolarHBondContact O-CB 3.44Å; F524-F528 WeakPolarHBondContact O-CD2 3.43Å; F524-F528 PolarHBondContact O-N 2.98Å
529	G	79.3	Confident	83.2	Confident	27 Å²	27	79.9 Å²	79.9	28%	0.278	42%	0.417	S	S	.	.			trans	62.8	-171.8	177.6	0	0	0	0	0	115.2	T525	T525-G529 WeakPolarHBondContact O-CA 3.48Å; T525-G529 PolarHBondContact O-N 3.05Å
530	Q	69.9	Low	82.4	Confident	100 Å²	100	78.8 Å²	78.8	47%	0.467	41%	0.411	S	S	.	.	S	Bend	trans	-97.6	-8.8	170	-64.9	-171.6	1	0	0	112.8	R383	R383-Q530 PolarHBondContact N-O 3.28Å; R383-Q530 CarbonylContact O-C 3.45Å; R383-Q530 WeakPolarHBondContact O-CA 3.44Å; R383-Q530 WeakPolarHBondContact O-CB 3.19Å
531	E	59.3	Low	81.4	Confident	133 Å²	133	78.8 Å²	78.8	62%	0.621	42%	0.416	S	S	*	.	B	Isolated β-bridge	trans	-114.7	133.8	177.1	-57.2	-163.3	150.1	0	0	108.4	K382	K382-E531 IonicContact NZ-OE1 3.57Å; K382-E531 PolarHBondContact NZ-OE1 3.45Å
532	G	46.1	Very low	80.4	Confident	74 Å²	74	85.6 Å²	85.6	76%	0.763	45%	0.453	S	S	*	.			trans	-74	0	-160	0	0	0	0	0	116.4	E381 R383	E381-G532 WeakPolarHBondContact O-CA 3.47Å; E381-G532 PolarHBondContact O-N 3.02Å; R383-G532 PolarHBondContact NH1-OXT 3.08Å; R383-G532 VanDerWaalsContact NH1-OXT 3.15Å; R383-G532 PolarHBondContact NH2-OXT 3.1Å

Retrieved 532 of 532 residues in 140.6 ms (Link to these results)

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