A0A096MIV5_RAT Loading...

ATP binding cassette subfamily F member 2

AlphaFold DB , UniProt , Accession A0A096MIV5, Species RAT (Rattus norvegicus, Rat), Gene Abcf2, Length 627 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	35.7	Very low	52.9	Low	237 Å²	237	114.1 Å²	114.1	100%	1.167	62%	0.621	S	S	*	*				0	129.7	0	-63.8	-157	-170.2	0	0	108.1	S3	M1-S3 PolarHBondContact O-N 3.46Å
2	P	44.8	Very low	53.9	Low	90 Å²	90	117.8 Å²	117.8	58%	0.584	63%	0.627	S	S	*	*			trans	-61.4	134.3	177	-10.9	24.8	0	0	0	108.7	A6	P2-A6 HydrophobicContact CB-CB 4.42Å
3	S	51.3	Low	54.3	Low	76 Å²	76	117.2 Å²	117.2	53%	0.531	62%	0.615	S	S	.	*			trans	-60.2	149.5	179.6	72.8	0	0	0	0	110.7	M1 L5 A6 K7	M1-S3 PolarHBondContact O-N 3.46Å; S3-L5 PolarHBondContact O-N 3.14Å; S3-A6 WeakPolarHBondContact O-CB 3.41Å; S3-A6 PolarHBondContact O-N 3.39Å; S3-K7 PolarHBondContact O-N 2.96Å
4	D	52.8	Low	54.5	Low	126 Å²	126	115.4 Å²	115.4	67%	0.674	60%	0.6	S	S	*	*	H	α-helix	trans	-54.7	-21.3	177.8	-70.4	-37.7	0	0	0	113.1	K8	D4-K8 WeakPolarHBondContact O-CB 3.17Å; D4-K8 PolarHBondContact O-N 2.82Å
5	L	50.3	Low	54.9	Low	127 Å²	127	117.3 Å²	117.3	67%	0.665	61%	0.605	S	S	*	*	H	α-helix	trans	-71.2	-37.8	175.4	-124.9	146.8	0	0	0	112.7	S3 K9	S3-L5 PolarHBondContact O-N 3.14Å; L5-K9 PolarHBondContact O-N 3.27Å
6	A	51.7	Low	55.2	Low	49 Å²	49	113.5 Å²	113.5	41%	0.405	60%	0.596	S	S	.	*	H	α-helix	trans	-68.9	-42.5	174.3	0	0	0	0	0	111.1	P2 S3 K8 K9 A10	P2-A6 HydrophobicContact CB-CB 4.42Å; S3-A6 WeakPolarHBondContact O-CB 3.41Å; S3-A6 PolarHBondContact O-N 3.39Å; A6-K8 PolarHBondContact O-N 2.91Å; A6-K9 PolarHBondContact O-N 2.78Å; A6-A10 PolarHBondContact O-N 3.35Å
7	K	54.8	Low	55.1	Low	131 Å²	131	108.7 Å²	108.7	57%	0.57	58%	0.577	S	S	*	*	H	α-helix	trans	-61.8	-42.9	174.5	-73.6	-175.6	176.4	-179.5	0	112.2	S3 A10 A11	S3-K7 PolarHBondContact O-N 2.96Å; K7-A10 PolarHBondContact O-N 2.96Å; K7-A11 WeakPolarHBondContact O-CB 3.39Å; K7-A11 PolarHBondContact O-N 3.12Å
8	K	58.3	Low	55	Low	160 Å²	160	111.2 Å²	111.2	70%	0.696	58%	0.582	S	S	*	*	H	α-helix	trans	-65	-37.3	175.4	-85.2	-178.7	174	176.4	0	113.3	D4 A6 K12	D4-K8 WeakPolarHBondContact O-CB 3.17Å; D4-K8 PolarHBondContact O-N 2.82Å; A6-K8 PolarHBondContact O-N 2.91Å; K8-K12 PolarHBondContact O-N 3.01Å
9	K	61.8	Low	54.9	Low	153 Å²	153	109.2 Å²	109.2	67%	0.665	58%	0.583	S	S	*	*	H	α-helix	trans	-66.5	-42.7	174.7	-88.4	-172.3	174.1	-176.5	0	112	L5 A6 K12 K13	L5-K9 PolarHBondContact O-N 3.27Å; A6-K9 PolarHBondContact O-N 2.78Å; K9-K12 PolarHBondContact O-N 2.65Å; K9-K13 PolarHBondContact O-N 3.24Å
10	A	58.5	Low	54.8	Low	50 Å²	50	112.7 Å²	112.7	41%	0.413	59%	0.588	S	S	.	*	H	α-helix	trans	-62.8	-43.3	176.1	0	0	0	0	0	111.8	A6 K7 K13 K14	A6-A10 PolarHBondContact O-N 3.35Å; K7-A10 PolarHBondContact O-N 2.96Å; A10-K13 PolarHBondContact O-N 3.15Å; A10-K14 PolarHBondContact O-N 3.32Å
11	A	62.1	Low	54.5	Low	56 Å²	56	112.8 Å²	112.8	46%	0.463	59%	0.585	S	S	.	*	H	α-helix	trans	-62.1	-44.3	176.2	0	0	0	0	0	112.7	K7 K13 K14 E15	K7-A11 WeakPolarHBondContact O-CB 3.39Å; K7-A11 PolarHBondContact O-N 3.12Å; A11-K13 PolarHBondContact O-N 3.06Å; A11-K14 PolarHBondContact O-N 2.96Å; A11-E15 PolarHBondContact O-N 3.46Å
12	K	64.4	Low	54.6	Low	159 Å²	159	112.1 Å²	112.1	69%	0.691	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-39.4	174.9	-96.8	-171.3	172.2	-173.4	0	113	K8 K9 K14 E15 A16	K8-K12 PolarHBondContact O-N 3.01Å; K9-K12 PolarHBondContact O-N 2.65Å; K12-K14 VanDerWaalsContact C-N 3.34Å; K12-E15 PolarHBondContact O-N 3.24Å; K12-A16 WeakPolarHBondContact O-CB 3.5Å; K12-A16 PolarHBondContact O-N 3.05Å
13	K	59.4	Low	54	Low	109 Å²	109	113.8 Å²	113.8	47%	0.474	58%	0.581	S	S	.	*	H	α-helix	trans	-62.4	-41.4	173.8	-93	-162.8	174	-156.3	0	111.3	K9 A10 A11 E15 A16 A17 E201	K9-K13 PolarHBondContact O-N 3.24Å; A10-K13 PolarHBondContact O-N 3.15Å; A11-K13 PolarHBondContact O-N 3.06Å; K13-E15 PolarHBondContact O-N 2.65Å; K13-A16 PolarHBondContact O-N 3.13Å; K13-A17 PolarHBondContact O-N 3.38Å; K13-A17 VanDerWaalsContact O-N 3.08Å; K13-E201 IonicContact NZ-OE1 2.75Å; K13-E201 IonicContact NZ-OE2 2.74Å; K13-E201 PolarHBondContact NZ-OE2 3.42Å
14	K	57.2	Low	53.2	Low	92 Å²	92	122 Å²	122	40%	0.4	60%	0.6	S	S	.	*	H	α-helix	trans	-64.7	-38	178.7	-143.2	174	-172.2	175	0	112.4	A10 A11 K12 K18 A188	A10-K14 PolarHBondContact O-N 3.32Å; A11-K14 PolarHBondContact O-N 2.96Å; K12-K14 VanDerWaalsContact C-N 3.34Å; K14-K18 PolarHBondContact O-N 3.48Å; K14-A188 PolarHBondContact NZ-O 2.89Å
15	E	60.5	Low	52.1	Low	144 Å²	144	126.1 Å²	126.1	67%	0.673	61%	0.612	S	S	*	*	H	α-helix	trans	-70.2	-40.1	174	-79.9	-174.5	149.1	0	0	113	A11 K12 K13 A17 K18 A19	A11-E15 PolarHBondContact O-N 3.46Å; K12-E15 PolarHBondContact O-N 3.24Å; K13-E15 PolarHBondContact O-N 2.65Å; E15-A17 PolarHBondContact O-N 3.18Å; E15-K18 PolarHBondContact O-N 3.11Å; E15-A19 PolarHBondContact O-N 3.27Å; E15-A19 VanDerWaalsContact O-N 3.13Å
16	A	59	Low	51.3	Low	57 Å²	57	123.7 Å²	123.7	47%	0.471	62%	0.618	S	S	.	*	H	α-helix	trans	-65.4	-37.3	178.6	0	0	0	0	0	112.5	K12 K13 A19 R20	K12-A16 WeakPolarHBondContact O-CB 3.5Å; K12-A16 PolarHBondContact O-N 3.05Å; K13-A16 PolarHBondContact O-N 3.13Å; A16-A19 PolarHBondContact O-N 3.45Å; A16-R20 PolarHBondContact O-N 3.14Å
17	A	54.7	Low	50.4	Low	32 Å²	32	130.8 Å²	130.8	26%	0.264	64%	0.642	S	S	.	*	H	α-helix	trans	-64.1	-42.3	174.2	0	0	0	0	0	112.1	K13 E15 A19 R20	K13-A17 PolarHBondContact O-N 3.38Å; K13-A17 VanDerWaalsContact O-N 3.08Å; E15-A17 PolarHBondContact O-N 3.18Å; A17-A19 VanDerWaalsContact C-N 3.29Å; A17-A19 PolarHBondContact O-N 3.15Å; A17-R20 PolarHBondContact O-N 3.44Å
18	K	52.2	Low	49.1	Very low	153 Å²	153	133.2 Å²	133.2	67%	0.665	66%	0.655	S	S	*	*	H	α-helix	trans	-64.8	-30.2	175.8	-77.1	-176.9	175.1	-175.8	0	113.4	K14 E15	K14-K18 PolarHBondContact O-N 3.48Å; E15-K18 PolarHBondContact O-N 3.11Å
19	A	53.5	Low	48	Very low	73 Å²	73	135.1 Å²	135.1	60%	0.603	67%	0.667	S	S	*	*	H	α-helix	trans	-73.7	-25.5	179.8	0	0	0	0	0	113.5	E15 A16 A17	E15-A19 PolarHBondContact O-N 3.27Å; E15-A19 VanDerWaalsContact O-N 3.13Å; A16-A19 PolarHBondContact O-N 3.45Å; A17-A19 VanDerWaalsContact C-N 3.29Å; A17-A19 PolarHBondContact O-N 3.15Å
20	R	53.7	Low	46.5	Very low	179 Å²	179	135.7 Å²	135.7	68%	0.675	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-13.4	179.6	-75.3	-179.3	168.6	-166.1	-7	114.1	A16 A17 R22 D204	A16-R20 PolarHBondContact O-N 3.14Å; A17-R20 PolarHBondContact O-N 3.44Å; R20-R22 PolarHBondContact O-N 3.36Å; R20-D204 IonicContact CZ-OD2 3.35Å; R20-D204 IonicContact NH1-OD2 3.61Å; R20-D204 PolarHBondContact NH1-OD2 3.48Å; R20-D204 IonicContact NH2-OD2 2.71Å; R20-D204 PolarHBondContact NH2-OD2 3.34Å
21	Q	47.5	Very low	45.3	Very low	116 Å²	116	137 Å²	137	54%	0.542	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	15.7	-175.4	-75.2	-176.4	-26.8	0	0	115.8
22	R	37	Very low	43.7	Very low	222 Å²	222	142.2 Å²	142.2	84%	0.838	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-91.4	122.6	175.7	-76.1	-175.4	176.1	-176.2	-0.5	111.6	R20	R20-R22 PolarHBondContact O-N 3.36Å
23	P	33.5	Very low	42.2	Very low	125 Å²	125	139.5 Å²	139.5	81%	0.812	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-72.8	134.7	-177.7	28.5	-31.3	0	0	0	111.3	K25	P23-K25 PolarHBondContact O-N 3.22Å
24	R	33.8	Very low	40.8	Very low	248 Å²	248	140.4 Å²	140.4	94%	0.936	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-75.6	117.8	169.7	-78	-177.9	169.9	174.9	-2.5	109.1
25	K	29.3	Very low	39.7	Very low	214 Å²	214	143 Å²	143	93%	0.93	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-71.6	129.4	167.8	-78.1	-177.6	171.8	-175.9	0	109.8	P23	P23-K25 PolarHBondContact O-N 3.22Å
26	G	33.6	Very low	38.2	Very low	76 Å²	76	144.7 Å²	144.7	78%	0.784	77%	0.769	S	S	*	*			trans	-144.8	129	171.9	0	0	0	0	0	110.6
27	H	33	Very low	36.9	Very low	198 Å²	198	147.5 Å²	147.5	92%	0.917	78%	0.783	S	S	*	*			trans	-45.2	141.3	-168.9	-94.9	-92.7	0	0	0	119.3
28	E	28.1	Very low	35.9	Very low	181 Å²	181	155.4 Å²	155.4	85%	0.846	81%	0.814	S	S	*	*			trans	-83.6	140.6	158.9	-71	173.3	155.4	0	0	111
29	E	35.1	Very low	34.7	Very low	201 Å²	201	154.8 Å²	154.8	94%	0.939	82%	0.823	S	S	*	*			trans	-139.8	132.4	151.2	-105.2	-177	179.2	0	0	109.7
30	N	30	Very low	33.7	Very low	165 Å²	165	156.2 Å²	156.2	88%	0.882	83%	0.834	S	S	*	*			trans	-74.2	154.1	-170.7	-81.1	-31.1	0	0	0	114.5
31	G	34	Very low	32.5	Very low	78 Å²	78	156.2 Å²	156.2	80%	0.804	84%	0.842	S	S	*	*			trans	-176.2	86.2	162.2	0	0	0	0	0	113.2
32	D	28.7	Very low	31.7	Very low	164 Å²	164	160 Å²	160	88%	0.877	86%	0.86	S	S	*	*			trans	-66.6	137.5	169.8	-78.7	-46.4	0	0	0	112.5
33	A	33.7	Very low	31.3	Very low	103 Å²	103	158.6 Å²	158.6	85%	0.851	86%	0.86	S	S	*	*			trans	-166	120.2	138.6	0	0	0	0	0	111.5
34	V	29.7	Very low	31.1	Very low	127 Å²	127	160.5 Å²	160.5	77%	0.77	86%	0.863	S	S	*	*			trans	-84	139.6	178.6	172.3	0	0	0	0	110.4
35	T	33.3	Very low	30.9	Very low	147 Å²	147	157.5 Å²	157.5	90%	0.902	86%	0.859	S	S	*	*			trans	-160.2	133.5	142.3	-14	0	0	0	0	113.4
36	E	29.5	Very low	31.1	Very low	179 Å²	179	154.1 Å²	154.1	84%	0.836	86%	0.857	S	S	*	*			trans	-82.7	170.7	-174.5	-93.5	-178.5	169.4	0	0	115.1
37	P	31.9	Very low	30.8	Very low	117 Å²	117	158.9 Å²	158.9	76%	0.76	86%	0.864	S	S	*	*			trans	-95.8	155.3	-158.5	37.3	-32.3	0	0	0	114.1
38	Q	32.4	Very low	30.5	Very low	198 Å²	198	152.9 Å²	152.9	93%	0.925	86%	0.857	S	S	*	*			trans	-130.4	129.7	168.1	-77.3	-171.7	-10	0	0	112.6
39	V	28.6	Very low	30.4	Very low	140 Å²	140	156.1 Å²	156.1	85%	0.848	86%	0.861	S	S	*	*			trans	-80.9	136	171.3	176.6	0	0	0	0	108.6
40	A	32.1	Very low	30	Very low	102 Å²	102	155.4 Å²	155.4	84%	0.843	86%	0.858	S	S	*	*			trans	-147.6	119.1	159.5	0	0	0	0	0	110.1
41	E	27.3	Very low	29.9	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	86%	0.859	S	S	*	*			trans	-69.1	140	165.1	-62.4	174	141.5	0	0	109.5
42	E	31.5	Very low	29.8	Very low	197 Å²	197	156.3 Å²	156.3	92%	0.921	85%	0.854	S	S	*	*				-171.4	150.4	127.6	-108.4	178.1	177.8	0	0	113.4
43	K	27.9	Very low	30.2	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	84%	0.837	S	S	*	*			trans	-69.2	145.1	-168	-64.5	156.3	175.3	172.6	0	113
44	N	30.5	Very low	30.5	Very low	164 Å²	164	152 Å²	152	88%	0.877	83%	0.828	S	S	*	*				-165	132.7	126.3	-105.7	-21.5	0	0	0	112.7
45	E	29.2	Very low	30.7	Very low	185 Å²	185	148 Å²	148	86%	0.864	81%	0.812	S	S	*	*			trans	-65.3	136.8	172.2	-64.6	172.3	148.5	0	0	110.5
46	T	32.2	Very low	31.1	Very low	143 Å²	143	147.9 Å²	147.9	88%	0.877	80%	0.802	S	S	*	*			trans	-167.9	128.1	144.9	12.7	0	0	0	0	110.7	G48	T46-G48 PolarHBondContact O-N 3.19Å
47	N	27.6	Very low	32	Very low	176 Å²	176	141.5 Å²	141.5	94%	0.941	78%	0.775	S	S	*	*			trans	-54	127	178.2	-71.9	-43.1	0	0	0	112.7
48	G	28.2	Very low	32.9	Very low	73 Å²	73	140.8 Å²	140.8	75%	0.753	77%	0.765	S	S	*	*			trans	-165.6	106.6	176	0	0	0	0	0	112	T46 E50	T46-G48 PolarHBondContact O-N 3.19Å; G48-E50 PolarHBondContact O-N 2.97Å
49	R	26.1	Very low	34.1	Very low	249 Å²	249	136.5 Å²	136.5	94%	0.94	75%	0.748	S	S	*	*			trans	-53.6	122.9	173.5	-133.4	173.4	-175.6	164.5	-0.7	111.1
50	E	26.5	Very low	35.3	Very low	186 Å²	186	134.7 Å²	134.7	87%	0.869	73%	0.733	S	S	*	*			trans	-176.1	80.7	151.9	-105.1	171.7	-153.9	0	0	109.1	G48 T52	G48-E50 PolarHBondContact O-N 2.97Å; E50-T52 PolarHBondContact O-N 2.71Å
51	T	28.2	Very low	36.7	Very low	147 Å²	147	132.1 Å²	132.1	90%	0.902	71%	0.706	S	S	*	*			trans	-86.2	104.8	171.1	40.7	0	0	0	0	109.3
52	T	30.1	Very low	38.5	Very low	114 Å²	114	129.9 Å²	129.9	70%	0.699	69%	0.694	S	S	*	*			trans	-69.5	133.9	171.7	40.9	0	0	0	0	110.6	E50 D54	E50-T52 PolarHBondContact O-N 2.71Å; T52-D54 PolarHBondContact O-N 2.8Å
53	G	38.8	Very low	40	Very low	51 Å²	51	126.5 Å²	126.5	53%	0.526	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.3	4.6	-168.4	0	0	0	0	0	117.7
54	D	39.2	Very low	41.6	Very low	126 Å²	126	122.3 Å²	122.3	67%	0.674	67%	0.665	S	S	*	*	H	α-helix	trans	-76.3	-29.3	179.9	-69.9	-27.7	0	0	0	112.4	T52 D58	T52-D54 PolarHBondContact O-N 2.8Å; D54-D58 PolarHBondContact O-N 2.9Å
55	G	34.6	Very low	43.4	Very low	42 Å²	42	118.9 Å²	118.9	43%	0.433	64%	0.643	S	S	.	*	H	α-helix	trans	-69.6	-34.9	-178.8	0	0	0	0	0	114.7	L59	G55-L59 WeakPolarHBondContact O-CD1 3.33Å; G55-L59 WeakPolarHBondContact O-CG 3.29Å; G55-L59 PolarHBondContact O-N 3.35Å
56	E	40.4	Very low	45.2	Very low	145 Å²	145	114 Å²	114	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-71.9	-35.2	178.2	-77.8	-176.9	161.5	0	0	112.2	L59 L60	E56-L59 PolarHBondContact O-N 3.37Å; E56-L60 PolarHBondContact O-N 3.12Å
57	V	49.5	Very low	46.8	Very low	45 Å²	45	112.6 Å²	112.6	27%	0.273	61%	0.605	S	S	.	*	H	α-helix	trans	-67.4	-44.6	177.2	177.6	0	0	0	0	110.5	L59 L60 T61 P157	V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 3.05Å; V57-L60 PolarHBondContact O-N 2.87Å; V57-T61 WeakPolarHBondContact O-CB 3.25Å; V57-T61 PolarHBondContact O-N 2.92Å; V57-T61 PolarHBondContact O-OG1 3.42Å; V57-P157 HydrophobicContact CB-CG 4.48Å; V57-P157 HydrophobicContact CG1-CG 3.6Å; V57-P157 HydrophobicContact CG2-CG 3.97Å
58	D	50.7	Low	48.6	Very low	102 Å²	102	106.3 Å²	106.3	55%	0.545	57%	0.57	S	S	.	*	H	α-helix	trans	-62.9	-37.7	177.2	-87.3	-4.9	0	0	0	112.2	D54 K62	D54-D58 PolarHBondContact O-N 2.9Å; D58-K62 WeakPolarHBondContact O-CB 3.14Å; D58-K62 WeakPolarHBondContact O-CG 3.41Å; D58-K62 PolarHBondContact O-N 3.09Å
59	L	56.5	Low	50.5	Low	109 Å²	109	108.4 Å²	108.4	57%	0.571	56%	0.562	S	S	*	*	H	α-helix	trans	-64.6	-50.5	175.4	-78.6	163.7	0	0	0	111.9	G55 E56 V57 T61 K62 E63	G55-L59 WeakPolarHBondContact O-CD1 3.33Å; G55-L59 WeakPolarHBondContact O-CG 3.29Å; G55-L59 PolarHBondContact O-N 3.35Å; E56-L59 PolarHBondContact O-N 3.37Å; V57-L59 VanDerWaalsContact C-N 3.31Å; V57-L59 PolarHBondContact O-N 3.05Å; L59-T61 VanDerWaalsContact C-N 3.28Å; L59-T61 PolarHBondContact O-N 3.08Å; L59-K62 PolarHBondContact O-N 3.13Å; L59-E63 WeakPolarHBondContact O-CG 3.41Å; L59-E63 PolarHBondContact O-N 3.04Å
60	L	55	Low	52.6	Low	102 Å²	102	103.4 Å²	103.4	53%	0.534	55%	0.547	S	S	.	.	H	α-helix	trans	-59.8	-39.5	177.1	-81.7	160.2	0	0	0	112.1	E56 V57 E63 L64	E56-L60 PolarHBondContact O-N 3.12Å; V57-L60 PolarHBondContact O-N 2.87Å; L60-E63 PolarHBondContact O-N 2.82Å; L60-L64 WeakPolarHBondContact O-CD1 3.37Å; L60-L64 VanDerWaalsContact O-CG 3.3Å; L60-L64 WeakPolarHBondContact O-CG 3.42Å; L60-L64 PolarHBondContact O-N 2.94Å; L60-L64 VanDerWaalsContact O-N 3.09Å
61	T	60.5	Low	54.7	Low	47 Å²	47	98.2 Å²	98.2	29%	0.288	52%	0.521	S	S	.	.	H	α-helix	trans	-65.6	-43.9	178.8	-47.9	0	0	0	0	110.8	V57 L59 L64 E65	V57-T61 WeakPolarHBondContact O-CB 3.25Å; V57-T61 PolarHBondContact O-N 2.92Å; V57-T61 PolarHBondContact O-OG1 3.42Å; L59-T61 VanDerWaalsContact C-N 3.28Å; L59-T61 PolarHBondContact O-N 3.08Å; T61-L64 PolarHBondContact O-N 3.01Å; T61-E65 WeakPolarHBondContact O-CG 3.35Å; T61-E65 PolarHBondContact O-N 2.78Å
62	K	66.2	Low	56.7	Low	133 Å²	133	92.6 Å²	92.6	58%	0.578	49%	0.489	S	S	*	.	H	α-helix	trans	-62.5	-44.6	174.3	-78.4	176.2	178.3	172.7	0	112.7	D58 L59 L64 E65 D66	D58-K62 WeakPolarHBondContact O-CB 3.14Å; D58-K62 WeakPolarHBondContact O-CG 3.41Å; D58-K62 PolarHBondContact O-N 3.09Å; L59-K62 PolarHBondContact O-N 3.13Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 2.91Å; K62-E65 PolarHBondContact O-N 3.17Å; K62-D66 PolarHBondContact O-N 3.49Å
63	E	63.4	Low	58.8	Low	126 Å²	126	91.5 Å²	91.5	59%	0.589	49%	0.492	S	S	*	.	H	α-helix	trans	-60.1	-39.1	178.2	-75.3	-177.1	171.6	0	0	112.3	L59 L60 F67	L59-E63 WeakPolarHBondContact O-CG 3.41Å; L59-E63 PolarHBondContact O-N 3.04Å; L60-E63 PolarHBondContact O-N 2.82Å; E63-F67 WeakPolarHBondContact O-CB 3.29Å; E63-F67 PolarHBondContact O-N 3.05Å
64	L	60.4	Low	60.6	Low	104 Å²	104	90.3 Å²	90.3	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-69.9	-38.2	176	-72.1	166.8	0	0	0	112.5	L60 T61 K62 F67 E68	L60-L64 WeakPolarHBondContact O-CD1 3.37Å; L60-L64 VanDerWaalsContact O-CG 3.3Å; L60-L64 WeakPolarHBondContact O-CG 3.42Å; L60-L64 PolarHBondContact O-N 2.94Å; L60-L64 VanDerWaalsContact O-N 3.09Å; T61-L64 PolarHBondContact O-N 3.01Å; K62-L64 VanDerWaalsContact C-N 3.28Å; K62-L64 PolarHBondContact O-N 2.91Å; L64-F67 PolarHBondContact O-N 3.5Å; L64-E68 PolarHBondContact O-N 2.84Å
65	E	67.4	Low	62.8	Low	91 Å²	91	85.4 Å²	85.4	43%	0.425	45%	0.449	S	S	.	.	H	α-helix	trans	-63.1	-44.8	172.4	-75.3	178.4	178.3	0	0	112	T61 K62 F67 E68 M69	T61-E65 WeakPolarHBondContact O-CG 3.35Å; T61-E65 PolarHBondContact O-N 2.78Å; K62-E65 PolarHBondContact O-N 3.17Å; E65-F67 VanDerWaalsContact C-N 3.32Å; E65-F67 PolarHBondContact O-N 3.45Å; E65-E68 PolarHBondContact O-N 2.84Å; E65-M69 PolarHBondContact O-N 2.9Å
66	D	67.8	Low	65.4	Low	82 Å²	82	86 Å²	86	44%	0.439	45%	0.45	S	S	.	.	H	α-helix	trans	-60.8	-41.4	174.5	-79.3	-13.3	0	0	0	111.6	K62 E68 M69 K70	K62-D66 PolarHBondContact O-N 3.49Å; D66-E68 VanDerWaalsContact C-N 3.35Å; D66-M69 PolarHBondContact O-N 3.31Å; D66-M69 WeakPolarHBondContact OD1-CE 3.4Å; D66-K70 WeakPolarHBondContact O-CB 3.3Å; D66-K70 VanDerWaalsContact O-CG 3.26Å; D66-K70 WeakPolarHBondContact O-CG 3.24Å; D66-K70 PolarHBondContact O-N 3.09Å
67	F	65.4	Low	67.8	Low	114 Å²	114	80.4 Å²	80.4	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-40.3	176.1	-174.7	-111.5	0	0	0	112.2	E63 L64 E65 K70 K71	E63-F67 WeakPolarHBondContact O-CB 3.29Å; E63-F67 PolarHBondContact O-N 3.05Å; L64-F67 PolarHBondContact O-N 3.5Å; E65-F67 VanDerWaalsContact C-N 3.32Å; E65-F67 PolarHBondContact O-N 3.45Å; F67-K70 PolarHBondContact O-N 2.96Å; F67-K71 HydrophobicContact CD1-CD 4.39Å; F67-K71 HydrophobicContact CE1-CD 4.08Å; F67-K71 VanDerWaalsContact CE1-NZ 3.34Å; F67-K71 PolarHBondContact O-N 3.14Å
68	E	66.4	Low	69.9	Low	45 Å²	45	82.4 Å²	82.4	21%	0.21	44%	0.438	C	S	.	.	H	α-helix	trans	-69.8	-39	174.9	-90.8	-158.7	-140.9	0	0	113.7	L64 E65 D66 K70 K71 A72 K137 R153	L64-E68 PolarHBondContact O-N 2.84Å; E65-E68 PolarHBondContact O-N 2.84Å; D66-E68 VanDerWaalsContact C-N 3.35Å; E68-K70 VanDerWaalsContact C-N 3.3Å; E68-K70 PolarHBondContact O-N 2.83Å; E68-K71 WeakPolarHBondContact O-CB 3.37Å; E68-K71 PolarHBondContact O-N 2.83Å; E68-A72 WeakPolarHBondContact O-CB 3.32Å; E68-A72 PolarHBondContact O-N 2.8Å; E68-K137 IonicContact OE2-NZ 3.23Å; E68-K137 PolarHBondContact OE2-NZ 3.43Å; E68-R153 IonicContact OE1-CZ 2.65Å; E68-R153 IonicContact OE1-NE 3.48Å; E68-R153 PolarHBondContact OE1-NE 2.88Å; E68-R153 IonicContact OE1-NH2 2.88Å; E68-R153 PolarHBondContact OE1-NH2 3.17Å; E68-R153 IonicContact OE2-NH2 2.79Å; E68-R153 PolarHBondContact OE2-NH2 2.96Å
69	M	67.8	Low	71.8	Confident	117 Å²	117	78.7 Å²	78.7	58%	0.576	42%	0.424	S	S	*	.	H	α-helix	trans	-61.2	-42.1	173.4	-81.4	-162.9	-80.3	0	0	110.7	E65 D66 K71 A72 A73	E65-M69 PolarHBondContact O-N 2.9Å; D66-M69 PolarHBondContact O-N 3.31Å; D66-M69 WeakPolarHBondContact OD1-CE 3.4Å; M69-K71 PolarHBondContact O-N 3.31Å; M69-A72 PolarHBondContact O-N 2.96Å; M69-A73 WeakPolarHBondContact O-CB 3.21Å; M69-A73 PolarHBondContact O-N 2.85Å
70	K	69.2	Low	73.6	Confident	144 Å²	144	77.4 Å²	77.4	63%	0.626	42%	0.42	S	S	*	.	H	α-helix	trans	-60.4	-42.5	173.5	-74.4	170.8	-175.2	170.8	0	112.1	D66 F67 E68 A73 A74	D66-K70 WeakPolarHBondContact O-CB 3.3Å; D66-K70 VanDerWaalsContact O-CG 3.26Å; D66-K70 WeakPolarHBondContact O-CG 3.24Å; D66-K70 PolarHBondContact O-N 3.09Å; F67-K70 PolarHBondContact O-N 2.96Å; E68-K70 VanDerWaalsContact C-N 3.3Å; E68-K70 PolarHBondContact O-N 2.83Å; K70-A73 PolarHBondContact O-N 2.87Å; K70-A74 WeakPolarHBondContact O-CB 3.36Å; K70-A74 PolarHBondContact O-N 3.04Å; K70-A74 VanDerWaalsContact O-N 3.16Å
71	K	70.6	Confident	75.4	Confident	77 Å²	77	74.8 Å²	74.8	34%	0.335	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-44.2	174.3	-78.2	-178.7	171	176.2	0	112.1	F67 E68 M69 A74 R75 F99	F67-K71 HydrophobicContact CD1-CD 4.39Å; F67-K71 HydrophobicContact CE1-CD 4.08Å; F67-K71 VanDerWaalsContact CE1-NZ 3.34Å; F67-K71 PolarHBondContact O-N 3.14Å; E68-K71 WeakPolarHBondContact O-CB 3.37Å; E68-K71 PolarHBondContact O-N 2.83Å; M69-K71 PolarHBondContact O-N 3.31Å; K71-A74 PolarHBondContact O-N 3.26Å; K71-R75 PolarHBondContact O-N 3.2Å; K71-F99 HydrophobicContact CB-CE2 4.35Å; K71-F99 HydrophobicContact CG-CE2 4.49Å; K71-F99 HydrophobicContact CG-CZ 4.29Å; K71-F99 WeakPolarHBondContact O-CE2 3.4Å
72	A	71.8	Confident	76.9	Confident	28 Å²	28	75.2 Å²	75.2	23%	0.231	42%	0.415	C	S	.	.	H	α-helix	trans	-64.5	-43.4	178.9	0	0	0	0	0	111.5	E68 M69 A74 R75	E68-A72 WeakPolarHBondContact O-CB 3.32Å; E68-A72 PolarHBondContact O-N 2.8Å; M69-A72 PolarHBondContact O-N 2.96Å; A72-A74 PolarHBondContact O-N 3Å; A72-R75 PolarHBondContact O-N 2.87Å; A72-R75 VanDerWaalsContact O-N 3.09Å
73	A	73	Confident	78	Confident	92 Å²	92	69.6 Å²	69.6	76%	0.76	39%	0.393	S	S	*	.	H	α-helix	trans	-63	-28.7	177.4	0	0	0	0	0	113.3	M69 K70 R75	M69-A73 WeakPolarHBondContact O-CB 3.21Å; M69-A73 PolarHBondContact O-N 2.85Å; K70-A73 PolarHBondContact O-N 2.87Å; A73-R75 VanDerWaalsContact C-N 3.31Å
74	A	77.8	Confident	79.1	Confident	25 Å²	25	69.5 Å²	69.5	21%	0.207	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-4.5	177.7	0	0	0	0	0	114.3	K70 K71 A72 F99 H100	K70-A74 WeakPolarHBondContact O-CB 3.36Å; K70-A74 PolarHBondContact O-N 3.04Å; K70-A74 VanDerWaalsContact O-N 3.16Å; K71-A74 PolarHBondContact O-N 3.26Å; A72-A74 PolarHBondContact O-N 3Å; A74-F99 HydrophobicContact CB-CD2 4.2Å; A74-F99 HydrophobicContact CB-CE2 3.9Å; A74-F99 WeakPolarHBondContact O-CA 3.49Å; A74-H100 WeakPolarHBondContact CB-CE1 3.42Å; A74-H100 WeakPolarHBondContact CB-ND1 3.39Å; A74-H100 PolarHBondContact O-N 3.45Å
75	R	84.2	Confident	80.2	Confident	23 Å²	23	68.3 Å²	68.3	9%	0.087	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.8	-174.9	-179.2	171.1	55.6	178.3	3.7	110.6	K71 A72 A73 V77 L97 T98 F99 M130 S133 E139	K71-R75 PolarHBondContact O-N 3.2Å; A72-R75 PolarHBondContact O-N 2.87Å; A72-R75 VanDerWaalsContact O-N 3.09Å; A73-R75 VanDerWaalsContact C-N 3.31Å; R75-V77 HydrophobicContact CG-CG2 3.88Å; R75-L97 HydrophobicContact CG-CD1 3.72Å; R75-T98 WeakPolarHBondContact CA-O 3.31Å; R75-F99 HydrophobicContact CB-CD2 4.14Å; R75-M130 PolarHBondContact NH1-O 2.88Å; R75-S133 PolarHBondContact NH2-O 2.81Å; R75-E139 IonicContact CZ-OE1 3.67Å; R75-E139 IonicContact CZ-OE2 3.43Å; R75-E139 IonicContact NE-OE1 3.84Å; R75-E139 PolarHBondContact NE-OE1 3.13Å; R75-E139 IonicContact NE-OE2 3.35Å; R75-E139 PolarHBondContact NE-OE2 3.44Å; R75-E139 IonicContact NH1-OE2 2.84Å; R75-E139 IonicContact NH2-OE1 3.49Å; R75-E139 PolarHBondContact NH2-OE1 2.79Å; R75-E139 IonicContact NH2-OE2 3.58Å; R75-E139 PolarHBondContact NH2-OE2 2.93Å
76	A	88.7	Confident	80.7	Confident	54 Å²	54	68.8 Å²	68.8	45%	0.446	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	133.3	168.4	0	0	0	0	0	110	T98	A76-T98 WeakPolarHBondContact CB-OG1 3.44Å; A76-T98 PolarHBondContact N-O 2.82Å; A76-T98 PolarHBondContact O-N 3.4Å; A76-T98 PolarHBondContact O-OG1 2.86Å
77	V	91.2	Very high	81.6	Confident	29 Å²	29	66.3 Å²	66.3	18%	0.176	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	135	-176.3	-160.3	0	0	0	0	109.2	R75 L95 S96 L97 A134 E139 V140	R75-V77 HydrophobicContact CG-CG2 3.88Å; V77-L95 HydrophobicContact CG1-CD1 3.82Å; V77-S96 WeakPolarHBondContact CA-O 3.5Å; V77-L97 HydrophobicContact CB-CD1 4.43Å; V77-L97 HydrophobicContact CG1-CD1 4.36Å; V77-L97 HydrophobicContact CG2-CD1 3.56Å; V77-A134 HydrophobicContact CG2-CB 4Å; V77-E139 HydrophobicContact CB-CB 4.38Å; V77-E139 HydrophobicContact CG2-CB 4.06Å; V77-E139 WeakPolarHBondContact CG2-OE2 3.24Å; V77-V140 HydrophobicContact CG1-CG1 3.55Å
78	T	93	Very high	82.6	Confident	87 Å²	87	62.9 Å²	62.9	53%	0.534	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.4	171.1	61.4	0	0	0	0	109.1	L95 S96	T78-L95 CarbonylContact O-C 3.57Å; T78-L95 WeakPolarHBondContact O-CA 3.48Å; T78-L95 WeakPolarHBondContact O-CD1 3.28Å; T78-S96 PolarHBondContact N-O 3.3Å; T78-S96 PolarHBondContact O-N 2.95Å; T78-S96 WeakPolarHBondContact OG1-CB 3.19Å
79	G	91.9	Very high	83.8	Confident	24 Å²	24	63 Å²	63	25%	0.247	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.2	154.9	176.6	0	0	0	0	0	111
80	V	93.4	Very high	85	Confident	81 Å²	81	57.5 Å²	57.5	49%	0.491	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.8	-179.8	-178	0	0	0	0	109.1	A82 I92 I93	V80-A82 PolarHBondContact O-N 2.93Å; V80-I92 CarbonylContact O-C 3.48Å; V80-I92 WeakPolarHBondContact O-CA 3.3Å; V80-I93 HydrophobicContact CB-CG1 4.06Å; V80-I93 PolarHBondContact N-O 2.87Å; V80-I93 WeakPolarHBondContact O-CG1 3.48Å; V80-I93 PolarHBondContact O-N 3.35Å
81	L	93.2	Very high	86.2	Confident	47 Å²	47	53.3 Å²	53.3	25%	0.246	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	117.6	174	-176.8	67.4	0	0	0	109.2	S83 I92 P141 P143	L81-S83 WeakPolarHBondContact CD1-OG 3.21Å; L81-I92 HydrophobicContact CD1-CG1 4.38Å; L81-P141 HydrophobicContact CB-CB 4.12Å; L81-P141 HydrophobicContact CB-CG 4.03Å; L81-P141 WeakPolarHBondContact CD1-O 3.39Å; L81-P143 HydrophobicContact CD2-CG 3.94Å
82	A	92.7	Very high	87.4	Confident	56 Å²	56	49.7 Å²	49.7	46%	0.463	32%	0.315	S	S	.	.			trans	-97.3	-25.3	177.2	0	0	0	0	0	112.7	V80 H91 I93	V80-A82 PolarHBondContact O-N 2.93Å; A82-H91 HydrophobicContact CB-CB 4.38Å; A82-H91 PolarHBondContact N-O 3.45Å; A82-I93 HydrophobicContact CB-CD1 4.25Å; A82-I93 HydrophobicContact CB-CG1 4.15Å; A82-I93 HydrophobicContact CB-CG2 3.82Å
83	S	89.5	Confident	88.5	Confident	16 Å²	16	52 Å²	52	11%	0.112	32%	0.323	C	S	.	.	S	Bend	trans	-73.7	154.3	174.1	56	0	0	0	0	111.5	L81 D89 H91	L81-S83 WeakPolarHBondContact CD1-OG 3.21Å; S83-D89 VanDerWaalsContact CB-O 3.24Å; S83-D89 WeakPolarHBondContact CB-O 3.12Å; S83-D89 PolarHBondContact OG-O 3.34Å; S83-H91 PolarHBondContact N-O 3.01Å; S83-H91 PolarHBondContact OG-N 3.45Å; S83-H91 VanDerWaalsContact OG-N 3.12Å
84	H	85.9	Confident	89.5	Confident	123 Å²	123	52 Å²	52	57%	0.569	31%	0.31	S	S	*	.			trans	-58.4	138.9	176.6	-171.7	-90.6	0	0	0	109.9	N86 S87	H84-N86 PolarHBondContact ND1-N 3.31Å; H84-N86 VanDerWaalsContact ND1-N 3.12Å; H84-N86 PolarHBondContact O-N 2.88Å; H84-S87 WeakPolarHBondContact O-CB 3.4Å; H84-S87 PolarHBondContact O-N 2.87Å
85	P	82.9	Confident	90.3	Very high	80 Å²	80	50.8 Å²	50.8	52%	0.519	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.3	-178.2	-27.9	35.4	0	0	0	113.9	H145	P85-H145 PolarHBondContact O-CE1 2.91Å; P85-H145 PolarHBondContact O-ND1 3.23Å
86	N	79	Confident	90.8	Very high	100 Å²	100	50.5 Å²	50.5	54%	0.535	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	0.7	174.6	-66.5	-23.2	0	0	0	114.7	H84 K192	H84-N86 PolarHBondContact ND1-N 3.31Å; H84-N86 VanDerWaalsContact ND1-N 3.12Å; H84-N86 PolarHBondContact O-N 2.88Å; N86-K192 WeakPolarHBondContact O-CE 3.25Å; N86-K192 PolarHBondContact O-NZ 3.42Å
87	S	85.6	Confident	91	Very high	31 Å²	31	48 Å²	48	22%	0.217	28%	0.281	C	S	.	.			trans	-68.5	150	178.2	-168	0	0	0	0	111.3	H84 D89 H145	H84-S87 WeakPolarHBondContact O-CB 3.4Å; H84-S87 PolarHBondContact O-N 2.87Å; S87-D89 VanDerWaalsContact C-N 3.3Å; S87-D89 PolarHBondContact OG-N 2.85Å; S87-H145 PolarHBondContact O-CE1 2.89Å; S87-H145 PolarHBondContact O-NE2 3.47Å
88	T	86	Confident	91	Very high	42 Å²	42	48.8 Å²	48.8	26%	0.258	29%	0.286	S	S	.	.	S	Bend	trans	-79.6	-17.5	165.8	44.9	0	0	0	0	112.2	F252	T88-F252 HydrophobicContact CG2-CE1 4.41Å; T88-F252 HydrophobicContact CG2-CE2 3.99Å; T88-F252 HydrophobicContact CG2-CZ 3.5Å; T88-F252 VanDerWaalsContact CG2-CZ 3.5Å; T88-F252 WeakPolarHBondContact O-CE1 3.37Å
89	D	91.8	Very high	90.7	Very high	48 Å²	48	46.7 Å²	46.7	26%	0.257	27%	0.269	S	S	.	.	S	Bend	trans	-88.2	138.8	175.5	-60.1	-28.6	0	0	0	111.3	S83 S87 N113 S114	S83-D89 VanDerWaalsContact CB-O 3.24Å; S83-D89 WeakPolarHBondContact CB-O 3.12Å; S83-D89 PolarHBondContact OG-O 3.34Å; S87-D89 VanDerWaalsContact C-N 3.3Å; S87-D89 PolarHBondContact OG-N 2.85Å; D89-N113 WeakPolarHBondContact OD1-CA 3.34Å; D89-S114 PolarHBondContact OD1-N 3.38Å
90	V	93.3	Very high	90.2	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	104.8	178.8	-179.1	0	0	0	0	109.6	I92 L112 I142 I146 M253 I281	V90-I92 HydrophobicContact CG1-CD1 4.03Å; V90-I92 HydrophobicContact CG1-CG1 4.01Å; V90-L112 HydrophobicContact CB-CB 4.28Å; V90-L112 PolarHBondContact N-O 2.89Å; V90-L112 PolarHBondContact O-N 3.42Å; V90-I142 HydrophobicContact CG1-CG1 4.26Å; V90-I142 HydrophobicContact CG2-CG2 4.33Å; V90-I146 HydrophobicContact CG2-CD1 3.24Å; V90-M253 HydrophobicContact CB-CE 4.36Å; V90-M253 HydrophobicContact CG2-CE 3.84Å; V90-I281 HydrophobicContact CG2-CD1 4.4Å
91	H	95.5	Very high	89.5	Confident	55 Å²	55	52.1 Å²	52.1	26%	0.255	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	115.2	178.9	-67.1	-157.3	0	0	0	108.6	A82 S83 L110 N113	A82-H91 HydrophobicContact CB-CB 4.38Å; A82-H91 PolarHBondContact N-O 3.45Å; S83-H91 PolarHBondContact N-O 3.01Å; S83-H91 PolarHBondContact OG-N 3.45Å; S83-H91 VanDerWaalsContact OG-N 3.12Å; H91-L110 CarbonylContact C-O 3.46Å; H91-L110 WeakPolarHBondContact CA-O 3.45Å; H91-N113 PolarHBondContact NE2-OD1 2.86Å
92	I	94.8	Very high	89	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	125	-179	-53.1	-176.8	0	0	0	108.1	V80 L81 V90 L95 K109 L110 V140 P141 I142	V80-I92 CarbonylContact O-C 3.48Å; V80-I92 WeakPolarHBondContact O-CA 3.3Å; L81-I92 HydrophobicContact CD1-CG1 4.38Å; V90-I92 HydrophobicContact CG1-CD1 4.03Å; V90-I92 HydrophobicContact CG1-CG1 4.01Å; I92-L95 HydrophobicContact CG2-CB 4.5Å; I92-K109 CarbonylContact O-C 3.14Å; I92-K109 VanDerWaalsContact O-CA 3.27Å; I92-K109 WeakPolarHBondContact O-CA 3.21Å; I92-L110 HydrophobicContact CB-CB 4.28Å; I92-L110 HydrophobicContact CD1-CD2 4.33Å; I92-L110 PolarHBondContact N-O 3.33Å; I92-L110 PolarHBondContact O-N 2.85Å; I92-V140 HydrophobicContact CD1-CB 3.71Å; I92-V140 HydrophobicContact CD1-CG2 4.01Å; I92-P141 HydrophobicContact CD1-CG 4.37Å; I92-P141 HydrophobicContact CG2-CG 4.4Å; I92-I142 HydrophobicContact CD1-CG1 4.46Å
93	I	95.2	Very high	88.8	Confident	76 Å²	76	56.7 Å²	56.7	39%	0.39	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	159.7	177.4	61.3	173.7	0	0	0	110.4	V80 A82 L95	V80-I93 HydrophobicContact CB-CG1 4.06Å; V80-I93 PolarHBondContact N-O 2.87Å; V80-I93 WeakPolarHBondContact O-CG1 3.48Å; V80-I93 PolarHBondContact O-N 3.35Å; A82-I93 HydrophobicContact CB-CD1 4.25Å; A82-I93 HydrophobicContact CB-CG1 4.15Å; A82-I93 HydrophobicContact CB-CG2 3.82Å; I93-L95 PolarHBondContact O-N 3.35Å
94	N	94.1	Very high	88.9	Confident	92 Å²	92	56.6 Å²	56.6	49%	0.492	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.9	38.8	-179.6	-53.1	-21.3	0	0	0	112.5	S96 T108	N94-S96 PolarHBondContact O-N 3.49Å; N94-T108 PolarHBondContact N-O 2.75Å
95	L	94.9	Very high	89.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.6	176	177.6	66.4	0	0	0	109.2	V77 T78 I92 I93 L105 D107 T108 L110 L131 V140 L307	V77-L95 HydrophobicContact CG1-CD1 3.82Å; T78-L95 CarbonylContact O-C 3.57Å; T78-L95 WeakPolarHBondContact O-CA 3.48Å; T78-L95 WeakPolarHBondContact O-CD1 3.28Å; I92-L95 HydrophobicContact CG2-CB 4.5Å; I93-L95 PolarHBondContact O-N 3.35Å; L95-L105 HydrophobicContact CD2-CD1 4.2Å; L95-D107 PolarHBondContact O-N 3.32Å; L95-T108 HydrophobicContact CB-CG2 3.97Å; L95-T108 WeakPolarHBondContact CB-O 3.27Å; L95-T108 HydrophobicContact CD2-CG2 4.15Å; L95-T108 HydrophobicContact CG-CG2 4.23Å; L95-T108 PolarHBondContact N-O 3.43Å; L95-T108 WeakPolarHBondContact O-CG2 3.37Å; L95-T108 PolarHBondContact O-N 2.92Å; L95-L110 HydrophobicContact CD2-CB 3.77Å; L95-L110 HydrophobicContact CD2-CD2 4.32Å; L95-L131 HydrophobicContact CD2-CD1 4.04Å; L95-V140 HydrophobicContact CD1-CG1 3.54Å; L95-L307 HydrophobicContact CD2-CD1 4.38Å
96	S	94.7	Very high	89.9	Confident	17 Å²	17	48.5 Å²	48.5	12%	0.119	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.8	171.4	-65.1	0	0	0	0	109.3	V77 T78 N94 L105 D107	V77-S96 WeakPolarHBondContact CA-O 3.5Å; T78-S96 PolarHBondContact N-O 3.3Å; T78-S96 PolarHBondContact O-N 2.95Å; T78-S96 WeakPolarHBondContact OG1-CB 3.19Å; N94-S96 PolarHBondContact O-N 3.49Å; S96-L105 WeakPolarHBondContact CA-O 3.5Å; S96-D107 PolarHBondContact OG-N 3.49Å; S96-D107 PolarHBondContact OG-OD1 3.49Å
97	L	93.2	Very high	90.6	Very high	1 Å²	1	49 Å²	49	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	120.2	-176.5	177.4	65.5	0	0	0	108.6	R75 V77 L104 L105 M130 L131	R75-L97 HydrophobicContact CG-CD1 3.72Å; V77-L97 HydrophobicContact CB-CD1 4.43Å; V77-L97 HydrophobicContact CG1-CD1 4.36Å; V77-L97 HydrophobicContact CG2-CD1 3.56Å; L97-L104 HydrophobicContact CD2-CB 4.32Å; L97-L104 HydrophobicContact CD2-CD1 4.23Å; L97-L104 HydrophobicContact CG-CB 4.31Å; L97-L104 HydrophobicContact CG-CD1 4.36Å; L97-L104 WeakPolarHBondContact O-CA 3.48Å; L97-L104 PolarHBondContact O-N 2.89Å; L97-L105 HydrophobicContact CB-CB 3.92Å; L97-L105 HydrophobicContact CB-CD1 4.23Å; L97-L105 HydrophobicContact CB-CG 4.29Å; L97-L105 HydrophobicContact CD2-CD1 4.39Å; L97-L105 PolarHBondContact N-O 3.29Å; L97-L105 PolarHBondContact O-N 2.99Å; L97-M130 HydrophobicContact CD2-CB 4.24Å; L97-L131 HydrophobicContact CD2-CB 4.27Å
98	T	91.4	Very high	91	Very high	47 Å²	47	47.9 Å²	47.9	29%	0.288	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.6	175.6	63.2	0	0	0	0	110.1	R75 A76 Q102 E103	R75-T98 WeakPolarHBondContact CA-O 3.31Å; A76-T98 WeakPolarHBondContact CB-OG1 3.44Å; A76-T98 PolarHBondContact N-O 2.82Å; A76-T98 PolarHBondContact O-N 3.4Å; A76-T98 PolarHBondContact O-OG1 2.86Å; T98-Q102 CarbonylContact C-O 3.47Å; T98-Q102 WeakPolarHBondContact CA-O 3.32Å; T98-E103 HydrophobicContact CG2-CB 4.28Å; T98-E103 HydrophobicContact CG2-CG 4.31Å
99	F	85.6	Confident	91.5	Very high	42 Å²	42	50.4 Å²	50.4	18%	0.184	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	124.1	179.3	-176.8	-113.5	0	0	0	109.7	K71 A74 R75 G101 Q102 L104 M130	K71-F99 HydrophobicContact CB-CE2 4.35Å; K71-F99 HydrophobicContact CG-CE2 4.49Å; K71-F99 HydrophobicContact CG-CZ 4.29Å; K71-F99 WeakPolarHBondContact O-CE2 3.4Å; A74-F99 HydrophobicContact CB-CD2 4.2Å; A74-F99 HydrophobicContact CB-CE2 3.9Å; A74-F99 WeakPolarHBondContact O-CA 3.49Å; R75-F99 HydrophobicContact CB-CD2 4.14Å; F99-G101 PolarHBondContact O-N 3.3Å; F99-G101 VanDerWaalsContact O-N 3.16Å; F99-Q102 PolarHBondContact N-O 3.27Å; F99-Q102 WeakPolarHBondContact O-CB 3.27Å; F99-Q102 PolarHBondContact O-N 3.42Å; F99-L104 HydrophobicContact CB-CD1 3.62Å; F99-L104 HydrophobicContact CB-CG 4.19Å; F99-M130 HydrophobicContact CD2-SD 4.26Å; F99-M130 HydrophobicContact CE2-SD 4.12Å; F99-M130 HydrophobicContact CZ-SD 4.33Å
100	H	80.9	Confident	91.7	Very high	140 Å²	140	48.4 Å²	48.4	65%	0.648	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	40.6	-172.7	-70.4	-66	0	0	0	113.4	A74 Q102	A74-H100 WeakPolarHBondContact CB-CE1 3.42Å; A74-H100 WeakPolarHBondContact CB-ND1 3.39Å; A74-H100 PolarHBondContact O-N 3.45Å; H100-Q102 PolarHBondContact O-N 2.86Å; H100-Q102 VanDerWaalsContact O-N 3.17Å
101	G	78.9	Confident	91.8	Very high	80 Å²	80	51 Å²	51	83%	0.825	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	-5.2	-178.4	0	0	0	0	0	115.2	F99	F99-G101 PolarHBondContact O-N 3.3Å; F99-G101 VanDerWaalsContact O-N 3.16Å
102	Q	83.2	Confident	91.8	Very high	132 Å²	132	48.6 Å²	48.6	62%	0.617	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.8	171.3	-173.4	176.8	-3.4	0	0	109.9	T98 F99 H100 L104	T98-Q102 CarbonylContact C-O 3.47Å; T98-Q102 WeakPolarHBondContact CA-O 3.32Å; F99-Q102 PolarHBondContact N-O 3.27Å; F99-Q102 WeakPolarHBondContact O-CB 3.27Å; F99-Q102 PolarHBondContact O-N 3.42Å; H100-Q102 PolarHBondContact O-N 2.86Å; H100-Q102 VanDerWaalsContact O-N 3.17Å; Q102-L104 HydrophobicContact CG-CD2 4.3Å; Q102-L104 PolarHBondContact O-N 3.45Å
103	E	89.6	Confident	91.8	Very high	66 Å²	66	51.1 Å²	51.1	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	114.5	174.6	-172	-174.5	-149.5	0	0	110.6	T98 S106 K305	T98-E103 HydrophobicContact CG2-CB 4.28Å; T98-E103 HydrophobicContact CG2-CG 4.31Å; E103-S106 WeakPolarHBondContact OE1-CB 3.44Å; E103-S106 PolarHBondContact OE1-OG 2.99Å; E103-K305 HydrophobicContact CB-CD 4.5Å; E103-K305 HydrophobicContact CG-CD 4.21Å; E103-K305 WeakPolarHBondContact O-CE 3.08Å; E103-K305 IonicContact OE2-NZ 3.85Å; E103-K305 PolarHBondContact OE2-NZ 3.23Å
104	L	91.4	Very high	91.6	Very high	14 Å²	14	49.2 Å²	49.2	7%	0.073	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-39	-179.8	-56.2	-178.2	0	0	0	111.4	L97 F99 Q102 M130 M302 K305	L97-L104 HydrophobicContact CD2-CB 4.32Å; L97-L104 HydrophobicContact CD2-CD1 4.23Å; L97-L104 HydrophobicContact CG-CB 4.31Å; L97-L104 HydrophobicContact CG-CD1 4.36Å; L97-L104 WeakPolarHBondContact O-CA 3.48Å; L97-L104 PolarHBondContact O-N 2.89Å; F99-L104 HydrophobicContact CB-CD1 3.62Å; F99-L104 HydrophobicContact CB-CG 4.19Å; Q102-L104 HydrophobicContact CG-CD2 4.3Å; Q102-L104 PolarHBondContact O-N 3.45Å; L104-M130 HydrophobicContact CD1-CB 4.15Å; L104-M130 HydrophobicContact CD1-CG 4.26Å; L104-M302 HydrophobicContact CB-CE 4.32Å; L104-M302 WeakPolarHBondContact O-CE 3.45Å; L104-K305 WeakPolarHBondContact O-CA 3.33Å
105	L	94.5	Very high	91.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144	171.8	-65.6	172.3	0	0	0	110.5	L95 S96 L97 T108 L131 M302 K305 L307	L95-L105 HydrophobicContact CD2-CD1 4.2Å; S96-L105 WeakPolarHBondContact CA-O 3.5Å; L97-L105 HydrophobicContact CB-CB 3.92Å; L97-L105 HydrophobicContact CB-CD1 4.23Å; L97-L105 HydrophobicContact CB-CG 4.29Å; L97-L105 HydrophobicContact CD2-CD1 4.39Å; L97-L105 PolarHBondContact N-O 3.29Å; L97-L105 PolarHBondContact O-N 2.99Å; L105-T108 HydrophobicContact CB-CG2 4.12Å; L105-T108 HydrophobicContact CD1-CG2 4.14Å; L105-T108 HydrophobicContact CD2-CG2 4.18Å; L105-T108 HydrophobicContact CG-CG2 4.38Å; L105-L131 HydrophobicContact CD1-CD1 3.94Å; L105-L131 HydrophobicContact CD1-CD2 4.26Å; L105-M302 HydrophobicContact CD1-CE 4.44Å; L105-M302 HydrophobicContact CD2-CE 3.61Å; L105-M302 HydrophobicContact CD2-CG 4.08Å; L105-M302 HydrophobicContact CD2-SD 4.36Å; L105-M302 HydrophobicContact CG-CE 3.77Å; L105-K305 CarbonylContact C-O 3.5Å; L105-K305 VanDerWaalsContact CA-O 3.31Å; L105-K305 WeakPolarHBondContact CA-O 3.42Å; L105-L307 HydrophobicContact CD1-CD1 4.26Å; L105-L307 HydrophobicContact CD1-CD2 4.42Å; L105-L307 HydrophobicContact CD1-CG 4.33Å; L105-L307 HydrophobicContact CD2-CD2 3.99Å; L105-L307 HydrophobicContact CD2-CG 4.05Å
106	S	94.1	Very high	91.5	Very high	33 Å²	33	51.5 Å²	51.5	23%	0.231	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	115.4	-177	-164.9	0	0	0	0	110.4	E103 T108 K305	E103-S106 WeakPolarHBondContact OE1-CB 3.44Å; E103-S106 PolarHBondContact OE1-OG 2.99Å; S106-T108 PolarHBondContact O-N 3.32Å; S106-K305 PolarHBondContact N-O 2.93Å
107	D	93	Very high	91.7	Very high	110 Å²	110	53 Å²	53	59%	0.588	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	41.8	46.2	175	-62.8	-35.5	0	0	0	113.7	L95 S96	L95-D107 PolarHBondContact O-N 3.32Å; S96-D107 PolarHBondContact OG-N 3.49Å; S96-D107 PolarHBondContact OG-OD1 3.49Å
108	T	94.9	Very high	91.9	Very high	9 Å²	9	53.1 Å²	53.1	6%	0.055	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	169.6	-179.4	-166.4	0	0	0	0	111.1	N94 L95 L105 S106 L307	N94-T108 PolarHBondContact N-O 2.75Å; L95-T108 HydrophobicContact CB-CG2 3.97Å; L95-T108 WeakPolarHBondContact CB-O 3.27Å; L95-T108 HydrophobicContact CD2-CG2 4.15Å; L95-T108 HydrophobicContact CG-CG2 4.23Å; L95-T108 PolarHBondContact N-O 3.43Å; L95-T108 WeakPolarHBondContact O-CG2 3.37Å; L95-T108 PolarHBondContact O-N 2.92Å; L105-T108 HydrophobicContact CB-CG2 4.12Å; L105-T108 HydrophobicContact CD1-CG2 4.14Å; L105-T108 HydrophobicContact CD2-CG2 4.18Å; L105-T108 HydrophobicContact CG-CG2 4.38Å; S106-T108 PolarHBondContact O-N 3.32Å; T108-L307 HydrophobicContact CG2-CD1 4.04Å; T108-L307 HydrophobicContact CG2-CG 3.98Å; T108-L307 PolarHBondContact OG1-N 2.88Å
109	K	95.5	Very high	92.1	Very high	95 Å²	95	50.9 Å²	50.9	41%	0.413	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142.3	168.7	63.2	-174.8	-165.6	151.4	0	110.6	I92 E111	I92-K109 CarbonylContact O-C 3.14Å; I92-K109 VanDerWaalsContact O-CA 3.27Å; I92-K109 WeakPolarHBondContact O-CA 3.21Å; K109-E111 HydrophobicContact CD-CG 4.4Å; K109-E111 VanDerWaalsContact CD-OE1 3.31Å; K109-E111 WeakPolarHBondContact CD-OE1 3.34Å; K109-E111 WeakPolarHBondContact CE-OE1 3.17Å; K109-E111 HydrophobicContact CG-CG 4.47Å; K109-E111 IonicContact NZ-OE1 3.11Å; K109-E111 PolarHBondContact NZ-OE1 2.91Å; K109-E111 IonicContact NZ-OE2 2.76Å; K109-E111 PolarHBondContact NZ-OE2 3.04Å
110	L	96.4	Very high	92.6	Very high	6 Å²	6	49 Å²	49	3%	0.031	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	108.6	169.4	176.5	69.1	0	0	0	108.6	H91 I92 L95 L112 V135 L307 Y309	H91-L110 CarbonylContact C-O 3.46Å; H91-L110 WeakPolarHBondContact CA-O 3.45Å; I92-L110 HydrophobicContact CB-CB 4.28Å; I92-L110 HydrophobicContact CD1-CD2 4.33Å; I92-L110 PolarHBondContact N-O 3.33Å; I92-L110 PolarHBondContact O-N 2.85Å; L95-L110 HydrophobicContact CD2-CB 3.77Å; L95-L110 HydrophobicContact CD2-CD2 4.32Å; L110-L112 HydrophobicContact CD1-CD1 4.27Å; L110-L112 HydrophobicContact CD1-CD2 4.22Å; L110-L112 HydrophobicContact CD1-CG 4.08Å; L110-L112 HydrophobicContact CD2-CD1 4.38Å; L110-L112 HydrophobicContact CG-CD1 4.32Å; L110-L112 HydrophobicContact CG-CG 4.21Å; L110-V135 HydrophobicContact CD2-CG2 3.95Å; L110-L307 HydrophobicContact CB-CD1 4.42Å; L110-L307 HydrophobicContact CD1-CD1 4.04Å; L110-Y309 VanDerWaalsContact CA-OH 3.27Å; L110-Y309 WeakPolarHBondContact CA-OH 3.37Å
111	E	95.5	Very high	93.2	Very high	56 Å²	56	42.7 Å²	42.7	26%	0.262	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	109.7	-178.8	-66.1	175	165.8	0	0	109.9	K109 Y309	K109-E111 HydrophobicContact CD-CG 4.4Å; K109-E111 VanDerWaalsContact CD-OE1 3.31Å; K109-E111 WeakPolarHBondContact CD-OE1 3.34Å; K109-E111 WeakPolarHBondContact CE-OE1 3.17Å; K109-E111 HydrophobicContact CG-CG 4.47Å; K109-E111 IonicContact NZ-OE1 3.11Å; K109-E111 PolarHBondContact NZ-OE1 2.91Å; K109-E111 IonicContact NZ-OE2 2.76Å; K109-E111 PolarHBondContact NZ-OE2 3.04Å; E111-Y309 HydrophobicContact CB-CE1 4.16Å; E111-Y309 PolarHBondContact N-OH 3.42Å; E111-Y309 WeakPolarHBondContact O-CE1 3.23Å
112	L	96.1	Very high	93.6	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	99.7	178.3	-58.3	176.7	0	0	0	109.9	V90 L110 Y118 M253 I281 V283 I300	V90-L112 HydrophobicContact CB-CB 4.28Å; V90-L112 PolarHBondContact N-O 2.89Å; V90-L112 PolarHBondContact O-N 3.42Å; L110-L112 HydrophobicContact CD1-CD1 4.27Å; L110-L112 HydrophobicContact CD1-CD2 4.22Å; L110-L112 HydrophobicContact CD1-CG 4.08Å; L110-L112 HydrophobicContact CD2-CD1 4.38Å; L110-L112 HydrophobicContact CG-CD1 4.32Å; L110-L112 HydrophobicContact CG-CG 4.21Å; L112-Y118 HydrophobicContact CB-CE2 4.33Å; L112-Y118 HydrophobicContact CD2-CD1 4.43Å; L112-Y118 HydrophobicContact CD2-CD2 3.74Å; L112-Y118 HydrophobicContact CD2-CE2 3.91Å; L112-Y118 HydrophobicContact CD2-CG 4.03Å; L112-M253 HydrophobicContact CD1-CE 3.85Å; L112-M253 HydrophobicContact CD1-SD 4.3Å; L112-I281 HydrophobicContact CB-CD1 4.32Å; L112-I281 HydrophobicContact CB-CG2 4.12Å; L112-V283 HydrophobicContact CD1-CG2 4.08Å; L112-V283 HydrophobicContact CD2-CG2 3.81Å; L112-I300 HydrophobicContact CD2-CD1 3.97Å
113	N	94.1	Very high	93.5	Very high	54 Å²	54	36.4 Å²	36.4	29%	0.289	19%	0.189	S	C	.	.			trans	-85.3	143.9	176.2	-57	-23	0	0	0	112.4	D89 H91 R116 Y118	D89-N113 WeakPolarHBondContact OD1-CA 3.34Å; H91-N113 PolarHBondContact NE2-OD1 2.86Å; N113-R116 HydrophobicContact CB-CG 3.97Å; N113-R116 WeakPolarHBondContact O-CB 3.35Å; N113-R116 PolarHBondContact O-N 3.05Å; N113-Y118 WeakPolarHBondContact CB-OH 3.27Å; N113-Y118 PolarHBondContact N-OH 3.41Å
114	S	92	Very high	93.1	Very high	36 Å²	36	35.6 Å²	35.6	25%	0.252	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	144.8	173.7	-170.3	0	0	0	0	111.9	D89 R116	D89-S114 PolarHBondContact OD1-N 3.38Å; S114-R116 PolarHBondContact O-N 3.37Å
115	G	91.3	Very high	92.4	Very high	28 Å²	28	38.4 Å²	38.4	29%	0.289	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	4.8	-177.1	0	0	0	0	0	116.1	K279	G115-K279 WeakPolarHBondContact CA-O 3.32Å; G115-K279 PolarHBondContact N-O 3.48Å
116	R	95.9	Very high	91.9	Very high	112 Å²	112	40.4 Å²	40.4	42%	0.423	23%	0.23	S	C	.	.			trans	-103.2	147.8	176.2	-58.3	-60.2	-178.2	162.7	-1.9	111.5	N113 S114 Y118 L282	N113-R116 HydrophobicContact CB-CG 3.97Å; N113-R116 WeakPolarHBondContact O-CB 3.35Å; N113-R116 PolarHBondContact O-N 3.05Å; S114-R116 PolarHBondContact O-N 3.37Å; R116-Y118 HydrophobicContact CB-CD2 4.24Å; R116-Y118 HydrophobicContact CB-CE1 4.35Å; R116-Y118 HydrophobicContact CB-CE2 3.44Å; R116-Y118 VanDerWaalsContact CB-CE2 3.44Å; R116-Y118 VanDerWaalsContact CB-CZ 3.48Å; R116-Y118 VanDerWaalsContact CB-OH 3.3Å; R116-Y118 WeakPolarHBondContact CB-OH 3.29Å; R116-Y118 HydrophobicContact CG-CE2 4.5Å; R116-Y118 WeakPolarHBondContact CG-OH 3.4Å; R116-L282 PolarHBondContact O-N 3.38Å
117	R	97.3	Very high	91.6	Very high	48 Å²	48	39.3 Å²	39.3	18%	0.181	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109	178.9	-60.7	176	-66.7	-80.4	2.6	108.2	L275 F278 L282 V295 C296 T297 N298	R117-L275 VanDerWaalsContact CD-O 3.23Å; R117-L275 WeakPolarHBondContact CD-O 3.17Å; R117-F278 PolarHBondContact NH1-O 3.45Å; R117-L282 CarbonylContact C-O 3.58Å; R117-L282 WeakPolarHBondContact CA-O 3.32Å; R117-L282 HydrophobicContact CB-CB 4.23Å; R117-L282 HydrophobicContact CB-CD2 4.2Å; R117-L282 HydrophobicContact CG-CB 3.95Å; R117-L282 HydrophobicContact CG-CD2 4Å; R117-V295 WeakPolarHBondContact CD-O 3.46Å; R117-V295 PolarHBondContact NE-O 3.4Å; R117-C296 WeakPolarHBondContact O-CA 3.35Å; R117-T297 PolarHBondContact N-OG1 2.92Å; R117-T297 PolarHBondContact O-N 3.32Å; R117-T297 PolarHBondContact O-OG1 3.4Å; R117-N298 PolarHBondContact O-N 2.84Å; R117-N298 VanDerWaalsContact O-N 3.13Å
118	Y	97.6	Very high	91.5	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.6	-173.3	-62.1	-85.9	0	0	0	110.8	L112 N113 R116 I281 L282 V283 L284 N298 I300 Y309	L112-Y118 HydrophobicContact CB-CE2 4.33Å; L112-Y118 HydrophobicContact CD2-CD1 4.43Å; L112-Y118 HydrophobicContact CD2-CD2 3.74Å; L112-Y118 HydrophobicContact CD2-CE2 3.91Å; L112-Y118 HydrophobicContact CD2-CG 4.03Å; N113-Y118 WeakPolarHBondContact CB-OH 3.27Å; N113-Y118 PolarHBondContact N-OH 3.41Å; R116-Y118 HydrophobicContact CB-CD2 4.24Å; R116-Y118 HydrophobicContact CB-CE1 4.35Å; R116-Y118 HydrophobicContact CB-CE2 3.44Å; R116-Y118 VanDerWaalsContact CB-CE2 3.44Å; R116-Y118 VanDerWaalsContact CB-CZ 3.48Å; R116-Y118 VanDerWaalsContact CB-OH 3.3Å; R116-Y118 WeakPolarHBondContact CB-OH 3.29Å; R116-Y118 HydrophobicContact CG-CE2 4.5Å; R116-Y118 WeakPolarHBondContact CG-OH 3.4Å; Y118-I281 HydrophobicContact CD2-CG2 4.47Å; Y118-I281 HydrophobicContact CE2-CG2 4.45Å; Y118-L282 PolarHBondContact N-O 3.47Å; Y118-V283 HydrophobicContact CD2-CG2 4.39Å; Y118-V283 WeakPolarHBondContact O-CA 3.26Å; Y118-L284 PolarHBondContact O-N 3.32Å; Y118-N298 CarbonylContact C-O 3.51Å; Y118-N298 WeakPolarHBondContact CA-O 3.26Å; Y118-N298 HydrophobicContact CD1-CB 3.55Å; Y118-N298 HydrophobicContact CE1-CB 3.69Å; Y118-N298 HydrophobicContact CG-CB 4.44Å; Y118-I300 HydrophobicContact CD1-CD1 3.75Å; Y118-I300 HydrophobicContact CD1-CG1 3.81Å; Y118-I300 HydrophobicContact CG-CD1 3.94Å; Y118-I300 HydrophobicContact CG-CG1 4.33Å; Y118-Y309 HydrophobicContact CE1-CE1 4.49Å
119	G	96.8	Very high	91.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	112	166	0	0	0	0	0	110.4	L284 C296 N298 I299 I300	G119-L284 CarbonylContact C-O 3.51Å; G119-L284 WeakPolarHBondContact CA-O 3.41Å; G119-C296 VanDerWaalsContact CA-SG 3.57Å; G119-C296 PolarHBondContact N-SG 2.68Å; G119-N298 PolarHBondContact N-O 3.48Å; G119-I299 WeakPolarHBondContact O-CA 3.38Å; G119-I300 PolarHBondContact O-N 3.25Å
120	L	95.6	Very high	90.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.8	175.2	175.9	62.8	0	0	0	109.8	K128 L131 L132 V283 L284 V285 I300 M302 L307	L120-K128 HydrophobicContact CD2-CB 4.01Å; L120-K128 HydrophobicContact CD2-CG 4.4Å; L120-K128 HydrophobicContact CG-CB 4.32Å; L120-K128 HydrophobicContact CG-CG 4.22Å; L120-L131 HydrophobicContact CD1-CD2 4.43Å; L120-L131 HydrophobicContact CD2-CD2 4.04Å; L120-L132 HydrophobicContact CD2-CD2 4.31Å; L120-L132 HydrophobicContact CD2-CG 4.33Å; L120-V283 HydrophobicContact CB-CG1 4.4Å; L120-L284 PolarHBondContact N-O 2.96Å; L120-V285 HydrophobicContact CB-CG2 3.79Å; L120-V285 HydrophobicContact CD2-CG2 3.75Å; L120-V285 HydrophobicContact CG-CG2 3.95Å; L120-I300 WeakPolarHBondContact CA-O 3.43Å; L120-I300 HydrophobicContact CD1-CB 4.03Å; L120-I300 HydrophobicContact CD1-CG2 3.84Å; L120-M302 HydrophobicContact CD1-CB 4.25Å; L120-L307 HydrophobicContact CD1-CD2 4.43Å
121	I	92.6	Very high	90.8	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.041	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	159	-176.3	66	168.8	0	0	0	112.1	L292 I299 I300 H301 M302 Y314 Y317	I121-L292 HydrophobicContact CG2-CD1 3.72Å; I121-I299 HydrophobicContact CD1-CG2 3.36Å; I121-I299 HydrophobicContact CG1-CG2 3.62Å; I121-I299 HydrophobicContact CG2-CG2 4.47Å; I121-I300 PolarHBondContact N-O 2.95Å; I121-H301 HydrophobicContact CD1-CB 4.39Å; I121-H301 HydrophobicContact CG1-CB 4.16Å; I121-M302 PolarHBondContact O-N 2.74Å; I121-Y314 HydrophobicContact CD1-CD2 4.41Å; I121-Y314 HydrophobicContact CD1-CE2 4.01Å; I121-Y317 HydrophobicContact CD1-CD1 3.78Å; I121-Y317 HydrophobicContact CD1-CE1 3.19Å; I121-Y317 HydrophobicContact CD1-CE2 4.15Å; I121-Y317 HydrophobicContact CD1-CG 4.46Å
122	G	87.4	Confident	90.8	Very high	16 Å²	16	30.8 Å²	30.8	17%	0.165	19%	0.186	C	C	.	.			trans	152.1	170.3	175.1	0	0	0	0	0	111.2	K128	G122-K128 WeakPolarHBondContact O-CE 3.31Å; G122-K128 PolarHBondContact O-NZ 3.13Å
123	L	82.6	Confident	90.6	Very high	64 Å²	64	31.7 Å²	31.7	34%	0.335	19%	0.193	S	C	.	.			trans	-56.7	155.9	-177.9	-61.4	176.5	0	0	0	112.9	I126 E554	L123-I126 HydrophobicContact CB-CG2 3.86Å; L123-I126 VanDerWaalsContact O-CG1 3.22Å; L123-I126 WeakPolarHBondContact O-CG1 3.5Å; L123-I126 WeakPolarHBondContact O-CG2 3.43Å; L123-E554 WeakPolarHBondContact CD2-OE2 3.48Å
124	N	79.8	Confident	90.5	Very high	49 Å²	49	29.1 Å²	29.1	26%	0.262	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	136.3	176.9	-73.5	-12.2	0	0	0	111.9	H287 H550 D552	N124-H287 PolarHBondContact OD1-CE1 3.08Å; N124-H287 PolarHBondContact OD1-NE2 3.33Å; N124-H287 VanDerWaalsContact OD1-NE2 3.09Å; N124-H550 PolarHBondContact ND2-O 3.02Å; N124-D552 PolarHBondContact ND2-N 2.87Å
125	G	76.6	Confident	90.7	Very high	73 Å²	73	27.7 Å²	27.7	75%	0.753	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	1.7	178.7	0	0	0	0	0	115.9	G127	G125-G127 VanDerWaalsContact C-N 3.32Å; G125-G127 PolarHBondContact O-N 3.16Å
126	I	85.6	Confident	90.7	Very high	43 Å²	43	27.4 Å²	27.4	22%	0.221	17%	0.166	C	C	.	.	S	Bend	trans	-75.6	-18.8	178.3	68.2	-178.7	0	0	0	113.8	L123 K128 M302	L123-I126 HydrophobicContact CB-CG2 3.86Å; L123-I126 VanDerWaalsContact O-CG1 3.22Å; L123-I126 WeakPolarHBondContact O-CG1 3.5Å; L123-I126 WeakPolarHBondContact O-CG2 3.43Å; I126-K128 HydrophobicContact CD1-CG 4.11Å; I126-K128 HydrophobicContact CG1-CG 4.04Å; I126-M302 HydrophobicContact CB-CE 4.46Å; I126-M302 HydrophobicContact CD1-CB 3.68Å; I126-M302 HydrophobicContact CD1-CG 3.69Å; I126-M302 WeakPolarHBondContact CD1-O 3.43Å; I126-M302 HydrophobicContact CD1-SD 3.92Å; I126-M302 HydrophobicContact CG1-CE 4.27Å; I126-M302 HydrophobicContact CG1-CG 4.18Å; I126-M302 HydrophobicContact CG1-SD 3.8Å; I126-M302 WeakPolarHBondContact O-CE 3.37Å
127	G	86.2	Confident	90.5	Very high	9 Å²	9	26.5 Å²	26.5	9%	0.093	17%	0.165	C	C	.	.	S	Bend	trans	119.6	14	178.3	0	0	0	0	0	117.4	G125 S129 M130 L131	G125-G127 VanDerWaalsContact C-N 3.32Å; G125-G127 PolarHBondContact O-N 3.16Å; G127-S129 PolarHBondContact O-N 3.47Å; G127-M130 WeakPolarHBondContact O-CB 3.43Å; G127-M130 PolarHBondContact O-N 3.19Å; G127-M130 VanDerWaalsContact O-N 3.09Å; G127-L131 PolarHBondContact O-N 2.96Å
128	K	91.3	Very high	90.3	Very high	14 Å²	14	29 Å²	29	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-52.3	-56.4	-180	-61.4	178.5	-61.9	-172.5	0	113.1	L120 G122 I126 M130 L131 L132 V285 H287 M302	L120-K128 HydrophobicContact CD2-CB 4.01Å; L120-K128 HydrophobicContact CD2-CG 4.4Å; L120-K128 HydrophobicContact CG-CB 4.32Å; L120-K128 HydrophobicContact CG-CG 4.22Å; G122-K128 WeakPolarHBondContact O-CE 3.31Å; G122-K128 PolarHBondContact O-NZ 3.13Å; I126-K128 HydrophobicContact CD1-CG 4.11Å; I126-K128 HydrophobicContact CG1-CG 4.04Å; K128-M130 VanDerWaalsContact C-N 3.26Å; K128-M130 PolarHBondContact O-N 3.3Å; K128-L131 WeakPolarHBondContact O-CB 3.5Å; K128-L131 PolarHBondContact O-N 2.95Å; K128-L132 PolarHBondContact O-N 2.91Å; K128-V285 HydrophobicContact CB-CG1 4.42Å; K128-V285 HydrophobicContact CB-CG2 4.14Å; K128-V285 HydrophobicContact CD-CG1 4.13Å; K128-H287 PolarHBondContact NZ-CE1 3.47Å; K128-H287 PolarHBondContact NZ-NE2 3.35Å; K128-M302 HydrophobicContact CG-SD 4.36Å
129	S	88.9	Confident	89.9	Confident	44 Å²	44	32 Å²	32	31%	0.308	19%	0.188	S	C	.	.	H	α-helix	trans	-61.7	-34.6	176.7	-47.4	0	0	0	0	112.2	G127 L132 S133 D257	G127-S129 PolarHBondContact O-N 3.47Å; S129-L132 PolarHBondContact O-N 3.39Å; S129-S133 WeakPolarHBondContact O-CB 3.38Å; S129-S133 PolarHBondContact O-N 3.32Å; S129-S133 PolarHBondContact O-OG 3.18Å; S129-S133 VanDerWaalsContact O-OG 3.08Å; S129-D257 WeakPolarHBondContact CB-OD2 3.33Å; S129-D257 PolarHBondContact OG-OD2 3.22Å
130	M	90	Very high	89.7	Confident	29 Å²	29	32 Å²	32	14%	0.143	19%	0.189	C	C	.	.	H	α-helix	trans	-67.7	-38	177.5	-65.5	-61.4	96.3	0	0	112.2	R75 L97 F99 L104 G127 K128 A134	R75-M130 PolarHBondContact NH1-O 2.88Å; L97-M130 HydrophobicContact CD2-CB 4.24Å; F99-M130 HydrophobicContact CD2-SD 4.26Å; F99-M130 HydrophobicContact CE2-SD 4.12Å; F99-M130 HydrophobicContact CZ-SD 4.33Å; L104-M130 HydrophobicContact CD1-CB 4.15Å; L104-M130 HydrophobicContact CD1-CG 4.26Å; G127-M130 WeakPolarHBondContact O-CB 3.43Å; G127-M130 PolarHBondContact O-N 3.19Å; G127-M130 VanDerWaalsContact O-N 3.09Å; K128-M130 VanDerWaalsContact C-N 3.26Å; K128-M130 PolarHBondContact O-N 3.3Å; M130-A134 WeakPolarHBondContact O-CB 3.37Å; M130-A134 PolarHBondContact O-N 3.48Å
131	L	94.1	Very high	89.5	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-49.1	172.2	176.1	62.7	0	0	0	110.5	L95 L97 L105 L120 G127 K128 S133 A134 V135 L307	L95-L131 HydrophobicContact CD2-CD1 4.04Å; L97-L131 HydrophobicContact CD2-CB 4.27Å; L105-L131 HydrophobicContact CD1-CD1 3.94Å; L105-L131 HydrophobicContact CD1-CD2 4.26Å; L120-L131 HydrophobicContact CD1-CD2 4.43Å; L120-L131 HydrophobicContact CD2-CD2 4.04Å; G127-L131 PolarHBondContact O-N 2.96Å; K128-L131 WeakPolarHBondContact O-CB 3.5Å; K128-L131 PolarHBondContact O-N 2.95Å; L131-S133 VanDerWaalsContact C-N 3.34Å; L131-S133 PolarHBondContact O-N 3.32Å; L131-A134 WeakPolarHBondContact O-CB 3.14Å; L131-A134 PolarHBondContact O-N 3.14Å; L131-A134 VanDerWaalsContact O-N 3.08Å; L131-V135 HydrophobicContact CD1-CG2 4.34Å; L131-V135 WeakPolarHBondContact O-CG2 3.41Å; L131-V135 PolarHBondContact O-N 3.3Å; L131-L307 HydrophobicContact CD2-CD1 3.99Å; L131-L307 HydrophobicContact CD2-CD2 4Å
132	L	94.6	Very high	89.5	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-44.6	176	-69.1	-172.8	0	0	0	112	L120 K128 S129 A134 V135 G136 L255 D257 V283 V285	L120-L132 HydrophobicContact CD2-CD2 4.31Å; L120-L132 HydrophobicContact CD2-CG 4.33Å; K128-L132 PolarHBondContact O-N 2.91Å; S129-L132 PolarHBondContact O-N 3.39Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.48Å; L132-V135 PolarHBondContact O-N 2.85Å; L132-G136 PolarHBondContact O-N 2.86Å; L132-L255 HydrophobicContact CD2-CB 4.39Å; L132-L255 HydrophobicContact CD2-CD2 4.23Å; L132-D257 HydrophobicContact CD1-CB 3.98Å; L132-V283 HydrophobicContact CD2-CB 4.31Å; L132-V283 HydrophobicContact CD2-CG1 3.75Å; L132-V285 HydrophobicContact CD1-CB 4.37Å; L132-V285 HydrophobicContact CD1-CG2 3.57Å; L132-V285 HydrophobicContact CG-CG2 4.19Å
133	S	92.6	Very high	89.5	Confident	22 Å²	22	34.5 Å²	34.5	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-30.1	175.9	-66	0	0	0	0	113	R75 S129 L131 K137 H150	R75-S133 PolarHBondContact NH2-O 2.81Å; S129-S133 WeakPolarHBondContact O-CB 3.38Å; S129-S133 PolarHBondContact O-N 3.32Å; S129-S133 PolarHBondContact O-OG 3.18Å; S129-S133 VanDerWaalsContact O-OG 3.08Å; L131-S133 VanDerWaalsContact C-N 3.34Å; L131-S133 PolarHBondContact O-N 3.32Å; S133-K137 WeakPolarHBondContact O-CB 3.33Å; S133-K137 WeakPolarHBondContact O-CG 3.29Å; S133-K137 PolarHBondContact O-N 2.87Å; S133-K137 VanDerWaalsContact O-N 3.14Å; S133-H150 VanDerWaalsContact CA-CE1 3.43Å; S133-H150 WeakPolarHBondContact CA-CE1 3.26Å; S133-H150 PolarHBondContact N-CE1 2.86Å
134	A	92.9	Very high	89.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-73.8	-42.7	178.1	0	0	0	0	0	110.5	V77 M130 L131 L132 R138 E139	V77-A134 HydrophobicContact CG2-CB 4Å; M130-A134 WeakPolarHBondContact O-CB 3.37Å; M130-A134 PolarHBondContact O-N 3.48Å; L131-A134 WeakPolarHBondContact O-CB 3.14Å; L131-A134 PolarHBondContact O-N 3.14Å; L131-A134 VanDerWaalsContact O-N 3.08Å; L132-A134 VanDerWaalsContact C-N 3.27Å; L132-A134 PolarHBondContact O-N 3.48Å; A134-R138 PolarHBondContact O-N 3.13Å; A134-E139 HydrophobicContact CB-CB 4.46Å; A134-E139 PolarHBondContact O-N 2.85Å
135	V	94.4	Very high	89.7	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.03	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-50.9	172.6	177.6	0	0	0	0	110.3	L110 L131 L132 K137 R138 V140 I142 I148 M253 L255	L110-V135 HydrophobicContact CD2-CG2 3.95Å; L131-V135 HydrophobicContact CD1-CG2 4.34Å; L131-V135 WeakPolarHBondContact O-CG2 3.41Å; L131-V135 PolarHBondContact O-N 3.3Å; L132-V135 PolarHBondContact O-N 2.85Å; V135-K137 VanDerWaalsContact C-N 3.33Å; V135-K137 PolarHBondContact O-N 2.82Å; V135-R138 PolarHBondContact O-N 2.87Å; V135-V140 HydrophobicContact CB-CG2 4.33Å; V135-V140 HydrophobicContact CG2-CG2 4Å; V135-I142 HydrophobicContact CB-CD1 4.32Å; V135-I142 HydrophobicContact CG1-CD1 3.55Å; V135-I142 WeakPolarHBondContact O-CD1 3.41Å; V135-I148 WeakPolarHBondContact O-CD1 3.46Å; V135-M253 HydrophobicContact CG1-SD 3.66Å; V135-L255 HydrophobicContact CB-CD1 3.99Å; V135-L255 HydrophobicContact CG1-CD1 3.7Å; V135-L255 HydrophobicContact CG1-CD2 4.28Å
136	G	93	Very high	90.2	Very high	22 Å²	22	35 Å²	35	23%	0.227	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-34.4	-178.2	0	0	0	0	0	114.4	L132 R138	L132-G136 PolarHBondContact O-N 2.86Å; G136-R138 VanDerWaalsContact C-N 3.31Å
137	K	90.8	Very high	90.3	Very high	94 Å²	94	34.9 Å²	34.9	41%	0.409	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	6.8	176.6	-65.6	-173.8	-178.6	-176.1	0	113.4	E68 S133 V135 E139	E68-K137 IonicContact OE2-NZ 3.23Å; E68-K137 PolarHBondContact OE2-NZ 3.43Å; S133-K137 WeakPolarHBondContact O-CB 3.33Å; S133-K137 WeakPolarHBondContact O-CG 3.29Å; S133-K137 PolarHBondContact O-N 2.87Å; S133-K137 VanDerWaalsContact O-N 3.14Å; V135-K137 VanDerWaalsContact C-N 3.33Å; V135-K137 PolarHBondContact O-N 2.82Å; K137-E139 HydrophobicContact CB-CG 4.27Å; K137-E139 PolarHBondContact O-N 3.36Å
138	R	91.9	Very high	90.7	Very high	99 Å²	99	36 Å²	36	37%	0.374	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	33.6	-176.1	-60.4	-176.1	177.8	-93	3.7	114.1	A134 V135 G136 V140 I142 P143 E144 I146 I148	A134-R138 PolarHBondContact O-N 3.13Å; V135-R138 PolarHBondContact O-N 2.87Å; G136-R138 VanDerWaalsContact C-N 3.31Å; R138-V140 CarbonylContact C-O 3.57Å; R138-V140 PolarHBondContact O-N 3.43Å; R138-I142 PolarHBondContact NH1-O 3.07Å; R138-I142 VanDerWaalsContact NH1-O 3.07Å; R138-P143 PolarHBondContact NH1-O 2.89Å; R138-E144 PolarHBondContact NH2-O 2.83Å; R138-I146 PolarHBondContact NH2-O 2.99Å; R138-I148 HydrophobicContact CG-CD1 3.95Å
139	E	90.9	Very high	90.8	Very high	67 Å²	67	37.3 Å²	37.3	31%	0.313	19%	0.189	S	C	.	.			trans	-73.9	-14.9	171.8	-66.8	175.9	-177.8	0	0	112	R75 V77 A134 K137	R75-E139 IonicContact CZ-OE1 3.67Å; R75-E139 IonicContact CZ-OE2 3.43Å; R75-E139 IonicContact NE-OE1 3.84Å; R75-E139 PolarHBondContact NE-OE1 3.13Å; R75-E139 IonicContact NE-OE2 3.35Å; R75-E139 PolarHBondContact NE-OE2 3.44Å; R75-E139 IonicContact NH1-OE2 2.84Å; R75-E139 IonicContact NH2-OE1 3.49Å; R75-E139 PolarHBondContact NH2-OE1 2.79Å; R75-E139 IonicContact NH2-OE2 3.58Å; R75-E139 PolarHBondContact NH2-OE2 2.93Å; V77-E139 HydrophobicContact CB-CB 4.38Å; V77-E139 HydrophobicContact CG2-CB 4.06Å; V77-E139 WeakPolarHBondContact CG2-OE2 3.24Å; A134-E139 HydrophobicContact CB-CB 4.46Å; A134-E139 PolarHBondContact O-N 2.85Å; K137-E139 HydrophobicContact CB-CG 4.27Å; K137-E139 PolarHBondContact O-N 3.36Å
140	V	91.7	Very high	91.1	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	18%	0.181	C	C	.	.	S	Bend	trans	-101.2	148.2	165.7	-68.9	0	0	0	0	109.5	V77 I92 L95 V135 R138 I142	V77-V140 HydrophobicContact CG1-CG1 3.55Å; I92-V140 HydrophobicContact CD1-CB 3.71Å; I92-V140 HydrophobicContact CD1-CG2 4.01Å; L95-V140 HydrophobicContact CD1-CG1 3.54Å; V135-V140 HydrophobicContact CB-CG2 4.33Å; V135-V140 HydrophobicContact CG2-CG2 4Å; R138-V140 CarbonylContact C-O 3.57Å; R138-V140 PolarHBondContact O-N 3.43Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 HydrophobicContact CG2-CD1 3.72Å; V140-I142 HydrophobicContact CG2-CG1 3.88Å; V140-I142 PolarHBondContact O-N 3.48Å
141	P	91.5	Very high	91.2	Very high	53 Å²	53	36 Å²	36	34%	0.344	18%	0.178	S	C	.	.			trans	-71.8	84	-173.5	30.4	-37.8	0	0	0	111.7	L81 I92	L81-P141 HydrophobicContact CB-CB 4.12Å; L81-P141 HydrophobicContact CB-CG 4.03Å; L81-P141 WeakPolarHBondContact CD1-O 3.39Å; I92-P141 HydrophobicContact CD1-CG 4.37Å; I92-P141 HydrophobicContact CG2-CG 4.4Å
142	I	91.9	Very high	90.7	Very high	14 Å²	14	39 Å²	39	7%	0.072	20%	0.197	C	C	.	.			trans	-98.2	130	176.5	-60.6	167.1	0	0	0	108.9	V90 I92 V135 R138 V140 I146 I148	V90-I142 HydrophobicContact CG1-CG1 4.26Å; V90-I142 HydrophobicContact CG2-CG2 4.33Å; I92-I142 HydrophobicContact CD1-CG1 4.46Å; V135-I142 HydrophobicContact CB-CD1 4.32Å; V135-I142 HydrophobicContact CG1-CD1 3.55Å; V135-I142 WeakPolarHBondContact O-CD1 3.41Å; R138-I142 PolarHBondContact NH1-O 3.07Å; R138-I142 VanDerWaalsContact NH1-O 3.07Å; V140-I142 VanDerWaalsContact C-N 3.34Å; V140-I142 HydrophobicContact CG2-CD1 3.72Å; V140-I142 HydrophobicContact CG2-CG1 3.88Å; V140-I142 PolarHBondContact O-N 3.48Å; I142-I146 HydrophobicContact CG2-CB 4.05Å; I142-I146 HydrophobicContact CG2-CG2 4.03Å; I142-I148 HydrophobicContact CB-CD1 4.26Å; I142-I148 HydrophobicContact CD1-CD1 3.41Å; I142-I148 VanDerWaalsContact CD1-CD1 3.41Å; I142-I148 HydrophobicContact CG1-CD1 4.43Å; I142-I148 HydrophobicContact CG2-CD1 3.96Å
143	P	88.5	Confident	90.1	Very high	11 Å²	11	43.1 Å²	43.1	7%	0.071	21%	0.212	C	C	.	.			trans	-50.4	142.5	176.7	-28.8	34.5	0	0	0	114.2	L81 R138 H145 I146	L81-P143 HydrophobicContact CD2-CG 3.94Å; R138-P143 PolarHBondContact NH1-O 2.89Å; P143-H145 VanDerWaalsContact C-N 3.33Å; P143-H145 WeakPolarHBondContact CB-CE1 2.89Å; P143-H145 WeakPolarHBondContact CB-ND1 3.5Å; P143-H145 PolarHBondContact O-N 3.37Å; P143-I146 HydrophobicContact CB-CD1 4.27Å; P143-I146 HydrophobicContact CB-CG1 4.37Å; P143-I146 HydrophobicContact CG-CD1 4.18Å; P143-I146 PolarHBondContact O-N 3.42Å
144	E	85.1	Confident	89.8	Confident	169 Å²	169	45.7 Å²	45.7	79%	0.79	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-36.2	-174.7	-67.1	-176	171.7	0	0	113	R138 I146	R138-E144 PolarHBondContact NH2-O 2.83Å; E144-I146 PolarHBondContact O-N 3.23Å
145	H	80.8	Confident	89.6	Confident	28 Å²	28	46.7 Å²	46.7	13%	0.13	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.1	179.1	70	-86.1	0	0	0	113.7	P85 S87 P143 D147 K192	P85-H145 PolarHBondContact O-CE1 2.91Å; P85-H145 PolarHBondContact O-ND1 3.23Å; S87-H145 PolarHBondContact O-CE1 2.89Å; S87-H145 PolarHBondContact O-NE2 3.47Å; P143-H145 VanDerWaalsContact C-N 3.33Å; P143-H145 WeakPolarHBondContact CB-CE1 2.89Å; P143-H145 WeakPolarHBondContact CB-ND1 3.5Å; P143-H145 PolarHBondContact O-N 3.37Å; H145-D147 PolarHBondContact O-N 2.83Å; H145-K192 PolarHBondContact CD2-NZ 3.31Å; H145-K192 PolarHBondContact CE1-NZ 3.22Å; H145-K192 PolarHBondContact ND1-NZ 3.49Å; H145-K192 PolarHBondContact NE2-NZ 2.7Å
146	I	87.1	Confident	89.3	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-86.2	100.1	174.5	-64.1	178.9	0	0	0	107.3	V90 R138 I142 P143 E144 I148 F252 M253	V90-I146 HydrophobicContact CG2-CD1 3.24Å; R138-I146 PolarHBondContact NH2-O 2.99Å; I142-I146 HydrophobicContact CG2-CB 4.05Å; I142-I146 HydrophobicContact CG2-CG2 4.03Å; P143-I146 HydrophobicContact CB-CD1 4.27Å; P143-I146 HydrophobicContact CB-CG1 4.37Å; P143-I146 HydrophobicContact CG-CD1 4.18Å; P143-I146 PolarHBondContact O-N 3.42Å; E144-I146 PolarHBondContact O-N 3.23Å; I146-I148 HydrophobicContact CG2-CG1 4.4Å; I146-F252 HydrophobicContact CB-CD1 4.34Å; I146-F252 HydrophobicContact CG1-CD1 4.01Å; I146-F252 HydrophobicContact CG1-CE1 4.37Å; I146-F252 HydrophobicContact CG2-CB 4.28Å; I146-F252 HydrophobicContact CG2-CD1 3.83Å; I146-F252 HydrophobicContact CG2-CG 4.4Å; I146-M253 HydrophobicContact CG2-CB 4.03Å; I146-M253 HydrophobicContact CG2-CE 4.14Å
147	D	88.8	Confident	89.1	Confident	39 Å²	39	51 Å²	51	21%	0.209	25%	0.251	C	S	.	.			trans	-76.3	134.9	173.2	75	-63.3	0	0	0	110.6	H145 R199 P251 F252 M253	H145-D147 PolarHBondContact O-N 2.83Å; D147-R199 IonicContact OD1-CZ 2.82Å; D147-R199 IonicContact OD1-NH1 3.69Å; D147-R199 PolarHBondContact OD1-NH1 3Å; D147-R199 IonicContact OD2-CZ 3.74Å; D147-R199 IonicContact OD2-NH1 3.75Å; D147-R199 PolarHBondContact OD2-NH1 3.27Å; D147-R199 IonicContact OD2-NH2 3.71Å; D147-R199 PolarHBondContact OD2-NH2 3.45Å; D147-P251 WeakPolarHBondContact OD2-CA 3.45Å; D147-P251 VanDerWaalsContact OD2-CB 3.25Å; D147-P251 WeakPolarHBondContact OD2-CB 3.4Å; D147-F252 PolarHBondContact O-N 3.17Å; D147-F252 WeakPolarHBondContact OD1-CB 3.31Å; D147-F252 PolarHBondContact OD1-N 3.26Å; D147-M253 PolarHBondContact O-N 3.3Å
148	I	92.9	Very high	89.1	Confident	32 Å²	32	48.2 Å²	48.2	16%	0.164	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.2	-175.2	-49.6	169.8	0	0	0	107.5	V135 R138 I142 I146 M253 L255	V135-I148 WeakPolarHBondContact O-CD1 3.46Å; R138-I148 HydrophobicContact CG-CD1 3.95Å; I142-I148 HydrophobicContact CB-CD1 4.26Å; I142-I148 HydrophobicContact CD1-CD1 3.41Å; I142-I148 VanDerWaalsContact CD1-CD1 3.41Å; I142-I148 HydrophobicContact CG1-CD1 4.43Å; I142-I148 HydrophobicContact CG2-CD1 3.96Å; I146-I148 HydrophobicContact CG2-CG1 4.4Å; I148-M253 WeakPolarHBondContact CA-O 3.42Å; I148-M253 HydrophobicContact CD1-SD 4.49Å; I148-M253 HydrophobicContact CG1-CB 4.23Å; I148-M253 HydrophobicContact CG1-SD 4.24Å; I148-M253 HydrophobicContact CG2-CB 4.39Å; I148-M253 HydrophobicContact CG2-CG 4.35Å; I148-M253 HydrophobicContact CG2-SD 4.28Å; I148-L255 HydrophobicContact CG2-CD1 3.75Å; I148-L255 HydrophobicContact CG2-CG 4.01Å
149	Y	94	Very high	89.1	Confident	42 Å²	42	47.9 Å²	47.9	17%	0.165	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	114.7	165.8	-158.9	-84.9	0	0	0	108.5	A246 I249 M253 L254 L255	Y149-A246 HydrophobicContact CD1-CB 3.55Å; Y149-A246 HydrophobicContact CE1-CB 3.42Å; Y149-A246 VanDerWaalsContact CE1-CB 3.42Å; Y149-A246 HydrophobicContact CG-CB 4.48Å; Y149-I249 HydrophobicContact CD2-CD1 3.85Å; Y149-I249 HydrophobicContact CD2-CG2 4.44Å; Y149-I249 HydrophobicContact CE2-CD1 3.34Å; Y149-M253 PolarHBondContact N-O 3.07Å; Y149-L254 HydrophobicContact CD1-CD1 4.27Å; Y149-L255 PolarHBondContact O-N 2.73Å
150	H	94.7	Very high	89.2	Confident	31 Å²	31	48.7 Å²	48.7	14%	0.144	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	109.5	175.5	-174.1	-161.1	0	0	0	109.7	S133 T152 L255	S133-H150 VanDerWaalsContact CA-CE1 3.43Å; S133-H150 WeakPolarHBondContact CA-CE1 3.26Å; S133-H150 PolarHBondContact N-CE1 2.86Å; H150-T152 WeakPolarHBondContact CE1-CG2 3.42Å; H150-T152 VanDerWaalsContact ND1-CG2 3.26Å; H150-T152 WeakPolarHBondContact ND1-CG2 3.36Å; H150-T152 WeakPolarHBondContact NE2-CG2 3.22Å; H150-T152 PolarHBondContact O-N 3.41Å; H150-L255 HydrophobicContact CB-CB 4.24Å; H150-L255 HydrophobicContact CB-CD1 4.19Å
151	L	92.2	Very high	89.3	Confident	16 Å²	16	49.8 Å²	49.8	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	99	176.8	-178.2	66.8	0	0	0	109.6	M239 A242 L243 L255 L256	L151-M239 HydrophobicContact CD1-SD 4.34Å; L151-M239 HydrophobicContact CD2-SD 4.48Å; L151-M239 HydrophobicContact CG-SD 4.38Å; L151-A242 HydrophobicContact CD1-CB 3.51Å; L151-L243 HydrophobicContact CD2-CB 3.88Å; L151-L243 HydrophobicContact CD2-CD1 3.68Å; L151-L243 HydrophobicContact CD2-CG 4.38Å; L151-L255 PolarHBondContact N-O 2.93Å; L151-L256 HydrophobicContact CB-CD2 3.86Å; L151-L256 HydrophobicContact CD2-CD2 3.88Å
152	T	84.4	Confident	89.3	Confident	69 Å²	69	47.3 Å²	47.3	42%	0.423	24%	0.242	S	C	.	.			trans	-111.5	-26.3	179.7	51.4	0	0	0	0	114.2	H150	H150-T152 WeakPolarHBondContact CE1-CG2 3.42Å; H150-T152 VanDerWaalsContact ND1-CG2 3.26Å; H150-T152 WeakPolarHBondContact ND1-CG2 3.36Å; H150-T152 WeakPolarHBondContact NE2-CG2 3.22Å; H150-T152 PolarHBondContact O-N 3.41Å
153	R	82.3	Confident	89.3	Confident	90 Å²	90	47.4 Å²	47.4	34%	0.34	24%	0.242	S	C	.	.	S	Bend	trans	-131.3	151.9	-168.3	-64.8	179.2	-177.8	-168.4	-3.1	111.3	E68 A242	E68-R153 IonicContact OE1-CZ 2.65Å; E68-R153 IonicContact OE1-NE 3.48Å; E68-R153 PolarHBondContact OE1-NE 2.88Å; E68-R153 IonicContact OE1-NH2 2.88Å; E68-R153 PolarHBondContact OE1-NH2 3.17Å; E68-R153 IonicContact OE2-NH2 2.79Å; E68-R153 PolarHBondContact OE2-NH2 2.96Å; R153-A242 WeakPolarHBondContact O-CB 3.49Å
154	E	86.9	Confident	89.4	Confident	76 Å²	76	51.2 Å²	51.2	36%	0.355	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-68.7	157.4	164.9	59	-178.7	-146.2	0	0	111	G235 R238 M239	E154-G235 WeakPolarHBondContact OE2-CA 3.47Å; E154-R238 HydrophobicContact CB-CB 4.12Å; E154-R238 IonicContact OE1-CZ 3.73Å; E154-R238 IonicContact OE1-NH1 2.72Å; E154-R238 PolarHBondContact OE1-NH1 2.94Å; E154-R238 IonicContact OE1-NH2 3.13Å; E154-R238 PolarHBondContact OE1-NH2 3.29Å; E154-R238 IonicContact OE2-NH2 3.97Å; E154-M239 HydrophobicContact CB-CB 4.12Å; E154-M239 HydrophobicContact CB-CE 4.11Å; E154-M239 VanDerWaalsContact N-CE 3.31Å
155	M	88.2	Confident	89.7	Confident	21 Å²	21	43.4 Å²	43.4	10%	0.103	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-62.8	138.2	170.8	-75.4	-67.2	169	0	0	110.5	L230 R238 V241 A242 R245	M155-L230 HydrophobicContact CB-CD1 4.15Å; M155-R238 HydrophobicContact CB-CB 4.3Å; M155-R238 PolarHBondContact N-O 2.79Å; M155-R238 WeakPolarHBondContact O-CB 3.43Å; M155-R238 WeakPolarHBondContact O-CD 3.41Å; M155-R238 PolarHBondContact O-NH1 2.97Å; M155-V241 HydrophobicContact CG-CB 4.23Å; M155-V241 HydrophobicContact CG-CG1 4.09Å; M155-A242 HydrophobicContact CE-CB 4.22Å; M155-A242 HydrophobicContact CG-CB 4.03Å; M155-R245 HydrophobicContact CE-CB 4.03Å; M155-R245 HydrophobicContact CE-CG 4.31Å
156	P	88.3	Confident	90.1	Very high	75 Å²	75	42 Å²	42	49%	0.487	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-62.2	150.3	173.7	27	-33.7	0	0	0	110.4	S158	P156-S158 PolarHBondContact O-N 2.96Å
157	P	89.1	Confident	90.1	Very high	44 Å²	44	44.8 Å²	44.8	29%	0.286	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-61	130.3	172.1	28.9	-32.2	0	0	0	108.4	V57 K231	V57-P157 HydrophobicContact CB-CG 4.48Å; V57-P157 HydrophobicContact CG1-CG 3.6Å; V57-P157 HydrophobicContact CG2-CG 3.97Å; P157-K231 HydrophobicContact CB-CB 4.14Å
158	S	90.7	Very high	89.9	Confident	34 Å²	34	45.8 Å²	45.8	24%	0.238	23%	0.234	C	C	.	.			trans	-151	165.9	-179.5	66.1	0	0	0	0	111.3	P156 K160 L230 K231	P156-S158 PolarHBondContact O-N 2.96Å; S158-K160 PolarHBondContact O-N 2.84Å; S158-L230 PolarHBondContact O-N 3.27Å; S158-L230 WeakPolarHBondContact OG-CD1 3.31Å; S158-K231 PolarHBondContact O-N 3.27Å
159	D	91.8	Very high	89.3	Confident	92 Å²	92	44.6 Å²	44.6	49%	0.492	23%	0.228	S	C	.	.	S	Bend	trans	-75	-6.1	174.3	-82.9	-52.6	0	0	0	113.8	K229 K231	D159-K229 HydrophobicContact CB-CD 4.45Å; D159-K229 WeakPolarHBondContact O-CG 3.35Å; D159-K229 WeakPolarHBondContact OD1-CD 3.31Å; D159-K229 WeakPolarHBondContact OD1-CE 3.45Å; D159-K229 IonicContact OD1-NZ 3.01Å; D159-K229 PolarHBondContact OD1-NZ 2.95Å; D159-K231 VanDerWaalsContact OD1-CE 3.25Å; D159-K231 WeakPolarHBondContact OD1-CE 3.25Å; D159-K231 IonicContact OD1-NZ 2.76Å; D159-K231 PolarHBondContact OD1-NZ 3.43Å; D159-K231 IonicContact OD2-NZ 2.71Å
160	K	92	Very high	88.4	Confident	85 Å²	85	48.2 Å²	48.2	37%	0.37	25%	0.25	S	S	.	.	S	Bend	trans	-75.7	153.4	178.8	-65.1	173.7	173.4	-172.1	0	111.2	S158 Q164 C165 E168 L230	S158-K160 PolarHBondContact O-N 2.84Å; K160-Q164 HydrophobicContact CB-CB 4.46Å; K160-C165 WeakPolarHBondContact CB-SG 3.25Å; K160-E168 WeakPolarHBondContact CD-OE1 3.29Å; K160-E168 WeakPolarHBondContact CE-OE1 3.24Å; K160-E168 IonicContact NZ-OE1 3.52Å; K160-E168 PolarHBondContact NZ-OE1 3.13Å; K160-E168 IonicContact NZ-OE2 3.8Å; K160-E168 PolarHBondContact NZ-OE2 3.04Å; K160-L230 PolarHBondContact O-N 3.35Å
161	T	93.5	Very high	87.6	Confident	25 Å²	25	51.1 Å²	51.1	15%	0.153	27%	0.27	C	S	.	.			trans	-85.1	156.9	174.7	73.1	0	0	0	0	111.3	L163 Q164 C165 Q226 R227 K228	T161-L163 PolarHBondContact O-N 3.29Å; T161-Q164 PolarHBondContact O-N 2.93Å; T161-Q164 VanDerWaalsContact O-N 3.12Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.31Å; T161-Q164 PolarHBondContact OG1-N 3.37Å; T161-C165 PolarHBondContact O-N 2.99Å; T161-Q226 WeakPolarHBondContact CB-O 3.27Å; T161-R227 WeakPolarHBondContact CG2-O 3.43Å; T161-K228 WeakPolarHBondContact CA-O 3.26Å
162	P	92.9	Very high	87	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-49.7	-41.7	171.9	-30.9	35	0	0	0	113.2	C165 V166 L216 F221 K228 L230 F233 V241	P162-C165 PolarHBondContact O-N 3.18Å; P162-V166 VanDerWaalsContact O-CG2 3.29Å; P162-V166 WeakPolarHBondContact O-CG2 3.49Å; P162-V166 PolarHBondContact O-N 2.94Å; P162-L216 HydrophobicContact CB-CD1 4Å; P162-L216 HydrophobicContact CB-CD2 3.98Å; P162-F221 HydrophobicContact CB-CD1 4.33Å; P162-F221 HydrophobicContact CB-CE1 4.19Å; P162-F221 HydrophobicContact CG-CD1 4.15Å; P162-F221 HydrophobicContact CG-CE1 3.91Å; P162-K228 WeakPolarHBondContact CD-O 3.46Å; P162-L230 HydrophobicContact CG-CD2 4.24Å; P162-F233 HydrophobicContact CG-CE2 3.8Å; P162-F233 HydrophobicContact CG-CZ 4.18Å; P162-V241 HydrophobicContact CB-CG1 4.33Å; P162-V241 HydrophobicContact CB-CG2 3.82Å; P162-V241 HydrophobicContact CG-CG2 4.12Å
163	L	91.2	Very high	86.7	Confident	17 Å²	17	52 Å²	52	9%	0.089	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-45.4	179.9	-170.8	65.2	0	0	0	111.6	T161 V166 M167 E209 A212 L216	T161-L163 PolarHBondContact O-N 3.29Å; L163-V166 PolarHBondContact O-N 3.29Å; L163-M167 HydrophobicContact CG-CE 3.94Å; L163-M167 HydrophobicContact CG-SD 4.31Å; L163-M167 VanDerWaalsContact O-CG 3.28Å; L163-M167 WeakPolarHBondContact O-CG 3.45Å; L163-M167 PolarHBondContact O-N 3.04Å; L163-M167 VanDerWaalsContact O-N 3.09Å; L163-E209 HydrophobicContact CD1-CG 4.24Å; L163-E209 HydrophobicContact CD2-CG 3.85Å; L163-E209 HydrophobicContact CG-CG 4.33Å; L163-A212 HydrophobicContact CD1-CB 3.78Å; L163-L216 HydrophobicContact CB-CD1 4.31Å; L163-L216 HydrophobicContact CD1-CD1 4.2Å
164	Q	91.2	Very high	86.7	Confident	90 Å²	90	49.2 Å²	49.2	42%	0.421	26%	0.262	S	S	.	.	H	α-helix	trans	-60.4	-48.8	175.9	-72.5	169.9	-23.8	0	0	111.1	K160 T161 V166 M167 E168	K160-Q164 HydrophobicContact CB-CB 4.46Å; T161-Q164 PolarHBondContact O-N 2.93Å; T161-Q164 VanDerWaalsContact O-N 3.12Å; T161-Q164 WeakPolarHBondContact OG1-CG 3.31Å; T161-Q164 PolarHBondContact OG1-N 3.37Å; Q164-V166 VanDerWaalsContact C-N 3.29Å; Q164-V166 PolarHBondContact O-N 3.44Å; Q164-M167 CarbonylContact O-C 3.59Å; Q164-M167 PolarHBondContact O-N 2.87Å; Q164-M167 VanDerWaalsContact O-N 3.11Å; Q164-E168 VanDerWaalsContact O-CG 3.27Å; Q164-E168 WeakPolarHBondContact O-CG 3.25Å; Q164-E168 PolarHBondContact O-N 3.4Å
165	C	91.1	Very high	86.5	Confident	5 Å²	5	51 Å²	51	3%	0.034	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-29.3	-178.2	-70.4	0	0	0	0	114.5	K160 T161 P162 L230 V241	K160-C165 WeakPolarHBondContact CB-SG 3.25Å; T161-C165 PolarHBondContact O-N 2.99Å; P162-C165 PolarHBondContact O-N 3.18Å; C165-L230 HydrophobicContact CB-CD1 4.04Å; C165-L230 WeakPolarHBondContact SG-CD1 3.31Å; C165-V241 HydrophobicContact CB-CG1 4.15Å
166	V	90	Very high	86.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.2	-37.4	173.7	173.2	0	0	0	0	111.1	P162 L163 Q164 A212 L216 V241 A244 R245 F248	P162-V166 VanDerWaalsContact O-CG2 3.29Å; P162-V166 WeakPolarHBondContact O-CG2 3.49Å; P162-V166 PolarHBondContact O-N 2.94Å; L163-V166 PolarHBondContact O-N 3.29Å; Q164-V166 VanDerWaalsContact C-N 3.29Å; Q164-V166 PolarHBondContact O-N 3.44Å; V166-A212 HydrophobicContact CB-CB 4.22Å; V166-A212 HydrophobicContact CG1-CB 3.6Å; V166-L216 HydrophobicContact CG2-CD1 4.2Å; V166-L216 HydrophobicContact CG2-CD2 4.05Å; V166-L216 HydrophobicContact CG2-CG 4.18Å; V166-V241 HydrophobicContact CG2-CG1 4.11Å; V166-A244 HydrophobicContact CG2-CB 3.67Å; V166-R245 HydrophobicContact CG2-CB 4.46Å; V166-F248 HydrophobicContact CG1-CB 3.6Å; V166-F248 HydrophobicContact CG1-CD1 4.19Å; V166-F248 HydrophobicContact CG1-CD2 4.1Å; V166-F248 HydrophobicContact CG1-CG 3.71Å; V166-F248 WeakPolarHBondContact O-CD1 3.42Å
167	M	86.2	Confident	86	Confident	58 Å²	58	50.5 Å²	50.5	29%	0.286	26%	0.263	S	S	.	.	H	α-helix	trans	-79	-17.9	179.2	-67.5	-173.7	-51.4	0	0	113.9	L163 Q164 V169 E209 A212	L163-M167 HydrophobicContact CG-CE 3.94Å; L163-M167 HydrophobicContact CG-SD 4.31Å; L163-M167 VanDerWaalsContact O-CG 3.28Å; L163-M167 WeakPolarHBondContact O-CG 3.45Å; L163-M167 PolarHBondContact O-N 3.04Å; L163-M167 VanDerWaalsContact O-N 3.09Å; Q164-M167 CarbonylContact O-C 3.59Å; Q164-M167 PolarHBondContact O-N 2.87Å; Q164-M167 VanDerWaalsContact O-N 3.11Å; M167-V169 PolarHBondContact O-N 3.4Å; M167-E209 VanDerWaalsContact SD-CA 3.58Å; M167-E209 HydrophobicContact SD-CB 3.8Å; M167-E209 HydrophobicContact SD-CG 4.02Å; M167-A212 HydrophobicContact CG-CB 3.89Å
168	E	85.3	Confident	85.8	Confident	60 Å²	60	56.6 Å²	56.6	28%	0.28	28%	0.28	S	S	.	.			trans	-69.8	77.3	175.3	-80.2	174.7	-175.6	0	0	111.3	K160 Q164 R245	K160-E168 WeakPolarHBondContact CD-OE1 3.29Å; K160-E168 WeakPolarHBondContact CE-OE1 3.24Å; K160-E168 IonicContact NZ-OE1 3.52Å; K160-E168 PolarHBondContact NZ-OE1 3.13Å; K160-E168 IonicContact NZ-OE2 3.8Å; K160-E168 PolarHBondContact NZ-OE2 3.04Å; Q164-E168 VanDerWaalsContact O-CG 3.27Å; Q164-E168 WeakPolarHBondContact O-CG 3.25Å; Q164-E168 PolarHBondContact O-N 3.4Å; E168-R245 VanDerWaalsContact O-CZ 3.29Å; E168-R245 PolarHBondContact O-NH2 3.01Å
169	V	79.5	Confident	85.4	Confident	7 Å²	7	56.8 Å²	56.8	4%	0.042	28%	0.277	C	S	.	.			trans	-121.2	16.7	179.5	-61.1	0	0	0	0	112.7	M167 T171 E172 R173 L203 F248 I249	M167-V169 PolarHBondContact O-N 3.4Å; V169-T171 PolarHBondContact O-N 3.11Å; V169-E172 WeakPolarHBondContact CA-OE2 3.31Å; V169-E172 PolarHBondContact O-N 3.19Å; V169-E172 VanDerWaalsContact O-N 3.12Å; V169-R173 WeakPolarHBondContact O-CB 3.48Å; V169-R173 PolarHBondContact O-N 2.83Å; V169-L203 HydrophobicContact CG2-CD2 4.25Å; V169-F248 HydrophobicContact CB-CE1 4.49Å; V169-F248 HydrophobicContact CG1-CD1 3.71Å; V169-F248 HydrophobicContact CG1-CE1 3.78Å; V169-F248 HydrophobicContact CG2-CE1 3.89Å; V169-I249 HydrophobicContact CB-CG1 4.42Å; V169-I249 HydrophobicContact CG1-CD1 4.1Å; V169-I249 HydrophobicContact CG1-CG1 3.52Å
170	D	75.3	Confident	85	Confident	118 Å²	118	52.5 Å²	52.5	63%	0.631	26%	0.255	S	S	*	.	H	α-helix	trans	-57.7	-37	-175.2	-66.2	-44	0	0	0	112.1	A174	D170-A174 VanDerWaalsContact O-CB 3.23Å; D170-A174 WeakPolarHBondContact O-CB 3.48Å; D170-A174 PolarHBondContact O-N 3.49Å
171	T	77.3	Confident	84.7	Confident	91 Å²	91	53.9 Å²	53.9	56%	0.558	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-45.2	177.2	41.2	0	0	0	0	112.2	V169 A174 M175	V169-T171 PolarHBondContact O-N 3.11Å; T171-A174 PolarHBondContact O-N 3.35Å; T171-M175 WeakPolarHBondContact O-CG 3.47Å; T171-M175 PolarHBondContact O-N 2.77Å
172	E	79.1	Confident	84.3	Confident	25 Å²	25	57.2 Å²	57.2	12%	0.117	27%	0.273	C	S	.	.	H	α-helix	trans	-69.4	-42.3	-180	-64.3	87.1	152.7	0	0	110.5	V169 M175 L176 R245 I249	V169-E172 WeakPolarHBondContact CA-OE2 3.31Å; V169-E172 PolarHBondContact O-N 3.19Å; V169-E172 VanDerWaalsContact O-N 3.12Å; E172-M175 HydrophobicContact CG-CE 4.31Å; E172-M175 PolarHBondContact O-N 3.34Å; E172-L176 VanDerWaalsContact O-CG 3.26Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.29Å; E172-R245 IonicContact OE1-CZ 3.96Å; E172-R245 IonicContact OE1-NE 3.01Å; E172-R245 IonicContact OE1-NH2 3.93Å; E172-R245 PolarHBondContact OE1-NH2 3.18Å; E172-R245 IonicContact OE2-NH2 2.72Å; E172-I249 HydrophobicContact CG-CD1 4.13Å; E172-I249 HydrophobicContact CG-CG2 4.4Å; E172-I249 WeakPolarHBondContact OE1-CD1 3.31Å
173	R	79.9	Confident	83.8	Confident	79 Å²	79	57.7 Å²	57.7	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-49.6	173.4	-178.9	-179.8	170.3	162.5	3.4	111.2	V169 M175 L176 E177 L200	V169-R173 WeakPolarHBondContact O-CB 3.48Å; V169-R173 PolarHBondContact O-N 2.83Å; R173-M175 VanDerWaalsContact C-N 3.3Å; R173-M175 PolarHBondContact O-N 2.71Å; R173-L176 PolarHBondContact O-N 2.83Å; R173-L176 VanDerWaalsContact O-N 3.15Å; R173-E177 HydrophobicContact CG-CG 4.41Å; R173-E177 IonicContact CZ-OE1 3.6Å; R173-E177 IonicContact NE-OE1 2.85Å; R173-E177 PolarHBondContact NE-OE1 2.82Å; R173-E177 IonicContact NH2-OE1 3.44Å; R173-E177 PolarHBondContact NH2-OE1 2.84Å; R173-E177 WeakPolarHBondContact O-CG 3.49Å; R173-E177 PolarHBondContact O-N 3.42Å; R173-L200 HydrophobicContact CG-CD2 4.18Å
174	A	80.7	Confident	83.4	Confident	32 Å²	32	58.6 Å²	58.6	26%	0.264	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-37.1	178.8	0	0	0	0	0	112.4	D170 T171 R178	D170-A174 VanDerWaalsContact O-CB 3.23Å; D170-A174 WeakPolarHBondContact O-CB 3.48Å; D170-A174 PolarHBondContact O-N 3.49Å; T171-A174 PolarHBondContact O-N 3.35Å; A174-R178 WeakPolarHBondContact O-CG 3.42Å; A174-R178 PolarHBondContact O-N 3.32Å; A174-R178 VanDerWaalsContact O-N 3.11Å
175	M	82.7	Confident	83.1	Confident	112 Å²	112	62.8 Å²	62.8	55%	0.552	30%	0.304	S	S	*	.	H	α-helix	trans	-64.2	-43.8	173.7	-75.1	-172.1	-69.2	0	0	112	T171 E172 R173 R178 E179	T171-M175 WeakPolarHBondContact O-CG 3.47Å; T171-M175 PolarHBondContact O-N 2.77Å; E172-M175 HydrophobicContact CG-CE 4.31Å; E172-M175 PolarHBondContact O-N 3.34Å; R173-M175 VanDerWaalsContact C-N 3.3Å; R173-M175 PolarHBondContact O-N 2.71Å; M175-R178 PolarHBondContact O-N 2.84Å; M175-E179 PolarHBondContact O-N 3.49Å
176	L	81.3	Confident	82.6	Confident	13 Å²	13	68.5 Å²	68.5	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-37.6	178.2	-68.4	167.7	0	0	0	112.6	E172 R173 E179 A180 L196 R199 L200 L203	E172-L176 VanDerWaalsContact O-CG 3.26Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.29Å; R173-L176 PolarHBondContact O-N 2.83Å; R173-L176 VanDerWaalsContact O-N 3.15Å; L176-E179 PolarHBondContact O-N 3.39Å; L176-A180 VanDerWaalsContact O-CB 3.27Å; L176-A180 WeakPolarHBondContact O-CB 3.41Å; L176-A180 PolarHBondContact O-N 3.42Å; L176-L196 HydrophobicContact CD2-CD2 3.62Å; L176-R199 HydrophobicContact CD1-CG 4.08Å; L176-R199 VanDerWaalsContact CD2-NH1 3.35Å; L176-L200 HydrophobicContact CB-CD2 3.71Å; L176-L200 HydrophobicContact CB-CG 4.26Å; L176-L203 HydrophobicContact CD1-CD1 3.57Å
177	E	84.5	Confident	81.9	Confident	73 Å²	73	72.6 Å²	72.6	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-62.1	-47.1	175.1	-73.5	174.9	175	0	0	110.8	R173 E179 A180 E181 L200	R173-E177 HydrophobicContact CG-CG 4.41Å; R173-E177 IonicContact CZ-OE1 3.6Å; R173-E177 IonicContact NE-OE1 2.85Å; R173-E177 PolarHBondContact NE-OE1 2.82Å; R173-E177 IonicContact NH2-OE1 3.44Å; R173-E177 PolarHBondContact NH2-OE1 2.84Å; R173-E177 WeakPolarHBondContact O-CG 3.49Å; R173-E177 PolarHBondContact O-N 3.42Å; E177-E179 PolarHBondContact O-N 3.05Å; E177-A180 PolarHBondContact O-N 3.02Å; E177-E181 WeakPolarHBondContact O-CG 3.44Å; E177-E181 PolarHBondContact O-N 3.35Å; E177-L200 HydrophobicContact CG-CD1 4.05Å; E177-L200 HydrophobicContact CG-CD2 3.61Å; E177-L200 HydrophobicContact CG-CG 4.5Å
178	R	85.6	Confident	81.3	Confident	173 Å²	173	72.2 Å²	72.2	65%	0.653	36%	0.358	S	S	*	.	H	α-helix	trans	-60.8	-43	176	-71.6	176.4	-165	156.3	4.9	112.7	A174 M175 E181 R182	A174-R178 WeakPolarHBondContact O-CG 3.42Å; A174-R178 PolarHBondContact O-N 3.32Å; A174-R178 VanDerWaalsContact O-N 3.11Å; M175-R178 PolarHBondContact O-N 2.84Å; R178-E181 PolarHBondContact O-N 3.29Å; R178-R182 WeakPolarHBondContact O-CB 3.45Å; R178-R182 PolarHBondContact O-N 3.11Å
179	E	82.1	Confident	80.5	Confident	37 Å²	37	77 Å²	77	17%	0.173	38%	0.381	C	S	.	.	H	α-helix	trans	-68.8	-38.3	179.5	-178.4	62.8	-179.2	0	0	111.7	M175 L176 E177 E181 R182 L183 L196	M175-E179 PolarHBondContact O-N 3.49Å; L176-E179 PolarHBondContact O-N 3.39Å; E177-E179 PolarHBondContact O-N 3.05Å; E179-E181 VanDerWaalsContact C-N 3.35Å; E179-R182 PolarHBondContact O-N 3.11Å; E179-R182 IonicContact OE1-CZ 3.79Å; E179-R182 IonicContact OE1-NE 3.83Å; E179-R182 IonicContact OE1-NH2 3.74Å; E179-R182 PolarHBondContact OE1-NH2 3.22Å; E179-R182 IonicContact OE2-CZ 2.87Å; E179-R182 IonicContact OE2-NE 3.39Å; E179-R182 PolarHBondContact OE2-NE 3.28Å; E179-R182 IonicContact OE2-NH2 3.87Å; E179-R182 PolarHBondContact OE2-NH2 2.97Å; E179-L183 HydrophobicContact CG-CD1 4.21Å; E179-L183 WeakPolarHBondContact O-CB 3.4Å; E179-L183 WeakPolarHBondContact O-CG 3.46Å; E179-L183 PolarHBondContact O-N 2.75Å; E179-L196 HydrophobicContact CB-CD1 4.36Å; E179-L196 HydrophobicContact CG-CD1 3.85Å
180	A	84.1	Confident	80	Confident	3 Å²	3	78 Å²	78	3%	0.025	39%	0.387	C	S	.	.	H	α-helix	trans	-64	-40.2	173.6	0	0	0	0	0	111.6	L176 E177 A184 L193 L196 Y197 L200	L176-A180 VanDerWaalsContact O-CB 3.27Å; L176-A180 WeakPolarHBondContact O-CB 3.41Å; L176-A180 PolarHBondContact O-N 3.42Å; E177-A180 PolarHBondContact O-N 3.02Å; A180-A184 WeakPolarHBondContact O-CB 3.41Å; A180-A184 PolarHBondContact O-N 3.07Å; A180-L193 HydrophobicContact CB-CD1 4.05Å; A180-L193 VanDerWaalsContact O-CD1 3.23Å; A180-L193 WeakPolarHBondContact O-CD1 3.34Å; A180-L196 HydrophobicContact CB-CB 4.27Å; A180-L196 HydrophobicContact CB-CD1 4.2Å; A180-Y197 HydrophobicContact CB-CE1 4.27Å; A180-L200 HydrophobicContact CB-CD1 4.13Å
181	E	85.9	Confident	79.9	Confident	114 Å²	114	79.9 Å²	79.9	53%	0.533	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-44.9	174.3	-75.1	176	178.7	0	0	112.1	E177 R178 E179 A184 H185	E177-E181 WeakPolarHBondContact O-CG 3.44Å; E177-E181 PolarHBondContact O-N 3.35Å; R178-E181 PolarHBondContact O-N 3.29Å; E179-E181 VanDerWaalsContact C-N 3.35Å; E181-A184 PolarHBondContact O-N 3.08Å; E181-H185 PolarHBondContact O-N 3.35Å
182	R	85	Confident	79.6	Confident	95 Å²	95	76.7 Å²	76.7	36%	0.358	37%	0.371	S	S	.	.	H	α-helix	trans	-58.8	-52.7	176.3	-172.5	-175.9	72.9	87.3	-2.3	111.4	R178 E179 A184 H185 E186	R178-R182 WeakPolarHBondContact O-CB 3.45Å; R178-R182 PolarHBondContact O-N 3.11Å; E179-R182 PolarHBondContact O-N 3.11Å; E179-R182 IonicContact OE1-CZ 3.79Å; E179-R182 IonicContact OE1-NE 3.83Å; E179-R182 IonicContact OE1-NH2 3.74Å; E179-R182 PolarHBondContact OE1-NH2 3.22Å; E179-R182 IonicContact OE2-CZ 2.87Å; E179-R182 IonicContact OE2-NE 3.39Å; E179-R182 PolarHBondContact OE2-NE 3.28Å; E179-R182 IonicContact OE2-NH2 3.87Å; E179-R182 PolarHBondContact OE2-NH2 2.97Å; R182-A184 VanDerWaalsContact C-N 3.34Å; R182-A184 PolarHBondContact O-N 3.18Å; R182-H185 WeakPolarHBondContact O-CB 3.48Å; R182-H185 PolarHBondContact O-N 3.42Å; R182-H185 VanDerWaalsContact O-N 3.1Å; R182-E186 IonicContact CZ-OE1 2.89Å; R182-E186 IonicContact CZ-OE2 2.81Å; R182-E186 IonicContact NH1-OE1 3.5Å; R182-E186 PolarHBondContact NH1-OE1 2.85Å; R182-E186 IonicContact NH1-OE2 3.68Å; R182-E186 PolarHBondContact NH1-OE2 3.1Å; R182-E186 PolarHBondContact O-N 3.17Å
183	L	82.1	Confident	79.6	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.052	37%	0.367	C	S	.	.	H	α-helix	trans	-64.9	-36.7	179.7	-72.8	172.1	0	0	0	112.3	E179 H185 E186 D187 K192 L193 L196	E179-L183 HydrophobicContact CG-CD1 4.21Å; E179-L183 WeakPolarHBondContact O-CB 3.4Å; E179-L183 WeakPolarHBondContact O-CG 3.46Å; E179-L183 PolarHBondContact O-N 2.75Å; L183-H185 PolarHBondContact O-N 3.15Å; L183-E186 PolarHBondContact O-N 3.01Å; L183-D187 CarbonylContact O-C 3.26Å; L183-D187 VanDerWaalsContact O-C 3.26Å; L183-D187 PolarHBondContact O-N 3.43Å; L183-D187 VanDerWaalsContact O-O 3.07Å; L183-K192 HydrophobicContact CD1-CB 4.07Å; L183-K192 HydrophobicContact CD1-CD 4.46Å; L183-L193 HydrophobicContact CB-CD1 4.39Å; L183-L196 HydrophobicContact CD1-CD1 3.57Å
184	A	83.1	Confident	79.6	Confident	35 Å²	35	77 Å²	77	29%	0.289	38%	0.377	S	S	.	.	H	α-helix	trans	-64.6	-27.6	174.8	0	0	0	0	0	113	A180 E181 R182 L193	A180-A184 WeakPolarHBondContact O-CB 3.41Å; A180-A184 PolarHBondContact O-N 3.07Å; E181-A184 PolarHBondContact O-N 3.08Å; R182-A184 VanDerWaalsContact C-N 3.34Å; R182-A184 PolarHBondContact O-N 3.18Å; A184-L193 HydrophobicContact CB-CD1 4.12Å; A184-L193 HydrophobicContact CB-CD2 3.88Å
185	H	84.4	Confident	79.5	Confident	178 Å²	178	79.2 Å²	79.2	82%	0.824	38%	0.382	S	S	*	.	H	α-helix	trans	-80.6	-38.9	175.7	-157.8	68.5	0	0	0	112.6	E181 R182 L183	E181-H185 PolarHBondContact O-N 3.35Å; R182-H185 WeakPolarHBondContact O-CB 3.48Å; R182-H185 PolarHBondContact O-N 3.42Å; R182-H185 VanDerWaalsContact O-N 3.1Å; L183-H185 PolarHBondContact O-N 3.15Å
186	E	81.1	Confident	79.4	Confident	125 Å²	125	74.8 Å²	74.8	58%	0.584	36%	0.36	S	S	*	.	H	α-helix	trans	-74.7	-49.7	179.5	-71.5	174.9	-170.5	0	0	112.6	R182 L183	R182-E186 IonicContact CZ-OE1 2.89Å; R182-E186 IonicContact CZ-OE2 2.81Å; R182-E186 IonicContact NH1-OE1 3.5Å; R182-E186 PolarHBondContact NH1-OE1 2.85Å; R182-E186 IonicContact NH1-OE2 3.68Å; R182-E186 PolarHBondContact NH1-OE2 3.1Å; R182-E186 PolarHBondContact O-N 3.17Å; L183-E186 PolarHBondContact O-N 3.01Å
187	D	75.3	Confident	79.5	Confident	86 Å²	86	77.7 Å²	77.7	46%	0.46	37%	0.371	S	S	.	.			trans	-153.7	99.4	179.5	-178.8	5.3	0	0	0	111.2	L183 E189 C190	L183-D187 CarbonylContact O-C 3.26Å; L183-D187 VanDerWaalsContact O-C 3.26Å; L183-D187 PolarHBondContact O-N 3.43Å; L183-D187 VanDerWaalsContact O-O 3.07Å; D187-E189 PolarHBondContact O-N 3.28Å; D187-E189 VanDerWaalsContact O-N 3.08Å; D187-E189 PolarHBondContact OD1-N 3.32Å; D187-C190 HydrophobicContact CB-CB 4.21Å; D187-C190 WeakPolarHBondContact O-CB 3.26Å; D187-C190 PolarHBondContact O-N 2.96Å
188	A	72.3	Confident	79.4	Confident	50 Å²	50	79.2 Å²	79.2	41%	0.413	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.3	-179.2	0	0	0	0	0	114.6	K14	K14-A188 PolarHBondContact NZ-O 2.89Å
189	E	68.4	Low	79.2	Confident	162 Å²	162	71.1 Å²	71.1	76%	0.757	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	4.3	175	-61.4	-164.7	163.7	0	0	113.2	D187 E191	D187-E189 PolarHBondContact O-N 3.28Å; D187-E189 VanDerWaalsContact O-N 3.08Å; D187-E189 PolarHBondContact OD1-N 3.32Å; E189-E191 PolarHBondContact O-N 3.25Å
190	C	70.9	Confident	79.3	Confident	26 Å²	26	70.6 Å²	70.6	18%	0.176	35%	0.346	C	S	.	.			trans	-57.5	124.4	178.1	-168.1	0	0	0	0	111.4	D187 K192 L193	D187-C190 HydrophobicContact CB-CB 4.21Å; D187-C190 WeakPolarHBondContact O-CB 3.26Å; D187-C190 PolarHBondContact O-N 2.96Å; C190-K192 PolarHBondContact O-N 3.12Å; C190-K192 VanDerWaalsContact O-N 3.13Å; C190-L193 HydrophobicContact CB-CB 4.47Å; C190-L193 VanDerWaalsContact O-CB 3.27Å; C190-L193 WeakPolarHBondContact O-CB 3.44Å; C190-L193 PolarHBondContact O-N 3.26Å
191	E	72.5	Confident	79.1	Confident	158 Å²	158	75.7 Å²	75.7	74%	0.738	37%	0.369	S	S	*	.	H	α-helix	trans	-54.6	-33.9	177.4	-70.9	-173.2	155.3	0	0	112.2	E189 L193 M194 E195	E189-E191 PolarHBondContact O-N 3.25Å; E191-L193 PolarHBondContact O-N 3.05Å; E191-M194 WeakPolarHBondContact O-CB 3.31Å; E191-M194 PolarHBondContact O-N 3.18Å; E191-M194 VanDerWaalsContact O-N 3.12Å; E191-E195 PolarHBondContact O-N 3.43Å
192	K	70.8	Confident	78.8	Confident	25 Å²	25	74 Å²	74	11%	0.109	36%	0.361	C	S	.	.	H	α-helix	trans	-58.2	-34.9	176	-59.2	-178.3	176.6	-168.7	0	113.1	N86 H145 L183 C190 M194 E195 L196	N86-K192 WeakPolarHBondContact O-CE 3.25Å; N86-K192 PolarHBondContact O-NZ 3.42Å; H145-K192 PolarHBondContact CD2-NZ 3.31Å; H145-K192 PolarHBondContact CE1-NZ 3.22Å; H145-K192 PolarHBondContact ND1-NZ 3.49Å; H145-K192 PolarHBondContact NE2-NZ 2.7Å; L183-K192 HydrophobicContact CD1-CB 4.07Å; L183-K192 HydrophobicContact CD1-CD 4.46Å; C190-K192 PolarHBondContact O-N 3.12Å; C190-K192 VanDerWaalsContact O-N 3.13Å; K192-M194 VanDerWaalsContact C-N 3.28Å; K192-M194 PolarHBondContact O-N 3.14Å; K192-E195 PolarHBondContact O-N 2.95Å; K192-L196 WeakPolarHBondContact O-CG 3.31Å; K192-L196 PolarHBondContact O-N 2.79Å
193	L	78.5	Confident	78.5	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-36	-179.3	-175.8	63	0	0	0	110.8	A180 L183 A184 C190 E191 L196 Y197	A180-L193 HydrophobicContact CB-CD1 4.05Å; A180-L193 VanDerWaalsContact O-CD1 3.23Å; A180-L193 WeakPolarHBondContact O-CD1 3.34Å; L183-L193 HydrophobicContact CB-CD1 4.39Å; A184-L193 HydrophobicContact CB-CD1 4.12Å; A184-L193 HydrophobicContact CB-CD2 3.88Å; C190-L193 HydrophobicContact CB-CB 4.47Å; C190-L193 VanDerWaalsContact O-CB 3.27Å; C190-L193 WeakPolarHBondContact O-CB 3.44Å; C190-L193 PolarHBondContact O-N 3.26Å; E191-L193 PolarHBondContact O-N 3.05Å; L193-L196 PolarHBondContact O-N 3.47Å; L193-Y197 HydrophobicContact CD1-CD2 4.23Å; L193-Y197 HydrophobicContact CD1-CE1 4.39Å; L193-Y197 HydrophobicContact CD1-CE2 3.68Å; L193-Y197 HydrophobicContact CD2-CE2 3.83Å; L193-Y197 HydrophobicContact CG-CD2 3.9Å; L193-Y197 HydrophobicContact CG-CE2 3.45Å; L193-Y197 VanDerWaalsContact CG-CE2 3.45Å; L193-Y197 VanDerWaalsContact O-CD2 3.24Å; L193-Y197 WeakPolarHBondContact O-CD2 3.35Å; L193-Y197 PolarHBondContact O-N 2.89Å
194	M	79.4	Confident	78.1	Confident	105 Å²	105	70.8 Å²	70.8	52%	0.517	35%	0.351	S	S	.	.	H	α-helix	trans	-65.5	-43.9	174.5	-71.6	-175.5	-86.2	0	0	111.3	E191 K192 L196 Y197 E198	E191-M194 WeakPolarHBondContact O-CB 3.31Å; E191-M194 PolarHBondContact O-N 3.18Å; E191-M194 VanDerWaalsContact O-N 3.12Å; K192-M194 VanDerWaalsContact C-N 3.28Å; K192-M194 PolarHBondContact O-N 3.14Å; M194-L196 VanDerWaalsContact C-N 3.33Å; M194-L196 PolarHBondContact O-N 3.04Å; M194-Y197 PolarHBondContact O-N 2.94Å; M194-E198 WeakPolarHBondContact O-CG 3.4Å; M194-E198 PolarHBondContact O-N 3.42Å
195	E	79.2	Confident	77.5	Confident	77 Å²	77	72.1 Å²	72.1	36%	0.36	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-37.4	176.4	-64.5	-173	168.7	0	0	112.8	E191 K192 R199	E191-E195 PolarHBondContact O-N 3.43Å; K192-E195 PolarHBondContact O-N 2.95Å; E195-R199 WeakPolarHBondContact O-CB 3.47Å; E195-R199 PolarHBondContact O-N 3Å
196	L	81.3	Confident	76.9	Confident	20 Å²	20	70.6 Å²	70.6	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-43.9	175	-74.1	178.1	0	0	0	111.8	L176 E179 A180 L183 K192 L193 M194 R199 L200	L176-L196 HydrophobicContact CD2-CD2 3.62Å; E179-L196 HydrophobicContact CB-CD1 4.36Å; E179-L196 HydrophobicContact CG-CD1 3.85Å; A180-L196 HydrophobicContact CB-CB 4.27Å; A180-L196 HydrophobicContact CB-CD1 4.2Å; L183-L196 HydrophobicContact CD1-CD1 3.57Å; K192-L196 WeakPolarHBondContact O-CG 3.31Å; K192-L196 PolarHBondContact O-N 2.79Å; L193-L196 PolarHBondContact O-N 3.47Å; M194-L196 VanDerWaalsContact C-N 3.33Å; M194-L196 PolarHBondContact O-N 3.04Å; L196-R199 WeakPolarHBondContact O-CB 3.43Å; L196-R199 PolarHBondContact O-N 3.13Å; L196-R199 VanDerWaalsContact O-N 3.16Å; L196-L200 WeakPolarHBondContact O-CG 3.05Å; L196-L200 PolarHBondContact O-N 3.28Å
197	Y	83.6	Confident	76.7	Confident	73 Å²	73	72.5 Å²	72.5	29%	0.286	37%	0.366	S	S	.	.	H	α-helix	trans	-64.6	-39.7	176.1	-74.5	-41.9	0	0	0	112.7	A180 L193 M194 R199 L200 E201	A180-Y197 HydrophobicContact CB-CE1 4.27Å; L193-Y197 HydrophobicContact CD1-CD2 4.23Å; L193-Y197 HydrophobicContact CD1-CE1 4.39Å; L193-Y197 HydrophobicContact CD1-CE2 3.68Å; L193-Y197 HydrophobicContact CD2-CE2 3.83Å; L193-Y197 HydrophobicContact CG-CD2 3.9Å; L193-Y197 HydrophobicContact CG-CE2 3.45Å; L193-Y197 VanDerWaalsContact CG-CE2 3.45Å; L193-Y197 VanDerWaalsContact O-CD2 3.24Å; L193-Y197 WeakPolarHBondContact O-CD2 3.35Å; L193-Y197 PolarHBondContact O-N 2.89Å; M194-Y197 PolarHBondContact O-N 2.94Å; Y197-R199 PolarHBondContact O-N 3.34Å; Y197-L200 HydrophobicContact CD1-CD1 4.31Å; Y197-L200 PolarHBondContact O-N 3.08Å; Y197-E201 WeakPolarHBondContact O-CB 3.48Å; Y197-E201 PolarHBondContact O-N 2.63Å
198	E	82.8	Confident	77	Confident	105 Å²	105	69 Å²	69	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-59.3	-39.9	172.4	-74.9	-175.3	171.4	0	0	111.2	M194 E201 E202	M194-E198 WeakPolarHBondContact O-CG 3.4Å; M194-E198 PolarHBondContact O-N 3.42Å; E198-E201 PolarHBondContact O-N 3.44Å; E198-E202 WeakPolarHBondContact O-CG 3.39Å; E198-E202 PolarHBondContact O-N 3.03Å
199	R	81.1	Confident	77.6	Confident	3 Å²	3	71.7 Å²	71.7	1%	0.011	35%	0.353	C	S	.	.	H	α-helix	trans	-69.8	-40.8	177.2	-169.2	176.7	176	-167.8	-1	113.4	D147 L176 E195 L196 Y197 E201 E202 L203 I249 R250	D147-R199 IonicContact OD1-CZ 2.82Å; D147-R199 IonicContact OD1-NH1 3.69Å; D147-R199 PolarHBondContact OD1-NH1 3Å; D147-R199 IonicContact OD2-CZ 3.74Å; D147-R199 IonicContact OD2-NH1 3.75Å; D147-R199 PolarHBondContact OD2-NH1 3.27Å; D147-R199 IonicContact OD2-NH2 3.71Å; D147-R199 PolarHBondContact OD2-NH2 3.45Å; L176-R199 HydrophobicContact CD1-CG 4.08Å; L176-R199 VanDerWaalsContact CD2-NH1 3.35Å; E195-R199 WeakPolarHBondContact O-CB 3.47Å; E195-R199 PolarHBondContact O-N 3Å; L196-R199 WeakPolarHBondContact O-CB 3.43Å; L196-R199 PolarHBondContact O-N 3.13Å; L196-R199 VanDerWaalsContact O-N 3.16Å; Y197-R199 PolarHBondContact O-N 3.34Å; R199-E201 VanDerWaalsContact C-N 3.27Å; R199-E201 PolarHBondContact O-N 2.91Å; R199-E202 WeakPolarHBondContact O-CB 3.2Å; R199-E202 PolarHBondContact O-N 2.98Å; R199-E202 VanDerWaalsContact O-N 3.16Å; R199-L203 HydrophobicContact CG-CD1 4.38Å; R199-L203 WeakPolarHBondContact O-CG 3.46Å; R199-L203 PolarHBondContact O-N 2.86Å; R199-I249 PolarHBondContact NE-O 2.91Å; R199-I249 PolarHBondContact NH2-O 3.23Å; R199-I249 VanDerWaalsContact NH2-O 3.17Å; R199-R250 PolarHBondContact NE-O 3.41Å
200	L	82.8	Confident	78.5	Confident	27 Å²	27	68.9 Å²	68.9	14%	0.141	34%	0.341	C	S	.	.	H	α-helix	trans	-62.7	-37.2	173.9	-73.5	171.7	0	0	0	111.3	R173 L176 E177 A180 L196 Y197 E202 L203 D204	R173-L200 HydrophobicContact CG-CD2 4.18Å; L176-L200 HydrophobicContact CB-CD2 3.71Å; L176-L200 HydrophobicContact CB-CG 4.26Å; E177-L200 HydrophobicContact CG-CD1 4.05Å; E177-L200 HydrophobicContact CG-CD2 3.61Å; E177-L200 HydrophobicContact CG-CG 4.5Å; A180-L200 HydrophobicContact CB-CD1 4.13Å; L196-L200 WeakPolarHBondContact O-CG 3.05Å; L196-L200 PolarHBondContact O-N 3.28Å; Y197-L200 HydrophobicContact CD1-CD1 4.31Å; Y197-L200 PolarHBondContact O-N 3.08Å; L200-E202 VanDerWaalsContact C-N 3.35Å; L200-L203 PolarHBondContact O-N 3.02Å; L200-D204 PolarHBondContact O-N 3.27Å
201	E	81.6	Confident	79.3	Confident	109 Å²	109	69.1 Å²	69.1	51%	0.509	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-36.1	172.7	-171.3	178.9	-175	0	0	111.8	K13 Y197 E198 R199 L203 D204	K13-E201 IonicContact NZ-OE1 2.75Å; K13-E201 IonicContact NZ-OE2 2.74Å; K13-E201 PolarHBondContact NZ-OE2 3.42Å; Y197-E201 WeakPolarHBondContact O-CB 3.48Å; Y197-E201 PolarHBondContact O-N 2.63Å; E198-E201 PolarHBondContact O-N 3.44Å; R199-E201 VanDerWaalsContact C-N 3.27Å; R199-E201 PolarHBondContact O-N 2.91Å; E201-L203 VanDerWaalsContact C-N 3.31Å; E201-L203 PolarHBondContact O-N 3.28Å; E201-D204 VanDerWaalsContact O-CB 3.23Å; E201-D204 WeakPolarHBondContact O-CB 3.32Å; E201-D204 PolarHBondContact O-N 3.23Å
202	E	78.2	Confident	80.2	Confident	79 Å²	79	61.6 Å²	61.6	37%	0.369	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-25.5	175	-80.3	-172.9	-176.7	0	0	114.2	E198 R199 L200 R211 R250	E198-E202 WeakPolarHBondContact O-CG 3.39Å; E198-E202 PolarHBondContact O-N 3.03Å; R199-E202 WeakPolarHBondContact O-CB 3.2Å; R199-E202 PolarHBondContact O-N 2.98Å; R199-E202 VanDerWaalsContact O-N 3.16Å; L200-E202 VanDerWaalsContact C-N 3.35Å; E202-R211 PolarHBondContact O-NH1 3.4Å; E202-R211 VanDerWaalsContact O-NH1 3.16Å; E202-R211 IonicContact OE2-NH1 3.05Å; E202-R250 VanDerWaalsContact CD-NH1 3.26Å; E202-R250 IonicContact OE1-NH1 3.02Å; E202-R250 PolarHBondContact OE1-NH1 2.89Å; E202-R250 IonicContact OE2-CZ 3.78Å; E202-R250 IonicContact OE2-NH1 3.83Å; E202-R250 PolarHBondContact OE2-NH1 2.87Å
203	L	78.5	Confident	81.2	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	2.8	175.2	-64.4	172.1	0	0	0	112.4	V169 L176 R199 L200 E201 F248	V169-L203 HydrophobicContact CG2-CD2 4.25Å; L176-L203 HydrophobicContact CD1-CD1 3.57Å; R199-L203 HydrophobicContact CG-CD1 4.38Å; R199-L203 WeakPolarHBondContact O-CG 3.46Å; R199-L203 PolarHBondContact O-N 2.86Å; L200-L203 PolarHBondContact O-N 3.02Å; E201-L203 VanDerWaalsContact C-N 3.31Å; E201-L203 PolarHBondContact O-N 3.28Å; L203-F248 HydrophobicContact CD2-CE1 4.2Å
204	D	74.9	Confident	81.8	Confident	32 Å²	32	66.7 Å²	66.7	17%	0.171	33%	0.327	C	S	.	.			trans	-64	140.7	-177.4	-152.6	-0.5	0	0	0	111.3	R20 L200 E201 D206 K207 A208	R20-D204 IonicContact CZ-OD2 3.35Å; R20-D204 IonicContact NH1-OD2 3.61Å; R20-D204 PolarHBondContact NH1-OD2 3.48Å; R20-D204 IonicContact NH2-OD2 2.71Å; R20-D204 PolarHBondContact NH2-OD2 3.34Å; L200-D204 PolarHBondContact O-N 3.27Å; E201-D204 VanDerWaalsContact O-CB 3.23Å; E201-D204 WeakPolarHBondContact O-CB 3.32Å; E201-D204 PolarHBondContact O-N 3.23Å; D204-D206 VanDerWaalsContact C-N 3.31Å; D204-D206 PolarHBondContact O-N 2.98Å; D204-K207 PolarHBondContact O-N 2.97Å; D204-A208 PolarHBondContact O-N 3.31Å
205	A	69.2	Low	82.5	Confident	63 Å²	63	61.7 Å²	61.7	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-35.2	-165.5	0	0	0	0	0	112.9	K207 A208	A205-K207 PolarHBondContact O-N 3.35Å; A205-K207 VanDerWaalsContact O-N 3.09Å; A205-A208 WeakPolarHBondContact O-CB 3.49Å; A205-A208 PolarHBondContact O-N 3.24Å; A205-A208 VanDerWaalsContact O-N 3.14Å
206	D	71.6	Confident	83.1	Confident	146 Å²	146	58 Å²	58	78%	0.781	29%	0.285	S	S	*	.	H	α-helix	trans	-60.9	-24.9	-173.2	-64.1	-18.1	0	0	0	113.7	D204	D204-D206 VanDerWaalsContact C-N 3.31Å; D204-D206 PolarHBondContact O-N 2.98Å
207	K	77.1	Confident	83.7	Confident	164 Å²	164	60 Å²	60	71%	0.713	29%	0.294	S	S	*	.	H	α-helix	trans	-117.1	-3.3	178.7	-64.1	-178.6	-175.8	173.1	0	113.3	D204 A205 E209 R211	D204-K207 PolarHBondContact O-N 2.97Å; A205-K207 PolarHBondContact O-N 3.35Å; A205-K207 VanDerWaalsContact O-N 3.09Å; K207-E209 PolarHBondContact O-N 3.32Å; K207-R211 WeakPolarHBondContact O-CB 3.22Å; K207-R211 PolarHBondContact O-N 2.85Å; K207-R211 VanDerWaalsContact O-N 3.07Å
208	A	81.5	Confident	84	Confident	12 Å²	12	56.9 Å²	56.9	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-48.6	-175.1	0	0	0	0	0	111.4	D204 A205 R211 A212 F248	D204-A208 PolarHBondContact O-N 3.31Å; A205-A208 WeakPolarHBondContact O-CB 3.49Å; A205-A208 PolarHBondContact O-N 3.24Å; A205-A208 VanDerWaalsContact O-N 3.14Å; A208-R211 PolarHBondContact O-N 3.49Å; A208-A212 VanDerWaalsContact O-CB 3.25Å; A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.31Å; A208-F248 HydrophobicContact CB-CE2 4.39Å; A208-F248 HydrophobicContact CB-CZ 3.87Å; A208-F248 WeakPolarHBondContact O-CE2 3.34Å
209	E	86.2	Confident	84.4	Confident	107 Å²	107	51.9 Å²	51.9	50%	0.5	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-46.9	-177.2	-168.1	179.2	176	0	0	112.2	L163 M167 K207 R211 A212 S213	L163-E209 HydrophobicContact CD1-CG 4.24Å; L163-E209 HydrophobicContact CD2-CG 3.85Å; L163-E209 HydrophobicContact CG-CG 4.33Å; M167-E209 VanDerWaalsContact SD-CA 3.58Å; M167-E209 HydrophobicContact SD-CB 3.8Å; M167-E209 HydrophobicContact SD-CG 4.02Å; K207-E209 PolarHBondContact O-N 3.32Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 2.71Å; E209-A212 PolarHBondContact O-N 3.04Å; E209-S213 VanDerWaalsContact O-CB 3.24Å; E209-S213 WeakPolarHBondContact O-CB 3.36Å; E209-S213 PolarHBondContact O-N 3.46Å
210	M	86.9	Confident	84.8	Confident	103 Å²	103	53.2 Å²	53.2	51%	0.507	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-43.2	178.3	-175.3	-173.3	-67.8	0	0	111.3	R214	M210-R214 WeakPolarHBondContact O-CB 3.39Å; M210-R214 PolarHBondContact O-N 3.45Å
211	R	88	Confident	85.2	Confident	32 Å²	32	52 Å²	52	12%	0.121	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-45.4	178.4	-178.3	-179.6	169.7	-166.6	-10.2	111.7	E202 K207 A208 E209 S213 R214 I215 L247 F248 R250	E202-R211 PolarHBondContact O-NH1 3.4Å; E202-R211 VanDerWaalsContact O-NH1 3.16Å; E202-R211 IonicContact OE2-NH1 3.05Å; K207-R211 WeakPolarHBondContact O-CB 3.22Å; K207-R211 PolarHBondContact O-N 2.85Å; K207-R211 VanDerWaalsContact O-N 3.07Å; A208-R211 PolarHBondContact O-N 3.49Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 2.71Å; R211-S213 VanDerWaalsContact C-N 3.35Å; R211-R214 PolarHBondContact O-N 2.8Å; R211-I215 HydrophobicContact CG-CD1 4.12Å; R211-I215 WeakPolarHBondContact O-CG1 3.39Å; R211-I215 PolarHBondContact O-N 3.5Å; R211-L247 PolarHBondContact NH2-O 3.31Å; R211-F248 HydrophobicContact CB-CE2 4.23Å; R211-F248 HydrophobicContact CG-CD2 4.15Å; R211-F248 HydrophobicContact CG-CE2 4.23Å; R211-F248 PolarHBondContact NH2-O 2.9Å; R211-R250 VanDerWaalsContact NH2-NH1 3.19Å
212	A	91.1	Very high	85.6	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-44.8	177.1	0	0	0	0	0	111.2	L163 V166 M167 A208 E209 R214 I215 L216 F248	L163-A212 HydrophobicContact CD1-CB 3.78Å; V166-A212 HydrophobicContact CB-CB 4.22Å; V166-A212 HydrophobicContact CG1-CB 3.6Å; M167-A212 HydrophobicContact CG-CB 3.89Å; A208-A212 VanDerWaalsContact O-CB 3.25Å; A208-A212 WeakPolarHBondContact O-CB 3.36Å; A208-A212 PolarHBondContact O-N 3.31Å; E209-A212 PolarHBondContact O-N 3.04Å; A212-R214 PolarHBondContact O-N 2.99Å; A212-I215 PolarHBondContact O-N 2.91Å; A212-L216 WeakPolarHBondContact O-CB 3.31Å; A212-L216 WeakPolarHBondContact O-CG 3.26Å; A212-L216 PolarHBondContact O-N 3.4Å; A212-F248 HydrophobicContact CB-CD2 4.14Å; A212-F248 HydrophobicContact CB-CE2 4.14Å
213	S	92.2	Very high	86.1	Confident	35 Å²	35	50.2 Å²	50.2	25%	0.245	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-40.6	176.1	-174.5	0	0	0	0	112.2	E209 R211 L216 H217 Q226	E209-S213 VanDerWaalsContact O-CB 3.24Å; E209-S213 WeakPolarHBondContact O-CB 3.36Å; E209-S213 PolarHBondContact O-N 3.46Å; R211-S213 VanDerWaalsContact C-N 3.35Å; S213-L216 PolarHBondContact O-N 2.94Å; S213-H217 VanDerWaalsContact O-CB 3.26Å; S213-H217 WeakPolarHBondContact O-CB 3.44Å; S213-H217 PolarHBondContact O-N 3.22Å; S213-Q226 PolarHBondContact O-NE2 3.42Å; S213-Q226 VanDerWaalsContact O-NE2 3.13Å; S213-Q226 PolarHBondContact OG-OE1 3.05Å
214	R	91.3	Very high	86.6	Confident	102 Å²	102	53.5 Å²	53.5	39%	0.385	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-47.2	175.1	-172.6	-169.9	77.2	172.9	11.5	112.3	M210 R211 A212 H217 G218 E274	M210-R214 WeakPolarHBondContact O-CB 3.39Å; M210-R214 PolarHBondContact O-N 3.45Å; R211-R214 PolarHBondContact O-N 2.8Å; A212-R214 PolarHBondContact O-N 2.99Å; R214-H217 PolarHBondContact O-N 3.47Å; R214-G218 PolarHBondContact O-N 2.87Å; R214-E274 IonicContact NH2-OE1 2.71Å; R214-E274 IonicContact NH2-OE2 2.77Å; R214-E274 PolarHBondContact NH2-OE2 3.36Å
215	I	92.7	Very high	87.4	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63	-46.9	179.2	-67.9	168.5	0	0	0	110.2	R211 A212 H217 G218 L219 A244 L247 F248 W270	R211-I215 HydrophobicContact CG-CD1 4.12Å; R211-I215 WeakPolarHBondContact O-CG1 3.39Å; R211-I215 PolarHBondContact O-N 3.5Å; A212-I215 PolarHBondContact O-N 2.91Å; I215-H217 VanDerWaalsContact C-N 3.3Å; I215-H217 PolarHBondContact O-N 3.36Å; I215-G218 PolarHBondContact O-N 3.33Å; I215-L219 HydrophobicContact CG2-CD1 4.17Å; I215-L219 WeakPolarHBondContact O-CG 3.36Å; I215-L219 PolarHBondContact O-N 3.33Å; I215-L219 VanDerWaalsContact O-N 3.09Å; I215-A244 HydrophobicContact CG2-CB 3.77Å; I215-L247 HydrophobicContact CD1-CB 4.41Å; I215-L247 HydrophobicContact CG2-CB 4.23Å; I215-L247 HydrophobicContact CG2-CD1 4.21Å; I215-F248 HydrophobicContact CD1-CB 4.02Å; I215-F248 HydrophobicContact CD1-CD2 4.24Å; I215-W270 HydrophobicContact CB-CH2 4.14Å; I215-W270 HydrophobicContact CG1-CH2 4.17Å; I215-W270 HydrophobicContact CG2-CH2 3.91Å; I215-W270 HydrophobicContact CG2-CZ3 4.46Å
216	L	93.4	Very high	88.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-42.3	176.2	-75.9	169.1	0	0	0	111.3	P162 L163 V166 A212 S213 L219 G220 F221 Q226 V241 A244	P162-L216 HydrophobicContact CB-CD1 4Å; P162-L216 HydrophobicContact CB-CD2 3.98Å; L163-L216 HydrophobicContact CB-CD1 4.31Å; L163-L216 HydrophobicContact CD1-CD1 4.2Å; V166-L216 HydrophobicContact CG2-CD1 4.2Å; V166-L216 HydrophobicContact CG2-CD2 4.05Å; V166-L216 HydrophobicContact CG2-CG 4.18Å; A212-L216 WeakPolarHBondContact O-CB 3.31Å; A212-L216 WeakPolarHBondContact O-CG 3.26Å; A212-L216 PolarHBondContact O-N 3.4Å; S213-L216 PolarHBondContact O-N 2.94Å; L216-L219 CarbonylContact O-C 3.5Å; L216-L219 PolarHBondContact O-N 3.3Å; L216-G220 PolarHBondContact O-N 2.8Å; L216-F221 HydrophobicContact CB-CB 4.06Å; L216-F221 HydrophobicContact CB-CD2 4.32Å; L216-F221 HydrophobicContact CB-CG 4.34Å; L216-F221 HydrophobicContact CD2-CD2 3.84Å; L216-F221 HydrophobicContact CD2-CE2 3.98Å; L216-F221 HydrophobicContact CD2-CG 4.14Å; L216-F221 HydrophobicContact CD2-CZ 4.42Å; L216-F221 VanDerWaalsContact O-CB 3.3Å; L216-F221 WeakPolarHBondContact O-CB 3.47Å; L216-F221 VanDerWaalsContact O-CD2 3.31Å; L216-F221 WeakPolarHBondContact O-CD2 3.48Å; L216-F221 PolarHBondContact O-N 2.8Å; L216-Q226 HydrophobicContact CB-CG 4.1Å; L216-Q226 HydrophobicContact CD1-CG 4.22Å; L216-V241 HydrophobicContact CD2-CG2 4.43Å; L216-A244 HydrophobicContact CD2-CB 3.73Å; L216-A244 HydrophobicContact CG-CB 4.26Å
217	H	92.2	Very high	89.4	Confident	61 Å²	61	53.4 Å²	53.4	28%	0.282	28%	0.276	S	S	.	.	H	α-helix	trans	-60.6	-46.7	177.3	-172.6	59.9	0	0	0	112.4	S213 R214 I215 L219 G220 F221 E616	S213-H217 VanDerWaalsContact O-CB 3.26Å; S213-H217 WeakPolarHBondContact O-CB 3.44Å; S213-H217 PolarHBondContact O-N 3.22Å; R214-H217 PolarHBondContact O-N 3.47Å; I215-H217 VanDerWaalsContact C-N 3.3Å; I215-H217 PolarHBondContact O-N 3.36Å; H217-L219 PolarHBondContact O-N 3.07Å; H217-G220 WeakPolarHBondContact O-CA 3.41Å; H217-G220 PolarHBondContact O-N 2.96Å; H217-F221 WeakPolarHBondContact CA-O 3.36Å; H217-E616 IonicContact NE2-OE2 2.78Å
218	G	90.5	Very high	90.1	Very high	9 Å²	9	50 Å²	50	9%	0.093	26%	0.261	C	S	.	.	H	α-helix	trans	-62.2	-27.6	176.3	0	0	0	0	0	114.2	R214 I215 G220 W270	R214-G218 PolarHBondContact O-N 2.87Å; I215-G218 PolarHBondContact O-N 3.33Å; G218-G220 PolarHBondContact O-N 2.93Å; G218-W270 VanDerWaalsContact CA-CD2 3.49Å
219	L	91.5	Very high	90.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	11	172.4	-65.7	171.9	0	0	0	113.6	I215 L216 H217 F221 R240 L243 A244 L263 W270	I215-L219 HydrophobicContact CG2-CD1 4.17Å; I215-L219 WeakPolarHBondContact O-CG 3.36Å; I215-L219 PolarHBondContact O-N 3.33Å; I215-L219 VanDerWaalsContact O-N 3.09Å; L216-L219 CarbonylContact O-C 3.5Å; L216-L219 PolarHBondContact O-N 3.3Å; H217-L219 PolarHBondContact O-N 3.07Å; L219-F221 HydrophobicContact CB-CD2 4.39Å; L219-R240 WeakPolarHBondContact O-CD 3.29Å; L219-R240 PolarHBondContact O-NH1 3.1Å; L219-L243 HydrophobicContact CD1-CD2 4.49Å; L219-L243 HydrophobicContact CD1-CG 4.43Å; L219-L243 HydrophobicContact CD2-CD2 3.99Å; L219-A244 HydrophobicContact CD1-CB 3.69Å; L219-L263 HydrophobicContact CD2-CD2 4.42Å; L219-W270 HydrophobicContact CD1-CZ3 4.46Å; L219-W270 HydrophobicContact CD2-CE3 3.94Å; L219-W270 HydrophobicContact CD2-CZ3 3.92Å; L219-W270 HydrophobicContact CG-CE3 4.08Å; L219-W270 HydrophobicContact CG-CZ3 3.82Å
220	G	89.6	Confident	90.9	Very high	30 Å²	30	48.4 Å²	48.4	31%	0.309	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	10.1	173.8	0	0	0	0	0	115.6	L216 H217 G218 T222	L216-G220 PolarHBondContact O-N 2.8Å; H217-G220 WeakPolarHBondContact O-CA 3.41Å; H217-G220 PolarHBondContact O-N 2.96Å; G218-G220 PolarHBondContact O-N 2.93Å; G220-T222 PolarHBondContact O-N 2.87Å
221	F	90.8	Very high	91	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	25%	0.248	C	C	.	.			trans	-83.2	114.7	176	-68.8	-102.4	0	0	0	111.5	P162 L216 H217 L219 M225 Q226 F233 W237 R240 V241	P162-F221 HydrophobicContact CB-CD1 4.33Å; P162-F221 HydrophobicContact CB-CE1 4.19Å; P162-F221 HydrophobicContact CG-CD1 4.15Å; P162-F221 HydrophobicContact CG-CE1 3.91Å; L216-F221 HydrophobicContact CB-CB 4.06Å; L216-F221 HydrophobicContact CB-CD2 4.32Å; L216-F221 HydrophobicContact CB-CG 4.34Å; L216-F221 HydrophobicContact CD2-CD2 3.84Å; L216-F221 HydrophobicContact CD2-CE2 3.98Å; L216-F221 HydrophobicContact CD2-CG 4.14Å; L216-F221 HydrophobicContact CD2-CZ 4.42Å; L216-F221 VanDerWaalsContact O-CB 3.3Å; L216-F221 WeakPolarHBondContact O-CB 3.47Å; L216-F221 VanDerWaalsContact O-CD2 3.31Å; L216-F221 WeakPolarHBondContact O-CD2 3.48Å; L216-F221 PolarHBondContact O-N 2.8Å; H217-F221 WeakPolarHBondContact CA-O 3.36Å; L219-F221 HydrophobicContact CB-CD2 4.39Å; F221-M225 HydrophobicContact CB-CB 4.42Å; F221-M225 HydrophobicContact CD1-CB 4.08Å; F221-Q226 HydrophobicContact CB-CG 3.76Å; F221-Q226 PolarHBondContact O-NE2 3.22Å; F221-Q226 VanDerWaalsContact O-NE2 3.17Å; F221-F233 HydrophobicContact CD1-CE1 4.34Å; F221-F233 HydrophobicContact CD1-CZ 4.28Å; F221-F233 HydrophobicContact CE1-CD1 4.46Å; F221-F233 AromaticContact CE1-CE1 3.93Å; F221-F233 HydrophobicContact CE1-CE1 3.93Å; F221-F233 HydrophobicContact CE1-CZ 4.03Å; F221-W237 HydrophobicContact CD1-CE3 4.23Å; F221-W237 HydrophobicContact CD1-CZ3 4.33Å; F221-W237 HydrophobicContact CD2-CE3 4.3Å; F221-W237 HydrophobicContact CD2-CZ3 4.07Å; F221-W237 AromaticContact CE1-CE3 3.74Å; F221-W237 HydrophobicContact CE1-CE3 3.74Å; F221-W237 HydrophobicContact CE1-CZ3 4.27Å; F221-W237 AromaticContact CE2-CE3 3.83Å; F221-W237 HydrophobicContact CE2-CE3 3.83Å; F221-W237 HydrophobicContact CE2-CZ3 4.03Å; F221-W237 HydrophobicContact CG-CE3 4.49Å; F221-W237 HydrophobicContact CG-CZ3 4.22Å; F221-W237 AromaticContact CZ-CE3 3.52Å; F221-W237 HydrophobicContact CZ-CE3 3.52Å; F221-W237 HydrophobicContact CZ-CZ3 4.12Å; F221-R240 HydrophobicContact CE2-CB 3.7Å; F221-R240 HydrophobicContact CZ-CB 4.1Å; F221-V241 HydrophobicContact CE1-CG2 3.78Å; F221-V241 HydrophobicContact CE2-CG2 4.16Å; F221-V241 HydrophobicContact CZ-CG2 3.32Å
222	T	89.3	Confident	91.1	Very high	64 Å²	64	50.8 Å²	50.8	39%	0.393	26%	0.262	S	S	.	.			trans	-65.8	157.9	169	67.4	0	0	0	0	111.4	G220 A224 M225 Q226	G220-T222 PolarHBondContact O-N 2.87Å; T222-A224 PolarHBondContact O-N 2.63Å; T222-A224 VanDerWaalsContact O-N 3.11Å; T222-M225 HydrophobicContact CG2-SD 4Å; T222-M225 WeakPolarHBondContact O-CA 3.47Å; T222-M225 WeakPolarHBondContact O-CB 3.48Å; T222-M225 PolarHBondContact O-N 2.77Å; T222-M225 WeakPolarHBondContact OG1-CG 3.32Å; T222-M225 PolarHBondContact OG1-N 2.79Å; T222-M225 PolarHBondContact OG1-SD 3.31Å; T222-M225 VanDerWaalsContact OG1-SD 3.38Å; T222-Q226 WeakPolarHBondContact O-CG 3.42Å; T222-Q226 PolarHBondContact O-N 2.92Å
223	P	89.7	Confident	90.9	Very high	87 Å²	87	51.6 Å²	51.6	57%	0.565	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-31.9	176.8	-28.2	35.8	0	0	0	114.1
224	A	90.1	Very high	90.5	Very high	75 Å²	75	53.4 Å²	53.4	62%	0.62	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-42.5	174.4	0	0	0	0	0	111.7	T222 Q226 R227 K228	T222-A224 PolarHBondContact O-N 2.63Å; T222-A224 VanDerWaalsContact O-N 3.11Å; A224-Q226 VanDerWaalsContact C-N 3.35Å; A224-Q226 PolarHBondContact O-N 2.89Å; A224-R227 PolarHBondContact O-N 2.81Å; A224-K228 PolarHBondContact O-N 3.14Å
225	M	90.5	Very high	90.1	Very high	42 Å²	42	49.5 Å²	49.5	21%	0.207	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-65.7	-37.4	177.7	-68.6	167	77	0	0	112	F221 T222 R227 K228 F233 W237	F221-M225 HydrophobicContact CB-CB 4.42Å; F221-M225 HydrophobicContact CD1-CB 4.08Å; T222-M225 HydrophobicContact CG2-SD 4Å; T222-M225 WeakPolarHBondContact O-CA 3.47Å; T222-M225 WeakPolarHBondContact O-CB 3.48Å; T222-M225 PolarHBondContact O-N 2.77Å; T222-M225 WeakPolarHBondContact OG1-CG 3.32Å; T222-M225 PolarHBondContact OG1-N 2.79Å; T222-M225 PolarHBondContact OG1-SD 3.31Å; T222-M225 VanDerWaalsContact OG1-SD 3.38Å; M225-R227 PolarHBondContact O-N 3.32Å; M225-R227 VanDerWaalsContact O-N 3.09Å; M225-K228 WeakPolarHBondContact O-CB 3.5Å; M225-K228 PolarHBondContact O-N 2.75Å; M225-F233 HydrophobicContact CB-CE1 4.26Å; M225-F233 HydrophobicContact CB-CZ 3.99Å; M225-F233 HydrophobicContact CE-CE1 3.79Å; M225-F233 HydrophobicContact CG-CE1 4.47Å; M225-F233 WeakPolarHBondContact O-CZ 3.48Å; M225-W237 HydrophobicContact CE-CD2 4.04Å; M225-W237 HydrophobicContact CE-CE3 3.78Å; M225-W237 HydrophobicContact CE-CH2 3.34Å; M225-W237 HydrophobicContact CE-CZ2 3.58Å; M225-W237 HydrophobicContact CE-CZ3 3.42Å; M225-W237 VanDerWaalsContact CE-CZ3 3.42Å
226	Q	91.8	Very high	89.7	Confident	9 Å²	9	50.3 Å²	50.3	4%	0.042	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-60.8	-20.2	176.6	-65.3	-178	21.6	0	0	113.4	T161 S213 L216 F221 T222 A224	T161-Q226 WeakPolarHBondContact CB-O 3.27Å; S213-Q226 PolarHBondContact O-NE2 3.42Å; S213-Q226 VanDerWaalsContact O-NE2 3.13Å; S213-Q226 PolarHBondContact OG-OE1 3.05Å; L216-Q226 HydrophobicContact CB-CG 4.1Å; L216-Q226 HydrophobicContact CD1-CG 4.22Å; F221-Q226 HydrophobicContact CB-CG 3.76Å; F221-Q226 PolarHBondContact O-NE2 3.22Å; F221-Q226 VanDerWaalsContact O-NE2 3.17Å; T222-Q226 WeakPolarHBondContact O-CG 3.42Å; T222-Q226 PolarHBondContact O-N 2.92Å; A224-Q226 VanDerWaalsContact C-N 3.35Å; A224-Q226 PolarHBondContact O-N 2.89Å
227	R	90.5	Very high	89.5	Confident	188 Å²	188	52.5 Å²	52.5	71%	0.709	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-101	-7.6	177.5	-60.7	-179.3	-167.5	-87.1	-1.7	113.8	T161 A224 M225	T161-R227 WeakPolarHBondContact CG2-O 3.43Å; A224-R227 PolarHBondContact O-N 2.81Å; M225-R227 PolarHBondContact O-N 3.32Å; M225-R227 VanDerWaalsContact O-N 3.09Å
228	K	91.7	Very high	89.4	Confident	93 Å²	93	51.3 Å²	51.3	40%	0.404	28%	0.28	S	S	.	.	S	Bend	trans	-75.6	154.8	176.3	-162.4	-172.7	-170.5	-156.8	0	109.8	T161 P162 A224 M225 D232 F233	T161-K228 WeakPolarHBondContact CA-O 3.26Å; P162-K228 WeakPolarHBondContact CD-O 3.46Å; A224-K228 PolarHBondContact O-N 3.14Å; M225-K228 WeakPolarHBondContact O-CB 3.5Å; M225-K228 PolarHBondContact O-N 2.75Å; K228-D232 HydrophobicContact CD-CB 3.94Å; K228-D232 HydrophobicContact CG-CB 4.19Å; K228-D232 VanDerWaalsContact NZ-CB 3.3Å; K228-D232 PolarHBondContact NZ-O 3.32Å; K228-F233 HydrophobicContact CB-CE2 3.79Å; K228-F233 HydrophobicContact CB-CZ 3.94Å; K228-F233 HydrophobicContact CD-CE2 4.17Å; K228-F233 HydrophobicContact CD-CZ 4.13Å; K228-F233 HydrophobicContact CG-CE2 4.25Å
229	K	93.4	Very high	89.4	Confident	84 Å²	84	53.4 Å²	53.4	37%	0.365	29%	0.288	S	S	.	.			trans	-75.8	145.2	178.6	-62.1	-176.1	161.6	-167.7	0	111.5	D159 K231 D232 F233	D159-K229 HydrophobicContact CB-CD 4.45Å; D159-K229 WeakPolarHBondContact O-CG 3.35Å; D159-K229 WeakPolarHBondContact OD1-CD 3.31Å; D159-K229 WeakPolarHBondContact OD1-CE 3.45Å; D159-K229 IonicContact OD1-NZ 3.01Å; D159-K229 PolarHBondContact OD1-NZ 2.95Å; K229-K231 VanDerWaalsContact C-N 3.28Å; K229-K231 HydrophobicContact CB-CG 4.12Å; K229-K231 PolarHBondContact O-N 3.21Å; K229-D232 PolarHBondContact O-N 3.12Å; K229-D232 VanDerWaalsContact O-N 3.12Å; K229-F233 VanDerWaalsContact O-CD2 3.23Å; K229-F233 WeakPolarHBondContact O-CD2 3.28Å
230	L	91	Very high	89.5	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.2	-35	179.8	-83.6	179.2	0	0	0	113.7	M155 S158 K160 P162 C165 D232 F233 R238 V241	M155-L230 HydrophobicContact CB-CD1 4.15Å; S158-L230 PolarHBondContact O-N 3.27Å; S158-L230 WeakPolarHBondContact OG-CD1 3.31Å; K160-L230 PolarHBondContact O-N 3.35Å; P162-L230 HydrophobicContact CG-CD2 4.24Å; C165-L230 HydrophobicContact CB-CD1 4.04Å; C165-L230 WeakPolarHBondContact SG-CD1 3.31Å; L230-D232 PolarHBondContact O-N 2.91Å; L230-D232 VanDerWaalsContact O-N 3.15Å; L230-F233 HydrophobicContact CD2-CD2 4.49Å; L230-F233 WeakPolarHBondContact O-CB 3.35Å; L230-F233 PolarHBondContact O-N 3.28Å; L230-F233 VanDerWaalsContact O-N 3.1Å; L230-R238 HydrophobicContact CD2-CG 4.3Å; L230-V241 HydrophobicContact CD2-CB 4.22Å; L230-V241 HydrophobicContact CD2-CG1 4.24Å; L230-V241 HydrophobicContact CD2-CG2 3.8Å
231	K	90.6	Very high	89.7	Confident	106 Å²	106	52.2 Å²	52.2	46%	0.461	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-60.5	-21.6	177.2	70.8	-172	-170.3	-175.8	0	114.3	P157 S158 D159 K229 F233	P157-K231 HydrophobicContact CB-CB 4.14Å; S158-K231 PolarHBondContact O-N 3.27Å; D159-K231 VanDerWaalsContact OD1-CE 3.25Å; D159-K231 WeakPolarHBondContact OD1-CE 3.25Å; D159-K231 IonicContact OD1-NZ 2.76Å; D159-K231 PolarHBondContact OD1-NZ 3.43Å; D159-K231 IonicContact OD2-NZ 2.71Å; K229-K231 VanDerWaalsContact C-N 3.28Å; K229-K231 HydrophobicContact CB-CG 4.12Å; K229-K231 PolarHBondContact O-N 3.21Å; K231-F233 VanDerWaalsContact C-N 3.32Å
232	D	88.8	Confident	89.8	Confident	79 Å²	79	52.3 Å²	52.3	42%	0.422	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-92.5	9.4	179.7	-51.1	-36.8	0	0	0	113.2	K228 K229 L230	K228-D232 HydrophobicContact CD-CB 3.94Å; K228-D232 HydrophobicContact CG-CB 4.19Å; K228-D232 VanDerWaalsContact NZ-CB 3.3Å; K228-D232 PolarHBondContact NZ-O 3.32Å; K229-D232 PolarHBondContact O-N 3.12Å; K229-D232 VanDerWaalsContact O-N 3.12Å; L230-D232 PolarHBondContact O-N 2.91Å; L230-D232 VanDerWaalsContact O-N 3.15Å
233	F	87.2	Confident	90	Very high	18 Å²	18	49.5 Å²	49.5	8%	0.079	26%	0.258	C	S	.	.	S	Bend	trans	-108.8	145.3	177.8	-75.4	-79.6	0	0	0	111.2	P162 F221 M225 K228 K229 L230 K231 W237 R238	P162-F233 HydrophobicContact CG-CE2 3.8Å; P162-F233 HydrophobicContact CG-CZ 4.18Å; F221-F233 HydrophobicContact CD1-CE1 4.34Å; F221-F233 HydrophobicContact CD1-CZ 4.28Å; F221-F233 HydrophobicContact CE1-CD1 4.46Å; F221-F233 AromaticContact CE1-CE1 3.93Å; F221-F233 HydrophobicContact CE1-CE1 3.93Å; F221-F233 HydrophobicContact CE1-CZ 4.03Å; M225-F233 HydrophobicContact CB-CE1 4.26Å; M225-F233 HydrophobicContact CB-CZ 3.99Å; M225-F233 HydrophobicContact CE-CE1 3.79Å; M225-F233 HydrophobicContact CG-CE1 4.47Å; M225-F233 WeakPolarHBondContact O-CZ 3.48Å; K228-F233 HydrophobicContact CB-CE2 3.79Å; K228-F233 HydrophobicContact CB-CZ 3.94Å; K228-F233 HydrophobicContact CD-CE2 4.17Å; K228-F233 HydrophobicContact CD-CZ 4.13Å; K228-F233 HydrophobicContact CG-CE2 4.25Å; K229-F233 VanDerWaalsContact O-CD2 3.23Å; K229-F233 WeakPolarHBondContact O-CD2 3.28Å; L230-F233 HydrophobicContact CD2-CD2 4.49Å; L230-F233 WeakPolarHBondContact O-CB 3.35Å; L230-F233 PolarHBondContact O-N 3.28Å; L230-F233 VanDerWaalsContact O-N 3.1Å; K231-F233 VanDerWaalsContact C-N 3.32Å; F233-W237 HydrophobicContact CB-CB 3.79Å; F233-W237 HydrophobicContact CD1-CB 3.58Å; F233-W237 HydrophobicContact CD1-CD2 4.21Å; F233-W237 AromaticContact CD1-CG 3.76Å; F233-W237 HydrophobicContact CD1-CG 3.76Å; F233-W237 HydrophobicContact CE1-CD2 4.49Å; F233-W237 HydrophobicContact CE1-CG 4.49Å; F233-W237 HydrophobicContact CG-CB 4.04Å; F233-R238 HydrophobicContact CB-CG 4.07Å
234	S	84.8	Confident	90.2	Very high	73 Å²	73	45.3 Å²	45.3	51%	0.51	23%	0.231	S	C	.	.			trans	-67.1	163.1	171.2	71.9	0	0	0	0	111.3	G236 W237 R238	S234-G236 VanDerWaalsContact C-N 3.29Å; S234-G236 PolarHBondContact O-N 2.82Å; S234-W237 PolarHBondContact O-N 3.45Å; S234-R238 PolarHBondContact O-N 3.3Å
235	G	82.3	Confident	90.4	Very high	19 Å²	19	43.8 Å²	43.8	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-52.9	-43.7	178.5	0	0	0	0	0	113.7	E154 W237 R238 M239	E154-G235 WeakPolarHBondContact OE2-CA 3.47Å; G235-W237 PolarHBondContact O-N 3.05Å; G235-R238 CarbonylContact O-C 3.59Å; G235-R238 WeakPolarHBondContact O-CA 3.47Å; G235-R238 WeakPolarHBondContact O-CB 3.37Å; G235-R238 PolarHBondContact O-N 3.44Å; G235-M239 PolarHBondContact O-N 2.95Å
236	G	84.3	Confident	90.5	Very high	18 Å²	18	41.8 Å²	41.8	19%	0.186	20%	0.199	C	C	.	.	H	α-helix	trans	-58.5	-41.5	175.4	0	0	0	0	0	113.8	S234 M239 R240	S234-G236 VanDerWaalsContact C-N 3.29Å; S234-G236 PolarHBondContact O-N 2.82Å; G236-M239 WeakPolarHBondContact O-CB 3.15Å; G236-M239 PolarHBondContact O-N 2.97Å; G236-R240 WeakPolarHBondContact O-CG 3.38Å; G236-R240 PolarHBondContact O-N 3.24Å
237	W	89.2	Confident	90.5	Very high	46 Å²	46	41.6 Å²	41.6	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-39.2	173.8	-78.2	105.6	0	0	0	111.7	F221 M225 F233 S234 G235 M239 R240 V241 N436	F221-W237 HydrophobicContact CD1-CE3 4.23Å; F221-W237 HydrophobicContact CD1-CZ3 4.33Å; F221-W237 HydrophobicContact CD2-CE3 4.3Å; F221-W237 HydrophobicContact CD2-CZ3 4.07Å; F221-W237 AromaticContact CE1-CE3 3.74Å; F221-W237 HydrophobicContact CE1-CE3 3.74Å; F221-W237 HydrophobicContact CE1-CZ3 4.27Å; F221-W237 AromaticContact CE2-CE3 3.83Å; F221-W237 HydrophobicContact CE2-CE3 3.83Å; F221-W237 HydrophobicContact CE2-CZ3 4.03Å; F221-W237 HydrophobicContact CG-CE3 4.49Å; F221-W237 HydrophobicContact CG-CZ3 4.22Å; F221-W237 AromaticContact CZ-CE3 3.52Å; F221-W237 HydrophobicContact CZ-CE3 3.52Å; F221-W237 HydrophobicContact CZ-CZ3 4.12Å; M225-W237 HydrophobicContact CE-CD2 4.04Å; M225-W237 HydrophobicContact CE-CE3 3.78Å; M225-W237 HydrophobicContact CE-CH2 3.34Å; M225-W237 HydrophobicContact CE-CZ2 3.58Å; M225-W237 HydrophobicContact CE-CZ3 3.42Å; M225-W237 VanDerWaalsContact CE-CZ3 3.42Å; F233-W237 HydrophobicContact CB-CB 3.79Å; F233-W237 HydrophobicContact CD1-CB 3.58Å; F233-W237 HydrophobicContact CD1-CD2 4.21Å; F233-W237 AromaticContact CD1-CG 3.76Å; F233-W237 HydrophobicContact CD1-CG 3.76Å; F233-W237 HydrophobicContact CE1-CD2 4.49Å; F233-W237 HydrophobicContact CE1-CG 4.49Å; F233-W237 HydrophobicContact CG-CB 4.04Å; S234-W237 PolarHBondContact O-N 3.45Å; G235-W237 PolarHBondContact O-N 3.05Å; W237-M239 VanDerWaalsContact C-N 3.27Å; W237-M239 PolarHBondContact O-N 3.2Å; W237-R240 WeakPolarHBondContact O-CB 3.27Å; W237-R240 PolarHBondContact O-N 3.34Å; W237-R240 VanDerWaalsContact O-N 3.14Å; W237-V241 WeakPolarHBondContact O-CG2 3.43Å; W237-V241 PolarHBondContact O-N 3.09Å; W237-V241 VanDerWaalsContact O-N 3.08Å; W237-N436 HydrophobicContact CZ2-CB 4.29Å
238	R	90.9	Very high	90.6	Very high	35 Å²	35	32.7 Å²	32.7	13%	0.132	17%	0.165	C	C	.	.	H	α-helix	trans	-64.4	-32.2	174.3	-67.5	-170.4	-74.2	114.9	1.4	112.1	E154 M155 L230 F233 S234 G235 V241 A242	E154-R238 HydrophobicContact CB-CB 4.12Å; E154-R238 IonicContact OE1-CZ 3.73Å; E154-R238 IonicContact OE1-NH1 2.72Å; E154-R238 PolarHBondContact OE1-NH1 2.94Å; E154-R238 IonicContact OE1-NH2 3.13Å; E154-R238 PolarHBondContact OE1-NH2 3.29Å; E154-R238 IonicContact OE2-NH2 3.97Å; M155-R238 HydrophobicContact CB-CB 4.3Å; M155-R238 PolarHBondContact N-O 2.79Å; M155-R238 WeakPolarHBondContact O-CB 3.43Å; M155-R238 WeakPolarHBondContact O-CD 3.41Å; M155-R238 PolarHBondContact O-NH1 2.97Å; L230-R238 HydrophobicContact CD2-CG 4.3Å; F233-R238 HydrophobicContact CB-CG 4.07Å; S234-R238 PolarHBondContact O-N 3.3Å; G235-R238 CarbonylContact O-C 3.59Å; G235-R238 WeakPolarHBondContact O-CA 3.47Å; G235-R238 WeakPolarHBondContact O-CB 3.37Å; G235-R238 PolarHBondContact O-N 3.44Å; R238-V241 PolarHBondContact O-N 2.8Å; R238-A242 PolarHBondContact O-N 3.06Å; R238-A242 VanDerWaalsContact O-N 3.09Å
239	M	90.5	Very high	90.4	Very high	53 Å²	53	28.4 Å²	28.4	26%	0.261	15%	0.146	S	C	.	.	H	α-helix	trans	-66.5	-41.5	170.3	-175.9	60	78	0	0	111.7	L151 E154 G235 G236 W237 V241 A242 L243	L151-M239 HydrophobicContact CD1-SD 4.34Å; L151-M239 HydrophobicContact CD2-SD 4.48Å; L151-M239 HydrophobicContact CG-SD 4.38Å; E154-M239 HydrophobicContact CB-CB 4.12Å; E154-M239 HydrophobicContact CB-CE 4.11Å; E154-M239 VanDerWaalsContact N-CE 3.31Å; G235-M239 PolarHBondContact O-N 2.95Å; G236-M239 WeakPolarHBondContact O-CB 3.15Å; G236-M239 PolarHBondContact O-N 2.97Å; W237-M239 VanDerWaalsContact C-N 3.27Å; W237-M239 PolarHBondContact O-N 3.2Å; M239-V241 VanDerWaalsContact C-N 3.28Å; M239-V241 PolarHBondContact O-N 2.89Å; M239-A242 WeakPolarHBondContact O-CB 3.38Å; M239-A242 PolarHBondContact O-N 3.36Å; M239-A242 VanDerWaalsContact O-N 3.09Å; M239-A242 HydrophobicContact SD-CB 4.46Å; M239-L243 PolarHBondContact O-N 3.2Å
240	R	92.7	Very high	90.2	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.019	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-37.1	173.7	-63.5	-168.2	-175.8	-168	0.1	112.4	L219 F221 G236 W237 L243 A244 H262 L263 D264 N436	L219-R240 WeakPolarHBondContact O-CD 3.29Å; L219-R240 PolarHBondContact O-NH1 3.1Å; F221-R240 HydrophobicContact CE2-CB 3.7Å; F221-R240 HydrophobicContact CZ-CB 4.1Å; G236-R240 WeakPolarHBondContact O-CG 3.38Å; G236-R240 PolarHBondContact O-N 3.24Å; W237-R240 WeakPolarHBondContact O-CB 3.27Å; W237-R240 PolarHBondContact O-N 3.34Å; W237-R240 VanDerWaalsContact O-N 3.14Å; R240-L243 PolarHBondContact O-N 3.35Å; R240-A244 WeakPolarHBondContact O-CB 3.43Å; R240-A244 PolarHBondContact O-N 3.1Å; R240-H262 PolarHBondContact NE-O 3.49Å; R240-H262 PolarHBondContact NH2-O 3.42Å; R240-L263 HydrophobicContact CG-CD2 3.58Å; R240-D264 IonicContact CZ-OD2 3.46Å; R240-D264 IonicContact NH1-OD1 2.75Å; R240-D264 IonicContact NH1-OD2 3.88Å; R240-D264 PolarHBondContact NH1-OD2 2.91Å; R240-D264 IonicContact NH2-OD1 2.75Å; R240-D264 IonicContact NH2-OD2 3.17Å; R240-D264 PolarHBondContact NH2-OD2 3.23Å; R240-D264 VanDerWaalsContact NH2-OD2 3.13Å; R240-N436 PolarHBondContact NH2-ND2 3.41Å
241	V	93.8	Very high	90.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65.9	-40.2	173.5	-177.8	0	0	0	0	111.4	M155 P162 C165 V166 L216 F221 L230 W237 R238 M239 L243 A244 R245	M155-V241 HydrophobicContact CG-CB 4.23Å; M155-V241 HydrophobicContact CG-CG1 4.09Å; P162-V241 HydrophobicContact CB-CG1 4.33Å; P162-V241 HydrophobicContact CB-CG2 3.82Å; P162-V241 HydrophobicContact CG-CG2 4.12Å; C165-V241 HydrophobicContact CB-CG1 4.15Å; V166-V241 HydrophobicContact CG2-CG1 4.11Å; L216-V241 HydrophobicContact CD2-CG2 4.43Å; F221-V241 HydrophobicContact CE1-CG2 3.78Å; F221-V241 HydrophobicContact CE2-CG2 4.16Å; F221-V241 HydrophobicContact CZ-CG2 3.32Å; L230-V241 HydrophobicContact CD2-CB 4.22Å; L230-V241 HydrophobicContact CD2-CG1 4.24Å; L230-V241 HydrophobicContact CD2-CG2 3.8Å; W237-V241 WeakPolarHBondContact O-CG2 3.43Å; W237-V241 PolarHBondContact O-N 3.09Å; W237-V241 VanDerWaalsContact O-N 3.08Å; R238-V241 PolarHBondContact O-N 2.8Å; M239-V241 VanDerWaalsContact C-N 3.28Å; M239-V241 PolarHBondContact O-N 2.89Å; V241-L243 VanDerWaalsContact C-N 3.35Å; V241-L243 PolarHBondContact O-N 3.19Å; V241-A244 WeakPolarHBondContact O-CB 3.5Å; V241-A244 PolarHBondContact O-N 2.97Å; V241-R245 PolarHBondContact O-N 3.22Å
242	A	93.1	Very high	90.2	Very high	3 Å²	3	22.2 Å²	22.2	3%	0.025	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-42.6	175.3	0	0	0	0	0	111.8	L151 R153 M155 R238 M239 R245 A246	L151-A242 HydrophobicContact CD1-CB 3.51Å; R153-A242 WeakPolarHBondContact O-CB 3.49Å; M155-A242 HydrophobicContact CE-CB 4.22Å; M155-A242 HydrophobicContact CG-CB 4.03Å; R238-A242 PolarHBondContact O-N 3.06Å; R238-A242 VanDerWaalsContact O-N 3.09Å; M239-A242 WeakPolarHBondContact O-CB 3.38Å; M239-A242 PolarHBondContact O-N 3.36Å; M239-A242 VanDerWaalsContact O-N 3.09Å; M239-A242 HydrophobicContact SD-CB 4.46Å; A242-R245 PolarHBondContact O-N 2.91Å; A242-A246 PolarHBondContact O-N 3.28Å
243	L	94.2	Very high	90.5	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.026	10%	0.098	C	C	.	.	H	α-helix	trans	-61.7	-44	172.2	-178.2	62.7	0	0	0	111.9	L151 L219 M239 R240 V241 R245 A246 L247 L256 P259 L263 L271	L151-L243 HydrophobicContact CD2-CB 3.88Å; L151-L243 HydrophobicContact CD2-CD1 3.68Å; L151-L243 HydrophobicContact CD2-CG 4.38Å; L219-L243 HydrophobicContact CD1-CD2 4.49Å; L219-L243 HydrophobicContact CD1-CG 4.43Å; L219-L243 HydrophobicContact CD2-CD2 3.99Å; M239-L243 PolarHBondContact O-N 3.2Å; R240-L243 PolarHBondContact O-N 3.35Å; V241-L243 VanDerWaalsContact C-N 3.35Å; V241-L243 PolarHBondContact O-N 3.19Å; L243-R245 VanDerWaalsContact C-N 3.3Å; L243-R245 PolarHBondContact O-N 2.92Å; L243-A246 WeakPolarHBondContact O-CB 3.31Å; L243-A246 PolarHBondContact O-N 3.21Å; L243-A246 VanDerWaalsContact O-N 3.14Å; L243-L247 HydrophobicContact CD1-CG 4.48Å; L243-L247 HydrophobicContact CG-CD1 4.3Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 2.81Å; L243-L256 HydrophobicContact CD1-CD1 4.38Å; L243-L256 HydrophobicContact CD1-CD2 3.95Å; L243-P259 HydrophobicContact CD1-CB 4.48Å; L243-L263 HydrophobicContact CD2-CD1 4.15Å; L243-L271 HydrophobicContact CD1-CD1 4.48Å; L243-L271 HydrophobicContact CD2-CD1 4.06Å; L243-L271 HydrophobicContact CD2-CD2 3.94Å; L243-L271 HydrophobicContact CG-CD1 4.49Å
244	A	94	Very high	91	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.3	-43.5	176.3	0	0	0	0	0	111.8	V166 I215 L216 L219 R240 V241 L247 F248	V166-A244 HydrophobicContact CG2-CB 3.67Å; I215-A244 HydrophobicContact CG2-CB 3.77Å; L216-A244 HydrophobicContact CD2-CB 3.73Å; L216-A244 HydrophobicContact CG-CB 4.26Å; L219-A244 HydrophobicContact CD1-CB 3.69Å; R240-A244 WeakPolarHBondContact O-CB 3.43Å; R240-A244 PolarHBondContact O-N 3.1Å; V241-A244 WeakPolarHBondContact O-CB 3.5Å; V241-A244 PolarHBondContact O-N 2.97Å; A244-L247 PolarHBondContact O-N 3.05Å; A244-F248 VanDerWaalsContact O-CB 3.31Å; A244-F248 WeakPolarHBondContact O-CB 3.39Å; A244-F248 PolarHBondContact O-N 3.46Å
245	R	92.8	Very high	91.6	Very high	42 Å²	42	14.2 Å²	14.2	16%	0.158	7%	0.07	C	C	.	.	H	α-helix	trans	-62.8	-43.7	175.5	-176.2	-178.2	172	159.5	-4.5	111.6	M155 V166 E168 E172 V241 A242 L243 L247 F248 I249	M155-R245 HydrophobicContact CE-CB 4.03Å; M155-R245 HydrophobicContact CE-CG 4.31Å; V166-R245 HydrophobicContact CG2-CB 4.46Å; E168-R245 VanDerWaalsContact O-CZ 3.29Å; E168-R245 PolarHBondContact O-NH2 3.01Å; E172-R245 IonicContact OE1-CZ 3.96Å; E172-R245 IonicContact OE1-NE 3.01Å; E172-R245 IonicContact OE1-NH2 3.93Å; E172-R245 PolarHBondContact OE1-NH2 3.18Å; E172-R245 IonicContact OE2-NH2 2.72Å; V241-R245 PolarHBondContact O-N 3.22Å; A242-R245 PolarHBondContact O-N 2.91Å; L243-R245 VanDerWaalsContact C-N 3.3Å; L243-R245 PolarHBondContact O-N 2.92Å; R245-L247 VanDerWaalsContact C-N 3.34Å; R245-L247 PolarHBondContact O-N 3Å; R245-F248 PolarHBondContact O-N 3.44Å; R245-I249 HydrophobicContact CG-CD1 3.7Å; R245-I249 HydrophobicContact CG-CG1 4.34Å; R245-I249 WeakPolarHBondContact O-CG1 3.22Å; R245-I249 PolarHBondContact O-N 3.46Å
246	A	92.7	Very high	92.2	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-59.3	-44.3	177.7	0	0	0	0	0	112.2	Y149 A242 L243 F248 R250 L254	Y149-A246 HydrophobicContact CD1-CB 3.55Å; Y149-A246 HydrophobicContact CE1-CB 3.42Å; Y149-A246 VanDerWaalsContact CE1-CB 3.42Å; Y149-A246 HydrophobicContact CG-CB 4.48Å; A242-A246 PolarHBondContact O-N 3.28Å; L243-A246 WeakPolarHBondContact O-CB 3.31Å; L243-A246 PolarHBondContact O-N 3.21Å; L243-A246 VanDerWaalsContact O-N 3.14Å; A246-F248 VanDerWaalsContact C-N 3.35Å; A246-R250 PolarHBondContact O-N 2.93Å; A246-L254 HydrophobicContact CB-CD1 3.97Å
247	L	92.9	Very high	92.6	Very high	5 Å²	5	15 Å²	15	3%	0.026	7%	0.065	C	C	.	.	H	α-helix	trans	-68.6	-33.1	176.6	-64.4	174.2	0	0	0	112.7	R211 I215 L243 A244 R245 L254 W270 L271 L275	R211-L247 PolarHBondContact NH2-O 3.31Å; I215-L247 HydrophobicContact CD1-CB 4.41Å; I215-L247 HydrophobicContact CG2-CB 4.23Å; I215-L247 HydrophobicContact CG2-CD1 4.21Å; L243-L247 HydrophobicContact CD1-CG 4.48Å; L243-L247 HydrophobicContact CG-CD1 4.3Å; L243-L247 WeakPolarHBondContact O-CG 3.34Å; L243-L247 PolarHBondContact O-N 2.81Å; A244-L247 PolarHBondContact O-N 3.05Å; R245-L247 VanDerWaalsContact C-N 3.34Å; R245-L247 PolarHBondContact O-N 3Å; L247-L254 HydrophobicContact CD2-CD2 4.37Å; L247-W270 HydrophobicContact CD1-CH2 4.17Å; L247-W270 HydrophobicContact CD1-CZ3 3.84Å; L247-L271 HydrophobicContact CD1-CD1 3.76Å; L247-L271 HydrophobicContact CD2-CD1 4.36Å; L247-L275 HydrophobicContact CD2-CD2 3.68Å; L247-L275 HydrophobicContact CD2-CG 4.5Å
248	F	91.6	Very high	92.5	Very high	1 Å²	1	13.8 Å²	13.8	0%	0.004	6%	0.062	C	C	.	.	H	α-helix	trans	-68.4	-48.6	176.4	-178.2	-99.5	0	0	0	111.6	V166 V169 L203 A208 R211 A212 I215 A244 R245 A246 R250	V166-F248 HydrophobicContact CG1-CB 3.6Å; V166-F248 HydrophobicContact CG1-CD1 4.19Å; V166-F248 HydrophobicContact CG1-CD2 4.1Å; V166-F248 HydrophobicContact CG1-CG 3.71Å; V166-F248 WeakPolarHBondContact O-CD1 3.42Å; V169-F248 HydrophobicContact CB-CE1 4.49Å; V169-F248 HydrophobicContact CG1-CD1 3.71Å; V169-F248 HydrophobicContact CG1-CE1 3.78Å; V169-F248 HydrophobicContact CG2-CE1 3.89Å; L203-F248 HydrophobicContact CD2-CE1 4.2Å; A208-F248 HydrophobicContact CB-CE2 4.39Å; A208-F248 HydrophobicContact CB-CZ 3.87Å; A208-F248 WeakPolarHBondContact O-CE2 3.34Å; R211-F248 HydrophobicContact CB-CE2 4.23Å; R211-F248 HydrophobicContact CG-CD2 4.15Å; R211-F248 HydrophobicContact CG-CE2 4.23Å; R211-F248 PolarHBondContact NH2-O 2.9Å; A212-F248 HydrophobicContact CB-CD2 4.14Å; A212-F248 HydrophobicContact CB-CE2 4.14Å; I215-F248 HydrophobicContact CD1-CB 4.02Å; I215-F248 HydrophobicContact CD1-CD2 4.24Å; A244-F248 VanDerWaalsContact O-CB 3.31Å; A244-F248 WeakPolarHBondContact O-CB 3.39Å; A244-F248 PolarHBondContact O-N 3.46Å; R245-F248 PolarHBondContact O-N 3.44Å; A246-F248 VanDerWaalsContact C-N 3.35Å; F248-R250 VanDerWaalsContact C-N 3.29Å; F248-R250 PolarHBondContact O-N 2.91Å
249	I	88.8	Confident	92.4	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.015	6%	0.059	C	C	.	.	H	α-helix	trans	-62.5	-35.1	179.4	-70.6	166.6	0	0	0	112.5	Y149 V169 E172 R199 R245	Y149-I249 HydrophobicContact CD2-CD1 3.85Å; Y149-I249 HydrophobicContact CD2-CG2 4.44Å; Y149-I249 HydrophobicContact CE2-CD1 3.34Å; V169-I249 HydrophobicContact CB-CG1 4.42Å; V169-I249 HydrophobicContact CG1-CD1 4.1Å; V169-I249 HydrophobicContact CG1-CG1 3.52Å; E172-I249 HydrophobicContact CG-CD1 4.13Å; E172-I249 HydrophobicContact CG-CG2 4.4Å; E172-I249 WeakPolarHBondContact OE1-CD1 3.31Å; R199-I249 PolarHBondContact NE-O 2.91Å; R199-I249 PolarHBondContact NH2-O 3.23Å; R199-I249 VanDerWaalsContact NH2-O 3.17Å; R245-I249 HydrophobicContact CG-CD1 3.7Å; R245-I249 HydrophobicContact CG-CG1 4.34Å; R245-I249 WeakPolarHBondContact O-CG1 3.22Å; R245-I249 PolarHBondContact O-N 3.46Å
250	R	89	Confident	92.3	Very high	53 Å²	53	11.1 Å²	11.1	20%	0.2	5%	0.052	C	C	.	.			trans	48.8	66.3	179.2	-166.3	177.1	-74.1	150.7	-6.8	112.4	R199 E202 R211 A246 F248 E274 F278	R199-R250 PolarHBondContact NE-O 3.41Å; E202-R250 VanDerWaalsContact CD-NH1 3.26Å; E202-R250 IonicContact OE1-NH1 3.02Å; E202-R250 PolarHBondContact OE1-NH1 2.89Å; E202-R250 IonicContact OE2-CZ 3.78Å; E202-R250 IonicContact OE2-NH1 3.83Å; E202-R250 PolarHBondContact OE2-NH1 2.87Å; R211-R250 VanDerWaalsContact NH2-NH1 3.19Å; A246-R250 PolarHBondContact O-N 2.93Å; F248-R250 VanDerWaalsContact C-N 3.29Å; F248-R250 PolarHBondContact O-N 2.91Å; R250-E274 IonicContact NH2-OE1 3.3Å; R250-F278 HydrophobicContact CG-CE2 3.9Å; R250-F278 HydrophobicContact CG-CZ 4.46Å
251	P	90.9	Very high	91.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.061	C	C	.	.			trans	-64.9	164.6	-177.8	36.3	-44.7	0	0	0	113.1	D147 M253 L254 R280	D147-P251 WeakPolarHBondContact OD2-CA 3.45Å; D147-P251 VanDerWaalsContact OD2-CB 3.25Å; D147-P251 WeakPolarHBondContact OD2-CB 3.4Å; P251-M253 VanDerWaalsContact C-N 3.28Å; P251-M253 WeakPolarHBondContact CG-O 3.46Å; P251-L254 HydrophobicContact CG-CB 3.76Å; P251-L254 HydrophobicContact CG-CD1 4.05Å; P251-L254 HydrophobicContact CG-CG 4.45Å; P251-R280 WeakPolarHBondContact O-CD 3.44Å
252	F	90.8	Very high	90.8	Very high	9 Å²	9	16.4 Å²	16.4	4%	0.039	8%	0.078	C	C	.	.	S	Bend	trans	-61.5	-37.2	168.7	-157.2	-80.9	0	0	0	112.4	T88 I146 D147 R280 I281	T88-F252 HydrophobicContact CG2-CE1 4.41Å; T88-F252 HydrophobicContact CG2-CE2 3.99Å; T88-F252 HydrophobicContact CG2-CZ 3.5Å; T88-F252 VanDerWaalsContact CG2-CZ 3.5Å; T88-F252 WeakPolarHBondContact O-CE1 3.37Å; I146-F252 HydrophobicContact CB-CD1 4.34Å; I146-F252 HydrophobicContact CG1-CD1 4.01Å; I146-F252 HydrophobicContact CG1-CE1 4.37Å; I146-F252 HydrophobicContact CG2-CB 4.28Å; I146-F252 HydrophobicContact CG2-CD1 3.83Å; I146-F252 HydrophobicContact CG2-CG 4.4Å; D147-F252 PolarHBondContact O-N 3.17Å; D147-F252 WeakPolarHBondContact OD1-CB 3.31Å; D147-F252 PolarHBondContact OD1-N 3.26Å; F252-R280 WeakPolarHBondContact O-CB 3.44Å; F252-I281 HydrophobicContact CD1-CD1 4.38Å; F252-I281 HydrophobicContact CE1-CD1 4.1Å; F252-I281 HydrophobicContact CE1-CG1 4.29Å; F252-I281 PolarHBondContact O-N 2.93Å
253	M	95	Very high	90.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.6	172.4	-173.6	-179.8	-67.5	0	0	110.2	V90 L112 V135 I146 D147 I148 Y149 P251 L255 I281	V90-M253 HydrophobicContact CB-CE 4.36Å; V90-M253 HydrophobicContact CG2-CE 3.84Å; L112-M253 HydrophobicContact CD1-CE 3.85Å; L112-M253 HydrophobicContact CD1-SD 4.3Å; V135-M253 HydrophobicContact CG1-SD 3.66Å; I146-M253 HydrophobicContact CG2-CB 4.03Å; I146-M253 HydrophobicContact CG2-CE 4.14Å; D147-M253 PolarHBondContact O-N 3.3Å; I148-M253 WeakPolarHBondContact CA-O 3.42Å; I148-M253 HydrophobicContact CD1-SD 4.49Å; I148-M253 HydrophobicContact CG1-CB 4.23Å; I148-M253 HydrophobicContact CG1-SD 4.24Å; I148-M253 HydrophobicContact CG2-CB 4.39Å; I148-M253 HydrophobicContact CG2-CG 4.35Å; I148-M253 HydrophobicContact CG2-SD 4.28Å; Y149-M253 PolarHBondContact N-O 3.07Å; P251-M253 VanDerWaalsContact C-N 3.28Å; P251-M253 WeakPolarHBondContact CG-O 3.46Å; M253-L255 HydrophobicContact CG-CD2 3.79Å; M253-L255 HydrophobicContact CG-CG 4.33Å; M253-L255 HydrophobicContact SD-CD2 3.95Å; M253-I281 WeakPolarHBondContact CA-O 3.34Å; M253-I281 HydrophobicContact CB-CB 4.38Å; M253-I281 HydrophobicContact CE-CD1 3.95Å; M253-I281 HydrophobicContact CE-CG2 4.27Å; M253-I281 HydrophobicContact CG-CB 4.26Å; M253-I281 HydrophobicContact CG-CG2 4.05Å
254	L	96.5	Very high	89.9	Confident	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.3	174.1	-177.6	57.6	0	0	0	109.4	Y149 A246 L247 P251 L256 L275 F278 I281 L282 V283	Y149-L254 HydrophobicContact CD1-CD1 4.27Å; A246-L254 HydrophobicContact CB-CD1 3.97Å; L247-L254 HydrophobicContact CD2-CD2 4.37Å; P251-L254 HydrophobicContact CG-CB 3.76Å; P251-L254 HydrophobicContact CG-CD1 4.05Å; P251-L254 HydrophobicContact CG-CG 4.45Å; L254-L256 HydrophobicContact CD1-CD2 3.88Å; L254-L256 HydrophobicContact CD1-CG 4.38Å; L254-L256 HydrophobicContact CD2-CD1 4.19Å; L254-L256 HydrophobicContact CD2-CD2 4.35Å; L254-L256 HydrophobicContact CD2-CG 4.32Å; L254-L256 HydrophobicContact CG-CD1 4.4Å; L254-L256 HydrophobicContact CG-CD2 4.03Å; L254-L256 HydrophobicContact CG-CG 3.99Å; L254-L275 HydrophobicContact CD2-CD2 4.27Å; L254-F278 HydrophobicContact CB-CE1 4.09Å; L254-F278 HydrophobicContact CB-CE2 4.37Å; L254-F278 HydrophobicContact CB-CZ 3.69Å; L254-F278 HydrophobicContact CD2-CE2 3.92Å; L254-F278 HydrophobicContact CD2-CZ 4.11Å; L254-I281 PolarHBondContact N-O 3.29Å; L254-L282 HydrophobicContact CB-CD1 4Å; L254-L282 HydrophobicContact CD2-CD1 3.94Å; L254-L282 HydrophobicContact CG-CD1 3.94Å; L254-V283 PolarHBondContact O-N 3.06Å
255	L	97.1	Very high	89.4	Confident	1 Å²	1	16.4 Å²	16.4	1%	0.005	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.4	176.1	-50.6	179.9	0	0	0	109.2	L132 V135 I148 Y149 H150 L151 M253 V283	L132-L255 HydrophobicContact CD2-CB 4.39Å; L132-L255 HydrophobicContact CD2-CD2 4.23Å; V135-L255 HydrophobicContact CB-CD1 3.99Å; V135-L255 HydrophobicContact CG1-CD1 3.7Å; V135-L255 HydrophobicContact CG1-CD2 4.28Å; I148-L255 HydrophobicContact CG2-CD1 3.75Å; I148-L255 HydrophobicContact CG2-CG 4.01Å; Y149-L255 PolarHBondContact O-N 2.73Å; H150-L255 HydrophobicContact CB-CB 4.24Å; H150-L255 HydrophobicContact CB-CD1 4.19Å; L151-L255 PolarHBondContact N-O 2.93Å; M253-L255 HydrophobicContact CG-CD2 3.79Å; M253-L255 HydrophobicContact CG-CG 4.33Å; M253-L255 HydrophobicContact SD-CD2 3.95Å; L255-V283 WeakPolarHBondContact CA-O 3.37Å; L255-V283 HydrophobicContact CD2-CB 3.66Å; L255-V283 HydrophobicContact CD2-CG2 3.81Å
256	L	95.5	Very high	89.1	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	126.6	-180	-58.9	179	0	0	0	110.2	L151 L243 L254 P259 L275 L282 V283 L284 V285	L151-L256 HydrophobicContact CB-CD2 3.86Å; L151-L256 HydrophobicContact CD2-CD2 3.88Å; L243-L256 HydrophobicContact CD1-CD1 4.38Å; L243-L256 HydrophobicContact CD1-CD2 3.95Å; L254-L256 HydrophobicContact CD1-CD2 3.88Å; L254-L256 HydrophobicContact CD1-CG 4.38Å; L254-L256 HydrophobicContact CD2-CD1 4.19Å; L254-L256 HydrophobicContact CD2-CD2 4.35Å; L254-L256 HydrophobicContact CD2-CG 4.32Å; L254-L256 HydrophobicContact CG-CD1 4.4Å; L254-L256 HydrophobicContact CG-CD2 4.03Å; L254-L256 HydrophobicContact CG-CG 3.99Å; L256-P259 HydrophobicContact CB-CB 4.16Å; L256-P259 HydrophobicContact CB-CG 4Å; L256-P259 HydrophobicContact CD1-CB 4.16Å; L256-P259 HydrophobicContact CD1-CG 4.15Å; L256-L275 HydrophobicContact CD1-CD1 3.94Å; L256-L275 HydrophobicContact CD1-CD2 4.16Å; L256-L282 HydrophobicContact CD1-CD1 4.05Å; L256-L282 HydrophobicContact CG-CD1 4.35Å; L256-V283 PolarHBondContact N-O 3.06Å; L256-L284 HydrophobicContact CB-CB 4.26Å; L256-L284 CarbonylContact O-C 3.57Å; L256-L284 VanDerWaalsContact O-CA 3.3Å; L256-L284 WeakPolarHBondContact O-CA 3.24Å; L256-V285 PolarHBondContact O-N 3.42Å
257	D	91.9	Very high	89	Confident	54 Å²	54	16.5 Å²	16.5	29%	0.289	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.5	175.2	-160.4	7.4	0	0	0	109.8	S129 L132 V285	S129-D257 WeakPolarHBondContact CB-OD2 3.33Å; S129-D257 PolarHBondContact OG-OD2 3.22Å; L132-D257 HydrophobicContact CD1-CB 3.98Å; D257-V285 WeakPolarHBondContact OD1-CB 3.42Å; D257-V285 WeakPolarHBondContact OD1-CG1 3.44Å
258	E	87.6	Confident	88.8	Confident	21 Å²	21	16.6 Å²	16.6	10%	0.098	8%	0.083	C	C	.	.	S	Bend	trans	48.7	58.5	-177.4	-62.1	-65.3	152.2	0	0	114.4	T260 N261 V285 S286 H287	E258-T260 PolarHBondContact O-N 3.23Å; E258-T260 VanDerWaalsContact O-N 3.13Å; E258-N261 WeakPolarHBondContact CB-ND2 3.28Å; E258-N261 WeakPolarHBondContact O-CB 3.47Å; E258-N261 PolarHBondContact O-N 3.17Å; E258-N261 VanDerWaalsContact O-N 3.08Å; E258-V285 WeakPolarHBondContact CA-O 3.38Å; E258-V285 HydrophobicContact CG-CG1 4.33Å; E258-V285 PolarHBondContact N-O 3.3Å; E258-V285 WeakPolarHBondContact OE1-CG1 3.38Å; E258-S286 VanDerWaalsContact CD-CA 3.5Å; E258-S286 WeakPolarHBondContact OE1-CA 3.45Å; E258-S286 PolarHBondContact OE1-N 2.82Å; E258-S286 WeakPolarHBondContact OE2-CA 3.44Å; E258-H287 IonicContact OE1-CD2 3.08Å; E258-H287 PolarHBondContact OE1-CD2 3.22Å; E258-H287 IonicContact OE1-CG 3.64Å; E258-H287 PolarHBondContact OE1-N 2.93Å; E258-H287 IonicContact OE1-NE2 3.54Å; E258-H287 PolarHBondContact OE1-NE2 3.46Å; E258-H287 IonicContact OE2-CD2 2.93Å; E258-H287 PolarHBondContact OE2-N 3.36Å
259	P	89.9	Confident	88.8	Confident	12 Å²	12	16.6 Å²	16.6	8%	0.078	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.3	-173.2	30.2	-37.1	0	0	0	114	L243 L256 N261 L263 L271 V285 F291	L243-P259 HydrophobicContact CD1-CB 4.48Å; L256-P259 HydrophobicContact CB-CB 4.16Å; L256-P259 HydrophobicContact CB-CG 4Å; L256-P259 HydrophobicContact CD1-CB 4.16Å; L256-P259 HydrophobicContact CD1-CG 4.15Å; P259-N261 VanDerWaalsContact C-N 3.26Å; P259-L263 WeakPolarHBondContact O-CD1 3.39Å; P259-L263 WeakPolarHBondContact O-CG 3.35Å; P259-L271 HydrophobicContact CB-CD2 4.11Å; P259-L271 HydrophobicContact CG-CD2 4.5Å; P259-V285 WeakPolarHBondContact CD-O 3.27Å; P259-F291 HydrophobicContact CG-CE1 4.01Å; P259-F291 HydrophobicContact CG-CZ 4.21Å
260	T	86.6	Confident	89	Confident	19 Å²	19	17.8 Å²	17.8	12%	0.117	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.3	176.6	51.6	0	0	0	0	112.5	E258 H262 L263 F291	E258-T260 PolarHBondContact O-N 3.23Å; E258-T260 VanDerWaalsContact O-N 3.13Å; T260-H262 PolarHBondContact O-N 3.03Å; T260-L263 WeakPolarHBondContact O-CB 3.46Å; T260-L263 PolarHBondContact O-N 3.38Å; T260-F291 HydrophobicContact CG2-CB 4.24Å; T260-F291 HydrophobicContact CG2-CD1 3.9Å; T260-F291 HydrophobicContact CG2-CD2 3.62Å; T260-F291 HydrophobicContact CG2-CE1 4.07Å; T260-F291 HydrophobicContact CG2-CE2 3.8Å; T260-F291 HydrophobicContact CG2-CG 3.65Å; T260-F291 HydrophobicContact CG2-CZ 3.99Å
261	N	79.9	Confident	89.2	Confident	37 Å²	37	15.3 Å²	15.3	20%	0.198	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	134.5	176.9	-70.6	-11.9	0	0	0	110.1	E258 P259 L263	E258-N261 WeakPolarHBondContact CB-ND2 3.28Å; E258-N261 WeakPolarHBondContact O-CB 3.47Å; E258-N261 PolarHBondContact O-N 3.17Å; E258-N261 VanDerWaalsContact O-N 3.08Å; P259-N261 VanDerWaalsContact C-N 3.26Å; N261-L263 PolarHBondContact O-N 3.26Å; N261-L263 VanDerWaalsContact O-N 3.16Å
262	H	75.8	Confident	89.3	Confident	79 Å²	79	15.7 Å²	15.7	37%	0.366	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	6.4	-177.9	-39.9	-70.8	0	0	0	115.6	R240 T260 N436	R240-H262 PolarHBondContact NE-O 3.49Å; R240-H262 PolarHBondContact NH2-O 3.42Å; T260-H262 PolarHBondContact O-N 3.03Å; H262-N436 PolarHBondContact O-ND2 3.37Å
263	L	84.3	Confident	89.4	Confident	3 Å²	3	18.3 Å²	18.3	2%	0.016	9%	0.092	C	C	.	.			trans	-89.9	138.5	170	-63.4	-169.6	0	0	0	110.1	L219 R240 L243 P259 T260 N261 A267 C268 L271 H575	L219-L263 HydrophobicContact CD2-CD2 4.42Å; R240-L263 HydrophobicContact CG-CD2 3.58Å; L243-L263 HydrophobicContact CD2-CD1 4.15Å; P259-L263 WeakPolarHBondContact O-CD1 3.39Å; P259-L263 WeakPolarHBondContact O-CG 3.35Å; T260-L263 WeakPolarHBondContact O-CB 3.46Å; T260-L263 PolarHBondContact O-N 3.38Å; N261-L263 PolarHBondContact O-N 3.26Å; N261-L263 VanDerWaalsContact O-N 3.16Å; L263-A267 HydrophobicContact CB-CB 4.24Å; L263-A267 HydrophobicContact CD2-CB 4.2Å; L263-C268 WeakPolarHBondContact CB-SG 3.2Å; L263-L271 HydrophobicContact CD1-CB 4.44Å; L263-L271 HydrophobicContact CD1-CD2 3.57Å; L263-H575 PolarHBondContact O-CD2 2.94Å; L263-H575 PolarHBondContact O-NE2 3.43Å
264	D	84.2	Confident	89.3	Confident	4 Å²	4	19.7 Å²	19.7	2%	0.021	10%	0.098	C	C	.	.			trans	-77.1	170.3	169.7	41.8	41.8	0	0	0	110.7	R240 D266 A267 C268 N436 H575	R240-D264 IonicContact CZ-OD2 3.46Å; R240-D264 IonicContact NH1-OD1 2.75Å; R240-D264 IonicContact NH1-OD2 3.88Å; R240-D264 PolarHBondContact NH1-OD2 2.91Å; R240-D264 IonicContact NH2-OD1 2.75Å; R240-D264 IonicContact NH2-OD2 3.17Å; R240-D264 PolarHBondContact NH2-OD2 3.23Å; R240-D264 VanDerWaalsContact NH2-OD2 3.13Å; D264-D266 PolarHBondContact O-N 3.1Å; D264-A267 PolarHBondContact O-N 3.26Å; D264-A267 WeakPolarHBondContact OD1-CB 3.41Å; D264-A267 PolarHBondContact OD1-N 3.05Å; D264-C268 WeakPolarHBondContact O-CB 3.02Å; D264-C268 PolarHBondContact O-N 2.76Å; D264-C268 PolarHBondContact O-SG 2.98Å; D264-C268 VanDerWaalsContact O-SG 3.36Å; D264-N436 WeakPolarHBondContact OD2-CB 3.43Å; D264-N436 PolarHBondContact OD2-N 3.08Å; D264-H575 VanDerWaalsContact CA-CE1 3.42Å; D264-H575 WeakPolarHBondContact CA-CE1 3.5Å
265	L	84.2	Confident	89.2	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-55.9	-40.2	179.5	-71.4	168.7	0	0	0	111.8	C268 V269 V433 H575 F577 I580 Y605 L609	L265-C268 PolarHBondContact O-N 3.4Å; L265-V269 VanDerWaalsContact O-CG2 3.28Å; L265-V269 WeakPolarHBondContact O-CG2 3.26Å; L265-V269 PolarHBondContact O-N 3.37Å; L265-V433 HydrophobicContact CD1-CB 3.68Å; L265-V433 HydrophobicContact CD1-CG1 3.4Å; L265-V433 VanDerWaalsContact CD1-CG1 3.4Å; L265-H575 HydrophobicContact CD2-CB 4.36Å; L265-H575 VanDerWaalsContact CD2-O 3.31Å; L265-H575 WeakPolarHBondContact CD2-O 3.4Å; L265-H575 PolarHBondContact N-ND1 2.65Å; L265-F577 HydrophobicContact CB-CZ 4.4Å; L265-F577 HydrophobicContact CD2-CD2 4.03Å; L265-F577 HydrophobicContact CD2-CE1 4.04Å; L265-F577 HydrophobicContact CD2-CE2 3.55Å; L265-F577 HydrophobicContact CD2-CG 4.48Å; L265-F577 HydrophobicContact CD2-CZ 3.55Å; L265-F577 HydrophobicContact CG-CZ 4.5Å; L265-I580 HydrophobicContact CD1-CD1 4.49Å; L265-Y605 HydrophobicContact CD1-CE1 4.43Å; L265-L609 HydrophobicContact CB-CD1 4.26Å
266	D	86.7	Confident	89	Confident	42 Å²	42	24 Å²	24	23%	0.225	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-51	179.1	-54.8	-35.3	0	0	0	111.2	D264 C268 V269 W270 L609	D264-D266 PolarHBondContact O-N 3.1Å; D266-C268 PolarHBondContact O-N 2.94Å; D266-V269 PolarHBondContact O-N 2.99Å; D266-W270 PolarHBondContact O-N 2.94Å; D266-L609 WeakPolarHBondContact OD1-CD1 3.16Å; D266-L609 WeakPolarHBondContact OD1-CD2 3.27Å
267	A	89.7	Confident	88.8	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-34.8	178.3	0	0	0	0	0	112.6	L263 D264 W270 L271	L263-A267 HydrophobicContact CB-CB 4.24Å; L263-A267 HydrophobicContact CD2-CB 4.2Å; D264-A267 PolarHBondContact O-N 3.26Å; D264-A267 WeakPolarHBondContact OD1-CB 3.41Å; D264-A267 PolarHBondContact OD1-N 3.05Å; A267-W270 PolarHBondContact O-N 2.5Å; A267-L271 VanDerWaalsContact O-CB 3.24Å; A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.4Å
268	C	89.9	Confident	88.9	Confident	8 Å²	8	26.3 Å²	26.3	5%	0.054	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-47.5	174.9	-80.4	0	0	0	0	111.6	L263 D264 L265 D266 W270 L271 E272	L263-C268 WeakPolarHBondContact CB-SG 3.2Å; D264-C268 WeakPolarHBondContact O-CB 3.02Å; D264-C268 PolarHBondContact O-N 2.76Å; D264-C268 PolarHBondContact O-SG 2.98Å; D264-C268 VanDerWaalsContact O-SG 3.36Å; L265-C268 PolarHBondContact O-N 3.4Å; D266-C268 PolarHBondContact O-N 2.94Å; C268-W270 VanDerWaalsContact C-N 3.35Å; C268-L271 PolarHBondContact O-N 3.29Å; C268-E272 WeakPolarHBondContact O-CB 3.47Å; C268-E272 PolarHBondContact O-N 3.43Å
269	V	90.8	Very high	88.9	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-41.7	178.5	170.9	0	0	0	0	110.9	L265 D266 E272 E273 F577 K606 L609 K610 L613	L265-V269 VanDerWaalsContact O-CG2 3.28Å; L265-V269 WeakPolarHBondContact O-CG2 3.26Å; L265-V269 PolarHBondContact O-N 3.37Å; D266-V269 PolarHBondContact O-N 2.99Å; V269-E272 WeakPolarHBondContact O-CB 3.33Å; V269-E272 PolarHBondContact O-N 3.23Å; V269-E273 PolarHBondContact O-N 3.46Å; V269-F577 HydrophobicContact CG2-CE2 3.95Å; V269-F577 HydrophobicContact CG2-CZ 3.6Å; V269-K606 HydrophobicContact CG2-CG 4Å; V269-L609 HydrophobicContact CG1-CB 4.46Å; V269-L609 HydrophobicContact CG2-CD1 4.38Å; V269-K610 HydrophobicContact CG1-CD 4.32Å; V269-K610 HydrophobicContact CG1-CG 3.39Å; V269-L613 HydrophobicContact CG1-CD1 4.07Å
270	W	92.8	Very high	89	Confident	29 Å²	29	35.1 Å²	35.1	11%	0.11	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-45.5	175.2	-178.4	85.5	0	0	0	112.1	I215 G218 L219 L247 D266 A267 C268 E272 E273 E274 L613	I215-W270 HydrophobicContact CB-CH2 4.14Å; I215-W270 HydrophobicContact CG1-CH2 4.17Å; I215-W270 HydrophobicContact CG2-CH2 3.91Å; I215-W270 HydrophobicContact CG2-CZ3 4.46Å; G218-W270 VanDerWaalsContact CA-CD2 3.49Å; L219-W270 HydrophobicContact CD1-CZ3 4.46Å; L219-W270 HydrophobicContact CD2-CE3 3.94Å; L219-W270 HydrophobicContact CD2-CZ3 3.92Å; L219-W270 HydrophobicContact CG-CE3 4.08Å; L219-W270 HydrophobicContact CG-CZ3 3.82Å; L247-W270 HydrophobicContact CD1-CH2 4.17Å; L247-W270 HydrophobicContact CD1-CZ3 3.84Å; D266-W270 PolarHBondContact O-N 2.94Å; A267-W270 PolarHBondContact O-N 2.5Å; C268-W270 VanDerWaalsContact C-N 3.35Å; W270-E272 VanDerWaalsContact C-N 3.32Å; W270-E272 PolarHBondContact O-N 3.15Å; W270-E273 PolarHBondContact O-N 3.45Å; W270-E274 HydrophobicContact CH2-CB 4.08Å; W270-E274 HydrophobicContact CH2-CG 3.96Å; W270-E274 HydrophobicContact CZ2-CB 4.28Å; W270-E274 HydrophobicContact CZ2-CG 4.32Å; W270-E274 HydrophobicContact CZ3-CB 4.27Å; W270-E274 HydrophobicContact CZ3-CG 4.48Å; W270-E274 PolarHBondContact O-N 3.11Å; W270-L613 HydrophobicContact CB-CD1 3.94Å; W270-L613 HydrophobicContact CB-CD2 4.4Å
271	L	93.8	Very high	89.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.6	-179.2	67.3	0	0	0	111.8	L243 L247 P259 L263 A267 C268 E273 E274 L275 F291	L243-L271 HydrophobicContact CD1-CD1 4.48Å; L243-L271 HydrophobicContact CD2-CD1 4.06Å; L243-L271 HydrophobicContact CD2-CD2 3.94Å; L243-L271 HydrophobicContact CG-CD1 4.49Å; L247-L271 HydrophobicContact CD1-CD1 3.76Å; L247-L271 HydrophobicContact CD2-CD1 4.36Å; P259-L271 HydrophobicContact CB-CD2 4.11Å; P259-L271 HydrophobicContact CG-CD2 4.5Å; L263-L271 HydrophobicContact CD1-CB 4.44Å; L263-L271 HydrophobicContact CD1-CD2 3.57Å; A267-L271 VanDerWaalsContact O-CB 3.24Å; A267-L271 WeakPolarHBondContact O-CB 3.47Å; A267-L271 PolarHBondContact O-N 3.4Å; C268-L271 PolarHBondContact O-N 3.29Å; L271-E273 PolarHBondContact O-N 2.87Å; L271-E274 PolarHBondContact O-N 2.93Å; L271-L275 HydrophobicContact CD1-CD1 3.88Å; L271-L275 HydrophobicContact CD1-CG 3.89Å; L271-L275 HydrophobicContact CD2-CD1 4.29Å; L271-L275 HydrophobicContact CG-CD1 3.8Å; L271-L275 HydrophobicContact CG-CG 4.18Å; L271-L275 WeakPolarHBondContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CG 3.45Å; L271-L275 PolarHBondContact O-N 3.08Å; L271-F291 HydrophobicContact CD2-CE2 4.07Å; L271-F291 HydrophobicContact CD2-CZ 3.85Å; L271-F291 HydrophobicContact CG-CE2 4.19Å; L271-F291 HydrophobicContact CG-CZ 4.14Å
272	E	93	Very high	90.2	Very high	8 Å²	8	32.4 Å²	32.4	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-55.8	-49.6	175	-174.2	-166.7	128.7	0	0	110.7	C268 V269 W270 K276 F291 V295 K606 K610	C268-E272 WeakPolarHBondContact O-CB 3.47Å; C268-E272 PolarHBondContact O-N 3.43Å; V269-E272 WeakPolarHBondContact O-CB 3.33Å; V269-E272 PolarHBondContact O-N 3.23Å; W270-E272 VanDerWaalsContact C-N 3.32Å; W270-E272 PolarHBondContact O-N 3.15Å; E272-K276 WeakPolarHBondContact O-CB 3.41Å; E272-K276 PolarHBondContact O-N 3.12Å; E272-F291 HydrophobicContact CB-CD2 4.27Å; E272-F291 HydrophobicContact CB-CE2 4.23Å; E272-V295 HydrophobicContact CB-CG2 4.38Å; E272-V295 HydrophobicContact CG-CG2 3.94Å; E272-K606 IonicContact OE1-NZ 3.62Å; E272-K606 WeakPolarHBondContact OE2-CE 3.44Å; E272-K606 IonicContact OE2-NZ 3.15Å; E272-K606 PolarHBondContact OE2-NZ 3.19Å; E272-K610 IonicContact OE1-NZ 3.45Å; E272-K610 PolarHBondContact OE1-NZ 3.4Å
273	E	92.7	Very high	91.3	Very high	65 Å²	65	29 Å²	29	30%	0.304	14%	0.138	S	C	.	.	H	α-helix	trans	-68.8	-39.1	-179.6	-67.9	-60.9	153.5	0	0	112.7	V269 W270 L271 K276 K610	V269-E273 PolarHBondContact O-N 3.46Å; W270-E273 PolarHBondContact O-N 3.45Å; L271-E273 PolarHBondContact O-N 2.87Å; E273-K276 IonicContact OE1-NZ 3.97Å; E273-K276 IonicContact OE2-NZ 3.59Å; E273-K610 WeakPolarHBondContact OE1-CE 3.33Å; E273-K610 IonicContact OE1-NZ 3.84Å; E273-K610 PolarHBondContact OE1-NZ 3.01Å
274	E	92.8	Very high	91.8	Very high	28 Å²	28	28.9 Å²	28.9	13%	0.131	14%	0.137	C	C	.	.	H	α-helix	trans	-65.5	-46.1	176.2	-174.3	72.9	-153.9	0	0	110.8	R214 R250 W270 L271 K276 T277	R214-E274 IonicContact NH2-OE1 2.71Å; R214-E274 IonicContact NH2-OE2 2.77Å; R214-E274 PolarHBondContact NH2-OE2 3.36Å; R250-E274 IonicContact NH2-OE1 3.3Å; W270-E274 HydrophobicContact CH2-CB 4.08Å; W270-E274 HydrophobicContact CH2-CG 3.96Å; W270-E274 HydrophobicContact CZ2-CB 4.28Å; W270-E274 HydrophobicContact CZ2-CG 4.32Å; W270-E274 HydrophobicContact CZ3-CB 4.27Å; W270-E274 HydrophobicContact CZ3-CG 4.48Å; W270-E274 PolarHBondContact O-N 3.11Å; L271-E274 PolarHBondContact O-N 2.93Å; E274-K276 PolarHBondContact O-N 3.45Å; E274-T277 PolarHBondContact O-N 3.05Å; E274-T277 PolarHBondContact O-OG1 3.25Å
275	L	94.5	Very high	92.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-70.2	-29.8	179.9	-71.5	179.5	0	0	0	113.5	R117 L247 L254 L256 L271 T277 F278 L282 F291 V295	R117-L275 VanDerWaalsContact CD-O 3.23Å; R117-L275 WeakPolarHBondContact CD-O 3.17Å; L247-L275 HydrophobicContact CD2-CD2 3.68Å; L247-L275 HydrophobicContact CD2-CG 4.5Å; L254-L275 HydrophobicContact CD2-CD2 4.27Å; L256-L275 HydrophobicContact CD1-CD1 3.94Å; L256-L275 HydrophobicContact CD1-CD2 4.16Å; L271-L275 HydrophobicContact CD1-CD1 3.88Å; L271-L275 HydrophobicContact CD1-CG 3.89Å; L271-L275 HydrophobicContact CD2-CD1 4.29Å; L271-L275 HydrophobicContact CG-CD1 3.8Å; L271-L275 HydrophobicContact CG-CG 4.18Å; L271-L275 WeakPolarHBondContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CG 3.45Å; L271-L275 PolarHBondContact O-N 3.08Å; L275-T277 PolarHBondContact O-N 2.84Å; L275-F278 WeakPolarHBondContact O-CB 3.44Å; L275-F278 PolarHBondContact O-N 3.27Å; L275-L282 HydrophobicContact CB-CD2 4.14Å; L275-L282 HydrophobicContact CD1-CD2 4.46Å; L275-L282 HydrophobicContact CD2-CD1 4.25Å; L275-L282 HydrophobicContact CD2-CD2 4.03Å; L275-L282 HydrophobicContact CG-CD2 4.46Å; L275-F291 HydrophobicContact CD1-CE1 4.4Å; L275-F291 HydrophobicContact CD1-CZ 3.73Å; L275-V295 HydrophobicContact CB-CG1 3.78Å; L275-V295 HydrophobicContact CB-CG2 4.13Å
276	K	93.4	Very high	92.5	Very high	91 Å²	91	28.7 Å²	28.7	40%	0.396	14%	0.136	S	C	.	.	H	α-helix	trans	-59.3	-31.1	174.4	-178.6	178.8	177.2	-174.2	0	112.4	E272 E273 E274 F278	E272-K276 WeakPolarHBondContact O-CB 3.41Å; E272-K276 PolarHBondContact O-N 3.12Å; E273-K276 IonicContact OE1-NZ 3.97Å; E273-K276 IonicContact OE2-NZ 3.59Å; E274-K276 PolarHBondContact O-N 3.45Å; K276-F278 VanDerWaalsContact C-N 3.33Å
277	T	91.3	Very high	92.2	Very high	92 Å²	92	27.9 Å²	27.9	56%	0.564	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	1	176.8	70.7	0	0	0	0	114.2	E274 L275 K279	E274-T277 PolarHBondContact O-N 3.05Å; E274-T277 PolarHBondContact O-OG1 3.25Å; L275-T277 PolarHBondContact O-N 2.84Å; T277-K279 WeakPolarHBondContact O-CG 3.37Å; T277-K279 PolarHBondContact O-N 3.48Å
278	F	92.1	Very high	92	Very high	11 Å²	11	28.3 Å²	28.3	5%	0.048	13%	0.134	C	C	.	.			trans	-65.6	118.7	-179.2	-158.4	-95.7	0	0	0	111	R117 R250 L254 L275 K276 R280 L282	R117-F278 PolarHBondContact NH1-O 3.45Å; R250-F278 HydrophobicContact CG-CE2 3.9Å; R250-F278 HydrophobicContact CG-CZ 4.46Å; L254-F278 HydrophobicContact CB-CE1 4.09Å; L254-F278 HydrophobicContact CB-CE2 4.37Å; L254-F278 HydrophobicContact CB-CZ 3.69Å; L254-F278 HydrophobicContact CD2-CE2 3.92Å; L254-F278 HydrophobicContact CD2-CZ 4.11Å; L275-F278 WeakPolarHBondContact O-CB 3.44Å; L275-F278 PolarHBondContact O-N 3.27Å; K276-F278 VanDerWaalsContact C-N 3.33Å; F278-R280 HydrophobicContact CD1-CB 4.21Å; F278-R280 HydrophobicContact CE1-CB 3.63Å; F278-R280 HydrophobicContact CZ-CB 4.24Å; F278-L282 HydrophobicContact CD1-CB 3.84Å; F278-L282 HydrophobicContact CE1-CB 4.27Å
279	K	89.5	Confident	91.8	Very high	183 Å²	183	28.8 Å²	28.8	80%	0.796	14%	0.136	S	C	*	.			trans	-92.1	-6.5	-171.9	-61.9	-177.2	-178.3	173.8	0	114.7	G115 T277	G115-K279 WeakPolarHBondContact CA-O 3.32Å; G115-K279 PolarHBondContact N-O 3.48Å; T277-K279 WeakPolarHBondContact O-CG 3.37Å; T277-K279 PolarHBondContact O-N 3.48Å
280	R	91.1	Very high	91.7	Very high	35 Å²	35	30.6 Å²	30.6	13%	0.132	15%	0.145	C	C	.	.	S	Bend	trans	-110.8	-167.6	-175.3	-64.7	165.4	171	-125.4	-1.8	109.6	P251 F252 F278 L282	P251-R280 WeakPolarHBondContact O-CD 3.44Å; F252-R280 WeakPolarHBondContact O-CB 3.44Å; F278-R280 HydrophobicContact CD1-CB 4.21Å; F278-R280 HydrophobicContact CE1-CB 3.63Å; F278-R280 HydrophobicContact CZ-CB 4.24Å; R280-L282 PolarHBondContact O-N 3.02Å
281	I	95.4	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	116.4	179.1	-56.7	176.4	0	0	0	108.8	V90 L112 Y118 F252 M253 L254 V283	V90-I281 HydrophobicContact CG2-CD1 4.4Å; L112-I281 HydrophobicContact CB-CD1 4.32Å; L112-I281 HydrophobicContact CB-CG2 4.12Å; Y118-I281 HydrophobicContact CD2-CG2 4.47Å; Y118-I281 HydrophobicContact CE2-CG2 4.45Å; F252-I281 HydrophobicContact CD1-CD1 4.38Å; F252-I281 HydrophobicContact CE1-CD1 4.1Å; F252-I281 HydrophobicContact CE1-CG1 4.29Å; F252-I281 PolarHBondContact O-N 2.93Å; M253-I281 WeakPolarHBondContact CA-O 3.34Å; M253-I281 HydrophobicContact CB-CB 4.38Å; M253-I281 HydrophobicContact CE-CD1 3.95Å; M253-I281 HydrophobicContact CE-CG2 4.27Å; M253-I281 HydrophobicContact CG-CB 4.26Å; M253-I281 HydrophobicContact CG-CG2 4.05Å; L254-I281 PolarHBondContact N-O 3.29Å; I281-V283 HydrophobicContact CG2-CG2 4.12Å
282	L	97.3	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.4	169.1	176.5	63.3	0	0	0	108.3	R116 R117 Y118 L254 L256 L275 F278 R280 L284 V295	R116-L282 PolarHBondContact O-N 3.38Å; R117-L282 CarbonylContact C-O 3.58Å; R117-L282 WeakPolarHBondContact CA-O 3.32Å; R117-L282 HydrophobicContact CB-CB 4.23Å; R117-L282 HydrophobicContact CB-CD2 4.2Å; R117-L282 HydrophobicContact CG-CB 3.95Å; R117-L282 HydrophobicContact CG-CD2 4Å; Y118-L282 PolarHBondContact N-O 3.47Å; L254-L282 HydrophobicContact CB-CD1 4Å; L254-L282 HydrophobicContact CD2-CD1 3.94Å; L254-L282 HydrophobicContact CG-CD1 3.94Å; L256-L282 HydrophobicContact CD1-CD1 4.05Å; L256-L282 HydrophobicContact CG-CD1 4.35Å; L275-L282 HydrophobicContact CB-CD2 4.14Å; L275-L282 HydrophobicContact CD1-CD2 4.46Å; L275-L282 HydrophobicContact CD2-CD1 4.25Å; L275-L282 HydrophobicContact CD2-CD2 4.03Å; L275-L282 HydrophobicContact CG-CD2 4.46Å; F278-L282 HydrophobicContact CD1-CB 3.84Å; F278-L282 HydrophobicContact CE1-CB 4.27Å; R280-L282 PolarHBondContact O-N 3.02Å; L282-L284 HydrophobicContact CD2-CD2 3.95Å; L282-L284 HydrophobicContact CG-CD2 4.27Å; L282-V295 HydrophobicContact CD2-CG1 3.71Å
283	V	97.2	Very high	91.5	Very high	8 Å²	8	30.7 Å²	30.7	5%	0.048	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119	167.5	-170.6	0	0	0	0	107.3	L112 Y118 L120 L132 L254 L255 L256 I281	L112-V283 HydrophobicContact CD1-CG2 4.08Å; L112-V283 HydrophobicContact CD2-CG2 3.81Å; Y118-V283 HydrophobicContact CD2-CG2 4.39Å; Y118-V283 WeakPolarHBondContact O-CA 3.26Å; L120-V283 HydrophobicContact CB-CG1 4.4Å; L132-V283 HydrophobicContact CD2-CB 4.31Å; L132-V283 HydrophobicContact CD2-CG1 3.75Å; L254-V283 PolarHBondContact O-N 3.06Å; L255-V283 WeakPolarHBondContact CA-O 3.37Å; L255-V283 HydrophobicContact CD2-CB 3.66Å; L255-V283 HydrophobicContact CD2-CG2 3.81Å; L256-V283 PolarHBondContact N-O 3.06Å; I281-V283 HydrophobicContact CG2-CG2 4.12Å
284	L	95.3	Very high	91.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	137.6	-179.9	74.6	90.9	0	0	0	110.3	Y118 G119 L120 L256 L282 F291 L292 V295	Y118-L284 PolarHBondContact O-N 3.32Å; G119-L284 CarbonylContact C-O 3.51Å; G119-L284 WeakPolarHBondContact CA-O 3.41Å; L120-L284 PolarHBondContact N-O 2.96Å; L256-L284 HydrophobicContact CB-CB 4.26Å; L256-L284 CarbonylContact O-C 3.57Å; L256-L284 VanDerWaalsContact O-CA 3.3Å; L256-L284 WeakPolarHBondContact O-CA 3.24Å; L282-L284 HydrophobicContact CD2-CD2 3.95Å; L282-L284 HydrophobicContact CG-CD2 4.27Å; L284-F291 HydrophobicContact CD1-CD1 4.19Å; L284-F291 HydrophobicContact CD1-CE1 4.07Å; L284-F291 HydrophobicContact CD2-CE1 4.18Å; L284-L292 HydrophobicContact CD1-CD2 3.61Å; L284-V295 HydrophobicContact CD2-CB 4.17Å; L284-V295 HydrophobicContact CD2-CG1 3.61Å
285	V	93.6	Very high	91.5	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.6	165.2	175.5	0	0	0	0	106.1	L120 K128 L132 L256 D257 E258 P259	L120-V285 HydrophobicContact CB-CG2 3.79Å; L120-V285 HydrophobicContact CD2-CG2 3.75Å; L120-V285 HydrophobicContact CG-CG2 3.95Å; K128-V285 HydrophobicContact CB-CG1 4.42Å; K128-V285 HydrophobicContact CB-CG2 4.14Å; K128-V285 HydrophobicContact CD-CG1 4.13Å; L132-V285 HydrophobicContact CD1-CB 4.37Å; L132-V285 HydrophobicContact CD1-CG2 3.57Å; L132-V285 HydrophobicContact CG-CG2 4.19Å; L256-V285 PolarHBondContact O-N 3.42Å; D257-V285 WeakPolarHBondContact OD1-CB 3.42Å; D257-V285 WeakPolarHBondContact OD1-CG1 3.44Å; E258-V285 WeakPolarHBondContact CA-O 3.38Å; E258-V285 HydrophobicContact CG-CG1 4.33Å; E258-V285 PolarHBondContact N-O 3.3Å; E258-V285 WeakPolarHBondContact OE1-CG1 3.38Å; P259-V285 WeakPolarHBondContact CD-O 3.27Å
286	S	88.9	Confident	91.6	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.007	14%	0.142	C	C	.	.			trans	-147	141.2	174.6	-176.3	0	0	0	0	110	E258 S288	E258-S286 VanDerWaalsContact CD-CA 3.5Å; E258-S286 WeakPolarHBondContact OE1-CA 3.45Å; E258-S286 PolarHBondContact OE1-N 2.82Å; E258-S286 WeakPolarHBondContact OE2-CA 3.44Å; S286-S288 PolarHBondContact OG-N 2.76Å; S286-S288 VanDerWaalsContact OG-N 3.12Å
287	H	82.2	Confident	91.8	Very high	24 Å²	24	24.9 Å²	24.9	11%	0.111	13%	0.131	C	C	.	.	S	Bend	trans	-91.8	-4.5	169.3	-70.7	-62.6	0	0	0	113.5	N124 K128 E258 L551 D552 I553	N124-H287 PolarHBondContact OD1-CE1 3.08Å; N124-H287 PolarHBondContact OD1-NE2 3.33Å; N124-H287 VanDerWaalsContact OD1-NE2 3.09Å; K128-H287 PolarHBondContact NZ-CE1 3.47Å; K128-H287 PolarHBondContact NZ-NE2 3.35Å; E258-H287 IonicContact OE1-CD2 3.08Å; E258-H287 PolarHBondContact OE1-CD2 3.22Å; E258-H287 IonicContact OE1-CG 3.64Å; E258-H287 PolarHBondContact OE1-N 2.93Å; E258-H287 IonicContact OE1-NE2 3.54Å; E258-H287 PolarHBondContact OE1-NE2 3.46Å; E258-H287 IonicContact OE2-CD2 2.93Å; E258-H287 PolarHBondContact OE2-N 3.36Å; H287-L551 WeakPolarHBondContact CB-O 3.24Å; H287-L551 PolarHBondContact CD2-O 3.45Å; H287-D552 WeakPolarHBondContact ND1-CA 3.22Å; H287-I553 WeakPolarHBondContact O-CG1 3.4Å
288	S	84.6	Confident	92	Very high	11 Å²	11	21.3 Å²	21.3	8%	0.077	11%	0.108	C	C	.	.			trans	-89.8	114.1	177.2	-173.7	0	0	0	0	111	S286 D290 F291 L292 D576	S286-S288 PolarHBondContact OG-N 2.76Å; S286-S288 VanDerWaalsContact OG-N 3.12Å; S288-D290 VanDerWaalsContact C-N 3.34Å; S288-D290 PolarHBondContact O-N 3.3Å; S288-F291 PolarHBondContact O-N 2.69Å; S288-L292 WeakPolarHBondContact O-CG 3.3Å; S288-L292 PolarHBondContact O-N 3.5Å; S288-D576 PolarHBondContact OG-OD2 2.78Å
289	Q	86.1	Confident	92.2	Very high	18 Å²	18	20.8 Å²	20.8	8%	0.084	11%	0.106	C	C	.	.	H	α-helix	trans	-62.3	-41.3	178.6	-66.8	-168.2	-1.1	0	0	112.3	L292 N293 Y314 I553	Q289-L292 PolarHBondContact O-N 3.17Å; Q289-N293 WeakPolarHBondContact O-CB 3.43Å; Q289-N293 PolarHBondContact O-N 3.23Å; Q289-N293 PolarHBondContact O-ND2 3.26Å; Q289-Y314 HydrophobicContact CB-CD1 4.03Å; Q289-Y314 HydrophobicContact CB-CE1 4.22Å; Q289-Y314 HydrophobicContact CG-CD1 3.82Å; Q289-Y314 HydrophobicContact CG-CE1 3.5Å; Q289-Y314 HydrophobicContact CG-CG 4.49Å; Q289-Y314 PolarHBondContact NE2-OH 3.41Å; Q289-I553 HydrophobicContact CG-CD1 4.26Å; Q289-I553 HydrophobicContact CG-CG1 4.5Å; Q289-I553 HydrophobicContact CG-CG2 4.06Å
290	D	87.3	Confident	92.6	Very high	38 Å²	38	12.2 Å²	12.2	20%	0.203	7%	0.069	C	C	.	.	H	α-helix	trans	-63.2	-42.8	179.8	176.6	61.3	0	0	0	111.3	S288 N293 G294 F577 K606	S288-D290 VanDerWaalsContact C-N 3.34Å; S288-D290 PolarHBondContact O-N 3.3Å; D290-N293 PolarHBondContact O-N 2.69Å; D290-G294 PolarHBondContact O-N 3.48Å; D290-F577 HydrophobicContact CB-CB 4.23Å; D290-F577 VanDerWaalsContact OD2-CD2 3.22Å; D290-F577 WeakPolarHBondContact OD2-CD2 3.39Å; D290-K606 IonicContact OD1-NZ 2.75Å; D290-K606 PolarHBondContact OD1-NZ 3.25Å; D290-K606 IonicContact OD2-NZ 3.4Å; D290-K606 PolarHBondContact OD2-NZ 3.38Å
291	F	89.9	Confident	92.7	Very high	4 Å²	4	11 Å²	11	2%	0.018	7%	0.065	C	C	.	.	H	α-helix	trans	-63.9	-44.5	175	-170.4	-103.2	0	0	0	112.5	P259 T260 L271 E272 L275 L284 S288 N293 G294 V295	P259-F291 HydrophobicContact CG-CE1 4.01Å; P259-F291 HydrophobicContact CG-CZ 4.21Å; T260-F291 HydrophobicContact CG2-CB 4.24Å; T260-F291 HydrophobicContact CG2-CD1 3.9Å; T260-F291 HydrophobicContact CG2-CD2 3.62Å; T260-F291 HydrophobicContact CG2-CE1 4.07Å; T260-F291 HydrophobicContact CG2-CE2 3.8Å; T260-F291 HydrophobicContact CG2-CG 3.65Å; T260-F291 HydrophobicContact CG2-CZ 3.99Å; L271-F291 HydrophobicContact CD2-CE2 4.07Å; L271-F291 HydrophobicContact CD2-CZ 3.85Å; L271-F291 HydrophobicContact CG-CE2 4.19Å; L271-F291 HydrophobicContact CG-CZ 4.14Å; E272-F291 HydrophobicContact CB-CD2 4.27Å; E272-F291 HydrophobicContact CB-CE2 4.23Å; L275-F291 HydrophobicContact CD1-CE1 4.4Å; L275-F291 HydrophobicContact CD1-CZ 3.73Å; L284-F291 HydrophobicContact CD1-CD1 4.19Å; L284-F291 HydrophobicContact CD1-CE1 4.07Å; L284-F291 HydrophobicContact CD2-CE1 4.18Å; S288-F291 PolarHBondContact O-N 2.69Å; F291-N293 VanDerWaalsContact C-N 3.26Å; F291-N293 PolarHBondContact O-N 3.26Å; F291-G294 PolarHBondContact O-N 3.44Å; F291-V295 HydrophobicContact CD2-CG2 4.45Å; F291-V295 HydrophobicContact CE1-CG2 4.33Å; F291-V295 HydrophobicContact CE2-CG2 4.2Å; F291-V295 HydrophobicContact CZ-CG2 4.16Å; F291-V295 WeakPolarHBondContact O-CG2 3.45Å; F291-V295 PolarHBondContact O-N 2.67Å
292	L	92.7	Very high	92.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-59.9	-39.4	174.4	-71	171	0	0	0	111.4	I121 L284 S288 Q289 C296 Y314	I121-L292 HydrophobicContact CG2-CD1 3.72Å; L284-L292 HydrophobicContact CD1-CD2 3.61Å; S288-L292 WeakPolarHBondContact O-CG 3.3Å; S288-L292 PolarHBondContact O-N 3.5Å; Q289-L292 PolarHBondContact O-N 3.17Å; L292-C296 WeakPolarHBondContact O-CB 3.29Å; L292-C296 PolarHBondContact O-N 2.98Å; L292-Y314 HydrophobicContact CD1-CD2 3.73Å; L292-Y314 HydrophobicContact CD1-CE2 4.31Å; L292-Y314 HydrophobicContact CD1-CG 4.38Å
293	N	92.9	Very high	92.2	Very high	35 Å²	35	13.1 Å²	13.1	19%	0.187	8%	0.075	C	C	.	.	H	α-helix	trans	-67.4	-38	178	-83.8	-30.2	0	0	0	113.5	Q289 D290 F291 N313 Y314 D315	Q289-N293 WeakPolarHBondContact O-CB 3.43Å; Q289-N293 PolarHBondContact O-N 3.23Å; Q289-N293 PolarHBondContact O-ND2 3.26Å; D290-N293 PolarHBondContact O-N 2.69Å; F291-N293 VanDerWaalsContact C-N 3.26Å; F291-N293 PolarHBondContact O-N 3.26Å; N293-N313 WeakPolarHBondContact OD1-CB 3.5Å; N293-N313 VanDerWaalsContact OD1-CG 3.26Å; N293-N313 PolarHBondContact OD1-ND2 3.48Å; N293-Y314 WeakPolarHBondContact OD1-CA 3.32Å; N293-Y314 VanDerWaalsContact OD1-CB 3.29Å; N293-Y314 WeakPolarHBondContact OD1-CB 3.22Å; N293-Y314 PolarHBondContact OD1-N 3.05Å; N293-D315 PolarHBondContact ND2-OD1 2.77Å; N293-D315 PolarHBondContact ND2-OD2 2.97Å; N293-D315 PolarHBondContact OD1-N 3.27Å
294	G	92	Very high	91.7	Very high	21 Å²	21	18.1 Å²	18.1	22%	0.216	10%	0.101	C	C	.	.	H	α-helix	trans	-72.7	-34.1	178.3	0	0	0	0	0	114	D290 F291	D290-G294 PolarHBondContact O-N 3.48Å; F291-G294 PolarHBondContact O-N 3.44Å
295	V	95.1	Very high	91.5	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.018	12%	0.121	C	C	.	.	H	α-helix	trans	-103	-45	-171.4	-178.7	0	0	0	0	113.7	R117 E272 L275 L282 L284 F291	R117-V295 WeakPolarHBondContact CD-O 3.46Å; R117-V295 PolarHBondContact NE-O 3.4Å; E272-V295 HydrophobicContact CB-CG2 4.38Å; E272-V295 HydrophobicContact CG-CG2 3.94Å; L275-V295 HydrophobicContact CB-CG1 3.78Å; L275-V295 HydrophobicContact CB-CG2 4.13Å; L282-V295 HydrophobicContact CD2-CG1 3.71Å; L284-V295 HydrophobicContact CD2-CB 4.17Å; L284-V295 HydrophobicContact CD2-CG1 3.61Å; F291-V295 HydrophobicContact CD2-CG2 4.45Å; F291-V295 HydrophobicContact CE1-CG2 4.33Å; F291-V295 HydrophobicContact CE2-CG2 4.2Å; F291-V295 HydrophobicContact CZ-CG2 4.16Å; F291-V295 WeakPolarHBondContact O-CG2 3.45Å; F291-V295 PolarHBondContact O-N 2.67Å
296	C	96.3	Very high	91.5	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.061	15%	0.145	C	C	.	.			trans	-80.3	142.4	-162.8	-60.7	0	0	0	0	113.5	R117 G119 L292 I299	R117-C296 WeakPolarHBondContact O-CA 3.35Å; G119-C296 VanDerWaalsContact CA-SG 3.57Å; G119-C296 PolarHBondContact N-SG 2.68Å; L292-C296 WeakPolarHBondContact O-CB 3.29Å; L292-C296 PolarHBondContact O-N 2.98Å; C296-I299 HydrophobicContact CB-CD1 4.07Å
297	T	96	Very high	91.8	Very high	28 Å²	28	28.6 Å²	28.6	17%	0.172	15%	0.147	C	C	.	.	S	Bend	trans	-100.3	-19.8	168.9	60.6	0	0	0	0	112.6	R117 G312	R117-T297 PolarHBondContact N-OG1 2.92Å; R117-T297 PolarHBondContact O-N 3.32Å; R117-T297 PolarHBondContact O-OG1 3.4Å; T297-G312 CarbonylContact C-O 3.48Å; T297-G312 CarbonylContact O-C 3.55Å; T297-G312 WeakPolarHBondContact O-CA 3.49Å; T297-G312 PolarHBondContact O-N 3.45Å; T297-G312 VanDerWaalsContact O-O 3.1Å
298	N	96.9	Very high	92.4	Very high	17 Å²	17	31.8 Å²	31.8	9%	0.091	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.9	-176.4	-68.3	84.7	0	0	0	109.1	R117 Y118 G119 Y310 G312	R117-N298 PolarHBondContact O-N 2.84Å; R117-N298 VanDerWaalsContact O-N 3.13Å; Y118-N298 CarbonylContact C-O 3.51Å; Y118-N298 WeakPolarHBondContact CA-O 3.26Å; Y118-N298 HydrophobicContact CD1-CB 3.55Å; Y118-N298 HydrophobicContact CE1-CB 3.69Å; Y118-N298 HydrophobicContact CG-CB 4.44Å; G119-N298 PolarHBondContact N-O 3.48Å; N298-Y310 VanDerWaalsContact CA-O 3.3Å; N298-Y310 WeakPolarHBondContact CA-O 3.22Å; N298-G312 WeakPolarHBondContact CA-O 3.32Å; N298-G312 PolarHBondContact N-O 3.17Å
299	I	96.8	Very high	92.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.7	174.7	-61.9	-61.6	0	0	0	108.7	G119 I121 C296 Y310 Y317	G119-I299 WeakPolarHBondContact O-CA 3.38Å; I121-I299 HydrophobicContact CD1-CG2 3.36Å; I121-I299 HydrophobicContact CG1-CG2 3.62Å; I121-I299 HydrophobicContact CG2-CG2 4.47Å; C296-I299 HydrophobicContact CB-CD1 4.07Å; I299-Y310 PolarHBondContact N-O 3.42Å; I299-Y310 PolarHBondContact O-N 3.47Å; I299-Y317 HydrophobicContact CB-CG 4.2Å; I299-Y317 HydrophobicContact CG1-CG 4.38Å; I299-Y317 HydrophobicContact CG2-CD1 4.15Å; I299-Y317 HydrophobicContact CG2-CD2 4.1Å; I299-Y317 HydrophobicContact CG2-CG 3.87Å
300	I	96.5	Very high	93.4	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	108.3	170.6	-52.6	179.9	0	0	0	106.8	L112 Y118 G119 L120 I121 L307 K308 Y309	L112-I300 HydrophobicContact CD2-CD1 3.97Å; Y118-I300 HydrophobicContact CD1-CD1 3.75Å; Y118-I300 HydrophobicContact CD1-CG1 3.81Å; Y118-I300 HydrophobicContact CG-CD1 3.94Å; Y118-I300 HydrophobicContact CG-CG1 4.33Å; G119-I300 PolarHBondContact O-N 3.25Å; L120-I300 WeakPolarHBondContact CA-O 3.43Å; L120-I300 HydrophobicContact CD1-CB 4.03Å; L120-I300 HydrophobicContact CD1-CG2 3.84Å; I121-I300 PolarHBondContact N-O 2.95Å; I300-L307 HydrophobicContact CG2-CB 4.04Å; I300-L307 HydrophobicContact CG2-CD2 3.93Å; I300-L307 HydrophobicContact CG2-CG 4.41Å; I300-K308 CarbonylContact C-O 3.59Å; I300-K308 WeakPolarHBondContact CA-O 3.47Å; I300-Y309 HydrophobicContact CD1-CD1 4.44Å; I300-Y309 HydrophobicContact CD1-CE1 3.64Å; I300-Y309 HydrophobicContact CG1-CD1 3.93Å; I300-Y309 HydrophobicContact CG1-CE1 3.59Å; I300-Y309 HydrophobicContact CG2-CE1 4.33Å
301	H	94	Very high	93.7	Very high	11 Å²	11	37.6 Å²	37.6	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	113.1	175.7	-175.2	-159	0	0	0	109.7	I121 H303 K308 Y310 Y317 R321	I121-H301 HydrophobicContact CD1-CB 4.39Å; I121-H301 HydrophobicContact CG1-CB 4.16Å; H301-H303 AromaticContact CE1-CD2 3.83Å; H301-H303 AromaticContact CE1-CG 3.97Å; H301-H303 AromaticContact NE2-CD2 4Å; H301-K308 HydrophobicContact CB-CB 4.48Å; H301-K308 PolarHBondContact N-O 2.77Å; H301-K308 PolarHBondContact O-N 3.16Å; H301-Y310 HydrophobicContact CB-CD2 4.33Å; H301-Y310 HydrophobicContact CB-CE2 3.83Å; H301-Y317 HydrophobicContact CB-CE2 4.13Å; H301-Y317 PolarHBondContact CE1-OH 3.28Å; H301-Y317 PolarHBondContact ND1-OH 3.02Å; H301-R321 PolarHBondContact CE1-NH1 3.26Å; H301-R321 VanDerWaalsContact CE1-NH1 3.26Å
302	M	92.8	Very high	93.9	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	108.6	172.9	-174.2	176.5	177.2	0	0	109.1	L104 L105 L120 I121 I126 K128 K306 L307	L104-M302 HydrophobicContact CB-CE 4.32Å; L104-M302 WeakPolarHBondContact O-CE 3.45Å; L105-M302 HydrophobicContact CD1-CE 4.44Å; L105-M302 HydrophobicContact CD2-CE 3.61Å; L105-M302 HydrophobicContact CD2-CG 4.08Å; L105-M302 HydrophobicContact CD2-SD 4.36Å; L105-M302 HydrophobicContact CG-CE 3.77Å; L120-M302 HydrophobicContact CD1-CB 4.25Å; I121-M302 PolarHBondContact O-N 2.74Å; I126-M302 HydrophobicContact CB-CE 4.46Å; I126-M302 HydrophobicContact CD1-CB 3.68Å; I126-M302 HydrophobicContact CD1-CG 3.69Å; I126-M302 WeakPolarHBondContact CD1-O 3.43Å; I126-M302 HydrophobicContact CD1-SD 3.92Å; I126-M302 HydrophobicContact CG1-CE 4.27Å; I126-M302 HydrophobicContact CG1-CG 4.18Å; I126-M302 HydrophobicContact CG1-SD 3.8Å; I126-M302 WeakPolarHBondContact O-CE 3.37Å; K128-M302 HydrophobicContact CG-SD 4.36Å; M302-K306 WeakPolarHBondContact CA-O 3.41Å; M302-L307 HydrophobicContact CB-CD2 3.88Å; M302-L307 HydrophobicContact CG-CD2 3.95Å
303	H	88.4	Confident	93.9	Very high	37 Å²	37	39.7 Å²	39.7	17%	0.171	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	141.6	-175.5	-176.8	-76.1	0	0	0	110.8	H301 K305 K306 D382	H301-H303 AromaticContact CE1-CD2 3.83Å; H301-H303 AromaticContact CE1-CG 3.97Å; H301-H303 AromaticContact NE2-CD2 4Å; H303-K305 VanDerWaalsContact C-N 3.27Å; H303-K305 PolarHBondContact O-N 3.23Å; H303-K306 PolarHBondContact N-O 2.99Å; H303-K306 PolarHBondContact O-N 2.87Å; H303-D382 IonicContact NE2-OD1 3.84Å
304	N	87	Confident	93.8	Very high	114 Å²	114	39 Å²	39	61%	0.61	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	47.2	-177.5	-71.2	-5.9	0	0	0	113.3	K306	N304-K306 PolarHBondContact O-N 3.34Å; N304-K306 VanDerWaalsContact O-N 3.13Å
305	K	90.7	Very high	93.9	Very high	95 Å²	95	42.1 Å²	42.1	41%	0.413	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	19.5	-179	-51.3	175.8	174.9	-177.8	0	115	E103 L104 L105 S106 H303	E103-K305 HydrophobicContact CB-CD 4.5Å; E103-K305 HydrophobicContact CG-CD 4.21Å; E103-K305 WeakPolarHBondContact O-CE 3.08Å; E103-K305 IonicContact OE2-NZ 3.85Å; E103-K305 PolarHBondContact OE2-NZ 3.23Å; L104-K305 WeakPolarHBondContact O-CA 3.33Å; L105-K305 CarbonylContact C-O 3.5Å; L105-K305 VanDerWaalsContact CA-O 3.31Å; L105-K305 WeakPolarHBondContact CA-O 3.42Å; S106-K305 PolarHBondContact N-O 2.93Å; H303-K305 VanDerWaalsContact C-N 3.27Å; H303-K305 PolarHBondContact O-N 3.23Å
306	K	93.8	Very high	93.8	Very high	117 Å²	117	47 Å²	47	51%	0.509	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	158	178.5	-66	-170.5	177.4	-173.3	0	111.4	M302 H303 N304	M302-K306 WeakPolarHBondContact CA-O 3.41Å; H303-K306 PolarHBondContact N-O 2.99Å; H303-K306 PolarHBondContact O-N 2.87Å; N304-K306 PolarHBondContact O-N 3.34Å; N304-K306 VanDerWaalsContact O-N 3.13Å
307	L	95.6	Very high	93.7	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.3	171.7	-59.1	176	0	0	0	109	L95 L105 T108 L110 L120 L131 I300 M302 Y309	L95-L307 HydrophobicContact CD2-CD1 4.38Å; L105-L307 HydrophobicContact CD1-CD1 4.26Å; L105-L307 HydrophobicContact CD1-CD2 4.42Å; L105-L307 HydrophobicContact CD1-CG 4.33Å; L105-L307 HydrophobicContact CD2-CD2 3.99Å; L105-L307 HydrophobicContact CD2-CG 4.05Å; T108-L307 HydrophobicContact CG2-CD1 4.04Å; T108-L307 HydrophobicContact CG2-CG 3.98Å; T108-L307 PolarHBondContact OG1-N 2.88Å; L110-L307 HydrophobicContact CB-CD1 4.42Å; L110-L307 HydrophobicContact CD1-CD1 4.04Å; L120-L307 HydrophobicContact CD1-CD2 4.43Å; L131-L307 HydrophobicContact CD2-CD1 3.99Å; L131-L307 HydrophobicContact CD2-CD2 4Å; I300-L307 HydrophobicContact CG2-CB 4.04Å; I300-L307 HydrophobicContact CG2-CD2 3.93Å; I300-L307 HydrophobicContact CG2-CG 4.41Å; M302-L307 HydrophobicContact CB-CD2 3.88Å; M302-L307 HydrophobicContact CG-CD2 3.95Å; L307-Y309 HydrophobicContact CB-CE2 4.04Å
308	K	94	Very high	93.4	Very high	91 Å²	91	47.8 Å²	47.8	40%	0.396	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.1	174.5	-66.3	-177.2	179.7	-179.8	0	109.6	I300 H301 Y310	I300-K308 CarbonylContact C-O 3.59Å; I300-K308 WeakPolarHBondContact CA-O 3.47Å; H301-K308 HydrophobicContact CB-CB 4.48Å; H301-K308 PolarHBondContact N-O 2.77Å; H301-K308 PolarHBondContact O-N 3.16Å; K308-Y310 HydrophobicContact CB-CE2 3.76Å
309	Y	95.7	Very high	93.2	Very high	55 Å²	55	53.4 Å²	53.4	22%	0.216	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.2	-175.4	-70.2	-95.4	0	0	0	110.9	L110 E111 Y118 I300 L307	L110-Y309 VanDerWaalsContact CA-OH 3.27Å; L110-Y309 WeakPolarHBondContact CA-OH 3.37Å; E111-Y309 HydrophobicContact CB-CE1 4.16Å; E111-Y309 PolarHBondContact N-OH 3.42Å; E111-Y309 WeakPolarHBondContact O-CE1 3.23Å; Y118-Y309 HydrophobicContact CE1-CE1 4.49Å; I300-Y309 HydrophobicContact CD1-CD1 4.44Å; I300-Y309 HydrophobicContact CD1-CE1 3.64Å; I300-Y309 HydrophobicContact CG1-CD1 3.93Å; I300-Y309 HydrophobicContact CG1-CE1 3.59Å; I300-Y309 HydrophobicContact CG2-CE1 4.33Å; L307-Y309 HydrophobicContact CB-CE2 4.04Å
310	Y	95.9	Very high	93	Very high	25 Å²	25	55.9 Å²	55.9	10%	0.098	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.9	174.8	-58.7	-93.9	0	0	0	108.8	N298 I299 H301 K308 Y317 T320 L324	N298-Y310 VanDerWaalsContact CA-O 3.3Å; N298-Y310 WeakPolarHBondContact CA-O 3.22Å; I299-Y310 PolarHBondContact N-O 3.42Å; I299-Y310 PolarHBondContact O-N 3.47Å; H301-Y310 HydrophobicContact CB-CD2 4.33Å; H301-Y310 HydrophobicContact CB-CE2 3.83Å; K308-Y310 HydrophobicContact CB-CE2 3.76Å; Y310-Y317 AromaticContact CD1-CD2 3.99Å; Y310-Y317 HydrophobicContact CD1-CD2 3.99Å; Y310-Y317 AromaticContact CD2-CD2 3.46Å; Y310-Y317 HydrophobicContact CD2-CD2 3.46Å; Y310-Y317 VanDerWaalsContact CD2-CD2 3.46Å; Y310-Y317 AromaticContact CD2-CE2 3.83Å; Y310-Y317 HydrophobicContact CD2-CE2 3.83Å; Y310-Y317 HydrophobicContact CE1-CD2 4.26Å; Y310-Y317 AromaticContact CE2-CD2 3.78Å; Y310-Y317 HydrophobicContact CE2-CD2 3.78Å; Y310-Y317 AromaticContact CE2-CE2 3.68Å; Y310-Y317 HydrophobicContact CE2-CE2 3.68Å; Y310-Y317 AromaticContact CG-CD2 3.58Å; Y310-Y317 HydrophobicContact CG-CD2 3.58Å; Y310-Y317 HydrophobicContact CG-CE2 4.33Å; Y310-T320 HydrophobicContact CD1-CG2 4.06Å; Y310-T320 HydrophobicContact CE1-CG2 4.37Å; Y310-L324 HydrophobicContact CE1-CD1 3.94Å
311	T	94.7	Very high	92.7	Very high	110 Å²	110	57.5 Å²	57.5	68%	0.675	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.8	173.5	-57.8	0	0	0	0	108.3
312	G	93.4	Very high	92.5	Very high	6 Å²	6	61.9 Å²	61.9	6%	0.062	30%	0.304	C	S	.	.	S	Bend	trans	120.3	-179.8	-176.5	0	0	0	0	0	113.9	T297 N298	T297-G312 CarbonylContact C-O 3.48Å; T297-G312 CarbonylContact O-C 3.55Å; T297-G312 WeakPolarHBondContact O-CA 3.49Å; T297-G312 PolarHBondContact O-N 3.45Å; T297-G312 VanDerWaalsContact O-O 3.1Å; N298-G312 WeakPolarHBondContact CA-O 3.32Å; N298-G312 PolarHBondContact N-O 3.17Å
313	N	92.7	Very high	92.5	Very high	41 Å²	41	66 Å²	66	22%	0.219	32%	0.323	C	S	.	.			trans	-79.4	-175.1	172.6	71.9	-4.5	0	0	0	111.3	N293 D315 Q316 Y317	N293-N313 WeakPolarHBondContact OD1-CB 3.5Å; N293-N313 VanDerWaalsContact OD1-CG 3.26Å; N293-N313 PolarHBondContact OD1-ND2 3.48Å; N313-D315 PolarHBondContact O-N 3.09Å; N313-D315 PolarHBondContact OD1-N 2.89Å; N313-Q316 PolarHBondContact O-N 3.39Å; N313-Q316 WeakPolarHBondContact OD1-CB 3.19Å; N313-Q316 VanDerWaalsContact OD1-CG 3.27Å; N313-Q316 WeakPolarHBondContact OD1-CG 3.5Å; N313-Q316 PolarHBondContact OD1-N 3.25Å; N313-Y317 PolarHBondContact O-N 3.33Å
314	Y	92.1	Very high	92.6	Very high	21 Å²	21	68.6 Å²	68.6	8%	0.082	34%	0.338	C	S	.	.	H	α-helix	trans	-62.8	-43.1	-177.6	-175.6	-91.2	0	0	0	112.4	I121 Q289 L292 N293 Q316 Y317 V318 I553	I121-Y314 HydrophobicContact CD1-CD2 4.41Å; I121-Y314 HydrophobicContact CD1-CE2 4.01Å; Q289-Y314 HydrophobicContact CB-CD1 4.03Å; Q289-Y314 HydrophobicContact CB-CE1 4.22Å; Q289-Y314 HydrophobicContact CG-CD1 3.82Å; Q289-Y314 HydrophobicContact CG-CE1 3.5Å; Q289-Y314 HydrophobicContact CG-CG 4.49Å; Q289-Y314 PolarHBondContact NE2-OH 3.41Å; L292-Y314 HydrophobicContact CD1-CD2 3.73Å; L292-Y314 HydrophobicContact CD1-CE2 4.31Å; L292-Y314 HydrophobicContact CD1-CG 4.38Å; N293-Y314 WeakPolarHBondContact OD1-CA 3.32Å; N293-Y314 VanDerWaalsContact OD1-CB 3.29Å; N293-Y314 WeakPolarHBondContact OD1-CB 3.22Å; N293-Y314 PolarHBondContact OD1-N 3.05Å; Y314-Q316 PolarHBondContact O-N 2.9Å; Y314-Y317 AromaticContact CD2-CD1 3.95Å; Y314-Y317 HydrophobicContact CD2-CD1 3.95Å; Y314-Y317 HydrophobicContact CD2-CE1 4.36Å; Y314-Y317 AromaticContact CE2-CD1 3.94Å; Y314-Y317 HydrophobicContact CE2-CD1 3.94Å; Y314-Y317 AromaticContact CE2-CE1 3.89Å; Y314-Y317 HydrophobicContact CE2-CE1 3.89Å; Y314-Y317 HydrophobicContact CG-CD1 4.48Å; Y314-Y317 WeakPolarHBondContact O-CA 3.48Å; Y314-Y317 VanDerWaalsContact O-CB 3.29Å; Y314-Y317 WeakPolarHBondContact O-CB 3.45Å; Y314-Y317 PolarHBondContact O-N 3.3Å; Y314-Y317 VanDerWaalsContact O-N 3.13Å; Y314-V318 HydrophobicContact CD1-CG2 3.84Å; Y314-V318 HydrophobicContact CE1-CG2 3.31Å; Y314-V318 HydrophobicContact CE2-CG2 4.48Å; Y314-V318 WeakPolarHBondContact O-CG2 3.36Å; Y314-V318 PolarHBondContact O-N 3.43Å; Y314-I553 HydrophobicContact CE2-CD1 3.66Å
315	D	92.7	Very high	92.6	Very high	86 Å²	86	65.4 Å²	65.4	46%	0.46	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-43.2	179.6	-64.3	-15.8	0	0	0	112.4	N293 N313 Y317 V318 K319	N293-D315 PolarHBondContact ND2-OD1 2.77Å; N293-D315 PolarHBondContact ND2-OD2 2.97Å; N293-D315 PolarHBondContact OD1-N 3.27Å; N313-D315 PolarHBondContact O-N 3.09Å; N313-D315 PolarHBondContact OD1-N 2.89Å; D315-Y317 VanDerWaalsContact C-N 3.3Å; D315-Y317 PolarHBondContact O-N 3.06Å; D315-V318 PolarHBondContact O-N 3.48Å; D315-K319 PolarHBondContact O-N 2.96Å
316	Q	93.4	Very high	92.7	Very high	106 Å²	106	65.9 Å²	65.9	50%	0.495	32%	0.323	S	S	.	.	H	α-helix	trans	-63.5	-38.8	175.7	-73.2	173.4	-8.6	0	0	111.4	N313 Y314 T320	N313-Q316 PolarHBondContact O-N 3.39Å; N313-Q316 WeakPolarHBondContact OD1-CB 3.19Å; N313-Q316 VanDerWaalsContact OD1-CG 3.27Å; N313-Q316 WeakPolarHBondContact OD1-CG 3.5Å; N313-Q316 PolarHBondContact OD1-N 3.25Å; Y314-Q316 PolarHBondContact O-N 2.9Å; Q316-T320 VanDerWaalsContact O-CB 3.28Å; Q316-T320 WeakPolarHBondContact O-CB 3.19Å; Q316-T320 PolarHBondContact O-N 3.13Å; Q316-T320 PolarHBondContact O-OG1 3.32Å
317	Y	93.6	Very high	92.6	Very high	5 Å²	5	64.2 Å²	64.2	2%	0.02	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-50.7	172	150.4	-104	0	0	0	111.6	I121 I299 H301 Y310 N313 Y314 D315 K319 T320 R321	I121-Y317 HydrophobicContact CD1-CD1 3.78Å; I121-Y317 HydrophobicContact CD1-CE1 3.19Å; I121-Y317 HydrophobicContact CD1-CE2 4.15Å; I121-Y317 HydrophobicContact CD1-CG 4.46Å; I299-Y317 HydrophobicContact CB-CG 4.2Å; I299-Y317 HydrophobicContact CG1-CG 4.38Å; I299-Y317 HydrophobicContact CG2-CD1 4.15Å; I299-Y317 HydrophobicContact CG2-CD2 4.1Å; I299-Y317 HydrophobicContact CG2-CG 3.87Å; H301-Y317 HydrophobicContact CB-CE2 4.13Å; H301-Y317 PolarHBondContact CE1-OH 3.28Å; H301-Y317 PolarHBondContact ND1-OH 3.02Å; Y310-Y317 AromaticContact CD1-CD2 3.99Å; Y310-Y317 HydrophobicContact CD1-CD2 3.99Å; Y310-Y317 AromaticContact CD2-CD2 3.46Å; Y310-Y317 HydrophobicContact CD2-CD2 3.46Å; Y310-Y317 VanDerWaalsContact CD2-CD2 3.46Å; Y310-Y317 AromaticContact CD2-CE2 3.83Å; Y310-Y317 HydrophobicContact CD2-CE2 3.83Å; Y310-Y317 HydrophobicContact CE1-CD2 4.26Å; Y310-Y317 AromaticContact CE2-CD2 3.78Å; Y310-Y317 HydrophobicContact CE2-CD2 3.78Å; Y310-Y317 AromaticContact CE2-CE2 3.68Å; Y310-Y317 HydrophobicContact CE2-CE2 3.68Å; Y310-Y317 AromaticContact CG-CD2 3.58Å; Y310-Y317 HydrophobicContact CG-CD2 3.58Å; Y310-Y317 HydrophobicContact CG-CE2 4.33Å; N313-Y317 PolarHBondContact O-N 3.33Å; Y314-Y317 AromaticContact CD2-CD1 3.95Å; Y314-Y317 HydrophobicContact CD2-CD1 3.95Å; Y314-Y317 HydrophobicContact CD2-CE1 4.36Å; Y314-Y317 AromaticContact CE2-CD1 3.94Å; Y314-Y317 HydrophobicContact CE2-CD1 3.94Å; Y314-Y317 AromaticContact CE2-CE1 3.89Å; Y314-Y317 HydrophobicContact CE2-CE1 3.89Å; Y314-Y317 HydrophobicContact CG-CD1 4.48Å; Y314-Y317 WeakPolarHBondContact O-CA 3.48Å; Y314-Y317 VanDerWaalsContact O-CB 3.29Å; Y314-Y317 WeakPolarHBondContact O-CB 3.45Å; Y314-Y317 PolarHBondContact O-N 3.3Å; Y314-Y317 VanDerWaalsContact O-N 3.13Å; D315-Y317 VanDerWaalsContact C-N 3.3Å; D315-Y317 PolarHBondContact O-N 3.06Å; Y317-K319 VanDerWaalsContact C-N 3.34Å; Y317-K319 PolarHBondContact O-N 3.25Å; Y317-T320 PolarHBondContact O-N 2.7Å; Y317-R321 HydrophobicContact CD2-CB 4.39Å; Y317-R321 HydrophobicContact CE2-CB 4.03Å; Y317-R321 HydrophobicContact CE2-CG 4.43Å; Y317-R321 VanDerWaalsContact O-CB 3.26Å; Y317-R321 WeakPolarHBondContact O-CB 3.42Å; Y317-R321 PolarHBondContact O-N 2.88Å; Y317-R321 VanDerWaalsContact OH-CD 3.27Å; Y317-R321 WeakPolarHBondContact OH-CD 3.32Å; Y317-R321 PolarHBondContact OH-NH1 2.84Å; Y317-R321 VanDerWaalsContact OH-NH1 3.1Å
318	V	90.7	Very high	92.3	Very high	49 Å²	49	66.7 Å²	66.7	30%	0.297	33%	0.331	S	S	.	.	H	α-helix	trans	-58.6	-48.1	-178.8	172.1	0	0	0	0	110.3	Y314 D315 T320 R321 L322	Y314-V318 HydrophobicContact CD1-CG2 3.84Å; Y314-V318 HydrophobicContact CE1-CG2 3.31Å; Y314-V318 HydrophobicContact CE2-CG2 4.48Å; Y314-V318 WeakPolarHBondContact O-CG2 3.36Å; Y314-V318 PolarHBondContact O-N 3.43Å; D315-V318 PolarHBondContact O-N 3.48Å; V318-T320 PolarHBondContact O-N 2.91Å; V318-R321 PolarHBondContact O-N 3.06Å; V318-L322 HydrophobicContact CG1-CD1 4.02Å; V318-L322 HydrophobicContact CG1-CG 4.48Å; V318-L322 WeakPolarHBondContact O-CG 3.27Å; V318-L322 PolarHBondContact O-N 2.81Å
319	K	93	Very high	92.1	Very high	134 Å²	134	64.8 Å²	64.8	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-58.7	-50.1	177.1	-174.9	-178.6	177.3	-176.7	0	111.9	D315 Y317 R321 L322 E323	D315-K319 PolarHBondContact O-N 2.96Å; Y317-K319 VanDerWaalsContact C-N 3.34Å; Y317-K319 PolarHBondContact O-N 3.25Å; K319-R321 VanDerWaalsContact C-N 3.31Å; K319-R321 PolarHBondContact O-N 3.22Å; K319-L322 PolarHBondContact O-N 3.16Å; K319-E323 WeakPolarHBondContact CE-OE1 3.11Å; K319-E323 WeakPolarHBondContact O-CG 3.21Å; K319-E323 PolarHBondContact O-N 2.93Å
320	T	93.3	Very high	92	Very high	53 Å²	53	67.9 Å²	67.9	33%	0.325	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-40.2	180	-55.7	0	0	0	0	111.3	Y310 Q316 Y317 V318 E323 L324	Y310-T320 HydrophobicContact CD1-CG2 4.06Å; Y310-T320 HydrophobicContact CE1-CG2 4.37Å; Q316-T320 VanDerWaalsContact O-CB 3.28Å; Q316-T320 WeakPolarHBondContact O-CB 3.19Å; Q316-T320 PolarHBondContact O-N 3.13Å; Q316-T320 PolarHBondContact O-OG1 3.32Å; Y317-T320 PolarHBondContact O-N 2.7Å; V318-T320 PolarHBondContact O-N 2.91Å; T320-E323 PolarHBondContact O-N 3.04Å; T320-L324 HydrophobicContact CG2-CD1 4.04Å; T320-L324 HydrophobicContact CG2-CG 4.43Å; T320-L324 WeakPolarHBondContact O-CB 3.45Å; T320-L324 VanDerWaalsContact O-CG 3.26Å; T320-L324 WeakPolarHBondContact O-CG 3.42Å; T320-L324 PolarHBondContact O-N 2.85Å
321	R	89.7	Confident	91.7	Very high	36 Å²	36	74.7 Å²	74.7	14%	0.136	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-48.5	177.5	178.5	178	172.9	-172.8	-6.2	110.9	H301 Y317 V318 K319 E323 L324 E325 D382	H301-R321 PolarHBondContact CE1-NH1 3.26Å; H301-R321 VanDerWaalsContact CE1-NH1 3.26Å; Y317-R321 HydrophobicContact CD2-CB 4.39Å; Y317-R321 HydrophobicContact CE2-CB 4.03Å; Y317-R321 HydrophobicContact CE2-CG 4.43Å; Y317-R321 VanDerWaalsContact O-CB 3.26Å; Y317-R321 WeakPolarHBondContact O-CB 3.42Å; Y317-R321 PolarHBondContact O-N 2.88Å; Y317-R321 VanDerWaalsContact OH-CD 3.27Å; Y317-R321 WeakPolarHBondContact OH-CD 3.32Å; Y317-R321 PolarHBondContact OH-NH1 2.84Å; Y317-R321 VanDerWaalsContact OH-NH1 3.1Å; V318-R321 PolarHBondContact O-N 3.06Å; K319-R321 VanDerWaalsContact C-N 3.31Å; K319-R321 PolarHBondContact O-N 3.22Å; R321-E323 VanDerWaalsContact C-N 3.34Å; R321-E323 PolarHBondContact O-N 3.22Å; R321-L324 PolarHBondContact O-N 3.05Å; R321-E325 HydrophobicContact CG-CG 4.32Å; R321-E325 IonicContact CZ-OE1 2.72Å; R321-E325 IonicContact NE-OE1 3.49Å; R321-E325 PolarHBondContact NE-OE1 2.81Å; R321-E325 IonicContact NH2-OE1 3.91Å; R321-E325 PolarHBondContact NH2-OE1 2.88Å; R321-E325 VanDerWaalsContact NH2-OE1 3.15Å; R321-E325 WeakPolarHBondContact O-CB 3.41Å; R321-E325 WeakPolarHBondContact O-CG 3.28Å; R321-E325 PolarHBondContact O-N 2.89Å; R321-D382 IonicContact CZ-OD2 3.38Å; R321-D382 IonicContact NH1-OD2 2.96Å; R321-D382 IonicContact NH2-OD2 3.72Å; R321-D382 PolarHBondContact NH2-OD2 3.49Å
322	L	89.1	Confident	91.5	Very high	103 Å²	103	71.2 Å²	71.2	54%	0.539	34%	0.34	S	S	.	.	H	α-helix	trans	-59.1	-44.9	177.9	-71.6	171.6	0	0	0	111.6	V318 K319 L324 E325 E326	V318-L322 HydrophobicContact CG1-CD1 4.02Å; V318-L322 HydrophobicContact CG1-CG 4.48Å; V318-L322 WeakPolarHBondContact O-CG 3.27Å; V318-L322 PolarHBondContact O-N 2.81Å; K319-L322 PolarHBondContact O-N 3.16Å; L322-L324 PolarHBondContact O-N 2.9Å; L322-E325 PolarHBondContact O-N 2.97Å; L322-E326 WeakPolarHBondContact O-CB 3.39Å; L322-E326 PolarHBondContact O-N 2.9Å
323	E	92.5	Very high	91.5	Very high	93 Å²	93	75.5 Å²	75.5	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-61.9	-42.3	176.4	-71.4	174.3	-170.9	0	0	112.1	K319 T320 R321 N327	K319-E323 WeakPolarHBondContact CE-OE1 3.11Å; K319-E323 WeakPolarHBondContact O-CG 3.21Å; K319-E323 PolarHBondContact O-N 2.93Å; T320-E323 PolarHBondContact O-N 3.04Å; R321-E323 VanDerWaalsContact C-N 3.34Å; R321-E323 PolarHBondContact O-N 3.22Å; E323-N327 WeakPolarHBondContact O-CB 3.47Å; E323-N327 PolarHBondContact O-N 3.09Å; E323-N327 PolarHBondContact O-ND2 3.01Å
324	L	90.4	Very high	91.4	Very high	91 Å²	91	80.6 Å²	80.6	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-67	-41.9	177.2	-73.2	172.8	0	0	0	112.1	Y310 T320 R321 L322 N327 Q328	Y310-L324 HydrophobicContact CE1-CD1 3.94Å; T320-L324 HydrophobicContact CG2-CD1 4.04Å; T320-L324 HydrophobicContact CG2-CG 4.43Å; T320-L324 WeakPolarHBondContact O-CB 3.45Å; T320-L324 VanDerWaalsContact O-CG 3.26Å; T320-L324 WeakPolarHBondContact O-CG 3.42Å; T320-L324 PolarHBondContact O-N 2.85Å; R321-L324 PolarHBondContact O-N 3.05Å; L322-L324 PolarHBondContact O-N 2.9Å; L324-N327 PolarHBondContact O-N 3.27Å; L324-Q328 VanDerWaalsContact O-CB 3.31Å; L324-Q328 WeakPolarHBondContact O-CB 3.4Å; L324-Q328 PolarHBondContact O-N 2.86Å
325	E	88.6	Confident	91.3	Very high	48 Å²	48	81 Å²	81	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-66.3	-41.9	177.7	-76	178.4	177	0	0	111.6	R321 L322 Q328 M329 V379	R321-E325 HydrophobicContact CG-CG 4.32Å; R321-E325 IonicContact CZ-OE1 2.72Å; R321-E325 IonicContact NE-OE1 3.49Å; R321-E325 PolarHBondContact NE-OE1 2.81Å; R321-E325 IonicContact NH2-OE1 3.91Å; R321-E325 PolarHBondContact NH2-OE1 2.88Å; R321-E325 VanDerWaalsContact NH2-OE1 3.15Å; R321-E325 WeakPolarHBondContact O-CB 3.41Å; R321-E325 WeakPolarHBondContact O-CG 3.28Å; R321-E325 PolarHBondContact O-N 2.89Å; L322-E325 PolarHBondContact O-N 2.97Å; E325-Q328 PolarHBondContact O-N 3.31Å; E325-M329 WeakPolarHBondContact O-CB 3.49Å; E325-M329 WeakPolarHBondContact O-CG 3.36Å; E325-M329 PolarHBondContact O-N 2.88Å; E325-V379 HydrophobicContact CB-CG1 4.12Å; E325-V379 HydrophobicContact CB-CG2 4.33Å; E325-V379 HydrophobicContact CG-CG1 3.89Å; E325-V379 HydrophobicContact CG-CG2 4.47Å
326	E	91	Very high	91.2	Very high	105 Å²	105	80.3 Å²	80.3	49%	0.491	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-44.8	174.8	-167.7	-169.4	163.2	0	0	111.1	L322 M329 K330	L322-E326 WeakPolarHBondContact O-CB 3.39Å; L322-E326 PolarHBondContact O-N 2.9Å; E326-M329 PolarHBondContact O-N 2.97Å; E326-K330 HydrophobicContact CG-CD 4.4Å; E326-K330 WeakPolarHBondContact O-CB 3.46Å; E326-K330 WeakPolarHBondContact O-CG 3.4Å; E326-K330 PolarHBondContact O-N 3.26Å; E326-K330 VanDerWaalsContact OE1-CE 3.24Å; E326-K330 WeakPolarHBondContact OE1-CE 3.27Å; E326-K330 IonicContact OE1-NZ 2.65Å; E326-K330 PolarHBondContact OE1-NZ 3.44Å
327	N	92.2	Very high	91.1	Very high	81 Å²	81	80.3 Å²	80.3	43%	0.433	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-40.5	176.3	-75.6	-38.7	0	0	0	112.3	E323 L324 K330 R331	E323-N327 WeakPolarHBondContact O-CB 3.47Å; E323-N327 PolarHBondContact O-N 3.09Å; E323-N327 PolarHBondContact O-ND2 3.01Å; L324-N327 PolarHBondContact O-N 3.27Å; N327-K330 PolarHBondContact O-N 3.09Å; N327-R331 WeakPolarHBondContact O-CG 3.36Å; N327-R331 PolarHBondContact O-N 2.89Å
328	Q	90.1	Very high	91	Very high	62 Å²	62	83.4 Å²	83.4	29%	0.29	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-44.2	174.8	-176.8	178	-12.7	0	0	110.9	L324 E325 R331 F332 T376 E377 V379	L324-Q328 VanDerWaalsContact O-CB 3.31Å; L324-Q328 WeakPolarHBondContact O-CB 3.4Å; L324-Q328 PolarHBondContact O-N 2.86Å; E325-Q328 PolarHBondContact O-N 3.31Å; Q328-R331 PolarHBondContact O-N 3.13Å; Q328-F332 WeakPolarHBondContact O-CB 3.49Å; Q328-F332 PolarHBondContact O-N 2.8Å; Q328-T376 HydrophobicContact CG-CG2 3.6Å; Q328-E377 PolarHBondContact NE2-O 3.13Å; Q328-V379 HydrophobicContact CB-CG2 3.78Å; Q328-V379 VanDerWaalsContact CD-CG2 3.5Å; Q328-V379 HydrophobicContact CG-CG2 3.69Å
329	M	89.6	Confident	90.9	Very high	51 Å²	51	81.6 Å²	81.6	25%	0.251	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-42.5	176.2	-79.2	-65.1	-85.9	0	0	112	E325 E326 R331 F332 H333 R378 V379	E325-M329 WeakPolarHBondContact O-CB 3.49Å; E325-M329 WeakPolarHBondContact O-CG 3.36Å; E325-M329 PolarHBondContact O-N 2.88Å; E326-M329 PolarHBondContact O-N 2.97Å; M329-R331 PolarHBondContact O-N 2.76Å; M329-F332 PolarHBondContact O-N 3.45Å; M329-H333 PolarHBondContact O-N 3.49Å; M329-H333 PolarHBondContact O-ND1 2.9Å; M329-R378 HydrophobicContact SD-CG 4.18Å; M329-V379 HydrophobicContact CG-CB 3.69Å; M329-V379 HydrophobicContact CG-CG2 3.62Å; M329-V379 HydrophobicContact SD-CB 3.75Å; M329-V379 HydrophobicContact SD-CG2 4.06Å
330	K	92.5	Very high	90.9	Very high	120 Å²	120	77.3 Å²	77.3	52%	0.522	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-44.8	174.8	-76.6	168.7	172.2	166.9	0	111.8	E326 N327 H333 W334	E326-K330 HydrophobicContact CG-CD 4.4Å; E326-K330 WeakPolarHBondContact O-CB 3.46Å; E326-K330 WeakPolarHBondContact O-CG 3.4Å; E326-K330 PolarHBondContact O-N 3.26Å; E326-K330 VanDerWaalsContact OE1-CE 3.24Å; E326-K330 WeakPolarHBondContact OE1-CE 3.27Å; E326-K330 IonicContact OE1-NZ 2.65Å; E326-K330 PolarHBondContact OE1-NZ 3.44Å; N327-K330 PolarHBondContact O-N 3.09Å; K330-H333 PolarHBondContact O-N 3.38Å; K330-W334 WeakPolarHBondContact O-CB 3.39Å; K330-W334 PolarHBondContact O-N 3.43Å
331	R	90.8	Very high	90.8	Very high	168 Å²	168	80.1 Å²	80.1	63%	0.634	38%	0.376	S	S	*	.	H	α-helix	trans	-63.2	-44.6	175.2	-73.2	178.3	-175	-170.9	2.8	112	N327 Q328 M329 W334 E335 T376	N327-R331 WeakPolarHBondContact O-CG 3.36Å; N327-R331 PolarHBondContact O-N 2.89Å; Q328-R331 PolarHBondContact O-N 3.13Å; M329-R331 PolarHBondContact O-N 2.76Å; R331-W334 PolarHBondContact O-N 2.84Å; R331-E335 WeakPolarHBondContact O-CB 3.12Å; R331-E335 WeakPolarHBondContact O-CG 3.26Å; R331-E335 PolarHBondContact O-N 3.19Å; R331-T376 HydrophobicContact CB-CG2 4.37Å
332	F	90.8	Very high	90.7	Very high	36 Å²	36	79 Å²	79	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-57.3	-50.9	176	175.9	-102.2	0	0	0	111.6	Q328 M329 W334 E335 Q336 T376 R378	Q328-F332 WeakPolarHBondContact O-CB 3.49Å; Q328-F332 PolarHBondContact O-N 2.8Å; M329-F332 PolarHBondContact O-N 3.45Å; F332-W334 VanDerWaalsContact C-N 3.35Å; F332-W334 PolarHBondContact O-N 2.99Å; F332-E335 PolarHBondContact O-N 3.28Å; F332-Q336 HydrophobicContact CD1-CG 4.25Å; F332-Q336 HydrophobicContact CD2-CG 4.23Å; F332-Q336 HydrophobicContact CE1-CG 3.81Å; F332-Q336 HydrophobicContact CE2-CG 3.82Å; F332-Q336 HydrophobicContact CG-CG 4.45Å; F332-Q336 HydrophobicContact CZ-CG 3.58Å; F332-Q336 VanDerWaalsContact O-CG 3.31Å; F332-Q336 WeakPolarHBondContact O-CG 3.5Å; F332-Q336 PolarHBondContact O-N 3.04Å; F332-T376 HydrophobicContact CB-CG2 4.24Å; F332-T376 VanDerWaalsContact CD2-O 3.22Å; F332-T376 WeakPolarHBondContact CD2-O 3.19Å; F332-R378 HydrophobicContact CD1-CB 4.32Å; F332-R378 HydrophobicContact CD1-CG 4.32Å; F332-R378 HydrophobicContact CD2-CB 4.24Å; F332-R378 HydrophobicContact CE1-CB 4Å; F332-R378 HydrophobicContact CE1-CG 4.02Å; F332-R378 HydrophobicContact CE2-CB 3.9Å; F332-R378 HydrophobicContact CG-CB 4.43Å; F332-R378 HydrophobicContact CZ-CB 3.78Å; F332-R378 HydrophobicContact CZ-CG 4.26Å
333	H	92	Very high	90.8	Very high	96 Å²	96	79.8 Å²	79.8	44%	0.444	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-44.3	177.9	-73.7	89.2	0	0	0	111.6	M329 K330 E335 Q336 D337	M329-H333 PolarHBondContact O-N 3.49Å; M329-H333 PolarHBondContact O-ND1 2.9Å; K330-H333 PolarHBondContact O-N 3.38Å; H333-E335 PolarHBondContact O-N 3.34Å; H333-Q336 PolarHBondContact O-N 2.84Å; H333-D337 WeakPolarHBondContact O-CB 3.46Å; H333-D337 VanDerWaalsContact O-CG 3.3Å; H333-D337 PolarHBondContact O-N 2.77Å
334	W	91.9	Very high	90.8	Very high	148 Å²	148	79.9 Å²	79.9	56%	0.561	38%	0.375	S	S	*	.	H	α-helix	trans	-59.6	-45.3	176.6	-179.9	83.9	0	0	0	112.3	K330 R331 F332 D337 Q338	K330-W334 WeakPolarHBondContact O-CB 3.39Å; K330-W334 PolarHBondContact O-N 3.43Å; R331-W334 PolarHBondContact O-N 2.84Å; F332-W334 VanDerWaalsContact C-N 3.35Å; F332-W334 PolarHBondContact O-N 2.99Å; W334-D337 PolarHBondContact O-N 3.03Å; W334-Q338 HydrophobicContact CD2-CG 4.2Å; W334-Q338 HydrophobicContact CE3-CG 4.47Å; W334-Q338 HydrophobicContact CH2-CG 4.28Å; W334-Q338 HydrophobicContact CZ2-CG 3.98Å; W334-Q338 VanDerWaalsContact O-CG 3.32Å; W334-Q338 WeakPolarHBondContact O-CG 3.44Å; W334-Q338 PolarHBondContact O-N 2.86Å
335	E	89.2	Confident	90.7	Very high	30 Å²	30	77.4 Å²	77.4	14%	0.14	36%	0.36	C	S	.	.	H	α-helix	trans	-63.5	-43.6	175.9	-73.9	176.1	-166.2	0	0	112	R331 F332 H333 D337 Q338 I339 T376	R331-E335 WeakPolarHBondContact O-CB 3.12Å; R331-E335 WeakPolarHBondContact O-CG 3.26Å; R331-E335 PolarHBondContact O-N 3.19Å; F332-E335 PolarHBondContact O-N 3.28Å; H333-E335 PolarHBondContact O-N 3.34Å; E335-D337 PolarHBondContact O-N 3.16Å; E335-Q338 PolarHBondContact O-N 3.25Å; E335-I339 WeakPolarHBondContact O-CB 3.22Å; E335-I339 WeakPolarHBondContact O-CD1 3.35Å; E335-I339 WeakPolarHBondContact O-CG1 3.34Å; E335-I339 PolarHBondContact O-N 3.31Å; E335-T376 VanDerWaalsContact CD-OG1 3.31Å; E335-T376 PolarHBondContact OE1-OG1 2.88Å; E335-T376 VanDerWaalsContact OE2-CB 3.32Å; E335-T376 WeakPolarHBondContact OE2-CB 3.28Å; E335-T376 PolarHBondContact OE2-N 3.38Å; E335-T376 PolarHBondContact OE2-OG1 3.31Å
336	Q	90	Very high	90.6	Very high	71 Å²	71	76.6 Å²	76.6	33%	0.332	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-40.7	177.1	-69.6	-55.6	-44.7	0	0	112	F332 H333 I339 A340	F332-Q336 HydrophobicContact CD1-CG 4.25Å; F332-Q336 HydrophobicContact CD2-CG 4.23Å; F332-Q336 HydrophobicContact CE1-CG 3.81Å; F332-Q336 HydrophobicContact CE2-CG 3.82Å; F332-Q336 HydrophobicContact CG-CG 4.45Å; F332-Q336 HydrophobicContact CZ-CG 3.58Å; F332-Q336 VanDerWaalsContact O-CG 3.31Å; F332-Q336 WeakPolarHBondContact O-CG 3.5Å; F332-Q336 PolarHBondContact O-N 3.04Å; H333-Q336 PolarHBondContact O-N 2.84Å; Q336-I339 PolarHBondContact O-N 3.2Å; Q336-A340 VanDerWaalsContact O-CB 3.29Å; Q336-A340 WeakPolarHBondContact O-CB 3.4Å; Q336-A340 PolarHBondContact O-N 2.93Å
337	D	92.8	Very high	90.5	Very high	107 Å²	107	75.2 Å²	75.2	57%	0.572	36%	0.363	S	S	*	.	H	α-helix	trans	-65.4	-41.3	175.7	-74	-17.3	0	0	0	111.4	H333 W334 E335 A340 H341	H333-D337 WeakPolarHBondContact O-CB 3.46Å; H333-D337 VanDerWaalsContact O-CG 3.3Å; H333-D337 PolarHBondContact O-N 2.77Å; W334-D337 PolarHBondContact O-N 3.03Å; E335-D337 PolarHBondContact O-N 3.16Å; D337-A340 PolarHBondContact O-N 3.2Å; D337-H341 VanDerWaalsContact O-CB 3.27Å; D337-H341 WeakPolarHBondContact O-CB 3.42Å; D337-H341 PolarHBondContact O-N 3.11Å
338	Q	90	Very high	90.2	Very high	70 Å²	70	80.9 Å²	80.9	33%	0.327	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-46.2	173.4	-71.6	-55	-50.1	0	0	111.3	W334 E335 A340 H341 M342	W334-Q338 HydrophobicContact CD2-CG 4.2Å; W334-Q338 HydrophobicContact CE3-CG 4.47Å; W334-Q338 HydrophobicContact CH2-CG 4.28Å; W334-Q338 HydrophobicContact CZ2-CG 3.98Å; W334-Q338 VanDerWaalsContact O-CG 3.32Å; W334-Q338 WeakPolarHBondContact O-CG 3.44Å; W334-Q338 PolarHBondContact O-N 2.86Å; E335-Q338 PolarHBondContact O-N 3.25Å; Q338-A340 PolarHBondContact O-N 3.22Å; Q338-H341 PolarHBondContact O-N 3.3Å; Q338-M342 WeakPolarHBondContact O-CB 3.38Å; Q338-M342 WeakPolarHBondContact O-CG 3.45Å; Q338-M342 PolarHBondContact O-N 3.47Å
339	I	90.3	Very high	90	Very high	10 Å²	10	81.2 Å²	81.2	5%	0.051	38%	0.379	C	S	.	.	H	α-helix	trans	-60.1	-47.2	176.7	-70	162	0	0	0	110.4	E335 Q336 M342 K343 L367 M370 L375	E335-I339 WeakPolarHBondContact O-CB 3.22Å; E335-I339 WeakPolarHBondContact O-CD1 3.35Å; E335-I339 WeakPolarHBondContact O-CG1 3.34Å; E335-I339 PolarHBondContact O-N 3.31Å; Q336-I339 PolarHBondContact O-N 3.2Å; I339-M342 PolarHBondContact O-N 2.93Å; I339-K343 HydrophobicContact CG2-CD 3.95Å; I339-K343 HydrophobicContact CG2-CG 4.37Å; I339-K343 WeakPolarHBondContact O-CB 3.48Å; I339-K343 WeakPolarHBondContact O-CG 3.22Å; I339-K343 PolarHBondContact O-N 3.02Å; I339-L367 HydrophobicContact CB-CD1 4.22Å; I339-L367 HydrophobicContact CG1-CD1 3.79Å; I339-L367 HydrophobicContact CG2-CD1 4.09Å; I339-M370 HydrophobicContact CG1-SD 4.32Å; I339-L375 HydrophobicContact CD1-CD1 3.68Å; I339-L375 HydrophobicContact CD1-CD2 3.77Å; I339-L375 HydrophobicContact CD1-CG 4.39Å
340	A	92.4	Very high	89.3	Confident	44 Å²	44	80.1 Å²	80.1	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-61.6	-45.4	178.9	0	0	0	0	0	111.2	Q336 D337 Q338 K343 N344	Q336-A340 VanDerWaalsContact O-CB 3.29Å; Q336-A340 WeakPolarHBondContact O-CB 3.4Å; Q336-A340 PolarHBondContact O-N 2.93Å; D337-A340 PolarHBondContact O-N 3.2Å; Q338-A340 PolarHBondContact O-N 3.22Å; A340-K343 PolarHBondContact O-N 3.26Å; A340-N344 VanDerWaalsContact O-CB 3.3Å; A340-N344 WeakPolarHBondContact O-CB 3.48Å; A340-N344 VanDerWaalsContact O-CG 3.23Å; A340-N344 PolarHBondContact O-N 3.18Å; A340-N344 PolarHBondContact O-ND2 3.16Å
341	H	91.3	Very high	88.7	Confident	112 Å²	112	83.5 Å²	83.5	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-64.5	-42.2	177.6	-176.3	-103.2	0	0	0	112.3	D337 Q338 N344 Y345	D337-H341 VanDerWaalsContact O-CB 3.27Å; D337-H341 WeakPolarHBondContact O-CB 3.42Å; D337-H341 PolarHBondContact O-N 3.11Å; Q338-H341 PolarHBondContact O-N 3.3Å; H341-N344 PolarHBondContact O-N 3.39Å; H341-Y345 WeakPolarHBondContact O-CB 3.28Å; H341-Y345 PolarHBondContact O-N 2.87Å
342	M	88.1	Confident	87.9	Confident	14 Å²	14	77.1 Å²	77.1	7%	0.069	39%	0.385	C	S	.	.	H	α-helix	trans	-65.6	-45.1	176.5	-70.1	170.4	79.4	0	0	111.6	Q338 I339 Y345 I346 K363 T366 L367	Q338-M342 WeakPolarHBondContact O-CB 3.38Å; Q338-M342 WeakPolarHBondContact O-CG 3.45Å; Q338-M342 PolarHBondContact O-N 3.47Å; I339-M342 PolarHBondContact O-N 2.93Å; M342-Y345 PolarHBondContact O-N 3.29Å; M342-I346 WeakPolarHBondContact O-CD1 3.45Å; M342-I346 VanDerWaalsContact O-CG1 3.23Å; M342-I346 WeakPolarHBondContact O-CG1 3.45Å; M342-I346 PolarHBondContact O-N 3.42Å; M342-K363 HydrophobicContact CE-CB 4.29Å; M342-K363 WeakPolarHBondContact CE-O 3.4Å; M342-T366 HydrophobicContact CE-CG2 3.85Å; M342-L367 HydrophobicContact CE-CB 3.76Å; M342-L367 HydrophobicContact SD-CD1 4.47Å
343	K	91.3	Very high	87.3	Confident	118 Å²	118	78.8 Å²	78.8	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-60.2	-45.5	174.8	-76.8	-179.7	176.9	179.1	0	111.7	I339 A340 Y345 I346 A347 L367	I339-K343 HydrophobicContact CG2-CD 3.95Å; I339-K343 HydrophobicContact CG2-CG 4.37Å; I339-K343 WeakPolarHBondContact O-CB 3.48Å; I339-K343 WeakPolarHBondContact O-CG 3.22Å; I339-K343 PolarHBondContact O-N 3.02Å; A340-K343 PolarHBondContact O-N 3.26Å; K343-Y345 VanDerWaalsContact C-N 3.32Å; K343-Y345 PolarHBondContact O-N 2.91Å; K343-I346 PolarHBondContact O-N 3.01Å; K343-A347 WeakPolarHBondContact O-CB 3.42Å; K343-A347 PolarHBondContact O-N 2.87Å; K343-L367 HydrophobicContact CG-CD2 4.03Å
344	N	91.7	Very high	86.8	Confident	96 Å²	96	77.8 Å²	77.8	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-61.6	-39.9	175.9	-77.2	-27.1	0	0	0	112	A340 H341 R348	A340-N344 VanDerWaalsContact O-CB 3.3Å; A340-N344 WeakPolarHBondContact O-CB 3.48Å; A340-N344 VanDerWaalsContact O-CG 3.23Å; A340-N344 PolarHBondContact O-N 3.18Å; A340-N344 PolarHBondContact O-ND2 3.16Å; H341-N344 PolarHBondContact O-N 3.39Å; N344-R348 WeakPolarHBondContact O-CB 3.32Å; N344-R348 VanDerWaalsContact O-CG 3.29Å; N344-R348 WeakPolarHBondContact O-CG 3.39Å; N344-R348 PolarHBondContact O-N 3.31Å
345	Y	87.5	Confident	86.5	Confident	38 Å²	38	78.1 Å²	78.1	15%	0.149	42%	0.415	C	S	.	.	H	α-helix	trans	-67	-44.5	176.4	-171	-82.1	0	0	0	112	H341 M342 K343 A347 R348 F349 Q359 K363	H341-Y345 WeakPolarHBondContact O-CB 3.28Å; H341-Y345 PolarHBondContact O-N 2.87Å; M342-Y345 PolarHBondContact O-N 3.29Å; K343-Y345 VanDerWaalsContact C-N 3.32Å; K343-Y345 PolarHBondContact O-N 2.91Å; Y345-A347 VanDerWaalsContact C-N 3.35Å; Y345-R348 PolarHBondContact O-N 2.78Å; Y345-F349 HydrophobicContact CD1-CB 4.43Å; Y345-F349 AromaticContact CD1-CD2 3.94Å; Y345-F349 HydrophobicContact CD1-CD2 3.94Å; Y345-F349 AromaticContact CD2-CD2 3.53Å; Y345-F349 HydrophobicContact CD2-CD2 3.53Å; Y345-F349 AromaticContact CD2-CE2 3.66Å; Y345-F349 HydrophobicContact CD2-CE2 3.66Å; Y345-F349 HydrophobicContact CE1-CB 4.13Å; Y345-F349 AromaticContact CE1-CD2 3.88Å; Y345-F349 HydrophobicContact CE1-CD2 3.88Å; Y345-F349 HydrophobicContact CE1-CG 4.34Å; Y345-F349 AromaticContact CE2-CD2 3.46Å; Y345-F349 HydrophobicContact CE2-CD2 3.46Å; Y345-F349 VanDerWaalsContact CE2-CD2 3.46Å; Y345-F349 AromaticContact CE2-CE2 3.57Å; Y345-F349 HydrophobicContact CE2-CE2 3.57Å; Y345-F349 HydrophobicContact CE2-CG 4.42Å; Y345-F349 AromaticContact CG-CD2 3.78Å; Y345-F349 HydrophobicContact CG-CD2 3.78Å; Y345-F349 HydrophobicContact CG-CE2 4.33Å; Y345-F349 AromaticContact CZ-CD2 3.63Å; Y345-F349 WeakPolarHBondContact O-CB 3.36Å; Y345-F349 WeakPolarHBondContact O-CD2 3.16Å; Y345-F349 PolarHBondContact O-N 2.85Å; Y345-Q359 HydrophobicContact CE1-CB 4.41Å; Y345-Q359 PolarHBondContact OH-OE1 3.12Å; Y345-K363 HydrophobicContact CD1-CD 3.52Å; Y345-K363 HydrophobicContact CE1-CD 3.95Å; Y345-K363 HydrophobicContact CG-CD 3.88Å
346	I	87.7	Confident	86.3	Confident	31 Å²	31	79.3 Å²	79.3	16%	0.159	42%	0.422	C	S	.	.	H	α-helix	trans	-62.3	-44.1	177.2	-66.5	160.9	0	0	0	110	M342 K343 R348 G350 K363 E364 L367	M342-I346 WeakPolarHBondContact O-CD1 3.45Å; M342-I346 VanDerWaalsContact O-CG1 3.23Å; M342-I346 WeakPolarHBondContact O-CG1 3.45Å; M342-I346 PolarHBondContact O-N 3.42Å; K343-I346 PolarHBondContact O-N 3.01Å; I346-R348 PolarHBondContact O-N 3.43Å; I346-G350 VanDerWaalsContact O-CA 3.27Å; I346-G350 WeakPolarHBondContact O-CA 3.41Å; I346-G350 PolarHBondContact O-N 3.17Å; I346-K363 HydrophobicContact CG1-CB 4.42Å; I346-E364 HydrophobicContact CD1-CB 3.82Å; I346-E364 HydrophobicContact CD1-CG 4.34Å; I346-E364 HydrophobicContact CG1-CB 4.42Å; I346-L367 HydrophobicContact CD1-CD2 4.3Å
347	A	88.5	Confident	86	Confident	76 Å²	76	76.9 Å²	76.9	63%	0.628	41%	0.414	S	S	*	.	H	α-helix	trans	-62.6	-40.2	177.2	0	0	0	0	0	112.8	K343 Y345	K343-A347 WeakPolarHBondContact O-CB 3.42Å; K343-A347 PolarHBondContact O-N 2.87Å; Y345-A347 VanDerWaalsContact C-N 3.35Å
348	R	87	Confident	85.6	Confident	200 Å²	200	80.8 Å²	80.8	76%	0.755	42%	0.421	S	S	*	.	H	α-helix	trans	-75.3	-36.7	-179.8	-74.6	179.4	-178.4	-174.4	1.4	113.8	N344 Y345 I346	N344-R348 WeakPolarHBondContact O-CB 3.32Å; N344-R348 VanDerWaalsContact O-CG 3.29Å; N344-R348 WeakPolarHBondContact O-CG 3.39Å; N344-R348 PolarHBondContact O-N 3.31Å; Y345-R348 PolarHBondContact O-N 2.78Å; I346-R348 PolarHBondContact O-N 3.43Å
349	F	85	Confident	85.5	Confident	69 Å²	69	81.7 Å²	81.7	30%	0.303	43%	0.425	S	S	.	.	H	α-helix	trans	-117.2	-4.5	-167.6	-62.5	-67	0	0	0	114.6	Y345 H351 G352 L356	Y345-F349 HydrophobicContact CD1-CB 4.43Å; Y345-F349 AromaticContact CD1-CD2 3.94Å; Y345-F349 HydrophobicContact CD1-CD2 3.94Å; Y345-F349 AromaticContact CD2-CD2 3.53Å; Y345-F349 HydrophobicContact CD2-CD2 3.53Å; Y345-F349 AromaticContact CD2-CE2 3.66Å; Y345-F349 HydrophobicContact CD2-CE2 3.66Å; Y345-F349 HydrophobicContact CE1-CB 4.13Å; Y345-F349 AromaticContact CE1-CD2 3.88Å; Y345-F349 HydrophobicContact CE1-CD2 3.88Å; Y345-F349 HydrophobicContact CE1-CG 4.34Å; Y345-F349 AromaticContact CE2-CD2 3.46Å; Y345-F349 HydrophobicContact CE2-CD2 3.46Å; Y345-F349 VanDerWaalsContact CE2-CD2 3.46Å; Y345-F349 AromaticContact CE2-CE2 3.57Å; Y345-F349 HydrophobicContact CE2-CE2 3.57Å; Y345-F349 HydrophobicContact CE2-CG 4.42Å; Y345-F349 AromaticContact CG-CD2 3.78Å; Y345-F349 HydrophobicContact CG-CD2 3.78Å; Y345-F349 HydrophobicContact CG-CE2 4.33Å; Y345-F349 AromaticContact CZ-CD2 3.63Å; Y345-F349 WeakPolarHBondContact O-CB 3.36Å; Y345-F349 WeakPolarHBondContact O-CD2 3.16Å; Y345-F349 PolarHBondContact O-N 2.85Å; F349-H351 PolarHBondContact O-N 3.13Å; F349-G352 PolarHBondContact O-N 3.23Å; F349-L356 HydrophobicContact CB-CB 4.29Å; F349-L356 HydrophobicContact CD1-CB 4.47Å; F349-L356 HydrophobicContact CD1-CD1 3.97Å; F349-L356 HydrophobicContact CD1-CD2 3.91Å; F349-L356 HydrophobicContact CD1-CG 4.34Å; F349-L356 HydrophobicContact CE1-CD1 4.41Å; F349-L356 HydrophobicContact CE1-CD2 4.32Å; F349-L356 HydrophobicContact CG-CD2 4.34Å
350	G	75.5	Confident	85.3	Confident	29 Å²	29	81.3 Å²	81.3	30%	0.299	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-31.3	-179.8	0	0	0	0	0	113.7	I346	I346-G350 VanDerWaalsContact O-CA 3.27Å; I346-G350 WeakPolarHBondContact O-CA 3.41Å; I346-G350 PolarHBondContact O-N 3.17Å
351	H	78.6	Confident	85.1	Confident	191 Å²	191	84.8 Å²	84.8	88%	0.884	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	12.4	176.1	-54.3	-59.5	0	0	0	113.3	F349	F349-H351 PolarHBondContact O-N 3.13Å
352	G	74.5	Confident	85	Confident	34 Å²	34	82.9 Å²	82.9	35%	0.351	43%	0.431	S	S	.	.	S	Bend	trans	-76.3	-168.8	-179.7	0	0	0	0	0	113.4	F349	F349-G352 PolarHBondContact O-N 3.23Å
353	S	77.4	Confident	85	Confident	70 Å²	70	85 Å²	85	49%	0.49	44%	0.44	S	S	.	.			trans	-51.2	153.7	174.2	69.5	0	0	0	0	112.3	K355 L356 A357	S353-K355 PolarHBondContact O-N 3.32Å; S353-L356 WeakPolarHBondContact O-CA 3.37Å; S353-L356 WeakPolarHBondContact O-CB 3.5Å; S353-L356 PolarHBondContact O-N 3.35Å; S353-L356 WeakPolarHBondContact OG-CD1 3.09Å; S353-A357 PolarHBondContact O-N 2.84Å
354	A	82.6	Confident	84.8	Confident	76 Å²	76	83.4 Å²	83.4	63%	0.628	44%	0.435	S	S	*	.	H	α-helix	trans	-51.4	-32.4	-176.2	0	0	0	0	0	114.1	R358	A354-R358 WeakPolarHBondContact O-CG 3.34Å; A354-R358 PolarHBondContact O-N 3.43Å
355	K	85.2	Confident	84.8	Confident	155 Å²	155	85.6 Å²	85.6	67%	0.674	44%	0.439	S	S	*	.	H	α-helix	trans	-69	-45	174.8	-173.2	178.7	178.6	-178.9	0	112.2	S353 Q359	S353-K355 PolarHBondContact O-N 3.32Å; K355-Q359 PolarHBondContact O-N 2.98Å
356	L	85	Confident	84.9	Confident	54 Å²	54	87.2 Å²	87.2	28%	0.283	45%	0.453	S	S	.	.	H	α-helix	trans	-68.9	-41.3	178.6	-72.4	167.2	0	0	0	111.5	F349 S353 R358 Q359 A360	F349-L356 HydrophobicContact CB-CB 4.29Å; F349-L356 HydrophobicContact CD1-CB 4.47Å; F349-L356 HydrophobicContact CD1-CD1 3.97Å; F349-L356 HydrophobicContact CD1-CD2 3.91Å; F349-L356 HydrophobicContact CD1-CG 4.34Å; F349-L356 HydrophobicContact CE1-CD1 4.41Å; F349-L356 HydrophobicContact CE1-CD2 4.32Å; F349-L356 HydrophobicContact CG-CD2 4.34Å; S353-L356 WeakPolarHBondContact O-CA 3.37Å; S353-L356 WeakPolarHBondContact O-CB 3.5Å; S353-L356 PolarHBondContact O-N 3.35Å; S353-L356 WeakPolarHBondContact OG-CD1 3.09Å; L356-R358 PolarHBondContact O-N 2.91Å; L356-Q359 WeakPolarHBondContact O-CB 3.47Å; L356-Q359 PolarHBondContact O-N 3.22Å; L356-Q359 VanDerWaalsContact O-N 3.13Å; L356-A360 PolarHBondContact O-N 3.28Å
357	A	82.8	Confident	85	Confident	20 Å²	20	86.4 Å²	86.4	17%	0.165	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-43.1	175.7	0	0	0	0	0	111.8	S353 Q359 A360 Q361	S353-A357 PolarHBondContact O-N 2.84Å; A357-Q359 VanDerWaalsContact C-N 3.34Å; A357-Q359 PolarHBondContact O-N 3.45Å; A357-A360 PolarHBondContact O-N 3.26Å; A357-Q361 WeakPolarHBondContact O-CG 3.49Å; A357-Q361 PolarHBondContact O-N 3.47Å
358	R	86.3	Confident	85	Confident	189 Å²	189	88.5 Å²	88.5	71%	0.713	45%	0.446	S	S	*	.	H	α-helix	trans	-62.1	-38.8	173.6	-76.2	179.3	-174.1	170	3.1	112.6	A354 L356 S362	A354-R358 WeakPolarHBondContact O-CG 3.34Å; A354-R358 PolarHBondContact O-N 3.43Å; L356-R358 PolarHBondContact O-N 2.91Å; R358-S362 PolarHBondContact O-N 3.09Å
359	Q	87.5	Confident	85.1	Confident	90 Å²	90	86.6 Å²	86.6	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-67.2	-40.5	175.5	-74.2	-176.3	-11.2	0	0	112	Y345 K355 L356 A357 S362 K363	Y345-Q359 HydrophobicContact CE1-CB 4.41Å; Y345-Q359 PolarHBondContact OH-OE1 3.12Å; K355-Q359 PolarHBondContact O-N 2.98Å; L356-Q359 WeakPolarHBondContact O-CB 3.47Å; L356-Q359 PolarHBondContact O-N 3.22Å; L356-Q359 VanDerWaalsContact O-N 3.13Å; A357-Q359 VanDerWaalsContact C-N 3.34Å; A357-Q359 PolarHBondContact O-N 3.45Å; Q359-S362 PolarHBondContact O-N 3.02Å; Q359-K363 PolarHBondContact O-N 3.34Å
360	A	86.2	Confident	85.2	Confident	2 Å²	2	85.5 Å²	85.5	2%	0.017	44%	0.44	C	S	.	.	H	α-helix	trans	-61.2	-47	174.6	0	0	0	0	0	111.4	L356 A357 S362 K363 E364	L356-A360 PolarHBondContact O-N 3.28Å; A357-A360 PolarHBondContact O-N 3.26Å; A360-S362 VanDerWaalsContact C-N 3.3Å; A360-S362 PolarHBondContact O-N 3.13Å; A360-K363 PolarHBondContact O-N 3.45Å; A360-K363 VanDerWaalsContact O-N 3.13Å; A360-E364 PolarHBondContact O-N 3.48Å
361	Q	87.5	Confident	85.7	Confident	116 Å²	116	89 Å²	89	54%	0.542	45%	0.45	S	S	.	.	H	α-helix	trans	-59.8	-37.4	175	-73.3	177.8	-3.4	0	0	112.9	A357 E364 K365	A357-Q361 WeakPolarHBondContact O-CG 3.49Å; A357-Q361 PolarHBondContact O-N 3.47Å; Q361-E364 PolarHBondContact O-N 2.97Å; Q361-K365 PolarHBondContact O-N 2.9Å
362	S	88.6	Confident	86	Confident	72 Å²	72	84.1 Å²	84.1	50%	0.503	44%	0.442	S	S	.	.	H	α-helix	trans	-64.9	-43.4	175	-171.9	0	0	0	0	111.8	R358 Q359 A360 E364 K365 T366	R358-S362 PolarHBondContact O-N 3.09Å; Q359-S362 PolarHBondContact O-N 3.02Å; A360-S362 VanDerWaalsContact C-N 3.3Å; A360-S362 PolarHBondContact O-N 3.13Å; S362-E364 VanDerWaalsContact C-N 3.32Å; S362-K365 PolarHBondContact O-N 3.29Å; S362-T366 PolarHBondContact O-N 3.18Å; S362-T366 VanDerWaalsContact O-N 3.11Å; S362-T366 PolarHBondContact O-OG1 3.16Å
363	K	87.7	Confident	86.4	Confident	59 Å²	59	87.1 Å²	87.1	26%	0.257	46%	0.458	S	S	.	.	H	α-helix	trans	-65.8	-36.8	175.7	-72	-170.1	-176.8	179.6	0	111.7	M342 Y345 I346 Q359 A360 T366 L367	M342-K363 HydrophobicContact CE-CB 4.29Å; M342-K363 WeakPolarHBondContact CE-O 3.4Å; Y345-K363 HydrophobicContact CD1-CD 3.52Å; Y345-K363 HydrophobicContact CE1-CD 3.95Å; Y345-K363 HydrophobicContact CG-CD 3.88Å; I346-K363 HydrophobicContact CG1-CB 4.42Å; Q359-K363 PolarHBondContact O-N 3.34Å; A360-K363 PolarHBondContact O-N 3.45Å; A360-K363 VanDerWaalsContact O-N 3.13Å; K363-T366 PolarHBondContact O-N 3.13Å; K363-L367 WeakPolarHBondContact O-CB 3.22Å; K363-L367 PolarHBondContact O-N 3.2Å
364	E	88.9	Confident	86.6	Confident	84 Å²	84	86.1 Å²	86.1	39%	0.393	46%	0.458	S	S	.	.	H	α-helix	trans	-61.5	-43.4	175.7	-172.7	163.3	-159.3	0	0	111.9	I346 A360 Q361 S362 T366 L367 Q368	I346-E364 HydrophobicContact CD1-CB 3.82Å; I346-E364 HydrophobicContact CD1-CG 4.34Å; I346-E364 HydrophobicContact CG1-CB 4.42Å; A360-E364 PolarHBondContact O-N 3.48Å; Q361-E364 PolarHBondContact O-N 2.97Å; S362-E364 VanDerWaalsContact C-N 3.32Å; E364-T366 VanDerWaalsContact C-N 3.35Å; E364-T366 PolarHBondContact O-N 3.01Å; E364-L367 WeakPolarHBondContact O-CB 3.13Å; E364-L367 PolarHBondContact O-N 3.49Å; E364-Q368 WeakPolarHBondContact O-CG 3.15Å; E364-Q368 PolarHBondContact O-N 3.42Å
365	K	90.6	Very high	86.6	Confident	142 Å²	142	85.4 Å²	85.4	62%	0.617	44%	0.444	S	S	*	.	H	α-helix	trans	-61.6	-40.2	172.3	-72.6	-178.6	-179.1	-177.8	0	112.6	Q361 S362 Q368 K369	Q361-K365 PolarHBondContact O-N 2.9Å; S362-K365 PolarHBondContact O-N 3.29Å; K365-Q368 PolarHBondContact O-N 2.93Å; K365-K369 WeakPolarHBondContact O-CG 3.35Å; K365-K369 PolarHBondContact O-N 3.02Å
366	T	89.9	Confident	86.5	Confident	72 Å²	72	79.6 Å²	79.6	44%	0.442	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-40.6	175.4	-57.4	0	0	0	0	111.5	M342 S362 K363 E364 K369 M370	M342-T366 HydrophobicContact CE-CG2 3.85Å; S362-T366 PolarHBondContact O-N 3.18Å; S362-T366 VanDerWaalsContact O-N 3.11Å; S362-T366 PolarHBondContact O-OG1 3.16Å; K363-T366 PolarHBondContact O-N 3.13Å; E364-T366 VanDerWaalsContact C-N 3.35Å; E364-T366 PolarHBondContact O-N 3.01Å; T366-K369 PolarHBondContact O-N 3.21Å; T366-M370 WeakPolarHBondContact O-CB 3.23Å; T366-M370 PolarHBondContact O-N 2.71Å
367	L	88.7	Confident	86.3	Confident	14 Å²	14	83.7 Å²	83.7	7%	0.073	44%	0.439	C	S	.	.	H	α-helix	trans	-62.9	-45.1	177	-178.5	62.7	0	0	0	110.6	I339 M342 K343 I346 K363 E364 K369 M370 M371	I339-L367 HydrophobicContact CB-CD1 4.22Å; I339-L367 HydrophobicContact CG1-CD1 3.79Å; I339-L367 HydrophobicContact CG2-CD1 4.09Å; M342-L367 HydrophobicContact CE-CB 3.76Å; M342-L367 HydrophobicContact SD-CD1 4.47Å; K343-L367 HydrophobicContact CG-CD2 4.03Å; I346-L367 HydrophobicContact CD1-CD2 4.3Å; K363-L367 WeakPolarHBondContact O-CB 3.22Å; K363-L367 PolarHBondContact O-N 3.2Å; E364-L367 WeakPolarHBondContact O-CB 3.13Å; E364-L367 PolarHBondContact O-N 3.49Å; L367-K369 VanDerWaalsContact C-N 3.35Å; L367-K369 PolarHBondContact O-N 3.02Å; L367-M370 PolarHBondContact O-N 3.06Å; L367-M371 HydrophobicContact CD1-SD 4.48Å; L367-M371 HydrophobicContact CG-SD 4.26Å; L367-M371 WeakPolarHBondContact O-CG 3.34Å; L367-M371 PolarHBondContact O-N 2.9Å
368	Q	88.8	Confident	86.3	Confident	121 Å²	121	90.6 Å²	90.6	57%	0.565	46%	0.461	S	S	*	.	H	α-helix	trans	-60.9	-42.1	175.9	-73.6	176.4	-4.8	0	0	112	E364 K365 M371 A372	E364-Q368 WeakPolarHBondContact O-CG 3.15Å; E364-Q368 PolarHBondContact O-N 3.42Å; K365-Q368 PolarHBondContact O-N 2.93Å; Q368-M371 PolarHBondContact O-N 2.89Å; Q368-A372 VanDerWaalsContact O-CB 3.27Å; Q368-A372 WeakPolarHBondContact O-CB 3.4Å; Q368-A372 PolarHBondContact O-N 2.83Å
369	K	90.3	Very high	85.9	Confident	159 Å²	159	82.7 Å²	82.7	69%	0.691	43%	0.434	S	S	*	.	H	α-helix	trans	-63.2	-42.8	174.9	-75.5	-178	179.5	-173.3	0	112.5	K365 T366 L367 A372 S373	K365-K369 WeakPolarHBondContact O-CG 3.35Å; K365-K369 PolarHBondContact O-N 3.02Å; T366-K369 PolarHBondContact O-N 3.21Å; L367-K369 VanDerWaalsContact C-N 3.35Å; L367-K369 PolarHBondContact O-N 3.02Å; K369-A372 PolarHBondContact O-N 3.09Å; K369-S373 PolarHBondContact O-N 3.03Å; K369-S373 PolarHBondContact O-OG 2.88Å
370	M	86	Confident	85.1	Confident	46 Å²	46	84 Å²	84	23%	0.227	45%	0.447	C	S	.	.	H	α-helix	trans	-64.5	-39.3	177.6	-176.8	-178.5	-80.8	0	0	111.8	I339 T366 L367 S373 L375	I339-M370 HydrophobicContact CG1-SD 4.32Å; T366-M370 WeakPolarHBondContact O-CB 3.23Å; T366-M370 PolarHBondContact O-N 2.71Å; L367-M370 PolarHBondContact O-N 3.06Å; M370-S373 PolarHBondContact O-OG 3.14Å; M370-L375 HydrophobicContact CG-CD2 3.97Å
371	M	85.6	Confident	84	Confident	104 Å²	104	88 Å²	88	51%	0.512	48%	0.476	S	S	.	.	H	α-helix	trans	-69.2	-35.9	173.9	-68.2	-179.8	70.1	0	0	111.9	L367 Q368 G374 L375	L367-M371 HydrophobicContact CD1-SD 4.48Å; L367-M371 HydrophobicContact CG-SD 4.26Å; L367-M371 WeakPolarHBondContact O-CG 3.34Å; L367-M371 PolarHBondContact O-N 2.9Å; Q368-M371 PolarHBondContact O-N 2.89Å; M371-G374 PolarHBondContact O-N 2.98Å; M371-L375 HydrophobicContact CG-CD1 4.5Å
372	A	85.1	Confident	82.9	Confident	87 Å²	87	84.1 Å²	84.1	72%	0.719	46%	0.458	S	S	*	.	H	α-helix	trans	-71.4	-28.3	178.5	0	0	0	0	0	113.5	Q368 K369 G374	Q368-A372 VanDerWaalsContact O-CB 3.27Å; Q368-A372 WeakPolarHBondContact O-CB 3.4Å; Q368-A372 PolarHBondContact O-N 2.83Å; K369-A372 PolarHBondContact O-N 3.09Å; A372-G374 PolarHBondContact O-N 2.87Å
373	S	84.4	Confident	81.6	Confident	97 Å²	97	89.4 Å²	89.4	68%	0.678	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-6.5	174.6	54.4	0	0	0	0	113.9	K369 M370	K369-S373 PolarHBondContact O-N 3.03Å; K369-S373 PolarHBondContact O-OG 2.88Å; M370-S373 PolarHBondContact O-OG 3.14Å
374	G	81.2	Confident	80.5	Confident	49 Å²	49	92.9 Å²	92.9	51%	0.505	50%	0.499	S	S	.	.			trans	83.7	132.2	-168.1	0	0	0	0	0	110.6	M371 A372	M371-G374 PolarHBondContact O-N 2.98Å; A372-G374 PolarHBondContact O-N 2.87Å
375	L	82.5	Confident	80	Confident	61 Å²	61	90.5 Å²	90.5	32%	0.319	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-87.7	150.5	172.2	-64	174.5	0	0	0	109.3	I339 M370 M371 E377	I339-L375 HydrophobicContact CD1-CD1 3.68Å; I339-L375 HydrophobicContact CD1-CD2 3.77Å; I339-L375 HydrophobicContact CD1-CG 4.39Å; M370-L375 HydrophobicContact CG-CD2 3.97Å; M371-L375 HydrophobicContact CG-CD1 4.5Å; L375-E377 PolarHBondContact O-N 3.47Å
376	T	81.9	Confident	79.6	Confident	34 Å²	34	87.7 Å²	87.7	21%	0.209	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-57.2	129.6	169.2	-62.5	0	0	0	0	108.3	Q328 R331 F332 E335	Q328-T376 HydrophobicContact CG-CG2 3.6Å; R331-T376 HydrophobicContact CB-CG2 4.37Å; F332-T376 HydrophobicContact CB-CG2 4.24Å; F332-T376 VanDerWaalsContact CD2-O 3.22Å; F332-T376 WeakPolarHBondContact CD2-O 3.19Å; E335-T376 VanDerWaalsContact CD-OG1 3.31Å; E335-T376 PolarHBondContact OE1-OG1 2.88Å; E335-T376 VanDerWaalsContact OE2-CB 3.32Å; E335-T376 WeakPolarHBondContact OE2-CB 3.28Å; E335-T376 PolarHBondContact OE2-N 3.38Å; E335-T376 PolarHBondContact OE2-OG1 3.31Å
377	E	81.2	Confident	79.6	Confident	139 Å²	139	84.4 Å²	84.4	65%	0.65	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-73	145.9	176.2	-67.7	180	175.9	0	0	110.2	Q328 L375 V379	Q328-E377 PolarHBondContact NE2-O 3.13Å; L375-E377 PolarHBondContact O-N 3.47Å; E377-V379 PolarHBondContact O-N 3.3Å
378	R	84.2	Confident	79.6	Confident	166 Å²	166	88 Å²	88	63%	0.626	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-63.6	133.1	170.1	-176.3	176.6	175.1	172.7	0.8	108.7	M329 F332 V380	M329-R378 HydrophobicContact SD-CG 4.18Å; F332-R378 HydrophobicContact CD1-CB 4.32Å; F332-R378 HydrophobicContact CD1-CG 4.32Å; F332-R378 HydrophobicContact CD2-CB 4.24Å; F332-R378 HydrophobicContact CE1-CB 4Å; F332-R378 HydrophobicContact CE1-CG 4.02Å; F332-R378 HydrophobicContact CE2-CB 3.9Å; F332-R378 HydrophobicContact CG-CB 4.43Å; F332-R378 HydrophobicContact CZ-CB 3.78Å; F332-R378 HydrophobicContact CZ-CG 4.26Å; R378-V380 PolarHBondContact O-N 3.29Å
379	V	77.9	Confident	79.7	Confident	23 Å²	23	82.6 Å²	82.6	14%	0.139	45%	0.454	C	S	.	.			trans	-64.4	114.2	169.1	-178.9	0	0	0	0	107.7	E325 Q328 M329 E377	E325-V379 HydrophobicContact CB-CG1 4.12Å; E325-V379 HydrophobicContact CB-CG2 4.33Å; E325-V379 HydrophobicContact CG-CG1 3.89Å; E325-V379 HydrophobicContact CG-CG2 4.47Å; Q328-V379 HydrophobicContact CB-CG2 3.78Å; Q328-V379 VanDerWaalsContact CD-CG2 3.5Å; Q328-V379 HydrophobicContact CG-CG2 3.69Å; M329-V379 HydrophobicContact CG-CB 3.69Å; M329-V379 HydrophobicContact CG-CG2 3.62Å; M329-V379 HydrophobicContact SD-CB 3.75Å; M329-V379 HydrophobicContact SD-CG2 4.06Å; E377-V379 PolarHBondContact O-N 3.3Å
380	V	69.8	Low	79.5	Confident	116 Å²	116	75.8 Å²	75.8	70%	0.703	43%	0.426	S	S	*	.			trans	-86.7	110.1	167.4	-178.4	0	0	0	0	105.1	R378	R378-V380 PolarHBondContact O-N 3.29Å
381	S	63.2	Low	79.6	Confident	88 Å²	88	77 Å²	77	62%	0.615	44%	0.438	S	S	*	.			trans	-63.8	142.4	170.7	57.3	0	0	0	0	108.8	K383	S381-K383 PolarHBondContact O-N 3.39Å
382	D	63.7	Low	79.6	Confident	34 Å²	34	72.7 Å²	72.7	18%	0.182	42%	0.417	C	S	.	.			trans	-55.1	141.9	166.8	-64.5	-47.4	0	0	0	108.7	H303 R321 T384 E554	H303-D382 IonicContact NE2-OD1 3.84Å; R321-D382 IonicContact CZ-OD2 3.38Å; R321-D382 IonicContact NH1-OD2 2.96Å; R321-D382 IonicContact NH2-OD2 3.72Å; R321-D382 PolarHBondContact NH2-OD2 3.49Å; D382-T384 PolarHBondContact O-N 2.95Å; D382-E554 WeakPolarHBondContact CB-OE1 3.49Å
383	K	62.5	Low	79.6	Confident	182 Å²	182	70.6 Å²	70.6	79%	0.791	40%	0.404	S	S	*	.			trans	-67.6	109.3	-178.5	-78.8	-176.3	177.8	-180	0	108	S381 L385	S381-K383 PolarHBondContact O-N 3.39Å; K383-L385 PolarHBondContact O-N 3.19Å; K383-L385 VanDerWaalsContact O-N 3.07Å
384	T	64.9	Low	79.7	Confident	133 Å²	133	75.8 Å²	75.8	82%	0.816	41%	0.414	S	S	*	.			trans	-59.1	114.2	172.4	53.5	0	0	0	0	109.3	D382	D382-T384 PolarHBondContact O-N 2.95Å
385	L	77.8	Confident	80.1	Confident	34 Å²	34	74.1 Å²	74.1	18%	0.178	39%	0.394	C	S	.	.			trans	-73.7	139.7	169.4	-62.1	177.5	0	0	0	107.9	K383 F387 T555 A558	K383-L385 PolarHBondContact O-N 3.19Å; K383-L385 VanDerWaalsContact O-N 3.07Å; L385-F387 HydrophobicContact CB-CE1 4.3Å; L385-T555 HydrophobicContact CD1-CG2 4.43Å; L385-A558 HydrophobicContact CB-CB 3.72Å; L385-A558 VanDerWaalsContact O-CB 3.29Å; L385-A558 WeakPolarHBondContact O-CB 3.24Å
386	S	82.2	Confident	80.4	Confident	82 Å²	82	75 Å²	75	57%	0.573	40%	0.403	S	S	*	.			trans	-131.6	96.7	176.2	173.3	0	0	0	0	107
387	F	89.2	Confident	80.7	Confident	4 Å²	4	78 Å²	78	2%	0.018	42%	0.423	C	S	.	.			trans	-74.7	155.5	174	-69.6	1.2	0	0	0	109	L385 Y507 R528 L531 T555 A558 L559 A562	L385-F387 HydrophobicContact CB-CE1 4.3Å; F387-Y507 HydrophobicContact CB-CD1 4.48Å; F387-Y507 HydrophobicContact CB-CE1 4.07Å; F387-Y507 AromaticContact CD1-CD1 3.74Å; F387-Y507 HydrophobicContact CD1-CD1 3.74Å; F387-Y507 HydrophobicContact CD1-CE1 4.19Å; F387-Y507 HydrophobicContact CD1-CG 4.29Å; F387-Y507 HydrophobicContact CD2-CD1 4.14Å; F387-Y507 HydrophobicContact CD2-CE1 4.17Å; F387-Y507 VanDerWaalsContact CE1-CA 3.47Å; F387-Y507 AromaticContact CE1-CD1 3.88Å; F387-Y507 HydrophobicContact CE1-CD1 3.88Å; F387-Y507 HydrophobicContact CE1-CG 4.36Å; F387-Y507 HydrophobicContact CE2-CD1 4.25Å; F387-Y507 AromaticContact CG-CD1 3.86Å; F387-Y507 HydrophobicContact CG-CD1 3.86Å; F387-Y507 AromaticContact CG-CE1 3.89Å; F387-Y507 HydrophobicContact CG-CE1 3.89Å; F387-Y507 HydrophobicContact CZ-CD1 4.08Å; F387-R528 HydrophobicContact CZ-CG 4.21Å; F387-L531 HydrophobicContact CD2-CD1 4.32Å; F387-L531 HydrophobicContact CE2-CD1 3.6Å; F387-L531 HydrophobicContact CZ-CD1 4.34Å; F387-T555 HydrophobicContact CE1-CG2 4.34Å; F387-T555 HydrophobicContact CE2-CG2 3.55Å; F387-T555 HydrophobicContact CZ-CG2 3.3Å; F387-A558 HydrophobicContact CD1-CB 4.24Å; F387-A558 HydrophobicContact CD2-CB 4.44Å; F387-A558 HydrophobicContact CG-CB 4.21Å; F387-L559 HydrophobicContact CD2-CB 4.04Å; F387-L559 HydrophobicContact CD2-CD1 4.26Å; F387-L559 HydrophobicContact CE2-CB 4.3Å; F387-A562 VanDerWaalsContact C-CB 3.49Å; F387-A562 HydrophobicContact CB-CB 3.52Å; F387-A562 WeakPolarHBondContact O-CB 3.09Å
388	Y	88.7	Confident	81	Confident	88 Å²	88	74.7 Å²	74.7	35%	0.345	41%	0.414	S	S	.	.			trans	-151.5	119	-174.5	175	-101.7	0	0	0	110.8	P390 P391 Y507	Y388-P390 HydrophobicContact CD1-CG 4.39Å; Y388-P390 HydrophobicContact CE1-CB 4.22Å; Y388-P390 HydrophobicContact CE1-CG 4.05Å; Y388-P391 WeakPolarHBondContact OH-CD 3.39Å; Y388-Y507 PolarHBondContact O-OH 2.9Å
389	F	90.6	Very high	81.4	Confident	9 Å²	9	66.8 Å²	66.8	4%	0.039	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-94.5	118.7	169.8	-67.7	-79.2	0	0	0	109.3	A535 L542 L559 A562 I563 F566	F389-A535 HydrophobicContact CD1-CB 3.54Å; F389-A535 HydrophobicContact CE1-CB 3.74Å; F389-A535 HydrophobicContact CG-CB 4.43Å; F389-L542 HydrophobicContact CD1-CD1 3.9Å; F389-L542 HydrophobicContact CD1-CD2 4.39Å; F389-L542 HydrophobicContact CD2-CD1 4.28Å; F389-L542 HydrophobicContact CE1-CD1 3.84Å; F389-L542 HydrophobicContact CE1-CD2 4.1Å; F389-L542 HydrophobicContact CE2-CD1 4.22Å; F389-L542 HydrophobicContact CG-CD1 4.14Å; F389-L542 HydrophobicContact CZ-CD1 4.01Å; F389-L559 HydrophobicContact CE2-CD1 4.28Å; F389-L559 HydrophobicContact CZ-CD1 4.31Å; F389-A562 HydrophobicContact CD2-CB 3.8Å; F389-A562 HydrophobicContact CE2-CB 3.86Å; F389-I563 HydrophobicContact CE2-CG1 4.19Å; F389-F566 HydrophobicContact CB-CB 4.28Å; F389-F566 HydrophobicContact CB-CD2 3.58Å; F389-F566 HydrophobicContact CB-CE2 4.31Å; F389-F566 HydrophobicContact CB-CG 4.25Å; F389-F566 HydrophobicContact CD2-CB 4.47Å; F389-F566 HydrophobicContact CG-CD2 4.24Å
390	P	88.1	Confident	82.3	Confident	16 Å²	16	65.7 Å²	65.7	10%	0.104	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-58	150	175	-22.9	33.4	0	0	0	112.3	Y388 C392 A535 W536 N538	Y388-P390 HydrophobicContact CD1-CG 4.39Å; Y388-P390 HydrophobicContact CE1-CB 4.22Å; Y388-P390 HydrophobicContact CE1-CG 4.05Å; P390-C392 PolarHBondContact O-N 3.13Å; P390-A535 WeakPolarHBondContact CD-O 3.49Å; P390-W536 HydrophobicContact CG-CE3 3.93Å; P390-W536 HydrophobicContact CG-CZ3 3.87Å; P390-N538 PolarHBondContact O-OD1 3.41Å
391	P	87	Confident	83.5	Confident	72 Å²	72	63 Å²	63	47%	0.468	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-66.9	130.8	177.1	26.4	-34.1	0	0	0	111.3	Y388 N538	Y388-P391 WeakPolarHBondContact OH-CD 3.39Å; P391-N538 PolarHBondContact O-ND2 3.08Å; P391-N538 VanDerWaalsContact O-ND2 3.15Å; P391-N538 PolarHBondContact O-OD1 3Å; P391-N538 VanDerWaalsContact O-OD1 3.11Å
392	C	85.3	Confident	85	Confident	13 Å²	13	59 Å²	59	9%	0.088	33%	0.33	C	S	.	.			trans	-86.2	-13	-173.7	60.4	0	0	0	0	114.9	P390 N538 P539 H540	P390-C392 PolarHBondContact O-N 3.13Å; C392-N538 WeakPolarHBondContact CA-OD1 3.45Å; C392-N538 PolarHBondContact N-OD1 3.49Å; C392-P539 VanDerWaalsContact CB-O 3.25Å; C392-P539 WeakPolarHBondContact CB-O 3.4Å; C392-H540 HydrophobicContact CB-CB 4.41Å; C392-H540 PolarHBondContact O-CD2 2.87Å; C392-H540 PolarHBondContact O-NE2 3.21Å; C392-H540 VanDerWaalsContact O-NE2 3.14Å
393	G	85.9	Confident	86.5	Confident	43 Å²	43	60.2 Å²	60.2	44%	0.443	33%	0.334	S	S	.	.			trans	79.8	-176.3	-168.1	0	0	0	0	0	112.3
394	K	86.8	Confident	88.1	Confident	205 Å²	205	55 Å²	55	89%	0.891	32%	0.315	S	S	*	.			trans	-104	140.8	-173.2	-63.2	-173	177.9	-174.4	0	112.1
395	I	89.4	Confident	89.5	Confident	15 Å²	15	48.7 Å²	48.7	8%	0.077	28%	0.277	C	S	.	.			trans	-122.1	134.2	170.4	-65.1	-178.3	0	0	0	108	V399 L426 H461 V464 H540	I395-V399 HydrophobicContact CG2-CG2 4.26Å; I395-L426 HydrophobicContact CB-CD1 3.95Å; I395-L426 HydrophobicContact CB-CG 4.5Å; I395-H461 HydrophobicContact CG2-CB 3.98Å; I395-H461 WeakPolarHBondContact CG2-ND1 3.47Å; I395-V464 HydrophobicContact CD1-CB 4.04Å; I395-V464 HydrophobicContact CD1-CG2 4.13Å; I395-H540 HydrophobicContact CD1-CB 3.81Å; I395-H540 WeakPolarHBondContact CD1-CD2 3.43Å
396	P	88.6	Confident	90.2	Very high	78 Å²	78	47.9 Å²	47.9	51%	0.506	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-67	139.2	175.6	28	-34.1	0	0	0	111
397	P	88	Confident	90.8	Very high	97 Å²	97	44.5 Å²	44.5	63%	0.63	25%	0.249	S	C	*	.	S	Bend	trans	-67.8	152.5	172.8	29.4	-34.2	0	0	0	110.6	D425	P397-D425 WeakPolarHBondContact CB-OD1 3.13Å
398	P	87.5	Confident	91	Very high	70 Å²	70	47.9 Å²	47.9	46%	0.455	26%	0.263	S	S	.	.	P	Polyproline II helix	cis	-82.5	137.8	-1	30.9	-31.5	0	0	0	112.5	M401 D425	P398-M401 HydrophobicContact CB-CE 3.9Å; P398-M401 HydrophobicContact CG-CE 3.51Å; P398-D425 WeakPolarHBondContact CA-OD1 3.45Å
399	V	93.4	Very high	90.9	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.271	C	S	.	.	S	Bend	trans	-78.5	-51.9	-179.1	-174.7	0	0	0	0	111.5	I395 I424 D425 L426 K460 H461 V464 M541	I395-V399 HydrophobicContact CG2-CG2 4.26Å; V399-I424 WeakPolarHBondContact CB-O 3.19Å; V399-I424 PolarHBondContact N-O 2.9Å; V399-D425 PolarHBondContact N-OD1 2.89Å; V399-D425 VanDerWaalsContact N-OD1 3.12Å; V399-L426 HydrophobicContact CG1-CD2 4.41Å; V399-L426 HydrophobicContact CG2-CD2 4.01Å; V399-L426 HydrophobicContact CG2-CG 3.83Å; V399-K460 WeakPolarHBondContact O-CA 3.35Å; V399-H461 PolarHBondContact O-N 3.28Å; V399-V464 HydrophobicContact CG1-CB 4.13Å; V399-V464 HydrophobicContact CG1-CG2 3.46Å; V399-V464 VanDerWaalsContact CG1-CG2 3.46Å; V399-M541 HydrophobicContact CG1-CG 4.17Å; V399-M541 HydrophobicContact CG1-SD 4.22Å
400	I	95	Very high	90.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	129.9	173	-52.5	176.4	0	0	0	109	V402 G423 I424 L447 I458 R459 K460 I466 F543	I400-V402 HydrophobicContact CG2-CG2 4.46Å; I400-G423 CarbonylContact O-C 3.54Å; I400-G423 WeakPolarHBondContact O-CA 3.25Å; I400-I424 HydrophobicContact CB-CB 4.27Å; I400-I424 PolarHBondContact N-O 3.27Å; I400-I424 PolarHBondContact O-N 3.05Å; I400-L447 HydrophobicContact CG2-CD2 3.87Å; I400-I458 HydrophobicContact CG2-CG2 3.96Å; I400-R459 CarbonylContact C-O 3.42Å; I400-R459 WeakPolarHBondContact CA-O 3.44Å; I400-K460 HydrophobicContact CG1-CG 4.24Å; I400-K460 HydrophobicContact CG2-CG 4.2Å; I400-I466 HydrophobicContact CD1-CD1 3.9Å; I400-F543 HydrophobicContact CD1-CZ 3.89Å
401	M	95.5	Very high	90.3	Very high	59 Å²	59	61.3 Å²	61.3	29%	0.291	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.5	177.1	-170.8	-175.2	-64.4	0	0	110	P398 Q403 I458 R459	P398-M401 HydrophobicContact CB-CE 3.9Å; P398-M401 HydrophobicContact CG-CE 3.51Å; M401-Q403 HydrophobicContact CG-CG 3.88Å; M401-Q403 VanDerWaalsContact SD-CD 3.55Å; M401-Q403 HydrophobicContact SD-CG 4.06Å; M401-Q403 PolarHBondContact SD-NE2 3.43Å; M401-I458 CarbonylContact O-C 3.55Å; M401-I458 WeakPolarHBondContact O-CA 3.3Å; M401-R459 HydrophobicContact CB-CB 4.48Å; M401-R459 PolarHBondContact N-O 3.5Å; M401-R459 PolarHBondContact O-N 2.87Å
402	V	95.6	Very high	90.1	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.7	178.5	-178.3	0	0	0	0	108.2	I400 V405 L420 E421 F422 L447 I458	I400-V402 HydrophobicContact CG2-CG2 4.46Å; V402-V405 HydrophobicContact CG1-CB 3.67Å; V402-V405 HydrophobicContact CG1-CG1 4.47Å; V402-V405 HydrophobicContact CG1-CG2 3.56Å; V402-L420 HydrophobicContact CG1-CB 4.19Å; V402-E421 WeakPolarHBondContact O-CA 3.31Å; V402-F422 HydrophobicContact CB-CD1 4.37Å; V402-F422 HydrophobicContact CB-CD2 4.26Å; V402-F422 HydrophobicContact CB-CE1 4.22Å; V402-F422 HydrophobicContact CB-CE2 4.1Å; V402-F422 HydrophobicContact CB-CG 4.39Å; V402-F422 HydrophobicContact CB-CZ 4.08Å; V402-F422 HydrophobicContact CG1-CD1 4.49Å; V402-F422 HydrophobicContact CG1-CE1 4.08Å; V402-F422 HydrophobicContact CG1-CZ 4.19Å; V402-F422 HydrophobicContact CG2-CD2 4.03Å; V402-F422 HydrophobicContact CG2-CE1 4.3Å; V402-F422 HydrophobicContact CG2-CE2 3.5Å; V402-F422 VanDerWaalsContact CG2-CE2 3.5Å; V402-F422 HydrophobicContact CG2-CZ 3.66Å; V402-F422 PolarHBondContact N-O 3.27Å; V402-F422 PolarHBondContact O-N 2.77Å; V402-L447 HydrophobicContact CG2-CD2 3.52Å; V402-I458 HydrophobicContact CG1-CG1 4.46Å; V402-I458 HydrophobicContact CG2-CG1 4.35Å; V402-I458 HydrophobicContact CG2-CG2 4.39Å
403	Q	95.5	Very high	89.8	Confident	60 Å²	60	66 Å²	66	28%	0.28	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	120.6	-175.3	-59.4	-175.8	-66.5	0	0	111.1	M401 V405 G456 M457	M401-Q403 HydrophobicContact CG-CG 3.88Å; M401-Q403 VanDerWaalsContact SD-CD 3.55Å; M401-Q403 HydrophobicContact SD-CG 4.06Å; M401-Q403 PolarHBondContact SD-NE2 3.43Å; Q403-V405 PolarHBondContact O-N 3.33Å; Q403-V405 VanDerWaalsContact O-N 3.14Å; Q403-G456 VanDerWaalsContact O-CA 3.32Å; Q403-G456 WeakPolarHBondContact O-CA 3.36Å; Q403-M457 HydrophobicContact CB-CG 4.28Å; Q403-M457 PolarHBondContact N-O 3.06Å; Q403-M457 PolarHBondContact O-N 3.02Å
404	N	94.9	Very high	89.7	Confident	71 Å²	71	68.9 Å²	68.9	38%	0.38	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.9	34.9	179.5	-61.8	-57	0	0	0	114	S406 N419 L420 E421 G456	N404-S406 PolarHBondContact O-N 2.94Å; N404-N419 WeakPolarHBondContact CA-OD1 3.46Å; N404-N419 VanDerWaalsContact CB-OD1 3.27Å; N404-N419 WeakPolarHBondContact CB-OD1 3.48Å; N404-N419 PolarHBondContact OD1-ND2 2.93Å; N404-N419 PolarHBondContact OD1-OD1 3.5Å; N404-L420 PolarHBondContact N-O 3.39Å; N404-L420 VanDerWaalsContact N-O 3.09Å; N404-E421 VanDerWaalsContact CG-OE1 3.31Å; N404-E421 PolarHBondContact ND2-OE1 2.62Å; N404-E421 PolarHBondContact OD1-OE1 2.72Å; N404-G456 VanDerWaalsContact O-CA 3.31Å; N404-G456 WeakPolarHBondContact O-CA 3.46Å
405	V	94.1	Very high	89.7	Confident	2 Å²	2	61 Å²	61	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124	-171.9	166.3	0	0	0	0	111.2	V402 Q403 N419 L420 P453 D455 M457 I458	V402-V405 HydrophobicContact CG1-CB 3.67Å; V402-V405 HydrophobicContact CG1-CG1 4.47Å; V402-V405 HydrophobicContact CG1-CG2 3.56Å; Q403-V405 PolarHBondContact O-N 3.33Å; Q403-V405 VanDerWaalsContact O-N 3.14Å; V405-N419 PolarHBondContact O-N 3.42Å; V405-L420 HydrophobicContact CB-CB 4.28Å; V405-L420 PolarHBondContact N-O 3.33Å; V405-L420 PolarHBondContact O-N 2.95Å; V405-P453 HydrophobicContact CG1-CB 3.76Å; V405-P453 HydrophobicContact CG2-CB 4.29Å; V405-D455 VanDerWaalsContact CA-O 3.31Å; V405-D455 WeakPolarHBondContact CA-O 3.26Å; V405-M457 WeakPolarHBondContact CG2-O 3.19Å; V405-I458 HydrophobicContact CG2-CD1 4.44Å; V405-I458 HydrophobicContact CG2-CG1 3.74Å
406	S	93.9	Very high	89.8	Confident	16 Å²	16	61.8 Å²	61.8	11%	0.112	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.9	171	-55.3	0	0	0	0	110.6	N404 Y417 N419 T454 D455	N404-S406 PolarHBondContact O-N 2.94Å; S406-Y417 CarbonylContact C-O 3.58Å; S406-Y417 WeakPolarHBondContact CA-O 3.39Å; S406-Y417 WeakPolarHBondContact CB-O 3.27Å; S406-N419 PolarHBondContact OG-N 3.29Å; S406-T454 WeakPolarHBondContact O-CB 3.4Å; S406-T454 PolarHBondContact O-N 3.37Å; S406-D455 PolarHBondContact N-O 3.23Å; S406-D455 PolarHBondContact O-N 2.95Å
407	F	94.2	Very high	90.1	Very high	12 Å²	12	58.1 Å²	58.1	5%	0.053	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	135.4	-177.1	-176.7	-99.8	0	0	0	113.4	Y409 I416 Y417 T442 L446 L451 L452	F407-Y409 HydrophobicContact CE1-CD1 4.05Å; F407-Y409 HydrophobicContact CE1-CD2 4.02Å; F407-Y409 HydrophobicContact CE1-CE1 4.02Å; F407-Y409 AromaticContact CE1-CE2 3.99Å; F407-Y409 HydrophobicContact CE1-CE2 3.99Å; F407-Y409 HydrophobicContact CE1-CG 4.05Å; F407-Y409 AromaticContact CE1-CZ 3.99Å; F407-Y409 HydrophobicContact CZ-CD1 4.1Å; F407-Y409 HydrophobicContact CZ-CE1 4.18Å; F407-Y409 HydrophobicContact CZ-CG 4.43Å; F407-I416 HydrophobicContact CD1-CB 4.27Å; F407-I416 HydrophobicContact CD1-CG1 4.33Å; F407-I416 PolarHBondContact O-N 3.46Å; F407-Y417 PolarHBondContact N-O 3.13Å; F407-Y417 PolarHBondContact O-N 2.98Å; F407-T442 HydrophobicContact CD1-CG2 3.57Å; F407-T442 HydrophobicContact CE1-CG2 3.43Å; F407-T442 VanDerWaalsContact CE1-CG2 3.43Å; F407-T442 HydrophobicContact CZ-CG2 4.33Å; F407-L446 HydrophobicContact CB-CD1 4Å; F407-L446 HydrophobicContact CD2-CD2 3.81Å; F407-L446 HydrophobicContact CE2-CD2 4.27Å; F407-L446 HydrophobicContact CG-CD1 4.09Å; F407-L446 HydrophobicContact CG-CD2 4.19Å; F407-L451 HydrophobicContact CE1-CD1 4.25Å; F407-L451 HydrophobicContact CE2-CB 4.27Å; F407-L451 HydrophobicContact CE2-CD1 4.46Å; F407-L451 HydrophobicContact CZ-CB 4.45Å; F407-L451 HydrophobicContact CZ-CD1 3.85Å; F407-L451 HydrophobicContact CZ-CD2 4.38Å; F407-L451 HydrophobicContact CZ-CG 4.46Å; F407-L452 WeakPolarHBondContact CD2-O 3.31Å; F407-L452 WeakPolarHBondContact CE2-O 3.3Å
408	K	92.4	Very high	90.3	Very high	75 Å²	75	58 Å²	58	33%	0.326	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.6	170.4	56.3	-176.7	179.2	176.1	0	110.5	T410 K411 T454	K408-T410 WeakPolarHBondContact CD-O 3.36Å; K408-T410 WeakPolarHBondContact CG-O 3.39Å; K408-K411 WeakPolarHBondContact CE-O 3.31Å; K408-K411 PolarHBondContact NZ-O 2.92Å; K408-T454 HydrophobicContact CG-CG2 4.15Å; K408-T454 PolarHBondContact N-OG1 3.33Å
409	Y	86.9	Confident	90.5	Very high	130 Å²	130	58.5 Å²	58.5	51%	0.51	31%	0.305	S	S	.	.	S	Bend	trans	-70.6	-36.9	179.2	-82.7	-74.4	0	0	0	113.1	F407 I416 T442 L451	F407-Y409 HydrophobicContact CE1-CD1 4.05Å; F407-Y409 HydrophobicContact CE1-CD2 4.02Å; F407-Y409 HydrophobicContact CE1-CE1 4.02Å; F407-Y409 AromaticContact CE1-CE2 3.99Å; F407-Y409 HydrophobicContact CE1-CE2 3.99Å; F407-Y409 HydrophobicContact CE1-CG 4.05Å; F407-Y409 AromaticContact CE1-CZ 3.99Å; F407-Y409 HydrophobicContact CZ-CD1 4.1Å; F407-Y409 HydrophobicContact CZ-CE1 4.18Å; F407-Y409 HydrophobicContact CZ-CG 4.43Å; Y409-I416 HydrophobicContact CD2-CD1 4.17Å; Y409-I416 HydrophobicContact CD2-CG1 3.84Å; Y409-I416 HydrophobicContact CE2-CD1 4.3Å; Y409-I416 HydrophobicContact CE2-CG1 3.99Å; Y409-T442 HydrophobicContact CE2-CG2 4.17Å; Y409-T442 WeakPolarHBondContact OH-CG2 3.49Å; Y409-T442 PolarHBondContact OH-OG1 2.78Å; Y409-L451 HydrophobicContact CE1-CD1 4.41Å
410	T	87.3	Confident	90.5	Very high	87 Å²	87	58.6 Å²	58.6	53%	0.534	31%	0.306	S	S	.	.	S	Bend	trans	-129.8	156.1	178.8	56.8	0	0	0	0	109.4	K408 D412 G413	K408-T410 WeakPolarHBondContact CD-O 3.36Å; K408-T410 WeakPolarHBondContact CG-O 3.39Å; T410-D412 VanDerWaalsContact C-N 3.26Å; T410-D412 PolarHBondContact O-N 2.85Å; T410-G413 PolarHBondContact O-N 3.33Å; T410-G413 VanDerWaalsContact O-N 3.13Å; T410-G413 WeakPolarHBondContact OG1-CA 2.95Å; T410-G413 PolarHBondContact OG1-N 3.3Å; T410-G413 VanDerWaalsContact OG1-N 3.12Å
411	K	79.9	Confident	90.5	Very high	178 Å²	178	64.3 Å²	64.3	77%	0.774	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-39.3	-176.4	-72.2	-175.9	177.9	-179.9	0	112.7	K408	K408-K411 WeakPolarHBondContact CE-O 3.31Å; K408-K411 PolarHBondContact NZ-O 2.92Å
412	D	81.9	Confident	90.4	Very high	165 Å²	165	63.2 Å²	63.2	88%	0.882	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	7.4	-179.8	-49.5	-52.2	0	0	0	112.5	T410	T410-D412 VanDerWaalsContact C-N 3.26Å; T410-D412 PolarHBondContact O-N 2.85Å
413	G	78.9	Confident	90.3	Very high	19 Å²	19	65 Å²	65	20%	0.196	35%	0.346	C	S	.	.	S	Bend	trans	-78.7	163.9	-179.9	0	0	0	0	0	112.8	T410 C415	T410-G413 PolarHBondContact O-N 3.33Å; T410-G413 VanDerWaalsContact O-N 3.13Å; T410-G413 WeakPolarHBondContact OG1-CA 2.95Å; T410-G413 PolarHBondContact OG1-N 3.3Å; T410-G413 VanDerWaalsContact OG1-N 3.12Å; G413-C415 PolarHBondContact O-N 3.02Å
414	P	84	Confident	90.2	Very high	103 Å²	103	62.2 Å²	62.2	67%	0.669	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-59.9	139.9	173.2	27.1	-33.9	0	0	0	110.3	I416	P414-I416 PolarHBondContact O-N 3.29Å
415	C	87.3	Confident	90.2	Very high	40 Å²	40	61.1 Å²	61.1	27%	0.27	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	128.2	171.8	-156.6	0	0	0	0	109	G413 Y417 Q593	G413-C415 PolarHBondContact O-N 3.02Å; C415-Y417 PolarHBondContact SG-O 3.17Å; C415-Q593 WeakPolarHBondContact O-CG 3.27Å; C415-Q593 PolarHBondContact O-NE2 2.87Å; C415-Q593 VanDerWaalsContact O-NE2 3.09Å
416	I	91	Very high	90.1	Very high	31 Å²	31	62.4 Å²	62.4	16%	0.159	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-42.5	174.1	-57.6	-59.7	0	0	0	109.4	F407 Y409 P414 Q593	F407-I416 HydrophobicContact CD1-CB 4.27Å; F407-I416 HydrophobicContact CD1-CG1 4.33Å; F407-I416 PolarHBondContact O-N 3.46Å; Y409-I416 HydrophobicContact CD2-CD1 4.17Å; Y409-I416 HydrophobicContact CD2-CG1 3.84Å; Y409-I416 HydrophobicContact CE2-CD1 4.3Å; Y409-I416 HydrophobicContact CE2-CG1 3.99Å; P414-I416 PolarHBondContact O-N 3.29Å; I416-Q593 VanDerWaalsContact O-CA 3.23Å; I416-Q593 WeakPolarHBondContact O-CA 3.37Å
417	Y	94.2	Very high	89.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.6	-179.3	-69.8	-52.3	0	0	0	111.4	S406 F407 C415 L420 G439 L443 L446 C590 Q593 I595	S406-Y417 CarbonylContact C-O 3.58Å; S406-Y417 WeakPolarHBondContact CA-O 3.39Å; S406-Y417 WeakPolarHBondContact CB-O 3.27Å; F407-Y417 PolarHBondContact N-O 3.13Å; F407-Y417 PolarHBondContact O-N 2.98Å; C415-Y417 PolarHBondContact SG-O 3.17Å; Y417-L420 HydrophobicContact CD1-CD1 3.63Å; Y417-L420 HydrophobicContact CD1-CD2 4.11Å; Y417-L420 HydrophobicContact CD1-CG 4.17Å; Y417-L420 HydrophobicContact CD2-CD1 3.83Å; Y417-L420 HydrophobicContact CE1-CD1 4.22Å; Y417-L420 HydrophobicContact CE2-CD1 4.39Å; Y417-L420 HydrophobicContact CG-CD1 3.41Å; Y417-L420 VanDerWaalsContact CG-CD1 3.41Å; Y417-L420 HydrophobicContact CG-CG 4.13Å; Y417-G439 PolarHBondContact OH-O 3.38Å; Y417-L443 HydrophobicContact CE2-CB 4.03Å; Y417-L443 HydrophobicContact CE2-CD1 4.34Å; Y417-L446 HydrophobicContact CD2-CD1 4.08Å; Y417-L446 HydrophobicContact CE2-CD1 4.41Å; Y417-C590 PolarHBondContact OH-SG 3.36Å; Y417-Q593 CarbonylContact C-O 3.59Å; Y417-Q593 WeakPolarHBondContact CA-O 3.4Å; Y417-I595 HydrophobicContact CE1-CD1 4.07Å; Y417-I595 HydrophobicContact CE1-CG1 3.95Å
418	N	92.8	Very high	89.9	Confident	94 Å²	94	67.6 Å²	67.6	50%	0.503	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	119.6	177.4	-167.6	17.4	0	0	0	110.1	L420 Q593	N418-L420 PolarHBondContact O-N 3.11Å; N418-Q593 PolarHBondContact N-O 2.72Å
419	N	92.7	Very high	90	Very high	81 Å²	81	65.5 Å²	65.5	43%	0.433	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.7	51.3	173.9	-154.9	61.2	0	0	0	115.3	N404 V405 S406	N404-N419 WeakPolarHBondContact CA-OD1 3.46Å; N404-N419 VanDerWaalsContact CB-OD1 3.27Å; N404-N419 WeakPolarHBondContact CB-OD1 3.48Å; N404-N419 PolarHBondContact OD1-ND2 2.93Å; N404-N419 PolarHBondContact OD1-OD1 3.5Å; V405-N419 PolarHBondContact O-N 3.42Å; S406-N419 PolarHBondContact OG-N 3.29Å
420	L	93.9	Very high	90.4	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	134	176.1	-66.1	179.8	0	0	0	111.9	V402 N404 V405 Y417 N418 F422 L443 I595	V402-L420 HydrophobicContact CG1-CB 4.19Å; N404-L420 PolarHBondContact N-O 3.39Å; N404-L420 VanDerWaalsContact N-O 3.09Å; V405-L420 HydrophobicContact CB-CB 4.28Å; V405-L420 PolarHBondContact N-O 3.33Å; V405-L420 PolarHBondContact O-N 2.95Å; Y417-L420 HydrophobicContact CD1-CD1 3.63Å; Y417-L420 HydrophobicContact CD1-CD2 4.11Å; Y417-L420 HydrophobicContact CD1-CG 4.17Å; Y417-L420 HydrophobicContact CD2-CD1 3.83Å; Y417-L420 HydrophobicContact CE1-CD1 4.22Å; Y417-L420 HydrophobicContact CE2-CD1 4.39Å; Y417-L420 HydrophobicContact CG-CD1 3.41Å; Y417-L420 VanDerWaalsContact CG-CD1 3.41Å; Y417-L420 HydrophobicContact CG-CG 4.13Å; N418-L420 PolarHBondContact O-N 3.11Å; L420-F422 HydrophobicContact CB-CE1 4.23Å; L420-F422 HydrophobicContact CD1-CE1 4.33Å; L420-L443 HydrophobicContact CD1-CD1 4.18Å; L420-I595 HydrophobicContact CD1-CD1 4Å; L420-I595 HydrophobicContact CD2-CB 4.21Å; L420-I595 HydrophobicContact CD2-CD1 4.21Å; L420-I595 HydrophobicContact CD2-CG1 4.06Å
421	E	94	Very high	90.8	Very high	120 Å²	120	55.1 Å²	55.1	56%	0.561	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	118.5	174.6	-64.8	-165.5	138.6	0	0	110.7	V402 N404	V402-E421 WeakPolarHBondContact O-CA 3.31Å; N404-E421 VanDerWaalsContact CG-OE1 3.31Å; N404-E421 PolarHBondContact ND2-OE1 2.62Å; N404-E421 PolarHBondContact OD1-OE1 2.72Å
422	F	94.1	Very high	91.4	Very high	35 Å²	35	46.8 Å²	46.8	15%	0.154	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	161.2	172.5	55.7	-94.5	0	0	0	111.4	V402 L420 I424 L443 L447 W588 I595	V402-F422 HydrophobicContact CB-CD1 4.37Å; V402-F422 HydrophobicContact CB-CD2 4.26Å; V402-F422 HydrophobicContact CB-CE1 4.22Å; V402-F422 HydrophobicContact CB-CE2 4.1Å; V402-F422 HydrophobicContact CB-CG 4.39Å; V402-F422 HydrophobicContact CB-CZ 4.08Å; V402-F422 HydrophobicContact CG1-CD1 4.49Å; V402-F422 HydrophobicContact CG1-CE1 4.08Å; V402-F422 HydrophobicContact CG1-CZ 4.19Å; V402-F422 HydrophobicContact CG2-CD2 4.03Å; V402-F422 HydrophobicContact CG2-CE1 4.3Å; V402-F422 HydrophobicContact CG2-CE2 3.5Å; V402-F422 VanDerWaalsContact CG2-CE2 3.5Å; V402-F422 HydrophobicContact CG2-CZ 3.66Å; V402-F422 PolarHBondContact N-O 3.27Å; V402-F422 PolarHBondContact O-N 2.77Å; L420-F422 HydrophobicContact CB-CE1 4.23Å; L420-F422 HydrophobicContact CD1-CE1 4.33Å; F422-I424 HydrophobicContact CD2-CD1 4.34Å; F422-I424 HydrophobicContact CD2-CG1 4.05Å; F422-I424 HydrophobicContact CE2-CD1 3.88Å; F422-I424 HydrophobicContact CE2-CG1 4.1Å; F422-L443 HydrophobicContact CE1-CD1 4.26Å; F422-L443 HydrophobicContact CZ-CD1 3.76Å; F422-L443 HydrophobicContact CZ-CD2 4.48Å; F422-L447 HydrophobicContact CE2-CD2 4.27Å; F422-L447 HydrophobicContact CZ-CD2 4.42Å; F422-W588 HydrophobicContact CB-CH2 4.03Å; F422-W588 HydrophobicContact CB-CZ3 4.44Å; F422-W588 HydrophobicContact CD1-CZ3 4.33Å; F422-W588 AromaticContact CD2-CH2 3.57Å; F422-W588 HydrophobicContact CD2-CH2 3.57Å; F422-W588 AromaticContact CD2-CZ3 3.58Å; F422-W588 HydrophobicContact CD2-CZ3 3.58Å; F422-W588 HydrophobicContact CE2-CH2 4.21Å; F422-W588 AromaticContact CE2-CZ3 3.79Å; F422-W588 HydrophobicContact CE2-CZ3 3.79Å; F422-W588 AromaticContact CG-CH2 3.88Å; F422-W588 HydrophobicContact CG-CH2 3.88Å; F422-W588 AromaticContact CG-CZ3 3.87Å; F422-W588 HydrophobicContact CG-CZ3 3.87Å; F422-W588 HydrophobicContact CZ-CZ3 4.25Å; F422-I595 HydrophobicContact CE1-CD1 4.05Å
423	G	93.1	Very high	91.9	Very high	43 Å²	43	39 Å²	39	44%	0.443	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	151.1	170.9	0	0	0	0	0	111.2	I400	I400-G423 CarbonylContact O-C 3.54Å; I400-G423 WeakPolarHBondContact O-CA 3.25Å
424	I	94	Very high	92.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.5	171.8	-55.8	170.5	0	0	0	107.4	V399 I400 F422 T428 L447 M541 M571 W588	V399-I424 WeakPolarHBondContact CB-O 3.19Å; V399-I424 PolarHBondContact N-O 2.9Å; I400-I424 HydrophobicContact CB-CB 4.27Å; I400-I424 PolarHBondContact N-O 3.27Å; I400-I424 PolarHBondContact O-N 3.05Å; F422-I424 HydrophobicContact CD2-CD1 4.34Å; F422-I424 HydrophobicContact CD2-CG1 4.05Å; F422-I424 HydrophobicContact CE2-CD1 3.88Å; F422-I424 HydrophobicContact CE2-CG1 4.1Å; I424-T428 HydrophobicContact CG2-CG2 3.98Å; I424-L447 HydrophobicContact CD1-CD1 3.88Å; I424-L447 HydrophobicContact CD1-CD2 4.48Å; I424-M541 HydrophobicContact CG2-CE 3.32Å; I424-M541 HydrophobicContact CG2-SD 4.35Å; I424-M571 HydrophobicContact CD1-CE 3.85Å; I424-M571 HydrophobicContact CD1-SD 3.64Å; I424-W588 HydrophobicContact CG1-CH2 4.29Å
425	D	93.3	Very high	92.4	Very high	49 Å²	49	35.3 Å²	35.3	26%	0.262	20%	0.197	S	C	.	.			trans	-120.1	175.8	177.9	-73	-40.9	0	0	0	111.4	P397 P398 V399 D427 T428	P397-D425 WeakPolarHBondContact CB-OD1 3.13Å; P398-D425 WeakPolarHBondContact CA-OD1 3.45Å; V399-D425 PolarHBondContact N-OD1 2.89Å; V399-D425 VanDerWaalsContact N-OD1 3.12Å; D425-D427 VanDerWaalsContact C-N 3.26Å; D425-D427 VanDerWaalsContact CB-OD1 3.29Å; D425-D427 WeakPolarHBondContact CB-OD1 3.2Å; D425-D427 PolarHBondContact O-N 3.06Å; D425-T428 PolarHBondContact N-OG1 2.87Å; D425-T428 VanDerWaalsContact O-CB 3.25Å; D425-T428 WeakPolarHBondContact O-CB 3.32Å; D425-T428 PolarHBondContact O-N 3.37Å; D425-T428 VanDerWaalsContact O-N 3.15Å; D425-T428 PolarHBondContact O-OG1 2.81Å
426	L	92.1	Very high	92.1	Very high	28 Å²	28	35.8 Å²	35.8	15%	0.147	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.7	-176.4	-66.7	-175.1	0	0	0	113.8	I395 V399 R429 H540 M541 G568 G569	I395-L426 HydrophobicContact CB-CD1 3.95Å; I395-L426 HydrophobicContact CB-CG 4.5Å; V399-L426 HydrophobicContact CG1-CD2 4.41Å; V399-L426 HydrophobicContact CG2-CD2 4.01Å; V399-L426 HydrophobicContact CG2-CG 3.83Å; L426-R429 PolarHBondContact O-NH1 2.61Å; L426-H540 HydrophobicContact CD2-CB 4.01Å; L426-H540 WeakPolarHBondContact CD2-O 3.3Å; L426-M541 HydrophobicContact CD2-SD 4.11Å; L426-G568 CarbonylContact O-C 3.06Å; L426-G569 WeakPolarHBondContact O-CA 3.5Å; L426-G569 PolarHBondContact O-N 2.96Å
427	D	90.7	Very high	91.6	Very high	115 Å²	115	37.9 Å²	37.9	62%	0.615	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.9	174.4	60.2	-14.6	0	0	0	112.7	D425 R429	D425-D427 VanDerWaalsContact C-N 3.26Å; D425-D427 VanDerWaalsContact CB-OD1 3.29Å; D425-D427 WeakPolarHBondContact CB-OD1 3.2Å; D425-D427 PolarHBondContact O-N 3.06Å; D427-R429 PolarHBondContact O-N 2.81Å
428	T	93	Very high	91.2	Very high	22 Å²	22	39 Å²	39	14%	0.135	24%	0.235	C	C	.	.			trans	-65.9	126.2	-179.2	-57.3	0	0	0	0	110.4	I424 D425 V430 G569 M570	I424-T428 HydrophobicContact CG2-CG2 3.98Å; D425-T428 PolarHBondContact N-OG1 2.87Å; D425-T428 VanDerWaalsContact O-CB 3.25Å; D425-T428 WeakPolarHBondContact O-CB 3.32Å; D425-T428 PolarHBondContact O-N 3.37Å; D425-T428 VanDerWaalsContact O-N 3.15Å; D425-T428 PolarHBondContact O-OG1 2.81Å; T428-V430 HydrophobicContact CG2-CB 4.43Å; T428-V430 HydrophobicContact CG2-CG2 3.43Å; T428-V430 VanDerWaalsContact CG2-CG2 3.43Å; T428-G569 WeakPolarHBondContact O-CA 3.39Å; T428-M570 PolarHBondContact O-N 3.44Å
429	R	94.7	Very high	90.9	Very high	31 Å²	31	34.7 Å²	34.7	12%	0.117	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	91.4	176.4	-64.3	-66.8	-178.4	-75.4	-0.1	109.2	L426 D427 F566 G568 Q585 E586	L426-R429 PolarHBondContact O-NH1 2.61Å; D427-R429 PolarHBondContact O-N 2.81Å; R429-F566 PolarHBondContact NH2-O 2.69Å; R429-G568 PolarHBondContact NH1-O 2.75Å; R429-G568 PolarHBondContact NH2-O 2.84Å; R429-Q585 HydrophobicContact CB-CB 4.1Å; R429-Q585 HydrophobicContact CB-CG 3.9Å; R429-Q585 HydrophobicContact CG-CG 4.35Å; R429-Q585 PolarHBondContact O-N 3.22Å; R429-E586 PolarHBondContact O-N 3.08Å
430	V	95.2	Very high	90.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134	-171.2	170.2	0	0	0	0	110.8	T428 M570 M571 L572 E586 W588	T428-V430 HydrophobicContact CG2-CB 4.43Å; T428-V430 HydrophobicContact CG2-CG2 3.43Å; T428-V430 VanDerWaalsContact CG2-CG2 3.43Å; V430-M570 PolarHBondContact N-O 2.83Å; V430-M571 HydrophobicContact CB-CG 4.35Å; V430-M571 CarbonylContact O-C 3.58Å; V430-M571 VanDerWaalsContact O-CA 3.29Å; V430-M571 WeakPolarHBondContact O-CA 3.47Å; V430-L572 PolarHBondContact O-N 3.04Å; V430-E586 CarbonylContact C-O 3.58Å; V430-E586 WeakPolarHBondContact CA-O 3.44Å; V430-E586 HydrophobicContact CG2-CB 4.1Å; V430-W588 HydrophobicContact CB-CD2 4.47Å; V430-W588 HydrophobicContact CG1-CB 3.77Å; V430-W588 HydrophobicContact CG1-CD2 3.51Å; V430-W588 HydrophobicContact CG1-CE3 3.95Å; V430-W588 HydrophobicContact CG1-CG 3.42Å; V430-W588 VanDerWaalsContact CG1-CG 3.42Å; V430-W588 HydrophobicContact CG2-CD2 4.11Å; V430-W588 HydrophobicContact CG2-CG 4.44Å; V430-W588 HydrophobicContact CG2-CZ2 3.88Å
431	A	95.6	Very high	90.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.9	160.2	0	0	0	0	0	110.4	L572 I580 A584 E586 I587 W588	A431-L572 CarbonylContact C-O 3.58Å; A431-L572 VanDerWaalsContact CA-O 3.25Å; A431-L572 WeakPolarHBondContact CA-O 3.4Å; A431-I580 HydrophobicContact CB-CB 4.4Å; A431-I580 HydrophobicContact CB-CG1 4.11Å; A431-I580 HydrophobicContact CB-CG2 3.55Å; A431-A584 HydrophobicContact CB-CB 3.59Å; A431-E586 PolarHBondContact N-O 3.12Å; A431-I587 HydrophobicContact CB-CD1 3.79Å; A431-I587 WeakPolarHBondContact O-CA 3.43Å; A431-W588 PolarHBondContact O-N 3.06Å
432	L	94	Very high	90.6	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.9	178.3	-175.3	70.6	0	0	0	109.6	K440 L443 L572 V573 W588 C590 I595	L432-K440 HydrophobicContact CD2-CB 3.82Å; L432-K440 HydrophobicContact CD2-CG 4.13Å; L432-K440 HydrophobicContact CG-CB 4.4Å; L432-K440 HydrophobicContact CG-CG 4.21Å; L432-L443 HydrophobicContact CD1-CD2 4.21Å; L432-L443 HydrophobicContact CD2-CB 4.43Å; L432-L443 HydrophobicContact CD2-CD2 3.69Å; L432-L572 PolarHBondContact N-O 3.4Å; L432-V573 HydrophobicContact CB-CG2 4.05Å; L432-V573 HydrophobicContact CD2-CG2 4.07Å; L432-W588 WeakPolarHBondContact CA-O 3.24Å; L432-W588 HydrophobicContact CD1-CB 4.03Å; L432-C590 HydrophobicContact CD1-CB 4.04Å; L432-C590 HydrophobicContact CG-CB 4.47Å; L432-I595 HydrophobicContact CD1-CG2 4.31Å
433	V	92.3	Very high	90.6	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	160.5	-176.8	-58.7	0	0	0	0	111.3	L265 I580 I587 W588 V589 C590 I602 Y605	L265-V433 HydrophobicContact CD1-CB 3.68Å; L265-V433 HydrophobicContact CD1-CG1 3.4Å; L265-V433 VanDerWaalsContact CD1-CG1 3.4Å; V433-I580 HydrophobicContact CG1-CD1 4.42Å; V433-I587 HydrophobicContact CB-CG2 4.43Å; V433-I587 HydrophobicContact CG1-CG2 4.02Å; V433-I587 HydrophobicContact CG2-CG2 3.51Å; V433-W588 WeakPolarHBondContact CG2-O 3.42Å; V433-W588 PolarHBondContact N-O 3.5Å; V433-V589 HydrophobicContact CG2-CB 4.34Å; V433-V589 HydrophobicContact CG2-CG2 3.79Å; V433-C590 WeakPolarHBondContact O-CB 3.46Å; V433-C590 PolarHBondContact O-N 3.46Å; V433-I602 HydrophobicContact CG1-CD1 4.26Å; V433-Y605 HydrophobicContact CB-CE1 4.23Å; V433-Y605 HydrophobicContact CG2-CD1 4.41Å; V433-Y605 HydrophobicContact CG2-CE1 3.84Å; V433-Y605 HydrophobicContact CG2-CE2 4.39Å
434	G	87.8	Confident	90.6	Very high	2 Å²	2	24.7 Å²	24.7	2%	0.021	16%	0.159	C	C	.	.			trans	145.2	171.5	177.7	0	0	0	0	0	112.2	K440	G434-K440 PolarHBondContact O-NZ 3Å
435	P	84.7	Confident	90.6	Very high	44 Å²	44	28.2 Å²	28.2	29%	0.286	17%	0.174	S	C	.	.			trans	-66.2	161.6	-174.6	24.1	-31.4	0	0	0	112.2	A438 K440 E591	P435-A438 HydrophobicContact CG-CB 4.11Å; P435-A438 WeakPolarHBondContact O-CB 3.17Å; P435-A438 PolarHBondContact O-N 3.03Å; P435-K440 PolarHBondContact O-NZ 2.84Å; P435-E591 HydrophobicContact CG-CG 4.4Å
436	N	82	Confident	90.7	Very high	49 Å²	49	26.1 Å²	26.1	26%	0.262	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	136	175	-81.1	-3.5	0	0	0	111.9	W237 R240 H262 D264 A438 K440	W237-N436 HydrophobicContact CZ2-CB 4.29Å; R240-N436 PolarHBondContact NH2-ND2 3.41Å; H262-N436 PolarHBondContact O-ND2 3.37Å; D264-N436 WeakPolarHBondContact OD2-CB 3.43Å; D264-N436 PolarHBondContact OD2-N 3.08Å; N436-A438 VanDerWaalsContact C-N 3.34Å; N436-K440 PolarHBondContact OD1-NZ 3.08Å
437	G	79.1	Confident	90.8	Very high	75 Å²	75	24.8 Å²	24.8	77%	0.773	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.3	-1.1	-172.1	0	0	0	0	0	115.2	G439	G437-G439 PolarHBondContact O-N 3.19Å; G437-G439 VanDerWaalsContact O-N 3.16Å
438	A	85.8	Confident	90.9	Very high	23 Å²	23	20.7 Å²	20.7	19%	0.19	14%	0.135	C	C	.	.	S	Bend	trans	-66.2	-13.8	178.5	0	0	0	0	0	115	P435 N436 C590	P435-A438 HydrophobicContact CG-CB 4.11Å; P435-A438 WeakPolarHBondContact O-CB 3.17Å; P435-A438 PolarHBondContact O-N 3.03Å; N436-A438 VanDerWaalsContact C-N 3.34Å; A438-C590 HydrophobicContact CB-CB 4.43Å; A438-C590 VanDerWaalsContact CB-O 3.26Å; A438-C590 WeakPolarHBondContact CB-O 3.26Å; A438-C590 PolarHBondContact O-SG 2.75Å
439	G	87.3	Confident	90.8	Very high	5 Å²	5	21.6 Å²	21.6	5%	0.052	15%	0.149	C	C	.	.	S	Bend	trans	109.4	6.1	179.9	0	0	0	0	0	115.4	Y417 G437 S441 T442 L443	Y417-G439 PolarHBondContact OH-O 3.38Å; G437-G439 PolarHBondContact O-N 3.19Å; G437-G439 VanDerWaalsContact O-N 3.16Å; G439-S441 PolarHBondContact O-N 3.47Å; G439-T442 CarbonylContact O-C 3.55Å; G439-T442 VanDerWaalsContact O-CA 3.27Å; G439-T442 WeakPolarHBondContact O-CA 3.36Å; G439-T442 WeakPolarHBondContact O-CB 3.3Å; G439-T442 PolarHBondContact O-N 2.61Å; G439-L443 PolarHBondContact O-N 3.07Å
440	K	91.1	Very high	90.7	Very high	13 Å²	13	25.5 Å²	25.5	6%	0.057	17%	0.169	C	C	.	.	H	α-helix	trans	-48.5	-56.8	-177.2	-57	-173	-63.2	-88.9	0	113.6	L432 G434 P435 N436 T442 L443 L444 V573 C590	L432-K440 HydrophobicContact CD2-CB 3.82Å; L432-K440 HydrophobicContact CD2-CG 4.13Å; L432-K440 HydrophobicContact CG-CB 4.4Å; L432-K440 HydrophobicContact CG-CG 4.21Å; G434-K440 PolarHBondContact O-NZ 3Å; P435-K440 PolarHBondContact O-NZ 2.84Å; N436-K440 PolarHBondContact OD1-NZ 3.08Å; K440-T442 VanDerWaalsContact C-N 3.26Å; K440-T442 PolarHBondContact O-N 2.86Å; K440-L443 WeakPolarHBondContact O-CB 3.37Å; K440-L443 PolarHBondContact O-N 3.33Å; K440-L444 PolarHBondContact O-N 3.09Å; K440-V573 HydrophobicContact CB-CG1 4.18Å; K440-V573 HydrophobicContact CB-CG2 4.23Å; K440-V573 HydrophobicContact CD-CG1 3.92Å; K440-C590 HydrophobicContact CG-CB 4.18Å
441	S	90.5	Very high	90.6	Very high	47 Å²	47	27.6 Å²	27.6	33%	0.329	18%	0.179	S	C	.	.	H	α-helix	trans	-66.1	-28.7	175.9	-48.6	0	0	0	0	112.8	G439 L444 K445 D545	G439-S441 PolarHBondContact O-N 3.47Å; S441-L444 PolarHBondContact O-N 3.01Å; S441-K445 WeakPolarHBondContact O-CG 3.43Å; S441-K445 PolarHBondContact O-N 2.78Å; S441-D545 WeakPolarHBondContact CB-OD2 3.38Å; S441-D545 PolarHBondContact OG-OD1 3.43Å; S441-D545 PolarHBondContact OG-OD2 3.27Å
442	T	91.9	Very high	90.5	Very high	10 Å²	10	34.4 Å²	34.4	6%	0.061	22%	0.215	C	C	.	.	H	α-helix	trans	-65.5	-41	174.5	-46.3	0	0	0	0	110.9	F407 Y409 G439 K440 K445 L446 L451	F407-T442 HydrophobicContact CD1-CG2 3.57Å; F407-T442 HydrophobicContact CE1-CG2 3.43Å; F407-T442 VanDerWaalsContact CE1-CG2 3.43Å; F407-T442 HydrophobicContact CZ-CG2 4.33Å; Y409-T442 HydrophobicContact CE2-CG2 4.17Å; Y409-T442 WeakPolarHBondContact OH-CG2 3.49Å; Y409-T442 PolarHBondContact OH-OG1 2.78Å; G439-T442 CarbonylContact O-C 3.55Å; G439-T442 VanDerWaalsContact O-CA 3.27Å; G439-T442 WeakPolarHBondContact O-CA 3.36Å; G439-T442 WeakPolarHBondContact O-CB 3.3Å; G439-T442 PolarHBondContact O-N 2.61Å; K440-T442 VanDerWaalsContact C-N 3.26Å; K440-T442 PolarHBondContact O-N 2.86Å; T442-K445 WeakPolarHBondContact O-CB 3.21Å; T442-K445 PolarHBondContact O-N 3.05Å; T442-L446 HydrophobicContact CG2-CD1 4.4Å; T442-L446 WeakPolarHBondContact O-CG 3.37Å; T442-L446 PolarHBondContact O-N 3.36Å; T442-L451 HydrophobicContact CG2-CD1 3.83Å
443	L	94.1	Very high	90.5	Very high	3 Å²	3	36 Å²	36	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-48.8	173.7	-175.8	69.1	0	0	0	111	Y417 L420 F422 L432 G439 K440 K445 L446 L447 I595	Y417-L443 HydrophobicContact CE2-CB 4.03Å; Y417-L443 HydrophobicContact CE2-CD1 4.34Å; L420-L443 HydrophobicContact CD1-CD1 4.18Å; F422-L443 HydrophobicContact CE1-CD1 4.26Å; F422-L443 HydrophobicContact CZ-CD1 3.76Å; F422-L443 HydrophobicContact CZ-CD2 4.48Å; L432-L443 HydrophobicContact CD1-CD2 4.21Å; L432-L443 HydrophobicContact CD2-CB 4.43Å; L432-L443 HydrophobicContact CD2-CD2 3.69Å; G439-L443 PolarHBondContact O-N 3.07Å; K440-L443 WeakPolarHBondContact O-CB 3.37Å; K440-L443 PolarHBondContact O-N 3.33Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.33Å; L443-L446 WeakPolarHBondContact O-CB 3.44Å; L443-L446 PolarHBondContact O-N 3.19Å; L443-L446 VanDerWaalsContact O-N 3.12Å; L443-L447 HydrophobicContact CD1-CD1 4.33Å; L443-L447 HydrophobicContact CD2-CD1 4.43Å; L443-L447 HydrophobicContact CG-CD1 3.94Å; L443-L447 HydrophobicContact CG-CG 4.47Å; L443-L447 VanDerWaalsContact O-CG 3.31Å; L443-L447 WeakPolarHBondContact O-CG 3.36Å; L443-L447 PolarHBondContact O-N 2.83Å; L443-I595 HydrophobicContact CD1-CD1 3.65Å; L443-I595 HydrophobicContact CD2-CD1 3.38Å; L443-I595 HydrophobicContact CG-CD1 4.04Å
444	L	94.5	Very high	90.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.2	-41.8	178	-61	-176.2	0	0	0	111.4	K440 S441 L447 T448 F543 D545 M571 V573	K440-L444 PolarHBondContact O-N 3.09Å; S441-L444 PolarHBondContact O-N 3.01Å; L444-L447 PolarHBondContact O-N 2.89Å; L444-T448 WeakPolarHBondContact O-CG2 3.47Å; L444-T448 PolarHBondContact O-N 2.91Å; L444-T448 PolarHBondContact O-OG1 3.07Å; L444-F543 HydrophobicContact CD2-CB 4.1Å; L444-F543 HydrophobicContact CD2-CD1 4.5Å; L444-F543 HydrophobicContact CD2-CD2 4.2Å; L444-F543 HydrophobicContact CD2-CG 4.03Å; L444-D545 HydrophobicContact CD1-CB 3.79Å; L444-M571 HydrophobicContact CD2-CB 4.39Å; L444-M571 HydrophobicContact CD2-CE 3.51Å; L444-V573 HydrophobicContact CD1-CG2 3.92Å
445	K	93.6	Very high	90.8	Very high	74 Å²	74	44.9 Å²	44.9	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-40	175.1	-74	176.4	179	-173.2	0	113.4	S441 T442 L443 L447 T448 G449 E450 L451	S441-K445 WeakPolarHBondContact O-CG 3.43Å; S441-K445 PolarHBondContact O-N 2.78Å; T442-K445 WeakPolarHBondContact O-CB 3.21Å; T442-K445 PolarHBondContact O-N 3.05Å; L443-K445 VanDerWaalsContact C-N 3.27Å; L443-K445 PolarHBondContact O-N 3.33Å; K445-L447 VanDerWaalsContact C-N 3.33Å; K445-T448 PolarHBondContact O-OG1 3.43Å; K445-G449 PolarHBondContact O-N 3Å; K445-E450 HydrophobicContact CB-CB 4.28Å; K445-E450 PolarHBondContact O-N 3.03Å; K445-L451 HydrophobicContact CB-CB 4.33Å; K445-L451 HydrophobicContact CB-CD1 3.64Å; K445-L451 HydrophobicContact CB-CG 3.82Å; K445-L451 HydrophobicContact CD-CD1 3.89Å; K445-L451 HydrophobicContact CD-CG 4.33Å; K445-L451 HydrophobicContact CG-CD1 4.38Å; K445-L451 PolarHBondContact O-N 3.2Å
446	L	94.4	Very high	91.2	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-42.3	175.7	-75.2	166.5	0	0	0	110.7	F407 Y417 T442 L443 G449 L451 I458	F407-L446 HydrophobicContact CB-CD1 4Å; F407-L446 HydrophobicContact CD2-CD2 3.81Å; F407-L446 HydrophobicContact CE2-CD2 4.27Å; F407-L446 HydrophobicContact CG-CD1 4.09Å; F407-L446 HydrophobicContact CG-CD2 4.19Å; Y417-L446 HydrophobicContact CD2-CD1 4.08Å; Y417-L446 HydrophobicContact CE2-CD1 4.41Å; T442-L446 HydrophobicContact CG2-CD1 4.4Å; T442-L446 WeakPolarHBondContact O-CG 3.37Å; T442-L446 PolarHBondContact O-N 3.36Å; L443-L446 WeakPolarHBondContact O-CB 3.44Å; L443-L446 PolarHBondContact O-N 3.19Å; L443-L446 VanDerWaalsContact O-N 3.12Å; L446-G449 PolarHBondContact O-N 3.14Å; L446-L451 HydrophobicContact CD2-CB 3.78Å; L446-L451 HydrophobicContact CG-CB 4.17Å; L446-I458 HydrophobicContact CB-CD1 3.84Å; L446-I458 WeakPolarHBondContact O-CD1 3.35Å
447	L	94.2	Very high	91.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-73.4	-34.1	179.9	-61.9	170.3	0	0	0	112.5	I400 V402 F422 I424 L443 L444 K445 G449 I458 K460 F543 M571	I400-L447 HydrophobicContact CG2-CD2 3.87Å; V402-L447 HydrophobicContact CG2-CD2 3.52Å; F422-L447 HydrophobicContact CE2-CD2 4.27Å; F422-L447 HydrophobicContact CZ-CD2 4.42Å; I424-L447 HydrophobicContact CD1-CD1 3.88Å; I424-L447 HydrophobicContact CD1-CD2 4.48Å; L443-L447 HydrophobicContact CD1-CD1 4.33Å; L443-L447 HydrophobicContact CD2-CD1 4.43Å; L443-L447 HydrophobicContact CG-CD1 3.94Å; L443-L447 HydrophobicContact CG-CG 4.47Å; L443-L447 VanDerWaalsContact O-CG 3.31Å; L443-L447 WeakPolarHBondContact O-CG 3.36Å; L443-L447 PolarHBondContact O-N 2.83Å; L444-L447 PolarHBondContact O-N 2.89Å; K445-L447 VanDerWaalsContact C-N 3.33Å; L447-G449 PolarHBondContact O-N 2.92Å; L447-I458 HydrophobicContact CD2-CG2 4.29Å; L447-K460 VanDerWaalsContact O-CD 3.24Å; L447-K460 WeakPolarHBondContact O-CD 3.48Å; L447-K460 PolarHBondContact O-NZ 3.36Å; L447-F543 HydrophobicContact CB-CE2 3.67Å; L447-F543 HydrophobicContact CB-CZ 4.08Å; L447-F543 HydrophobicContact CD1-CE2 4.46Å; L447-F543 HydrophobicContact CD1-CZ 4.32Å; L447-M571 HydrophobicContact CD1-CE 3.14Å; L447-M571 HydrophobicContact CD1-SD 4.33Å
448	T	92.9	Very high	92.6	Very high	29 Å²	29	44.5 Å²	44.5	18%	0.178	26%	0.258	C	S	.	.	H	α-helix	trans	-70.7	-22.1	170.5	58.5	0	0	0	0	112.4	L444 K445 E450 K460 I466 R468 F543	L444-T448 WeakPolarHBondContact O-CG2 3.47Å; L444-T448 PolarHBondContact O-N 2.91Å; L444-T448 PolarHBondContact O-OG1 3.07Å; K445-T448 PolarHBondContact O-OG1 3.43Å; T448-E450 PolarHBondContact OG1-OE1 3.41Å; T448-K460 VanDerWaalsContact C-NZ 3.32Å; T448-K460 PolarHBondContact O-NZ 3.41Å; T448-I466 HydrophobicContact CG2-CG2 4.07Å; T448-R468 HydrophobicContact CG2-CB 4.31Å; T448-F543 HydrophobicContact CG2-CD2 3.89Å; T448-F543 HydrophobicContact CG2-CE2 4.2Å
449	G	91.9	Very high	93	Very high	42 Å²	42	51 Å²	51	43%	0.433	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	13.1	-177.6	0	0	0	0	0	113.7	K445 L446 L447 L451	K445-G449 PolarHBondContact O-N 3Å; L446-G449 PolarHBondContact O-N 3.14Å; L447-G449 PolarHBondContact O-N 2.92Å; G449-L451 VanDerWaalsContact C-N 3.27Å
450	E	91.5	Very high	93.4	Very high	113 Å²	113	54.9 Å²	54.9	53%	0.528	29%	0.294	S	S	.	.	S	Bend	trans	-69.8	-28.3	170.7	-73.8	163.9	-127.4	0	0	112	K445 T448 R468	K445-E450 HydrophobicContact CB-CB 4.28Å; K445-E450 PolarHBondContact O-N 3.03Å; T448-E450 PolarHBondContact OG1-OE1 3.41Å; E450-R468 IonicContact OE1-CZ 2.75Å; E450-R468 IonicContact OE1-NH1 3.57Å; E450-R468 PolarHBondContact OE1-NH1 3.08Å; E450-R468 IonicContact OE2-CZ 3.61Å; E450-R468 IonicContact OE2-NH1 2.73Å; E450-R468 PolarHBondContact OE2-NH1 3.14Å
451	L	93.4	Very high	93.5	Very high	43 Å²	43	56.7 Å²	56.7	23%	0.225	30%	0.302	C	S	.	.	S	Bend	trans	-116	141.9	171.4	-66.1	176.2	0	0	0	109.2	F407 Y409 T442 K445 L446 G449	F407-L451 HydrophobicContact CE1-CD1 4.25Å; F407-L451 HydrophobicContact CE2-CB 4.27Å; F407-L451 HydrophobicContact CE2-CD1 4.46Å; F407-L451 HydrophobicContact CZ-CB 4.45Å; F407-L451 HydrophobicContact CZ-CD1 3.85Å; F407-L451 HydrophobicContact CZ-CD2 4.38Å; F407-L451 HydrophobicContact CZ-CG 4.46Å; Y409-L451 HydrophobicContact CE1-CD1 4.41Å; T442-L451 HydrophobicContact CG2-CD1 3.83Å; K445-L451 HydrophobicContact CB-CB 4.33Å; K445-L451 HydrophobicContact CB-CD1 3.64Å; K445-L451 HydrophobicContact CB-CG 3.82Å; K445-L451 HydrophobicContact CD-CD1 3.89Å; K445-L451 HydrophobicContact CD-CG 4.33Å; K445-L451 HydrophobicContact CG-CD1 4.38Å; K445-L451 PolarHBondContact O-N 3.2Å; L446-L451 HydrophobicContact CD2-CB 3.78Å; L446-L451 HydrophobicContact CG-CB 4.17Å; G449-L451 VanDerWaalsContact C-N 3.27Å
452	L	93.3	Very high	93.5	Very high	143 Å²	143	59.3 Å²	59.3	75%	0.749	32%	0.32	S	S	*	.			trans	-95.1	138.4	172.2	-66	173	0	0	0	109.6	F407	F407-L452 WeakPolarHBondContact CD2-O 3.31Å; F407-L452 WeakPolarHBondContact CE2-O 3.3Å
453	P	93.9	Very high	93.5	Very high	36 Å²	36	65.2 Å²	65.2	23%	0.234	35%	0.347	C	S	.	.			trans	-63.5	149.1	173.9	30.7	-36.2	0	0	0	110.2	V405 D455	V405-P453 HydrophobicContact CG1-CB 3.76Å; V405-P453 HydrophobicContact CG2-CB 4.29Å; P453-D455 WeakPolarHBondContact CB-O 3.41Å
454	T	93.5	Very high	93.4	Very high	78 Å²	78	66.2 Å²	66.2	48%	0.479	35%	0.353	S	S	.	.	S	Bend	trans	-76.5	-35.1	174.7	-52.6	0	0	0	0	111.3	S406 K408	S406-T454 WeakPolarHBondContact O-CB 3.4Å; S406-T454 PolarHBondContact O-N 3.37Å; K408-T454 HydrophobicContact CG-CG2 4.15Å; K408-T454 PolarHBondContact N-OG1 3.33Å
455	D	93.7	Very high	93.4	Very high	111 Å²	111	71.6 Å²	71.6	59%	0.594	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.9	173.3	-163.5	5.9	0	0	0	109.2	V405 S406 P453	V405-D455 VanDerWaalsContact CA-O 3.31Å; V405-D455 WeakPolarHBondContact CA-O 3.26Å; S406-D455 PolarHBondContact N-O 3.23Å; S406-D455 PolarHBondContact O-N 2.95Å; P453-D455 WeakPolarHBondContact CB-O 3.41Å
456	G	93.1	Very high	93.4	Very high	31 Å²	31	69.8 Å²	69.8	32%	0.32	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	78.9	-170.3	-175.1	0	0	0	0	0	114.1	Q403 N404	Q403-G456 VanDerWaalsContact O-CA 3.32Å; Q403-G456 WeakPolarHBondContact O-CA 3.36Å; N404-G456 VanDerWaalsContact O-CA 3.31Å; N404-G456 WeakPolarHBondContact O-CA 3.46Å
457	M	94.4	Very high	93.4	Very high	90 Å²	90	69.6 Å²	69.6	44%	0.443	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146.1	-177.5	64.1	177.6	171.8	0	0	113.5	Q403 V405 R459	Q403-M457 HydrophobicContact CB-CG 4.28Å; Q403-M457 PolarHBondContact N-O 3.06Å; Q403-M457 PolarHBondContact O-N 3.02Å; V405-M457 WeakPolarHBondContact CG2-O 3.19Å; M457-R459 HydrophobicContact SD-CG 4.27Å
458	I	95.7	Very high	93.3	Very high	39 Å²	39	70.7 Å²	70.7	20%	0.2	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.9	171.7	-57.7	175.5	0	0	0	107.5	I400 M401 V402 V405 L446 L447 K460	I400-I458 HydrophobicContact CG2-CG2 3.96Å; M401-I458 CarbonylContact O-C 3.55Å; M401-I458 WeakPolarHBondContact O-CA 3.3Å; V402-I458 HydrophobicContact CG1-CG1 4.46Å; V402-I458 HydrophobicContact CG2-CG1 4.35Å; V402-I458 HydrophobicContact CG2-CG2 4.39Å; V405-I458 HydrophobicContact CG2-CD1 4.44Å; V405-I458 HydrophobicContact CG2-CG1 3.74Å; L446-I458 HydrophobicContact CB-CD1 3.84Å; L446-I458 WeakPolarHBondContact O-CD1 3.35Å; L447-I458 HydrophobicContact CD2-CG2 4.29Å; I458-K460 HydrophobicContact CG2-CG 4.32Å
459	R	94.4	Very high	93.3	Very high	160 Å²	160	69.4 Å²	69.4	60%	0.604	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.3	177.9	-61.1	-178.9	75.4	166.3	3.4	109.1	I400 M401 M457	I400-R459 CarbonylContact C-O 3.42Å; I400-R459 WeakPolarHBondContact CA-O 3.44Å; M401-R459 HydrophobicContact CB-CB 4.48Å; M401-R459 PolarHBondContact N-O 3.5Å; M401-R459 PolarHBondContact O-N 2.87Å; M457-R459 HydrophobicContact SD-CG 4.27Å
460	K	94.6	Very high	93.1	Very high	87 Å²	87	68.9 Å²	68.9	38%	0.378	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.8	177.9	-60.6	-175.4	-68.3	-171.5	0	109.5	V399 I400 L447 T448 I458 S462 V464 I466	V399-K460 WeakPolarHBondContact O-CA 3.35Å; I400-K460 HydrophobicContact CG1-CG 4.24Å; I400-K460 HydrophobicContact CG2-CG 4.2Å; L447-K460 VanDerWaalsContact O-CD 3.24Å; L447-K460 WeakPolarHBondContact O-CD 3.48Å; L447-K460 PolarHBondContact O-NZ 3.36Å; T448-K460 VanDerWaalsContact C-NZ 3.32Å; T448-K460 PolarHBondContact O-NZ 3.41Å; I458-K460 HydrophobicContact CG2-CG 4.32Å; K460-S462 PolarHBondContact O-N 3.09Å; K460-V464 HydrophobicContact CB-CG1 4.15Å; K460-I466 HydrophobicContact CD-CD1 4.19Å
461	H	93.9	Very high	92.4	Very high	51 Å²	51	67 Å²	67	24%	0.236	34%	0.343	C	S	.	.			trans	-61.1	136.4	170.7	-171.9	-88	0	0	0	110.3	I395 V399 H463 V464	I395-H461 HydrophobicContact CG2-CB 3.98Å; I395-H461 WeakPolarHBondContact CG2-ND1 3.47Å; V399-H461 PolarHBondContact O-N 3.28Å; H461-H463 AromaticContact CE1-CD2 3.76Å; H461-H463 PolarHBondContact ND1-N 2.88Å; H461-H463 PolarHBondContact O-N 3.09Å; H461-H463 VanDerWaalsContact O-N 3.13Å; H461-V464 HydrophobicContact CB-CB 4.42Å; H461-V464 WeakPolarHBondContact O-CG1 3.43Å; H461-V464 PolarHBondContact O-N 3.36Å; H461-V464 VanDerWaalsContact O-N 3.09Å
462	S	91.5	Very high	91.7	Very high	101 Å²	101	70 Å²	70	71%	0.706	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.4	-172	52.9	0	0	0	0	114.3	K460	K460-S462 PolarHBondContact O-N 3.09Å
463	H	91.2	Very high	91	Very high	135 Å²	135	63.4 Å²	63.4	63%	0.625	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	3.3	-178.2	-60.1	-63.6	0	0	0	114.1	H461 K465 H540	H461-H463 AromaticContact CE1-CD2 3.76Å; H461-H463 PolarHBondContact ND1-N 2.88Å; H461-H463 PolarHBondContact O-N 3.09Å; H461-H463 VanDerWaalsContact O-N 3.13Å; H463-K465 PolarHBondContact O-N 3.4Å; H463-H540 PolarHBondContact O-CE1 3.42Å
464	V	92.9	Very high	90.2	Very high	23 Å²	23	62.9 Å²	62.9	14%	0.139	32%	0.315	C	S	.	.			trans	-66.4	133.1	178.2	76.3	0	0	0	0	110.4	I395 V399 K460 H461 I466 H540 M541	I395-V464 HydrophobicContact CD1-CB 4.04Å; I395-V464 HydrophobicContact CD1-CG2 4.13Å; V399-V464 HydrophobicContact CG1-CB 4.13Å; V399-V464 HydrophobicContact CG1-CG2 3.46Å; V399-V464 VanDerWaalsContact CG1-CG2 3.46Å; K460-V464 HydrophobicContact CB-CG1 4.15Å; H461-V464 HydrophobicContact CB-CB 4.42Å; H461-V464 WeakPolarHBondContact O-CG1 3.43Å; H461-V464 PolarHBondContact O-N 3.36Å; H461-V464 VanDerWaalsContact O-N 3.09Å; V464-I466 HydrophobicContact CG1-CD1 4.49Å; V464-I466 HydrophobicContact CG1-CG1 4.33Å; V464-I466 HydrophobicContact CG2-CG1 4.25Å; V464-H540 HydrophobicContact CG2-CB 4.21Å; V464-M541 HydrophobicContact CG2-CG 3.84Å
465	K	93.3	Very high	89.4	Confident	113 Å²	113	66.1 Å²	66.1	49%	0.491	33%	0.325	S	S	.	.			trans	-110	122.9	171.1	-62.3	178.1	-179.7	178.2	0	107.5	H463 H540 M541	H463-K465 PolarHBondContact O-N 3.4Å; K465-H540 WeakPolarHBondContact CB-ND1 3.1Å; K465-H540 PolarHBondContact N-ND1 3.29Å; K465-H540 PolarHBondContact O-N 2.71Å; K465-M541 PolarHBondContact O-N 3.26Å; K465-M541 VanDerWaalsContact O-N 3.08Å
466	I	94.1	Very high	88.8	Confident	36 Å²	36	66.7 Å²	66.7	19%	0.185	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.3	-179.6	-54.2	177.9	0	0	0	107.2	I400 T448 K460 V464 M541 F543	I400-I466 HydrophobicContact CD1-CD1 3.9Å; T448-I466 HydrophobicContact CG2-CG2 4.07Å; K460-I466 HydrophobicContact CD-CD1 4.19Å; V464-I466 HydrophobicContact CG1-CD1 4.49Å; V464-I466 HydrophobicContact CG1-CG1 4.33Å; V464-I466 HydrophobicContact CG2-CG1 4.25Å; I466-M541 CarbonylContact C-O 3.58Å; I466-M541 WeakPolarHBondContact CA-O 3.26Å; I466-M541 HydrophobicContact CB-CB 4.46Å; I466-M541 HydrophobicContact CG1-CB 4.14Å; I466-M541 HydrophobicContact CG2-CB 4.28Å; I466-F543 HydrophobicContact CD1-CE2 4.16Å; I466-F543 HydrophobicContact CD1-CZ 4.43Å; I466-F543 HydrophobicContact CG2-CD1 4.45Å; I466-F543 HydrophobicContact CG2-CD2 3.45Å; I466-F543 VanDerWaalsContact CG2-CD2 3.45Å; I466-F543 HydrophobicContact CG2-CE2 3.53Å; I466-F543 HydrophobicContact CG2-CG 3.94Å; I466-F543 HydrophobicContact CG2-CZ 4.07Å
467	G	93.4	Very high	88.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.7	168.9	0	0	0	0	0	108.4	L534 P539 M541 L542 F543	G467-L534 VanDerWaalsContact C-CD1 3.47Å; G467-L534 VanDerWaalsContact CA-CD1 3.43Å; G467-P539 VanDerWaalsContact N-CB 3.34Å; G467-M541 PolarHBondContact N-O 3.33Å; G467-L542 WeakPolarHBondContact O-CA 3.36Å; G467-F543 PolarHBondContact O-N 3.24Å
468	R	93.8	Very high	88.2	Confident	24 Å²	24	63.9 Å²	63.9	9%	0.091	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.2	177.8	-177.3	177	169.4	-162	-3.3	111.5	T448 E450 F543	T448-R468 HydrophobicContact CG2-CB 4.31Å; E450-R468 IonicContact OE1-CZ 2.75Å; E450-R468 IonicContact OE1-NH1 3.57Å; E450-R468 PolarHBondContact OE1-NH1 3.08Å; E450-R468 IonicContact OE2-CZ 3.61Å; E450-R468 IonicContact OE2-NH1 2.73Å; E450-R468 PolarHBondContact OE2-NH1 3.14Å; R468-F543 CarbonylContact C-O 3.57Å; R468-F543 WeakPolarHBondContact CA-O 2.83Å; R468-F543 HydrophobicContact CB-CB 4.42Å; R468-F543 HydrophobicContact CG-CB 4.28Å
469	Y	92.6	Very high	87.9	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.008	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.8	165.6	-171.8	-88	0	0	0	109.5	L473 C527 C530 L531 F543 D545 P547	Y469-L473 HydrophobicContact CD2-CD2 4.08Å; Y469-L473 HydrophobicContact CE2-CD2 4.44Å; Y469-C527 PolarHBondContact OH-SG 3.3Å; Y469-C530 HydrophobicContact CD2-CB 4.36Å; Y469-C530 HydrophobicContact CE2-CB 3.79Å; Y469-L531 HydrophobicContact CD2-CD2 4.02Å; Y469-L531 HydrophobicContact CE2-CD2 4.22Å; Y469-L531 HydrophobicContact CE2-CG 4.36Å; Y469-F543 PolarHBondContact N-O 3.12Å; Y469-D545 WeakPolarHBondContact O-CB 3.02Å; Y469-D545 PolarHBondContact O-N 3.09Å; Y469-P547 HydrophobicContact CD1-CB 4.09Å; Y469-P547 HydrophobicContact CE1-CB 4.25Å
470	H	87.4	Confident	87.8	Confident	30 Å²	30	62.9 Å²	62.9	14%	0.139	31%	0.31	C	S	.	.			trans	-144.7	157	172.6	65.6	76.3	0	0	0	111.5	H472 L473 D545	H470-H472 VanDerWaalsContact C-N 3.31Å; H470-H472 VanDerWaalsContact CE1-C 3.42Å; H470-H472 PolarHBondContact ND1-N 2.93Å; H470-H472 PolarHBondContact O-N 3.35Å; H470-L473 PolarHBondContact CE1-N 2.99Å; H470-L473 PolarHBondContact ND1-N 2.88Å; H470-L473 VanDerWaalsContact ND1-N 3.11Å; H470-L473 WeakPolarHBondContact O-CB 3.36Å; H470-L473 PolarHBondContact O-N 3.42Å; H470-D545 HydrophobicContact CB-CB 4.41Å
471	Q	76.5	Confident	87.7	Confident	75 Å²	75	60.7 Å²	60.7	35%	0.35	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-54.7	-42.3	-174.3	-62.7	-179.8	5.1	0	0	113.3	L473 E546 N549	Q471-L473 PolarHBondContact O-N 2.98Å; Q471-E546 HydrophobicContact CG-CB 4.21Å; Q471-E546 VanDerWaalsContact NE2-CB 3.32Å; Q471-N549 PolarHBondContact NE2-ND2 3.27Å
472	H	79.1	Confident	87.7	Confident	105 Å²	105	58.4 Å²	58.4	49%	0.486	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-75.8	3.2	178.4	-54.7	-65.7	0	0	0	115.1	H470 Q474 E475	H470-H472 VanDerWaalsContact C-N 3.31Å; H470-H472 VanDerWaalsContact CE1-C 3.42Å; H470-H472 PolarHBondContact ND1-N 2.93Å; H470-H472 PolarHBondContact O-N 3.35Å; H472-Q474 PolarHBondContact O-N 3.37Å; H472-E475 IonicContact CE1-OE1 3.06Å; H472-E475 IonicContact CG-OE1 2.69Å; H472-E475 IonicContact ND1-OE1 3.77Å; H472-E475 PolarHBondContact ND1-OE1 2.93Å; H472-E475 IonicContact ND1-OE2 3.58Å; H472-E475 WeakPolarHBondContact O-CB 3.39Å; H472-E475 PolarHBondContact O-N 2.74Å; H472-E475 VanDerWaalsContact O-N 3.13Å
473	L	78.7	Confident	87.8	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-65.4	-28.7	-177.5	-174.9	62.4	0	0	0	111	Y469 H470 Q471 E475 Q476 C530 W533	Y469-L473 HydrophobicContact CD2-CD2 4.08Å; Y469-L473 HydrophobicContact CE2-CD2 4.44Å; H470-L473 PolarHBondContact CE1-N 2.99Å; H470-L473 PolarHBondContact ND1-N 2.88Å; H470-L473 VanDerWaalsContact ND1-N 3.11Å; H470-L473 WeakPolarHBondContact O-CB 3.36Å; H470-L473 PolarHBondContact O-N 3.42Å; Q471-L473 PolarHBondContact O-N 2.98Å; L473-E475 VanDerWaalsContact C-N 3.26Å; L473-E475 PolarHBondContact O-N 3.29Å; L473-Q476 WeakPolarHBondContact O-CB 3.43Å; L473-Q476 PolarHBondContact O-N 3.5Å; L473-Q476 VanDerWaalsContact O-N 3.16Å; L473-C530 HydrophobicContact CD2-CB 3.79Å; L473-C530 HydrophobicContact CG-CB 4.29Å; L473-W533 HydrophobicContact CD1-CH2 4.03Å; L473-W533 HydrophobicContact CD1-CZ3 3.77Å; L473-W533 HydrophobicContact CD2-CE3 4.08Å; L473-W533 HydrophobicContact CD2-CZ3 3.75Å; L473-W533 HydrophobicContact CG-CZ3 4.32Å
474	Q	76	Confident	87.9	Confident	25 Å²	25	47.2 Å²	47.2	12%	0.117	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-64.9	-30.4	176.3	-56.7	-177	14.6	0	0	112.5	H472 Q476 L477 K526	H472-Q474 PolarHBondContact O-N 3.37Å; Q474-Q476 VanDerWaalsContact C-N 3.25Å; Q474-Q476 PolarHBondContact O-N 3.16Å; Q474-L477 WeakPolarHBondContact O-CB 3.5Å; Q474-L477 PolarHBondContact O-N 3.1Å; Q474-K526 HydrophobicContact CB-CB 4.49Å; Q474-K526 HydrophobicContact CG-CB 4.22Å
475	E	77.5	Confident	88	Confident	146 Å²	146	50.7 Å²	50.7	68%	0.682	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-73.1	-20.6	177.6	-60.4	167.7	-154.9	0	0	112	H472 L473 L477	H472-E475 IonicContact CE1-OE1 3.06Å; H472-E475 IonicContact CG-OE1 2.69Å; H472-E475 IonicContact ND1-OE1 3.77Å; H472-E475 PolarHBondContact ND1-OE1 2.93Å; H472-E475 IonicContact ND1-OE2 3.58Å; H472-E475 WeakPolarHBondContact O-CB 3.39Å; H472-E475 PolarHBondContact O-N 2.74Å; H472-E475 VanDerWaalsContact O-N 3.13Å; L473-E475 VanDerWaalsContact C-N 3.26Å; L473-E475 PolarHBondContact O-N 3.29Å; E475-L477 VanDerWaalsContact C-N 3.35Å
476	Q	81.5	Confident	88	Confident	123 Å²	123	46.5 Å²	46.5	58%	0.575	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-86.3	-7.9	176.5	-60.9	-179.7	0.4	0	0	112.9	L473 Q474	L473-Q476 WeakPolarHBondContact O-CB 3.43Å; L473-Q476 PolarHBondContact O-N 3.5Å; L473-Q476 VanDerWaalsContact O-N 3.16Å; Q474-Q476 VanDerWaalsContact C-N 3.25Å; Q474-Q476 PolarHBondContact O-N 3.16Å
477	L	85.8	Confident	87.9	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.042	22%	0.216	C	C	.	.	S	Bend	trans	-68.7	137	174.5	-64.9	176.6	0	0	0	109.9	Q474 E475 L479 Y486 I518 K526 V529	Q474-L477 WeakPolarHBondContact O-CB 3.5Å; Q474-L477 PolarHBondContact O-N 3.1Å; E475-L477 VanDerWaalsContact C-N 3.35Å; L477-L479 PolarHBondContact O-N 3.05Å; L477-Y486 HydrophobicContact CD2-CD1 4.29Å; L477-Y486 HydrophobicContact CD2-CE1 3.7Å; L477-Y486 HydrophobicContact CD2-CE2 4.27Å; L477-I518 HydrophobicContact CB-CD1 4.36Å; L477-I518 HydrophobicContact CB-CG2 4.08Å; L477-I518 HydrophobicContact CD1-CG2 3.99Å; L477-K526 HydrophobicContact CD1-CB 4.09Å; L477-K526 HydrophobicContact CD1-CG 4.47Å; L477-V529 HydrophobicContact CD2-CG1 4.36Å
478	D	89.4	Confident	87.8	Confident	53 Å²	53	47.6 Å²	47.6	28%	0.283	23%	0.23	S	C	.	.			trans	-71.7	96.4	174.2	-167.2	-22.9	0	0	0	108.9	D480 L481 Y486 K489	D478-D480 PolarHBondContact O-N 2.94Å; D478-L481 HydrophobicContact CB-CB 4.36Å; D478-L481 HydrophobicContact CB-CD1 3.9Å; D478-L481 HydrophobicContact CB-CG 4.07Å; D478-L481 PolarHBondContact O-N 2.99Å; D478-L481 VanDerWaalsContact O-N 3.14Å; D478-L481 VanDerWaalsContact OD2-CD1 3.25Å; D478-L481 WeakPolarHBondContact OD2-CD1 3.34Å; D478-Y486 HydrophobicContact CB-CD2 4.01Å; D478-Y486 HydrophobicContact CB-CE2 4.34Å; D478-K489 IonicContact OD2-NZ 3.05Å; D478-K489 PolarHBondContact OD2-NZ 3.23Å
479	L	89.2	Confident	87.8	Confident	76 Å²	76	53 Å²	53	40%	0.398	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.4	-170.1	-63.9	-175.9	0	0	0	113.9	L477 I518 R519	L477-L479 PolarHBondContact O-N 3.05Å; L479-I518 HydrophobicContact CD2-CG2 3.92Å; L479-R519 HydrophobicContact CB-CB 4.21Å; L479-R519 WeakPolarHBondContact O-CB 3.25Å; L479-R519 WeakPolarHBondContact O-CG 3.24Å; L479-R519 PolarHBondContact O-N 2.75Å
480	D	90.9	Very high	87.7	Confident	102 Å²	102	55.1 Å²	55.1	55%	0.545	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.4	-177.1	-65.5	-4.8	0	0	0	112	D478 R519	D478-D480 PolarHBondContact O-N 2.94Å; D480-R519 IonicContact OD1-CZ 3.83Å; D480-R519 IonicContact OD1-NE 3.52Å; D480-R519 IonicContact OD1-NH2 2.67Å; D480-R519 PolarHBondContact OD1-NH2 2.67Å; D480-R519 IonicContact OD2-NH2 2.69Å
481	L	92.8	Very high	87.8	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.215	27%	0.266	C	S	.	.	S	Bend	trans	-81.7	153.1	176.4	-61.8	-178	0	0	0	111.1	D478 E485 K489 I518	D478-L481 HydrophobicContact CB-CB 4.36Å; D478-L481 HydrophobicContact CB-CD1 3.9Å; D478-L481 HydrophobicContact CB-CG 4.07Å; D478-L481 PolarHBondContact O-N 2.99Å; D478-L481 VanDerWaalsContact O-N 3.14Å; D478-L481 VanDerWaalsContact OD2-CD1 3.25Å; D478-L481 WeakPolarHBondContact OD2-CD1 3.34Å; L481-E485 HydrophobicContact CB-CB 4.27Å; L481-E485 HydrophobicContact CD2-CB 4.36Å; L481-K489 HydrophobicContact CD1-CD 3.67Å; L481-I518 VanDerWaalsContact O-CG1 3.27Å; L481-I518 WeakPolarHBondContact O-CG1 3.42Å; L481-I518 PolarHBondContact O-N 3.25Å
482	S	93.8	Very high	88.3	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.028	28%	0.278	C	S	.	.			trans	-75.8	156.3	163.4	64.6	0	0	0	0	111	L484 E485 Y486 Q514 S516	S482-L484 PolarHBondContact O-N 3.41Å; S482-L484 VanDerWaalsContact O-N 3.13Å; S482-E485 WeakPolarHBondContact CB-OE2 3.44Å; S482-E485 PolarHBondContact N-OE2 2.83Å; S482-E485 PolarHBondContact O-N 3.49Å; S482-E485 VanDerWaalsContact OG-CG 3.26Å; S482-E485 WeakPolarHBondContact OG-CG 3.27Å; S482-E485 PolarHBondContact OG-N 3.07Å; S482-E485 PolarHBondContact OG-OE2 3.34Å; S482-Y486 WeakPolarHBondContact O-CB 3.27Å; S482-Y486 PolarHBondContact O-N 3.36Å; S482-Q514 WeakPolarHBondContact CB-O 3.29Å; S482-S516 WeakPolarHBondContact CA-O 3.43Å; S482-S516 WeakPolarHBondContact CB-O 3.38Å
483	P	93.5	Very high	88.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-51.9	-37.1	175.2	-29.3	35.2	0	0	0	113.6	M487 S516 I518 L521 V529	P483-M487 WeakPolarHBondContact O-CB 3.34Å; P483-M487 VanDerWaalsContact O-CG 3.24Å; P483-M487 WeakPolarHBondContact O-CG 3.47Å; P483-M487 PolarHBondContact O-N 3.49Å; P483-S516 WeakPolarHBondContact CD-O 3.44Å; P483-I518 HydrophobicContact CG-CG1 3.98Å; P483-L521 HydrophobicContact CG-CD1 3.51Å; P483-V529 HydrophobicContact CB-CG1 4.26Å; P483-V529 HydrophobicContact CB-CG2 3.82Å; P483-V529 HydrophobicContact CG-CG2 3.8Å
484	L	94.1	Very high	89.1	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-44.8	178.4	-176.8	56.3	0	0	0	112	S482 M488 K497 M500 R501 I504 Q514 V515	S482-L484 PolarHBondContact O-N 3.41Å; S482-L484 VanDerWaalsContact O-N 3.13Å; L484-M488 HydrophobicContact CD1-SD 4.36Å; L484-M488 HydrophobicContact CG-SD 4.45Å; L484-M488 WeakPolarHBondContact O-CB 3.44Å; L484-M488 VanDerWaalsContact O-CG 3.24Å; L484-M488 WeakPolarHBondContact O-CG 3.37Å; L484-M488 PolarHBondContact O-N 2.9Å; L484-K497 HydrophobicContact CD1-CG 4.2Å; L484-K497 HydrophobicContact CD2-CD 4.12Å; L484-K497 HydrophobicContact CD2-CG 3.83Å; L484-K497 HydrophobicContact CG-CG 4.23Å; L484-M500 HydrophobicContact CD1-CB 3.77Å; L484-M500 HydrophobicContact CD1-CG 3.63Å; L484-R501 HydrophobicContact CD1-CG 3.83Å; L484-R501 HydrophobicContact CD2-CG 3.71Å; L484-R501 HydrophobicContact CG-CG 4.45Å; L484-I504 HydrophobicContact CB-CD1 4.23Å; L484-I504 HydrophobicContact CD1-CD1 3.98Å; L484-Q514 WeakPolarHBondContact CB-O 3.37Å; L484-Q514 PolarHBondContact N-O 3.26Å; L484-Q514 VanDerWaalsContact N-O 3.16Å; L484-V515 HydrophobicContact CD2-CG1 4.41Å
485	E	94	Very high	89.4	Confident	95 Å²	95	64.4 Å²	64.4	44%	0.444	32%	0.317	S	S	.	.	H	α-helix	trans	-67.8	-41.3	176.5	-71.7	158.3	163.6	0	0	111.8	L481 S482 M488 K489	L481-E485 HydrophobicContact CB-CB 4.27Å; L481-E485 HydrophobicContact CD2-CB 4.36Å; S482-E485 WeakPolarHBondContact CB-OE2 3.44Å; S482-E485 PolarHBondContact N-OE2 2.83Å; S482-E485 PolarHBondContact O-N 3.49Å; S482-E485 VanDerWaalsContact OG-CG 3.26Å; S482-E485 WeakPolarHBondContact OG-CG 3.27Å; S482-E485 PolarHBondContact OG-N 3.07Å; S482-E485 PolarHBondContact OG-OE2 3.34Å; E485-M488 PolarHBondContact O-N 3.17Å; E485-K489 VanDerWaalsContact O-CB 3.28Å; E485-K489 WeakPolarHBondContact O-CB 3.47Å; E485-K489 PolarHBondContact O-N 2.83Å
486	Y	93.6	Very high	89.9	Confident	26 Å²	26	63.7 Å²	63.7	10%	0.102	31%	0.314	C	S	.	.	H	α-helix	trans	-58.4	-50.6	176	179.5	-97.9	0	0	0	111.3	L477 D478 S482 M488 K489 C490 I518 W533	L477-Y486 HydrophobicContact CD2-CD1 4.29Å; L477-Y486 HydrophobicContact CD2-CE1 3.7Å; L477-Y486 HydrophobicContact CD2-CE2 4.27Å; D478-Y486 HydrophobicContact CB-CD2 4.01Å; D478-Y486 HydrophobicContact CB-CE2 4.34Å; S482-Y486 WeakPolarHBondContact O-CB 3.27Å; S482-Y486 PolarHBondContact O-N 3.36Å; Y486-M488 PolarHBondContact O-N 2.91Å; Y486-K489 WeakPolarHBondContact O-CB 3.41Å; Y486-K489 PolarHBondContact O-N 2.7Å; Y486-C490 PolarHBondContact O-N 3.05Å; Y486-C490 PolarHBondContact O-SG 3.31Å; Y486-C490 VanDerWaalsContact O-SG 3.37Å; Y486-I518 HydrophobicContact CG-CD1 4.22Å; Y486-W533 AromaticContact CE1-CD1 3.91Å; Y486-W533 HydrophobicContact CE1-CG 4.28Å
487	M	92.7	Very high	90.3	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-64.8	-40.9	178.6	-71.3	-72.4	-69.2	0	0	112.5	P483 K489 C490 Y491 M500 I504 W533 W536	P483-M487 WeakPolarHBondContact O-CB 3.34Å; P483-M487 VanDerWaalsContact O-CG 3.24Å; P483-M487 WeakPolarHBondContact O-CG 3.47Å; P483-M487 PolarHBondContact O-N 3.49Å; M487-K489 VanDerWaalsContact C-N 3.29Å; M487-K489 PolarHBondContact O-N 3.09Å; M487-C490 PolarHBondContact O-N 3.21Å; M487-Y491 HydrophobicContact CE-CD2 3.92Å; M487-Y491 HydrophobicContact CE-CE2 3.73Å; M487-Y491 WeakPolarHBondContact O-CB 3.44Å; M487-Y491 WeakPolarHBondContact O-CD2 3.35Å; M487-Y491 PolarHBondContact O-N 3.22Å; M487-Y491 HydrophobicContact SD-CD2 4.32Å; M487-Y491 HydrophobicContact SD-CE2 3.99Å; M487-M500 HydrophobicContact CB-CE 4Å; M487-M500 HydrophobicContact CB-CG 3.93Å; M487-M500 HydrophobicContact CB-SD 3.5Å; M487-M500 WeakPolarHBondContact CB-SD 3.47Å; M487-M500 HydrophobicContact CE-SD 3.94Å; M487-M500 HydrophobicContact CG-SD 4.32Å; M487-I504 HydrophobicContact CB-CD1 4.01Å; M487-I504 HydrophobicContact CG-CD1 3.82Å; M487-I504 HydrophobicContact CG-CG1 3.99Å; M487-W533 VanDerWaalsContact SD-CA 3.59Å; M487-W533 HydrophobicContact SD-CB 3.8Å; M487-W536 HydrophobicContact CE-CB 4.21Å
488	M	92.1	Very high	90.6	Very high	57 Å²	57	68 Å²	68	28%	0.281	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-32.1	175.6	-72.6	-176	74	0	0	112.7	L484 E485 Y486 Y491 K497 M500	L484-M488 HydrophobicContact CD1-SD 4.36Å; L484-M488 HydrophobicContact CG-SD 4.45Å; L484-M488 WeakPolarHBondContact O-CB 3.44Å; L484-M488 VanDerWaalsContact O-CG 3.24Å; L484-M488 WeakPolarHBondContact O-CG 3.37Å; L484-M488 PolarHBondContact O-N 2.9Å; E485-M488 PolarHBondContact O-N 3.17Å; Y486-M488 PolarHBondContact O-N 2.91Å; M488-Y491 CarbonylContact O-C 3.57Å; M488-K497 HydrophobicContact CE-CB 4.39Å; M488-K497 HydrophobicContact SD-CB 4.18Å; M488-K497 HydrophobicContact SD-CD 4.48Å; M488-K497 HydrophobicContact SD-CG 3.97Å; M488-M500 HydrophobicContact CG-CB 4.25Å; M488-M500 HydrophobicContact CG-CE 4.49Å; M488-M500 HydrophobicContact CG-CG 4.02Å
489	K	92.3	Very high	90.6	Very high	137 Å²	137	69.6 Å²	69.6	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-69.5	-39.6	174.2	-180	-178.6	175.4	-176.9	0	111.5	D478 L481 E485 Y486 M487	D478-K489 IonicContact OD2-NZ 3.05Å; D478-K489 PolarHBondContact OD2-NZ 3.23Å; L481-K489 HydrophobicContact CD1-CD 3.67Å; E485-K489 VanDerWaalsContact O-CB 3.28Å; E485-K489 WeakPolarHBondContact O-CB 3.47Å; E485-K489 PolarHBondContact O-N 2.83Å; Y486-K489 WeakPolarHBondContact O-CB 3.41Å; Y486-K489 PolarHBondContact O-N 2.7Å; M487-K489 VanDerWaalsContact C-N 3.29Å; M487-K489 PolarHBondContact O-N 3.09Å
490	C	90.2	Very high	90.8	Very high	48 Å²	48	66 Å²	66	32%	0.324	32%	0.319	S	S	.	.	H	α-helix	trans	-72.2	-32.5	177.1	-68.7	0	0	0	0	113.2	Y486 M487 P492	Y486-C490 PolarHBondContact O-N 3.05Å; Y486-C490 PolarHBondContact O-SG 3.31Å; Y486-C490 VanDerWaalsContact O-SG 3.37Å; M487-C490 PolarHBondContact O-N 3.21Å; C490-P492 VanDerWaalsContact C-CD 3.47Å; C490-P492 WeakPolarHBondContact O-CD 3.36Å
491	Y	89.9	Confident	90.8	Very high	20 Å²	20	65.8 Å²	65.8	8%	0.078	31%	0.311	C	S	.	.			trans	-125.2	68.5	-172.7	-59.3	-64.4	0	0	0	111.4	M487 M488 E493 I494 M500 W533 W536 Q537	M487-Y491 HydrophobicContact CE-CD2 3.92Å; M487-Y491 HydrophobicContact CE-CE2 3.73Å; M487-Y491 WeakPolarHBondContact O-CB 3.44Å; M487-Y491 WeakPolarHBondContact O-CD2 3.35Å; M487-Y491 PolarHBondContact O-N 3.22Å; M487-Y491 HydrophobicContact SD-CD2 4.32Å; M487-Y491 HydrophobicContact SD-CE2 3.99Å; M488-Y491 CarbonylContact O-C 3.57Å; Y491-E493 VanDerWaalsContact CA-OE2 3.31Å; Y491-E493 WeakPolarHBondContact CA-OE2 3.36Å; Y491-E493 VanDerWaalsContact CB-OE1 3.31Å; Y491-E493 WeakPolarHBondContact CB-OE1 3.06Å; Y491-E493 VanDerWaalsContact CD1-OE1 3.31Å; Y491-E493 WeakPolarHBondContact CD1-OE1 3.39Å; Y491-E493 PolarHBondContact O-N 3.4Å; Y491-E493 VanDerWaalsContact O-N 3.14Å; Y491-I494 PolarHBondContact O-N 2.97Å; Y491-I494 VanDerWaalsContact O-N 3.12Å; Y491-M500 HydrophobicContact CD2-CE 4.4Å; Y491-W533 AromaticContact CE2-CD1 3.99Å; Y491-W533 PolarHBondContact OH-O 3.15Å; Y491-W536 AromaticContact CD1-CD1 3.77Å; Y491-W536 HydrophobicContact CD2-CB 4.45Å; Y491-W536 AromaticContact CD2-CD1 3.78Å; Y491-W536 HydrophobicContact CD2-CG 4.45Å; Y491-W536 HydrophobicContact CE1-CB 4.44Å; Y491-W536 AromaticContact CE1-CD1 3.96Å; Y491-W536 HydrophobicContact CE2-CB 3.84Å; Y491-W536 AromaticContact CE2-CD1 3.97Å; Y491-W536 HydrophobicContact CE2-CG 4.29Å; Y491-W536 AromaticContact CG-CD1 3.67Å; Y491-Q537 WeakPolarHBondContact OH-CG 3.15Å; Y491-Q537 PolarHBondContact OH-N 2.98Å
492	P	87.7	Confident	90.7	Very high	94 Å²	94	70.8 Å²	70.8	61%	0.61	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.5	-175.6	28.7	-36.6	0	0	0	113.9	C490 I494	C490-P492 VanDerWaalsContact C-CD 3.47Å; C490-P492 WeakPolarHBondContact O-CD 3.36Å; P492-I494 PolarHBondContact O-N 2.95Å
493	E	88	Confident	90.5	Very high	121 Å²	121	71.4 Å²	71.4	57%	0.565	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-27.3	172.7	67.5	-77.6	-178.1	0	0	112.9	Y491 K495	Y491-E493 VanDerWaalsContact CA-OE2 3.31Å; Y491-E493 WeakPolarHBondContact CA-OE2 3.36Å; Y491-E493 VanDerWaalsContact CB-OE1 3.31Å; Y491-E493 WeakPolarHBondContact CB-OE1 3.06Å; Y491-E493 VanDerWaalsContact CD1-OE1 3.31Å; Y491-E493 WeakPolarHBondContact CD1-OE1 3.39Å; Y491-E493 PolarHBondContact O-N 3.4Å; Y491-E493 VanDerWaalsContact O-N 3.14Å; E493-K495 PolarHBondContact O-N 3.32Å
494	I	85.7	Confident	90.4	Very high	13 Å²	13	71.4 Å²	71.4	7%	0.067	33%	0.333	C	S	.	.			trans	-86.6	97	175.7	-58.7	-174.8	0	0	0	109.1	Y491 P492 E499 M500 I503 W536	Y491-I494 PolarHBondContact O-N 2.97Å; Y491-I494 VanDerWaalsContact O-N 3.12Å; P492-I494 PolarHBondContact O-N 2.95Å; I494-E499 HydrophobicContact CG2-CB 4.17Å; I494-E499 HydrophobicContact CG2-CG 4.37Å; I494-M500 HydrophobicContact CB-CE 3.98Å; I494-M500 HydrophobicContact CD1-CE 3.73Å; I494-M500 HydrophobicContact CG1-CE 4.31Å; I494-M500 HydrophobicContact CG2-CB 4.38Å; I494-M500 HydrophobicContact CG2-CE 4.18Å; I494-I503 HydrophobicContact CD1-CD1 3.76Å; I494-W536 HydrophobicContact CD1-CZ2 3.79Å
495	K	82.6	Confident	90.2	Very high	187 Å²	187	72.9 Å²	72.9	81%	0.813	35%	0.349	S	S	*	.			trans	-77.4	-28.2	178.3	-62.7	-176.7	-178.5	178.6	0	112.7	E493 K497	E493-K495 PolarHBondContact O-N 3.32Å; K495-K497 PolarHBondContact O-N 2.96Å
496	E	88.7	Confident	90	Very high	130 Å²	130	75.1 Å²	75.1	61%	0.607	35%	0.353	S	S	*	.			trans	-85.9	110.5	-175.5	-66.6	-166.8	178.7	0	0	111.8	E498 E499 M500	E496-E498 PolarHBondContact O-N 2.88Å; E496-E499 HydrophobicContact CB-CB 4.09Å; E496-E499 WeakPolarHBondContact O-CB 3.15Å; E496-E499 PolarHBondContact O-N 3.16Å; E496-E499 VanDerWaalsContact O-N 3.11Å; E496-M500 PolarHBondContact O-N 2.93Å
497	K	89.7	Confident	89.8	Confident	93 Å²	93	74.1 Å²	74.1	40%	0.404	35%	0.349	S	S	.	.	H	α-helix	trans	-57.5	-32.1	176.2	-170.9	170.4	-173.7	167.6	0	112.5	L484 M488 K495 R501	L484-K497 HydrophobicContact CD1-CG 4.2Å; L484-K497 HydrophobicContact CD2-CD 4.12Å; L484-K497 HydrophobicContact CD2-CG 3.83Å; L484-K497 HydrophobicContact CG-CG 4.23Å; M488-K497 HydrophobicContact CE-CB 4.39Å; M488-K497 HydrophobicContact SD-CB 4.18Å; M488-K497 HydrophobicContact SD-CD 4.48Å; M488-K497 HydrophobicContact SD-CG 3.97Å; K495-K497 PolarHBondContact O-N 2.96Å; K497-R501 VanDerWaalsContact O-CG 3.26Å; K497-R501 WeakPolarHBondContact O-CG 3.4Å; K497-R501 PolarHBondContact O-N 2.76Å
498	E	91.4	Very high	89.5	Confident	129 Å²	129	74.9 Å²	74.9	60%	0.603	36%	0.357	S	S	*	.	H	α-helix	trans	-69.2	-35.4	178.4	-66.8	-165	168.3	0	0	113.2	E496 R501 K502	E496-E498 PolarHBondContact O-N 2.88Å; E498-R501 PolarHBondContact O-N 3.25Å; E498-K502 WeakPolarHBondContact O-CG 3.47Å; E498-K502 PolarHBondContact O-N 3.34Å; E498-K502 VanDerWaalsContact O-N 3.11Å
499	E	90.8	Very high	89.4	Confident	86 Å²	86	72.3 Å²	72.3	40%	0.402	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-46.9	174.8	-173.4	175	-166.5	0	0	110.3	I494 E496 R501 K502 I503	I494-E499 HydrophobicContact CG2-CB 4.17Å; I494-E499 HydrophobicContact CG2-CG 4.37Å; E496-E499 HydrophobicContact CB-CB 4.09Å; E496-E499 WeakPolarHBondContact O-CB 3.15Å; E496-E499 PolarHBondContact O-N 3.16Å; E496-E499 VanDerWaalsContact O-N 3.11Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 2.87Å; E499-K502 WeakPolarHBondContact O-CB 3.43Å; E499-K502 PolarHBondContact O-N 3.35Å; E499-I503 HydrophobicContact CG-CD1 4.44Å; E499-I503 WeakPolarHBondContact O-CG1 2.87Å; E499-I503 PolarHBondContact O-N 3.35Å
500	M	91.7	Very high	89.1	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.2	-39.3	176.5	-168.8	60	77.3	0	0	112.4	L484 M487 M488 Y491 I494 E496 K502 I503 I504	L484-M500 HydrophobicContact CD1-CB 3.77Å; L484-M500 HydrophobicContact CD1-CG 3.63Å; M487-M500 HydrophobicContact CB-CE 4Å; M487-M500 HydrophobicContact CB-CG 3.93Å; M487-M500 HydrophobicContact CB-SD 3.5Å; M487-M500 WeakPolarHBondContact CB-SD 3.47Å; M487-M500 HydrophobicContact CE-SD 3.94Å; M487-M500 HydrophobicContact CG-SD 4.32Å; M488-M500 HydrophobicContact CG-CB 4.25Å; M488-M500 HydrophobicContact CG-CE 4.49Å; M488-M500 HydrophobicContact CG-CG 4.02Å; Y491-M500 HydrophobicContact CD2-CE 4.4Å; I494-M500 HydrophobicContact CB-CE 3.98Å; I494-M500 HydrophobicContact CD1-CE 3.73Å; I494-M500 HydrophobicContact CG1-CE 4.31Å; I494-M500 HydrophobicContact CG2-CB 4.38Å; I494-M500 HydrophobicContact CG2-CE 4.18Å; E496-M500 PolarHBondContact O-N 2.93Å; M500-K502 VanDerWaalsContact C-N 3.3Å; M500-K502 PolarHBondContact O-N 2.96Å; M500-I503 PolarHBondContact O-N 2.97Å; M500-I503 HydrophobicContact SD-CD1 4.28Å; M500-I504 HydrophobicContact CG-CD1 3.86Å; M500-I504 HydrophobicContact CG-CG1 4.39Å; M500-I504 WeakPolarHBondContact O-CG1 3.41Å; M500-I504 PolarHBondContact O-N 3.35Å; M500-I504 HydrophobicContact SD-CD1 4.42Å; M500-I504 HydrophobicContact SD-CG1 4.46Å
501	R	92.5	Very high	89	Confident	99 Å²	99	69.3 Å²	69.3	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-37.1	173.9	-76.1	177.7	167.4	160.5	-3.6	112.9	L484 K497 E498 E499 G505 Q514	L484-R501 HydrophobicContact CD1-CG 3.83Å; L484-R501 HydrophobicContact CD2-CG 3.71Å; L484-R501 HydrophobicContact CG-CG 4.45Å; K497-R501 VanDerWaalsContact O-CG 3.26Å; K497-R501 WeakPolarHBondContact O-CG 3.4Å; K497-R501 PolarHBondContact O-N 2.76Å; E498-R501 PolarHBondContact O-N 3.25Å; E499-R501 VanDerWaalsContact C-N 3.31Å; E499-R501 PolarHBondContact O-N 2.87Å; R501-G505 WeakPolarHBondContact O-CA 3.31Å; R501-G505 PolarHBondContact O-N 2.73Å; R501-Q514 VanDerWaalsContact CG-OE1 3.29Å; R501-Q514 PolarHBondContact O-NE2 2.76Å
502	K	90.2	Very high	89	Confident	146 Å²	146	77 Å²	77	64%	0.635	38%	0.381	S	S	*	.	H	α-helix	trans	-67	-43.9	175.7	-70.9	170.2	-174.8	170	0	110.8	E498 E499 M500 G505 R506	E498-K502 WeakPolarHBondContact O-CG 3.47Å; E498-K502 PolarHBondContact O-N 3.34Å; E498-K502 VanDerWaalsContact O-N 3.11Å; E499-K502 WeakPolarHBondContact O-CB 3.43Å; E499-K502 PolarHBondContact O-N 3.35Å; M500-K502 VanDerWaalsContact C-N 3.3Å; M500-K502 PolarHBondContact O-N 2.96Å; K502-G505 PolarHBondContact O-N 3.45Å; K502-R506 WeakPolarHBondContact O-CG 3.42Å; K502-R506 PolarHBondContact O-N 3.04Å; K502-R506 VanDerWaalsContact O-N 3.1Å
503	I	89.3	Confident	89.1	Confident	16 Å²	16	74.7 Å²	74.7	8%	0.082	36%	0.361	C	S	.	.	H	α-helix	trans	-59.3	-56.1	177.6	-64.3	164.6	0	0	0	109.9	I494 E499 M500 G505 R506 Y507 W536	I494-I503 HydrophobicContact CD1-CD1 3.76Å; E499-I503 HydrophobicContact CG-CD1 4.44Å; E499-I503 WeakPolarHBondContact O-CG1 2.87Å; E499-I503 PolarHBondContact O-N 3.35Å; M500-I503 PolarHBondContact O-N 2.97Å; M500-I503 HydrophobicContact SD-CD1 4.28Å; I503-G505 PolarHBondContact O-N 2.87Å; I503-R506 WeakPolarHBondContact O-CB 3.4Å; I503-R506 PolarHBondContact O-N 2.78Å; I503-Y507 WeakPolarHBondContact O-CD2 3.46Å; I503-W536 HydrophobicContact CD1-CD2 4.01Å; I503-W536 HydrophobicContact CD1-CE3 4.13Å; I503-W536 HydrophobicContact CD1-CH2 3.61Å; I503-W536 HydrophobicContact CD1-CZ2 3.47Å; I503-W536 VanDerWaalsContact CD1-CZ2 3.47Å; I503-W536 HydrophobicContact CD1-CZ3 3.95Å; I503-W536 HydrophobicContact CG1-CE3 4.42Å; I503-W536 HydrophobicContact CG1-CH2 4.1Å; I503-W536 HydrophobicContact CG1-CZ2 4.44Å; I503-W536 HydrophobicContact CG1-CZ3 4.09Å; I503-W536 HydrophobicContact CG2-CD2 4.35Å; I503-W536 HydrophobicContact CG2-CE3 4.01Å; I503-W536 HydrophobicContact CG2-CZ3 4.41Å
504	I	91.6	Very high	89.3	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-62.1	-35.6	-179.9	-60.6	168.7	0	0	0	111.1	L484 M487 M500 R506 Y507 L509 Q514	L484-I504 HydrophobicContact CB-CD1 4.23Å; L484-I504 HydrophobicContact CD1-CD1 3.98Å; M487-I504 HydrophobicContact CB-CD1 4.01Å; M487-I504 HydrophobicContact CG-CD1 3.82Å; M487-I504 HydrophobicContact CG-CG1 3.99Å; M500-I504 HydrophobicContact CG-CD1 3.86Å; M500-I504 HydrophobicContact CG-CG1 4.39Å; M500-I504 WeakPolarHBondContact O-CG1 3.41Å; M500-I504 PolarHBondContact O-N 3.35Å; M500-I504 HydrophobicContact SD-CD1 4.42Å; M500-I504 HydrophobicContact SD-CG1 4.46Å; I504-R506 VanDerWaalsContact C-N 3.33Å; I504-R506 PolarHBondContact O-N 3.05Å; I504-Y507 PolarHBondContact O-N 2.98Å; I504-L509 HydrophobicContact CG2-CB 3.81Å; I504-L509 HydrophobicContact CG2-CD1 3.51Å; I504-L509 HydrophobicContact CG2-CG 4.27Å; I504-Q514 HydrophobicContact CB-CG 4.38Å; I504-Q514 HydrophobicContact CG2-CG 3.74Å
505	G	89.9	Confident	89.6	Confident	32 Å²	32	72.3 Å²	72.3	33%	0.33	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-33.7	178.1	0	0	0	0	0	114	R501 K502 I503 Y507 G508	R501-G505 WeakPolarHBondContact O-CA 3.31Å; R501-G505 PolarHBondContact O-N 2.73Å; K502-G505 PolarHBondContact O-N 3.45Å; I503-G505 PolarHBondContact O-N 2.87Å; G505-Y507 PolarHBondContact O-N 3.21Å; G505-G508 PolarHBondContact O-N 2.78Å; G505-G508 VanDerWaalsContact O-N 3.08Å
506	R	89.3	Confident	90	Very high	142 Å²	142	64.8 Å²	64.8	54%	0.536	33%	0.326	S	S	.	.	H	α-helix	trans	-61.8	-32	174.5	-72.8	-175.5	-179.4	-169.8	0.5	112.3	K502 I503 I504 G508	K502-R506 WeakPolarHBondContact O-CG 3.42Å; K502-R506 PolarHBondContact O-N 3.04Å; K502-R506 VanDerWaalsContact O-N 3.1Å; I503-R506 WeakPolarHBondContact O-CB 3.4Å; I503-R506 PolarHBondContact O-N 2.78Å; I504-R506 VanDerWaalsContact C-N 3.33Å; I504-R506 PolarHBondContact O-N 3.05Å; R506-G508 PolarHBondContact O-N 3.34Å
507	Y	89.8	Confident	90.1	Very high	5 Å²	5	60.8 Å²	60.8	2%	0.02	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	12	176.3	-71.7	-89.8	0	0	0	114	F387 Y388 I503 I504 G505 R528 L531 A532 A535	F387-Y507 HydrophobicContact CB-CD1 4.48Å; F387-Y507 HydrophobicContact CB-CE1 4.07Å; F387-Y507 AromaticContact CD1-CD1 3.74Å; F387-Y507 HydrophobicContact CD1-CD1 3.74Å; F387-Y507 HydrophobicContact CD1-CE1 4.19Å; F387-Y507 HydrophobicContact CD1-CG 4.29Å; F387-Y507 HydrophobicContact CD2-CD1 4.14Å; F387-Y507 HydrophobicContact CD2-CE1 4.17Å; F387-Y507 VanDerWaalsContact CE1-CA 3.47Å; F387-Y507 AromaticContact CE1-CD1 3.88Å; F387-Y507 HydrophobicContact CE1-CD1 3.88Å; F387-Y507 HydrophobicContact CE1-CG 4.36Å; F387-Y507 HydrophobicContact CE2-CD1 4.25Å; F387-Y507 AromaticContact CG-CD1 3.86Å; F387-Y507 HydrophobicContact CG-CD1 3.86Å; F387-Y507 AromaticContact CG-CE1 3.89Å; F387-Y507 HydrophobicContact CG-CE1 3.89Å; F387-Y507 HydrophobicContact CZ-CD1 4.08Å; Y388-Y507 PolarHBondContact O-OH 2.9Å; I503-Y507 WeakPolarHBondContact O-CD2 3.46Å; I504-Y507 PolarHBondContact O-N 2.98Å; G505-Y507 PolarHBondContact O-N 3.21Å; Y507-R528 WeakPolarHBondContact O-CB 3.45Å; Y507-R528 VanDerWaalsContact O-CD 3.27Å; Y507-R528 WeakPolarHBondContact O-CD 3.43Å; Y507-R528 WeakPolarHBondContact O-CG 3.44Å; Y507-L531 HydrophobicContact CD1-CB 3.89Å; Y507-L531 HydrophobicContact CE1-CB 3.94Å; Y507-A532 HydrophobicContact CD1-CB 4.18Å; Y507-A532 HydrophobicContact CD2-CB 3.44Å; Y507-A532 VanDerWaalsContact CD2-CB 3.44Å; Y507-A532 HydrophobicContact CE2-CB 3.99Å; Y507-A532 HydrophobicContact CG-CB 3.57Å; Y507-A535 HydrophobicContact CE2-CB 4.43Å; Y507-A535 WeakPolarHBondContact OH-CB 3.45Å
508	G	87.1	Confident	90.2	Very high	16 Å²	16	56.4 Å²	56.4	17%	0.165	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	18.8	170.5	0	0	0	0	0	115.6	G505 R506 R528	G505-G508 PolarHBondContact O-N 2.78Å; G505-G508 VanDerWaalsContact O-N 3.08Å; R506-G508 PolarHBondContact O-N 3.34Å; G508-R528 PolarHBondContact O-NH1 3.4Å
509	L	88.6	Confident	90	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	29%	0.29	C	S	.	.			trans	-94.8	119.4	173.6	-75.1	140.8	0	0	0	110.2	I504 Q513 Q514 L521 Q525 R528 V529	I504-L509 HydrophobicContact CG2-CB 3.81Å; I504-L509 HydrophobicContact CG2-CD1 3.51Å; I504-L509 HydrophobicContact CG2-CG 4.27Å; L509-Q513 HydrophobicContact CD2-CB 4.05Å; L509-Q514 HydrophobicContact CB-CG 4.1Å; L509-Q514 PolarHBondContact O-NE2 3.14Å; L509-L521 HydrophobicContact CD2-CD1 4.44Å; L509-Q525 HydrophobicContact CD2-CB 4.31Å; L509-R528 HydrophobicContact CD1-CB 4.19Å; L509-V529 HydrophobicContact CD1-CG2 3.6Å; L509-V529 HydrophobicContact CD2-CG2 4.06Å; L509-V529 HydrophobicContact CG-CG2 4.49Å
510	T	87.2	Confident	89.8	Confident	70 Å²	70	58.4 Å²	58.4	43%	0.429	30%	0.299	S	S	.	.			trans	-66.8	156.2	177.2	65.4	0	0	0	0	111.7	K512 Q513 Q514	T510-K512 PolarHBondContact O-N 2.75Å; T510-Q513 WeakPolarHBondContact O-CA 3.5Å; T510-Q513 WeakPolarHBondContact O-CB 3.45Å; T510-Q513 PolarHBondContact O-N 3.39Å; T510-Q513 WeakPolarHBondContact OG1-CG 3.38Å; T510-Q513 PolarHBondContact OG1-N 2.9Å; T510-Q513 PolarHBondContact OG1-OE1 3.13Å; T510-Q514 WeakPolarHBondContact O-CG 3.23Å; T510-Q514 PolarHBondContact O-N 2.78Å
511	G	87.8	Confident	89.5	Confident	52 Å²	52	58.9 Å²	58.9	54%	0.536	30%	0.301	S	S	.	.	H	α-helix	trans	-55	-30.6	179.4	0	0	0	0	0	114.4
512	K	89	Confident	89.1	Confident	181 Å²	181	56.5 Å²	56.5	79%	0.787	30%	0.3	S	S	*	.	H	α-helix	trans	-69.9	-41.9	173.5	-69.1	-173.3	179.2	-177.2	0	112.3	T510 Q514 V515 S516	T510-K512 PolarHBondContact O-N 2.75Å; K512-Q514 VanDerWaalsContact C-N 3.35Å; K512-V515 VanDerWaalsContact O-CG2 3.3Å; K512-V515 WeakPolarHBondContact O-CG2 3.47Å; K512-V515 PolarHBondContact O-N 2.85Å; K512-S516 PolarHBondContact O-N 2.91Å
513	Q	89.6	Confident	88.7	Confident	45 Å²	45	53 Å²	53	21%	0.21	29%	0.288	C	S	.	.	H	α-helix	trans	-69.1	-34.2	178.2	-71.2	156.9	-24.5	0	0	111.9	L509 T510 V515 S516 L521	L509-Q513 HydrophobicContact CD2-CB 4.05Å; T510-Q513 WeakPolarHBondContact O-CA 3.5Å; T510-Q513 WeakPolarHBondContact O-CB 3.45Å; T510-Q513 PolarHBondContact O-N 3.39Å; T510-Q513 WeakPolarHBondContact OG1-CG 3.38Å; T510-Q513 PolarHBondContact OG1-N 2.9Å; T510-Q513 PolarHBondContact OG1-OE1 3.13Å; Q513-V515 PolarHBondContact O-N 3.12Å; Q513-S516 PolarHBondContact O-N 3.2Å; Q513-L521 HydrophobicContact CB-CD2 4.04Å; Q513-L521 HydrophobicContact CG-CD2 4.24Å
514	Q	92.4	Very high	88.4	Confident	9 Å²	9	52.5 Å²	52.5	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-26.8	178.9	-68.4	-179.7	15.2	0	0	113.8	S482 L484 R501 I504 L509 T510 K512	S482-Q514 WeakPolarHBondContact CB-O 3.29Å; L484-Q514 WeakPolarHBondContact CB-O 3.37Å; L484-Q514 PolarHBondContact N-O 3.26Å; L484-Q514 VanDerWaalsContact N-O 3.16Å; R501-Q514 VanDerWaalsContact CG-OE1 3.29Å; R501-Q514 PolarHBondContact O-NE2 2.76Å; I504-Q514 HydrophobicContact CB-CG 4.38Å; I504-Q514 HydrophobicContact CG2-CG 3.74Å; L509-Q514 HydrophobicContact CB-CG 4.1Å; L509-Q514 PolarHBondContact O-NE2 3.14Å; T510-Q514 WeakPolarHBondContact O-CG 3.23Å; T510-Q514 PolarHBondContact O-N 2.78Å; K512-Q514 VanDerWaalsContact C-N 3.35Å
515	V	93	Very high	88.2	Confident	75 Å²	75	54.2 Å²	54.2	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-104.1	-6.9	178.9	-59.7	0	0	0	0	113	L484 K512 Q513	L484-V515 HydrophobicContact CD2-CG1 4.41Å; K512-V515 VanDerWaalsContact O-CG2 3.3Å; K512-V515 WeakPolarHBondContact O-CG2 3.47Å; K512-V515 PolarHBondContact O-N 2.85Å; Q513-V515 PolarHBondContact O-N 3.12Å
516	S	90.3	Very high	88.2	Confident	30 Å²	30	54.4 Å²	54.4	21%	0.21	29%	0.287	C	S	.	.	S	Bend	trans	-78	139.9	174.5	179.3	0	0	0	0	109.3	S482 P483 K512 Q513	S482-S516 WeakPolarHBondContact CA-O 3.43Å; S482-S516 WeakPolarHBondContact CB-O 3.38Å; P483-S516 WeakPolarHBondContact CD-O 3.44Å; K512-S516 PolarHBondContact O-N 2.91Å; Q513-S516 PolarHBondContact O-N 3.2Å
517	P	91.2	Very high	88.2	Confident	46 Å²	46	47.6 Å²	47.6	30%	0.299	26%	0.261	S	S	.	.			trans	-52.3	141.7	171	-27.8	36.1	0	0	0	112	R519 N520	P517-R519 HydrophobicContact CB-CG 3.84Å; P517-R519 PolarHBondContact O-N 2.76Å; P517-N520 PolarHBondContact O-N 3.37Å
518	I	91.1	Very high	88.2	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-59.1	-32.4	-176.7	-72.7	167.2	0	0	0	111.6	L477 L479 L481 P483 Y486 N520 L521 K526	L477-I518 HydrophobicContact CB-CD1 4.36Å; L477-I518 HydrophobicContact CB-CG2 4.08Å; L477-I518 HydrophobicContact CD1-CG2 3.99Å; L479-I518 HydrophobicContact CD2-CG2 3.92Å; L481-I518 VanDerWaalsContact O-CG1 3.27Å; L481-I518 WeakPolarHBondContact O-CG1 3.42Å; L481-I518 PolarHBondContact O-N 3.25Å; P483-I518 HydrophobicContact CG-CG1 3.98Å; Y486-I518 HydrophobicContact CG-CD1 4.22Å; I518-N520 PolarHBondContact O-N 2.8Å; I518-N520 VanDerWaalsContact O-N 3.09Å; I518-L521 HydrophobicContact CG1-CD1 4.25Å; I518-L521 WeakPolarHBondContact O-CB 3.35Å; I518-L521 PolarHBondContact O-N 3.27Å; I518-K526 HydrophobicContact CG2-CG 4.25Å
519	R	88.4	Confident	88.4	Confident	147 Å²	147	48.1 Å²	48.1	56%	0.555	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-53.9	-27.6	174.2	61.5	169.7	75.5	178.1	2.6	114.9	L479 D480 P517	L479-R519 HydrophobicContact CB-CB 4.21Å; L479-R519 WeakPolarHBondContact O-CB 3.25Å; L479-R519 WeakPolarHBondContact O-CG 3.24Å; L479-R519 PolarHBondContact O-N 2.75Å; D480-R519 IonicContact OD1-CZ 3.83Å; D480-R519 IonicContact OD1-NE 3.52Å; D480-R519 IonicContact OD1-NH2 2.67Å; D480-R519 PolarHBondContact OD1-NH2 2.67Å; D480-R519 IonicContact OD2-NH2 2.69Å; P517-R519 HydrophobicContact CB-CG 3.84Å; P517-R519 PolarHBondContact O-N 2.76Å
520	N	86.1	Confident	88.6	Confident	110 Å²	110	48 Å²	48	59%	0.588	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-92.2	-5.3	-177.5	-65.6	-17.7	0	0	0	112.8	P517 I518	P517-N520 PolarHBondContact O-N 3.37Å; I518-N520 PolarHBondContact O-N 2.8Å; I518-N520 VanDerWaalsContact O-N 3.09Å
521	L	85.7	Confident	88.8	Confident	10 Å²	10	44.7 Å²	44.7	5%	0.052	24%	0.237	C	C	.	.	S	Bend	trans	-81.7	147.4	180	-59	-178.6	0	0	0	110.6	P483 L509 Q513 I518 Q525 K526 V529	P483-L521 HydrophobicContact CG-CD1 3.51Å; L509-L521 HydrophobicContact CD2-CD1 4.44Å; Q513-L521 HydrophobicContact CB-CD2 4.04Å; Q513-L521 HydrophobicContact CG-CD2 4.24Å; I518-L521 HydrophobicContact CG1-CD1 4.25Å; I518-L521 WeakPolarHBondContact O-CB 3.35Å; I518-L521 PolarHBondContact O-N 3.27Å; L521-Q525 VanDerWaalsContact CA-OE1 3.32Å; L521-Q525 HydrophobicContact CB-CB 3.9Å; L521-K526 HydrophobicContact CB-CG 4.17Å; L521-K526 WeakPolarHBondContact O-CE 3.34Å; L521-V529 HydrophobicContact CD1-CG2 4.22Å
522	S	83.1	Confident	89	Confident	50 Å²	50	42.2 Å²	42.2	35%	0.35	21%	0.212	S	C	.	.			trans	-69.1	159.7	170.6	68.3	0	0	0	0	111	G524 Q525 K526	S522-G524 VanDerWaalsContact C-N 3.25Å; S522-G524 PolarHBondContact O-N 3.45Å; S522-Q525 CarbonylContact O-C 3.57Å; S522-Q525 WeakPolarHBondContact O-CA 3.47Å; S522-Q525 WeakPolarHBondContact O-CB 3.5Å; S522-Q525 PolarHBondContact O-N 3.45Å; S522-Q525 VanDerWaalsContact OG-CD 3.32Å; S522-Q525 WeakPolarHBondContact OG-CG 3.22Å; S522-Q525 PolarHBondContact OG-N 2.69Å; S522-K526 PolarHBondContact O-N 3.39Å
523	D	82.2	Confident	89.2	Confident	71 Å²	71	35.9 Å²	35.9	38%	0.38	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-33.5	-178.1	-57.9	-31.2	0	0	0	112.5	Q525 K526 C527 H550	D523-Q525 VanDerWaalsContact C-N 3.33Å; D523-Q525 PolarHBondContact O-N 3.06Å; D523-K526 PolarHBondContact O-N 3.17Å; D523-K526 IonicContact OD1-NZ 2.67Å; D523-K526 PolarHBondContact OD1-NZ 2.77Å; D523-C527 WeakPolarHBondContact O-CB 3.35Å; D523-C527 PolarHBondContact O-N 2.92Å; D523-H550 HydrophobicContact CB-CB 4.23Å
524	G	83.4	Confident	89.3	Confident	6 Å²	6	33.7 Å²	33.7	6%	0.062	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-34.7	170.2	0	0	0	0	0	113.4	S522 R528 H550	S522-G524 VanDerWaalsContact C-N 3.25Å; S522-G524 PolarHBondContact O-N 3.45Å; G524-R528 WeakPolarHBondContact O-CG 3.34Å; G524-R528 PolarHBondContact O-N 2.76Å; G524-R528 VanDerWaalsContact O-N 3.15Å; G524-H550 VanDerWaalsContact CA-O 3.28Å; G524-H550 WeakPolarHBondContact CA-O 3.49Å
525	Q	87.6	Confident	89.3	Confident	37 Å²	37	33.3 Å²	33.3	17%	0.173	17%	0.172	C	C	.	.	H	α-helix	trans	-71.8	-40.1	173.6	-71.2	162.2	6.9	0	0	111.4	L509 L521 S522 D523 C527 R528 V529	L509-Q525 HydrophobicContact CD2-CB 4.31Å; L521-Q525 VanDerWaalsContact CA-OE1 3.32Å; L521-Q525 HydrophobicContact CB-CB 3.9Å; S522-Q525 CarbonylContact O-C 3.57Å; S522-Q525 WeakPolarHBondContact O-CA 3.47Å; S522-Q525 WeakPolarHBondContact O-CB 3.5Å; S522-Q525 PolarHBondContact O-N 3.45Å; S522-Q525 VanDerWaalsContact OG-CD 3.32Å; S522-Q525 WeakPolarHBondContact OG-CG 3.22Å; S522-Q525 PolarHBondContact OG-N 2.69Å; D523-Q525 VanDerWaalsContact C-N 3.33Å; D523-Q525 PolarHBondContact O-N 3.06Å; Q525-C527 VanDerWaalsContact C-N 3.33Å; Q525-R528 WeakPolarHBondContact O-CB 3.45Å; Q525-R528 PolarHBondContact O-N 3.32Å; Q525-V529 WeakPolarHBondContact O-CG2 3.37Å; Q525-V529 PolarHBondContact O-N 2.93Å
526	K	90.3	Very high	89.2	Confident	36 Å²	36	33.5 Å²	33.5	16%	0.157	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-43.4	173.1	-64.8	176.6	-167	154.5	0	111.2	Q474 L477 I518 L521 S522 D523 R528 V529 C530	Q474-K526 HydrophobicContact CB-CB 4.49Å; Q474-K526 HydrophobicContact CG-CB 4.22Å; L477-K526 HydrophobicContact CD1-CB 4.09Å; L477-K526 HydrophobicContact CD1-CG 4.47Å; I518-K526 HydrophobicContact CG2-CG 4.25Å; L521-K526 HydrophobicContact CB-CG 4.17Å; L521-K526 WeakPolarHBondContact O-CE 3.34Å; S522-K526 PolarHBondContact O-N 3.39Å; D523-K526 PolarHBondContact O-N 3.17Å; D523-K526 IonicContact OD1-NZ 2.67Å; D523-K526 PolarHBondContact OD1-NZ 2.77Å; K526-R528 VanDerWaalsContact C-N 3.33Å; K526-R528 PolarHBondContact O-N 2.91Å; K526-V529 WeakPolarHBondContact O-CB 3.42Å; K526-V529 PolarHBondContact O-N 3.16Å; K526-V529 VanDerWaalsContact O-N 3.08Å; K526-C530 PolarHBondContact O-N 3.46Å; K526-C530 PolarHBondContact O-SG 3.3Å
527	C	89.2	Confident	89.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-55.1	-46.9	173.3	-179.8	0	0	0	0	111.7	Y469 D523 Q525 V529 C530 L531 L551	Y469-C527 PolarHBondContact OH-SG 3.3Å; D523-C527 WeakPolarHBondContact O-CB 3.35Å; D523-C527 PolarHBondContact O-N 2.92Å; Q525-C527 VanDerWaalsContact C-N 3.33Å; C527-V529 VanDerWaalsContact C-N 3.31Å; C527-V529 PolarHBondContact O-N 2.93Å; C527-C530 WeakPolarHBondContact O-CB 3.36Å; C527-C530 PolarHBondContact O-N 3.39Å; C527-C530 VanDerWaalsContact O-N 3.11Å; C527-L531 WeakPolarHBondContact O-CG 3.21Å; C527-L531 PolarHBondContact O-N 3.03Å; C527-L551 HydrophobicContact CB-CD2 3.89Å; C527-L551 WeakPolarHBondContact SG-CD2 3.25Å
528	R	89.4	Confident	89.1	Confident	31 Å²	31	35 Å²	35	12%	0.117	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-37.2	175.3	-69.7	171.1	-176.7	-176.6	10.1	113	F387 Y507 G508 L509 G524 Q525 K526 L531 A532 D552 T555	F387-R528 HydrophobicContact CZ-CG 4.21Å; Y507-R528 WeakPolarHBondContact O-CB 3.45Å; Y507-R528 VanDerWaalsContact O-CD 3.27Å; Y507-R528 WeakPolarHBondContact O-CD 3.43Å; Y507-R528 WeakPolarHBondContact O-CG 3.44Å; G508-R528 PolarHBondContact O-NH1 3.4Å; L509-R528 HydrophobicContact CD1-CB 4.19Å; G524-R528 WeakPolarHBondContact O-CG 3.34Å; G524-R528 PolarHBondContact O-N 2.76Å; G524-R528 VanDerWaalsContact O-N 3.15Å; Q525-R528 WeakPolarHBondContact O-CB 3.45Å; Q525-R528 PolarHBondContact O-N 3.32Å; K526-R528 VanDerWaalsContact C-N 3.33Å; K526-R528 PolarHBondContact O-N 2.91Å; R528-L531 PolarHBondContact O-N 3.34Å; R528-A532 WeakPolarHBondContact O-CB 3.33Å; R528-A532 PolarHBondContact O-N 3.42Å; R528-D552 IonicContact NH2-OD1 3.08Å; R528-D552 IonicContact NH2-OD2 2.73Å; R528-D552 PolarHBondContact NH2-OD2 3.25Å; R528-T555 HydrophobicContact CG-CG2 4.36Å; R528-T555 PolarHBondContact NE-OG1 3.34Å; R528-T555 PolarHBondContact NH2-OG1 3.4Å
529	V	91.9	Very high	89.2	Confident	1 Å²	1	35 Å²	35	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-45.3	173.1	177.8	0	0	0	0	110.7	L477 P483 L509 L521 Q525 K526 C527 L531 A532 W533	L477-V529 HydrophobicContact CD2-CG1 4.36Å; P483-V529 HydrophobicContact CB-CG1 4.26Å; P483-V529 HydrophobicContact CB-CG2 3.82Å; P483-V529 HydrophobicContact CG-CG2 3.8Å; L509-V529 HydrophobicContact CD1-CG2 3.6Å; L509-V529 HydrophobicContact CD2-CG2 4.06Å; L509-V529 HydrophobicContact CG-CG2 4.49Å; L521-V529 HydrophobicContact CD1-CG2 4.22Å; Q525-V529 WeakPolarHBondContact O-CG2 3.37Å; Q525-V529 PolarHBondContact O-N 2.93Å; K526-V529 WeakPolarHBondContact O-CB 3.42Å; K526-V529 PolarHBondContact O-N 3.16Å; K526-V529 VanDerWaalsContact O-N 3.08Å; C527-V529 VanDerWaalsContact C-N 3.31Å; C527-V529 PolarHBondContact O-N 2.93Å; V529-L531 VanDerWaalsContact C-N 3.34Å; V529-L531 PolarHBondContact O-N 3.49Å; V529-A532 PolarHBondContact O-N 3.06Å; V529-W533 WeakPolarHBondContact O-CB 3.34Å; V529-W533 PolarHBondContact O-N 3.41Å
530	C	92.5	Very high	89.5	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-61.1	-40.7	176.1	-68.6	0	0	0	0	112.4	Y469 L473 K526 C527 W533 L534	Y469-C530 HydrophobicContact CD2-CB 4.36Å; Y469-C530 HydrophobicContact CE2-CB 3.79Å; L473-C530 HydrophobicContact CD2-CB 3.79Å; L473-C530 HydrophobicContact CG-CB 4.29Å; K526-C530 PolarHBondContact O-N 3.46Å; K526-C530 PolarHBondContact O-SG 3.3Å; C527-C530 WeakPolarHBondContact O-CB 3.36Å; C527-C530 PolarHBondContact O-N 3.39Å; C527-C530 VanDerWaalsContact O-N 3.11Å; C530-W533 PolarHBondContact O-N 3Å; C530-L534 VanDerWaalsContact O-CB 3.26Å; C530-L534 WeakPolarHBondContact O-CB 3.43Å; C530-L534 PolarHBondContact O-N 3.31Å
531	L	91.7	Very high	89.9	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.5	-42.3	175.8	-70.1	172.9	0	0	0	111.8	F387 Y469 Y507 C527 R528 V529 W533 L534 A535 L551 L559	F387-L531 HydrophobicContact CD2-CD1 4.32Å; F387-L531 HydrophobicContact CE2-CD1 3.6Å; F387-L531 HydrophobicContact CZ-CD1 4.34Å; Y469-L531 HydrophobicContact CD2-CD2 4.02Å; Y469-L531 HydrophobicContact CE2-CD2 4.22Å; Y469-L531 HydrophobicContact CE2-CG 4.36Å; Y507-L531 HydrophobicContact CD1-CB 3.89Å; Y507-L531 HydrophobicContact CE1-CB 3.94Å; C527-L531 WeakPolarHBondContact O-CG 3.21Å; C527-L531 PolarHBondContact O-N 3.03Å; R528-L531 PolarHBondContact O-N 3.34Å; V529-L531 VanDerWaalsContact C-N 3.34Å; V529-L531 PolarHBondContact O-N 3.49Å; L531-W533 VanDerWaalsContact C-N 3.34Å; L531-W533 PolarHBondContact O-N 3.11Å; L531-L534 PolarHBondContact O-N 3.09Å; L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 3.29Å; L531-L551 HydrophobicContact CD1-CD1 4.32Å; L531-L559 HydrophobicContact CD2-CD1 4.25Å
532	A	91.8	Very high	90.3	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-43.7	174.5	0	0	0	0	0	111.8	Y507 R528 V529 W536	Y507-A532 HydrophobicContact CD1-CB 4.18Å; Y507-A532 HydrophobicContact CD2-CB 3.44Å; Y507-A532 VanDerWaalsContact CD2-CB 3.44Å; Y507-A532 HydrophobicContact CE2-CB 3.99Å; Y507-A532 HydrophobicContact CG-CB 3.57Å; R528-A532 WeakPolarHBondContact O-CB 3.33Å; R528-A532 PolarHBondContact O-N 3.42Å; V529-A532 PolarHBondContact O-N 3.06Å; A532-W536 PolarHBondContact O-N 3.42Å
533	W	92.2	Very high	90.9	Very high	47 Å²	47	20.8 Å²	20.8	18%	0.178	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-46.7	175.1	170.3	81.2	0	0	0	111.7	L473 Y486 M487 Y491 V529 C530 L531 W536 Q537	L473-W533 HydrophobicContact CD1-CH2 4.03Å; L473-W533 HydrophobicContact CD1-CZ3 3.77Å; L473-W533 HydrophobicContact CD2-CE3 4.08Å; L473-W533 HydrophobicContact CD2-CZ3 3.75Å; L473-W533 HydrophobicContact CG-CZ3 4.32Å; Y486-W533 AromaticContact CE1-CD1 3.91Å; Y486-W533 HydrophobicContact CE1-CG 4.28Å; M487-W533 VanDerWaalsContact SD-CA 3.59Å; M487-W533 HydrophobicContact SD-CB 3.8Å; Y491-W533 AromaticContact CE2-CD1 3.99Å; Y491-W533 PolarHBondContact OH-O 3.15Å; V529-W533 WeakPolarHBondContact O-CB 3.34Å; V529-W533 PolarHBondContact O-N 3.41Å; C530-W533 PolarHBondContact O-N 3Å; L531-W533 VanDerWaalsContact C-N 3.34Å; L531-W533 PolarHBondContact O-N 3.11Å; W533-W536 PolarHBondContact O-N 3.07Å; W533-Q537 VanDerWaalsContact CZ3-NE2 3.33Å; W533-Q537 PolarHBondContact O-N 3.12Å
534	L	92.5	Very high	91.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-46.5	-178.6	-179.3	66.5	0	0	0	112	G467 C530 L531 W536 Q537 L542 L544	G467-L534 VanDerWaalsContact C-CD1 3.47Å; G467-L534 VanDerWaalsContact CA-CD1 3.43Å; C530-L534 VanDerWaalsContact O-CB 3.26Å; C530-L534 WeakPolarHBondContact O-CB 3.43Å; C530-L534 PolarHBondContact O-N 3.31Å; L531-L534 PolarHBondContact O-N 3.09Å; L534-W536 VanDerWaalsContact C-N 3.26Å; L534-W536 PolarHBondContact O-N 2.98Å; L534-Q537 WeakPolarHBondContact O-CB 3.24Å; L534-Q537 PolarHBondContact O-N 2.98Å; L534-L542 HydrophobicContact CD2-CD2 4.08Å; L534-L542 HydrophobicContact CG-CD2 4.16Å; L534-L544 HydrophobicContact CD2-CD2 3.88Å
535	A	91.9	Very high	91.9	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-62.1	-36.7	-179.3	0	0	0	0	0	112.3	F389 P390 Y507 L531 Q537 N538	F389-A535 HydrophobicContact CD1-CB 3.54Å; F389-A535 HydrophobicContact CE1-CB 3.74Å; F389-A535 HydrophobicContact CG-CB 4.43Å; P390-A535 WeakPolarHBondContact CD-O 3.49Å; Y507-A535 HydrophobicContact CE2-CB 4.43Å; Y507-A535 WeakPolarHBondContact OH-CB 3.45Å; L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 3.29Å; A535-Q537 PolarHBondContact O-N 3.24Å; A535-N538 PolarHBondContact O-N 2.89Å
536	W	90	Very high	91.9	Very high	78 Å²	78	16.2 Å²	16.2	30%	0.295	7%	0.071	S	C	.	.	H	α-helix	trans	-77	-7.9	-177.5	-147.8	-105.3	0	0	0	114.4	P390 M487 Y491 I494 I503 A532 W533 L534 N538	P390-W536 HydrophobicContact CG-CE3 3.93Å; P390-W536 HydrophobicContact CG-CZ3 3.87Å; M487-W536 HydrophobicContact CE-CB 4.21Å; Y491-W536 AromaticContact CD1-CD1 3.77Å; Y491-W536 HydrophobicContact CD2-CB 4.45Å; Y491-W536 AromaticContact CD2-CD1 3.78Å; Y491-W536 HydrophobicContact CD2-CG 4.45Å; Y491-W536 HydrophobicContact CE1-CB 4.44Å; Y491-W536 AromaticContact CE1-CD1 3.96Å; Y491-W536 HydrophobicContact CE2-CB 3.84Å; Y491-W536 AromaticContact CE2-CD1 3.97Å; Y491-W536 HydrophobicContact CE2-CG 4.29Å; Y491-W536 AromaticContact CG-CD1 3.67Å; I494-W536 HydrophobicContact CD1-CZ2 3.79Å; I503-W536 HydrophobicContact CD1-CD2 4.01Å; I503-W536 HydrophobicContact CD1-CE3 4.13Å; I503-W536 HydrophobicContact CD1-CH2 3.61Å; I503-W536 HydrophobicContact CD1-CZ2 3.47Å; I503-W536 VanDerWaalsContact CD1-CZ2 3.47Å; I503-W536 HydrophobicContact CD1-CZ3 3.95Å; I503-W536 HydrophobicContact CG1-CE3 4.42Å; I503-W536 HydrophobicContact CG1-CH2 4.1Å; I503-W536 HydrophobicContact CG1-CZ2 4.44Å; I503-W536 HydrophobicContact CG1-CZ3 4.09Å; I503-W536 HydrophobicContact CG2-CD2 4.35Å; I503-W536 HydrophobicContact CG2-CE3 4.01Å; I503-W536 HydrophobicContact CG2-CZ3 4.41Å; A532-W536 PolarHBondContact O-N 3.42Å; W533-W536 PolarHBondContact O-N 3.07Å; L534-W536 VanDerWaalsContact C-N 3.26Å; L534-W536 PolarHBondContact O-N 2.98Å; W536-N538 PolarHBondContact O-N 3.3Å
537	Q	89.3	Confident	91.9	Very high	56 Å²	56	14.5 Å²	14.5	26%	0.262	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.4	167.7	-62.2	-178.1	3.2	0	0	112.9	Y491 W533 L534 A535	Y491-Q537 WeakPolarHBondContact OH-CG 3.15Å; Y491-Q537 PolarHBondContact OH-N 2.98Å; W533-Q537 VanDerWaalsContact CZ3-NE2 3.33Å; W533-Q537 PolarHBondContact O-N 3.12Å; L534-Q537 WeakPolarHBondContact O-CB 3.24Å; L534-Q537 PolarHBondContact O-N 2.98Å; A535-Q537 PolarHBondContact O-N 3.24Å
538	N	90.3	Very high	91.7	Very high	51 Å²	51	15.3 Å²	15.3	27%	0.273	7%	0.069	S	C	.	.			trans	49.1	60.7	-171.2	-160.3	8.4	0	0	0	112.1	P390 P391 C392 A535 W536	P390-N538 PolarHBondContact O-OD1 3.41Å; P391-N538 PolarHBondContact O-ND2 3.08Å; P391-N538 VanDerWaalsContact O-ND2 3.15Å; P391-N538 PolarHBondContact O-OD1 3Å; P391-N538 VanDerWaalsContact O-OD1 3.11Å; C392-N538 WeakPolarHBondContact CA-OD1 3.45Å; C392-N538 PolarHBondContact N-OD1 3.49Å; A535-N538 PolarHBondContact O-N 2.89Å; W536-N538 PolarHBondContact O-N 3.3Å
539	P	94	Very high	91.4	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.006	7%	0.067	C	C	.	.			trans	-72.4	143.5	-176.5	30.8	-33.9	0	0	0	111.3	C392 G467 L542 F566	C392-P539 VanDerWaalsContact CB-O 3.25Å; C392-P539 WeakPolarHBondContact CB-O 3.4Å; G467-P539 VanDerWaalsContact N-CB 3.34Å; P539-L542 HydrophobicContact CB-CD2 4.17Å; P539-L542 HydrophobicContact CG-CD2 3.41Å; P539-L542 VanDerWaalsContact CG-CD2 3.41Å; P539-L542 HydrophobicContact CG-CG 4.15Å; P539-F566 WeakPolarHBondContact O-CE2 3.23Å; P539-F566 VanDerWaalsContact O-CZ 3.28Å; P539-F566 WeakPolarHBondContact O-CZ 3.43Å
540	H	94.7	Very high	90.7	Very high	19 Å²	19	18.1 Å²	18.1	9%	0.088	8%	0.083	C	C	.	.	S	Bend	trans	-84.1	-25.7	169.6	-56.7	94.1	0	0	0	111.9	C392 I395 L426 H463 V464 K465 G568 G569	C392-H540 HydrophobicContact CB-CB 4.41Å; C392-H540 PolarHBondContact O-CD2 2.87Å; C392-H540 PolarHBondContact O-NE2 3.21Å; C392-H540 VanDerWaalsContact O-NE2 3.14Å; I395-H540 HydrophobicContact CD1-CB 3.81Å; I395-H540 WeakPolarHBondContact CD1-CD2 3.43Å; L426-H540 HydrophobicContact CD2-CB 4.01Å; L426-H540 WeakPolarHBondContact CD2-O 3.3Å; H463-H540 PolarHBondContact O-CE1 3.42Å; V464-H540 HydrophobicContact CG2-CB 4.21Å; K465-H540 WeakPolarHBondContact CB-ND1 3.1Å; K465-H540 PolarHBondContact N-ND1 3.29Å; K465-H540 PolarHBondContact O-N 2.71Å; H540-G568 CarbonylContact O-C 3.58Å; H540-G568 VanDerWaalsContact O-CA 3.24Å; H540-G568 WeakPolarHBondContact O-CA 3.28Å; H540-G569 PolarHBondContact O-N 2.94Å
541	M	94.5	Very high	90.3	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.6	177.7	-66	-63.4	-53.6	0	0	109.7	V399 I424 L426 V464 K465 I466 G467 F543 G569	V399-M541 HydrophobicContact CG1-CG 4.17Å; V399-M541 HydrophobicContact CG1-SD 4.22Å; I424-M541 HydrophobicContact CG2-CE 3.32Å; I424-M541 HydrophobicContact CG2-SD 4.35Å; L426-M541 HydrophobicContact CD2-SD 4.11Å; V464-M541 HydrophobicContact CG2-CG 3.84Å; K465-M541 PolarHBondContact O-N 3.26Å; K465-M541 VanDerWaalsContact O-N 3.08Å; I466-M541 CarbonylContact C-O 3.58Å; I466-M541 WeakPolarHBondContact CA-O 3.26Å; I466-M541 HydrophobicContact CB-CB 4.46Å; I466-M541 HydrophobicContact CG1-CB 4.14Å; I466-M541 HydrophobicContact CG2-CB 4.28Å; G467-M541 PolarHBondContact N-O 3.33Å; M541-F543 HydrophobicContact CB-CE1 4.26Å; M541-F543 HydrophobicContact CE-CE1 3.85Å; M541-G569 CarbonylContact C-O 3.46Å; M541-G569 WeakPolarHBondContact CA-O 3.46Å; M541-G569 WeakPolarHBondContact SD-CA 3.01Å
542	L	95.1	Very high	89.8	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.1	174.2	-74.5	177.4	0	0	0	110.8	F389 G467 L534 P539 F566 G569 M570 M571	F389-L542 HydrophobicContact CD1-CD1 3.9Å; F389-L542 HydrophobicContact CD1-CD2 4.39Å; F389-L542 HydrophobicContact CD2-CD1 4.28Å; F389-L542 HydrophobicContact CE1-CD1 3.84Å; F389-L542 HydrophobicContact CE1-CD2 4.1Å; F389-L542 HydrophobicContact CE2-CD1 4.22Å; F389-L542 HydrophobicContact CG-CD1 4.14Å; F389-L542 HydrophobicContact CZ-CD1 4.01Å; G467-L542 WeakPolarHBondContact O-CA 3.36Å; L534-L542 HydrophobicContact CD2-CD2 4.08Å; L534-L542 HydrophobicContact CG-CD2 4.16Å; P539-L542 HydrophobicContact CB-CD2 4.17Å; P539-L542 HydrophobicContact CG-CD2 3.41Å; P539-L542 VanDerWaalsContact CG-CD2 3.41Å; P539-L542 HydrophobicContact CG-CG 4.15Å; L542-F566 HydrophobicContact CB-CE1 4.09Å; L542-F566 HydrophobicContact CD1-CD1 3.57Å; L542-F566 HydrophobicContact CD1-CD2 4.22Å; L542-F566 HydrophobicContact CD1-CE1 3.53Å; L542-F566 HydrophobicContact CD1-CE2 4.2Å; L542-F566 HydrophobicContact CD1-CG 3.91Å; L542-F566 HydrophobicContact CD1-CZ 3.87Å; L542-F566 HydrophobicContact CG-CD1 4.15Å; L542-F566 HydrophobicContact CG-CE1 3.57Å; L542-F566 HydrophobicContact CG-CE2 4.4Å; L542-F566 HydrophobicContact CG-CZ 3.72Å; L542-G569 PolarHBondContact N-O 3.36Å; L542-M570 HydrophobicContact CB-CB 4.35Å; L542-M570 HydrophobicContact CB-CG 4.23Å; L542-M570 CarbonylContact O-C 3.58Å; L542-M570 VanDerWaalsContact O-CA 3.3Å; L542-M570 WeakPolarHBondContact O-CA 3.42Å; L542-M571 PolarHBondContact O-N 3.14Å
543	F	95.6	Very high	89.3	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.8	172	-66.4	-11	0	0	0	109.1	I400 L444 L447 T448 I466 G467 R468 Y469 M541 M571	I400-F543 HydrophobicContact CD1-CZ 3.89Å; L444-F543 HydrophobicContact CD2-CB 4.1Å; L444-F543 HydrophobicContact CD2-CD1 4.5Å; L444-F543 HydrophobicContact CD2-CD2 4.2Å; L444-F543 HydrophobicContact CD2-CG 4.03Å; L447-F543 HydrophobicContact CB-CE2 3.67Å; L447-F543 HydrophobicContact CB-CZ 4.08Å; L447-F543 HydrophobicContact CD1-CE2 4.46Å; L447-F543 HydrophobicContact CD1-CZ 4.32Å; T448-F543 HydrophobicContact CG2-CD2 3.89Å; T448-F543 HydrophobicContact CG2-CE2 4.2Å; I466-F543 HydrophobicContact CD1-CE2 4.16Å; I466-F543 HydrophobicContact CD1-CZ 4.43Å; I466-F543 HydrophobicContact CG2-CD1 4.45Å; I466-F543 HydrophobicContact CG2-CD2 3.45Å; I466-F543 VanDerWaalsContact CG2-CD2 3.45Å; I466-F543 HydrophobicContact CG2-CE2 3.53Å; I466-F543 HydrophobicContact CG2-CG 3.94Å; I466-F543 HydrophobicContact CG2-CZ 4.07Å; G467-F543 PolarHBondContact O-N 3.24Å; R468-F543 CarbonylContact C-O 3.57Å; R468-F543 WeakPolarHBondContact CA-O 2.83Å; R468-F543 HydrophobicContact CB-CB 4.42Å; R468-F543 HydrophobicContact CG-CB 4.28Å; Y469-F543 PolarHBondContact N-O 3.12Å; M541-F543 HydrophobicContact CB-CE1 4.26Å; M541-F543 HydrophobicContact CE-CE1 3.85Å; F543-M571 WeakPolarHBondContact CA-O 3.36Å; F543-M571 HydrophobicContact CD1-CB 3.83Å; F543-M571 HydrophobicContact CD1-CE 3.8Å; F543-M571 HydrophobicContact CD1-CG 4.15Å; F543-M571 HydrophobicContact CE1-CB 4.19Å; F543-M571 HydrophobicContact CE1-CE 3.42Å; F543-M571 VanDerWaalsContact CE1-CE 3.42Å; F543-M571 HydrophobicContact CE1-CG 3.99Å; F543-M571 HydrophobicContact CE1-SD 4.49Å; F543-M571 HydrophobicContact CE2-CE 4.2Å; F543-M571 HydrophobicContact CG-CE 4.36Å; F543-M571 HydrophobicContact CZ-CE 3.65Å
544	L	94.4	Very high	88.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	105.7	-173.2	-57.4	177.9	0	0	0	110	L534 P547 I563 M571 L572 V573	L534-L544 HydrophobicContact CD2-CD2 3.88Å; L544-P547 HydrophobicContact CB-CB 4.33Å; L544-P547 HydrophobicContact CB-CG 3.97Å; L544-I563 HydrophobicContact CD1-CD1 3.58Å; L544-I563 HydrophobicContact CD1-CG1 4.35Å; L544-M571 PolarHBondContact N-O 3.2Å; L544-L572 HydrophobicContact CB-CD1 3.8Å; L544-L572 HydrophobicContact CD1-CD1 4.34Å; L544-V573 PolarHBondContact O-N 3.09Å
545	D	92	Very high	88.5	Confident	11 Å²	11	19.9 Å²	19.9	6%	0.059	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	99.1	179.2	-161.3	0.7	0	0	0	110.8	S441 L444 Y469 H470	S441-D545 WeakPolarHBondContact CB-OD2 3.38Å; S441-D545 PolarHBondContact OG-OD1 3.43Å; S441-D545 PolarHBondContact OG-OD2 3.27Å; L444-D545 HydrophobicContact CD1-CB 3.79Å; Y469-D545 WeakPolarHBondContact O-CB 3.02Å; Y469-D545 PolarHBondContact O-N 3.09Å; H470-D545 HydrophobicContact CB-CB 4.41Å
546	E	87.7	Confident	88.3	Confident	6 Å²	6	20 Å²	20	3%	0.028	10%	0.095	C	C	.	.	S	Bend	trans	52	60.5	-175.5	-61.2	-62.2	153.1	0	0	113.8	Q471 T548 V573 S574 H575	Q471-E546 HydrophobicContact CG-CB 4.21Å; Q471-E546 VanDerWaalsContact NE2-CB 3.32Å; E546-T548 PolarHBondContact O-N 3.49Å; E546-V573 WeakPolarHBondContact CA-O 3.37Å; E546-V573 PolarHBondContact N-O 3.33Å; E546-S574 VanDerWaalsContact OE1-CA 3.31Å; E546-S574 WeakPolarHBondContact OE1-CA 3.46Å; E546-S574 WeakPolarHBondContact OE2-CA 3.47Å; E546-H575 VanDerWaalsContact CD-CD2 3.42Å; E546-H575 IonicContact OE1-CD2 2.63Å; E546-H575 PolarHBondContact OE1-CD2 3.26Å; E546-H575 IonicContact OE1-CE1 3.18Å; E546-H575 PolarHBondContact OE1-CE1 3.16Å; E546-H575 VanDerWaalsContact OE1-CE1 3.3Å; E546-H575 IonicContact OE1-CG 2.77Å; E546-H575 IonicContact OE1-ND1 3.05Å; E546-H575 IonicContact OE1-NE2 2.63Å; E546-H575 PolarHBondContact OE1-NE2 3.46Å; E546-H575 VanDerWaalsContact OE1-NE2 3.08Å; E546-H575 IonicContact OE2-CD2 2.86Å; E546-H575 PolarHBondContact OE2-CD2 3.43Å; E546-H575 IonicContact OE2-CG 2.92Å; E546-H575 PolarHBondContact OE2-N 2.93Å
547	P	89.2	Confident	88.2	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.6	-176.9	32.6	-38.1	0	0	0	113.6	Y469 L544 N549 L551 L559 L572 L579	Y469-P547 HydrophobicContact CD1-CB 4.09Å; Y469-P547 HydrophobicContact CE1-CB 4.25Å; L544-P547 HydrophobicContact CB-CB 4.33Å; L544-P547 HydrophobicContact CB-CG 3.97Å; P547-N549 VanDerWaalsContact C-N 3.31Å; P547-N549 PolarHBondContact O-N 2.87Å; P547-L551 WeakPolarHBondContact O-CD1 3.08Å; P547-L559 HydrophobicContact CB-CD2 3.95Å; P547-L559 HydrophobicContact CG-CD2 4.2Å; P547-L572 HydrophobicContact CG-CD1 3.6Å; P547-L579 HydrophobicContact CG-CD2 4.19Å
548	T	85.6	Confident	88.3	Confident	17 Å²	17	15.9 Å²	15.9	10%	0.104	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-15.4	-175.9	50.9	0	0	0	0	113.5	E546 H550 L551 I556 D576 L579	E546-T548 PolarHBondContact O-N 3.49Å; T548-H550 PolarHBondContact O-N 2.8Å; T548-L551 WeakPolarHBondContact O-CB 3.48Å; T548-L551 PolarHBondContact O-N 3.41Å; T548-I556 HydrophobicContact CG2-CD1 4.17Å; T548-I556 HydrophobicContact CG2-CG1 4.18Å; T548-I556 HydrophobicContact CG2-CG2 4.37Å; T548-D576 HydrophobicContact CG2-CB 4.08Å; T548-L579 HydrophobicContact CG2-CB 4.48Å; T548-L579 HydrophobicContact CG2-CD2 3.4Å; T548-L579 VanDerWaalsContact CG2-CD2 3.4Å
549	N	82.2	Confident	88.4	Confident	16 Å²	16	13.4 Å²	13.4	9%	0.086	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	127.7	-179.4	-72.2	-12.4	0	0	0	110.7	Q471 P547 L551	Q471-N549 PolarHBondContact NE2-ND2 3.27Å; P547-N549 VanDerWaalsContact C-N 3.31Å; P547-N549 PolarHBondContact O-N 2.87Å; N549-L551 PolarHBondContact O-N 2.65Å
550	H	78	Confident	88.3	Confident	75 Å²	75	13.4 Å²	13.4	35%	0.347	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	8.9	-178.5	-42.2	-74.3	0	0	0	115.8	N124 D523 G524 T548	N124-H550 PolarHBondContact ND2-O 3.02Å; D523-H550 HydrophobicContact CB-CB 4.23Å; G524-H550 VanDerWaalsContact CA-O 3.28Å; G524-H550 WeakPolarHBondContact CA-O 3.49Å; T548-H550 PolarHBondContact O-N 2.8Å
551	L	83	Confident	88.2	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.			trans	-88.9	142.3	173.6	-66.2	-171.5	0	0	0	110.9	H287 C527 L531 P547 T548 N549 T555 I556 L559	H287-L551 WeakPolarHBondContact CB-O 3.24Å; H287-L551 PolarHBondContact CD2-O 3.45Å; C527-L551 HydrophobicContact CB-CD2 3.89Å; C527-L551 WeakPolarHBondContact SG-CD2 3.25Å; L531-L551 HydrophobicContact CD1-CD1 4.32Å; P547-L551 WeakPolarHBondContact O-CD1 3.08Å; T548-L551 WeakPolarHBondContact O-CB 3.48Å; T548-L551 PolarHBondContact O-N 3.41Å; N549-L551 PolarHBondContact O-N 2.65Å; L551-T555 HydrophobicContact CB-CG2 4.45Å; L551-T555 HydrophobicContact CD1-CG2 4.01Å; L551-T555 HydrophobicContact CD2-CG2 3.75Å; L551-T555 HydrophobicContact CG-CG2 4.3Å; L551-I556 HydrophobicContact CB-CD1 4.49Å; L551-I556 HydrophobicContact CB-CG1 3.91Å; L551-L559 HydrophobicContact CD1-CD2 4.4Å
552	D	82.2	Confident	88.2	Confident	8 Å²	8	17.2 Å²	17.2	4%	0.043	9%	0.088	C	C	.	.			trans	-79.8	164.8	169.9	57.8	32.9	0	0	0	111.5	N124 H287 R528 E554 T555 I556	N124-D552 PolarHBondContact ND2-N 2.87Å; H287-D552 WeakPolarHBondContact ND1-CA 3.22Å; R528-D552 IonicContact NH2-OD1 3.08Å; R528-D552 IonicContact NH2-OD2 2.73Å; R528-D552 PolarHBondContact NH2-OD2 3.25Å; D552-E554 VanDerWaalsContact C-N 3.26Å; D552-E554 PolarHBondContact O-N 3.03Å; D552-T555 PolarHBondContact O-N 3.46Å; D552-T555 VanDerWaalsContact OD1-CB 3.22Å; D552-T555 WeakPolarHBondContact OD1-CB 3.33Å; D552-T555 PolarHBondContact OD1-N 3.46Å; D552-T555 PolarHBondContact OD1-OG1 2.93Å; D552-I556 WeakPolarHBondContact O-CG1 3.47Å; D552-I556 PolarHBondContact O-N 3.4Å
553	I	82	Confident	88.1	Confident	19 Å²	19	17.3 Å²	17.3	10%	0.097	9%	0.089	C	C	.	.	H	α-helix	trans	-55.8	-42.5	-175.8	-65.4	172.3	0	0	0	111.3	H287 Q289 Y314 T555 I556 D557	H287-I553 WeakPolarHBondContact O-CG1 3.4Å; Q289-I553 HydrophobicContact CG-CD1 4.26Å; Q289-I553 HydrophobicContact CG-CG1 4.5Å; Q289-I553 HydrophobicContact CG-CG2 4.06Å; Y314-I553 HydrophobicContact CE2-CD1 3.66Å; I553-T555 VanDerWaalsContact C-N 3.32Å; I553-T555 PolarHBondContact O-N 3.23Å; I553-I556 PolarHBondContact O-N 3.5Å; I553-D557 PolarHBondContact O-N 2.83Å
554	E	81.9	Confident	88	Confident	59 Å²	59	21.7 Å²	21.7	28%	0.276	11%	0.112	S	C	.	.	H	α-helix	trans	-65.2	-35.8	179	-65.2	175.1	-167.8	0	0	112.2	L123 D382 D552 A558	L123-E554 WeakPolarHBondContact CD2-OE2 3.48Å; D382-E554 WeakPolarHBondContact CB-OE1 3.49Å; D552-E554 VanDerWaalsContact C-N 3.26Å; D552-E554 PolarHBondContact O-N 3.03Å; E554-A558 WeakPolarHBondContact O-CB 3.37Å; E554-A558 PolarHBondContact O-N 2.88Å
555	T	85.7	Confident	87.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.7	-36.4	175.9	-50.7	0	0	0	0	111.9	L385 F387 R528 L551 D552 I553 D557 A558 L559	L385-T555 HydrophobicContact CD1-CG2 4.43Å; F387-T555 HydrophobicContact CE1-CG2 4.34Å; F387-T555 HydrophobicContact CE2-CG2 3.55Å; F387-T555 HydrophobicContact CZ-CG2 3.3Å; R528-T555 HydrophobicContact CG-CG2 4.36Å; R528-T555 PolarHBondContact NE-OG1 3.34Å; R528-T555 PolarHBondContact NH2-OG1 3.4Å; L551-T555 HydrophobicContact CB-CG2 4.45Å; L551-T555 HydrophobicContact CD1-CG2 4.01Å; L551-T555 HydrophobicContact CD2-CG2 3.75Å; L551-T555 HydrophobicContact CG-CG2 4.3Å; D552-T555 PolarHBondContact O-N 3.46Å; D552-T555 VanDerWaalsContact OD1-CB 3.22Å; D552-T555 WeakPolarHBondContact OD1-CB 3.33Å; D552-T555 PolarHBondContact OD1-N 3.46Å; D552-T555 PolarHBondContact OD1-OG1 2.93Å; I553-T555 VanDerWaalsContact C-N 3.32Å; I553-T555 PolarHBondContact O-N 3.23Å; T555-D557 VanDerWaalsContact C-N 3.34Å; T555-A558 PolarHBondContact O-N 3.07Å; T555-L559 WeakPolarHBondContact O-CB 3.36Å; T555-L559 PolarHBondContact O-N 3.48Å
556	I	87.7	Confident	87.9	Confident	5 Å²	5	27.8 Å²	27.8	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-63.7	-43.4	175.4	-64.8	170.9	0	0	0	109.9	T548 L551 D552 I553 L559 A560 L579	T548-I556 HydrophobicContact CG2-CD1 4.17Å; T548-I556 HydrophobicContact CG2-CG1 4.18Å; T548-I556 HydrophobicContact CG2-CG2 4.37Å; L551-I556 HydrophobicContact CB-CD1 4.49Å; L551-I556 HydrophobicContact CB-CG1 3.91Å; D552-I556 WeakPolarHBondContact O-CG1 3.47Å; D552-I556 PolarHBondContact O-N 3.4Å; I553-I556 PolarHBondContact O-N 3.5Å; I556-L559 WeakPolarHBondContact O-CB 3.32Å; I556-L559 PolarHBondContact O-N 3Å; I556-A560 PolarHBondContact O-N 3.21Å; I556-L579 HydrophobicContact CG2-CB 4.3Å; I556-L579 HydrophobicContact CG2-CD1 4.39Å
557	D	87.9	Confident	88	Confident	43 Å²	43	34 Å²	34	23%	0.23	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-46.6	175.6	-73.8	-12	0	0	0	111.5	I553 T555 L559 A560 D561 R578	I553-D557 PolarHBondContact O-N 2.83Å; T555-D557 VanDerWaalsContact C-N 3.34Å; D557-L559 VanDerWaalsContact C-N 3.28Å; D557-L559 PolarHBondContact O-N 3.12Å; D557-A560 WeakPolarHBondContact O-CB 3.37Å; D557-A560 PolarHBondContact O-N 3.04Å; D557-A560 VanDerWaalsContact O-N 3.16Å; D557-D561 PolarHBondContact O-N 3.01Å; D557-R578 VanDerWaalsContact CG-NH2 3.34Å; D557-R578 IonicContact OD1-CZ 3.76Å; D557-R578 IonicContact OD1-NH1 3.37Å; D557-R578 PolarHBondContact OD1-NH1 3.44Å; D557-R578 IonicContact OD1-NH2 2.74Å; D557-R578 PolarHBondContact OD1-NH2 3.18Å; D557-R578 IonicContact OD2-CZ 3.6Å; D557-R578 IonicContact OD2-NH1 2.61Å; D557-R578 IonicContact OD2-NH2 3.97Å; D557-R578 PolarHBondContact OD2-NH2 3.37Å; D557-R578 VanDerWaalsContact OD2-NH2 3.08Å
558	A	90.6	Very high	88.2	Confident	3 Å²	3	34 Å²	34	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-61.4	-35.9	176	0	0	0	0	0	112.9	L385 F387 E554 T555 A562	L385-A558 HydrophobicContact CB-CB 3.72Å; L385-A558 VanDerWaalsContact O-CB 3.29Å; L385-A558 WeakPolarHBondContact O-CB 3.24Å; F387-A558 HydrophobicContact CD1-CB 4.24Å; F387-A558 HydrophobicContact CD2-CB 4.44Å; F387-A558 HydrophobicContact CG-CB 4.21Å; E554-A558 WeakPolarHBondContact O-CB 3.37Å; E554-A558 PolarHBondContact O-N 2.88Å; T555-A558 PolarHBondContact O-N 3.07Å; A558-A562 WeakPolarHBondContact O-CB 3.43Å; A558-A562 PolarHBondContact O-N 2.88Å; A558-A562 VanDerWaalsContact O-N 3.13Å
559	L	92.4	Very high	88.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68.1	-42.9	174.8	178.4	63.6	0	0	0	111.4	F387 F389 L531 P547 L551 T555 I556 D557 A562 I563	F387-L559 HydrophobicContact CD2-CB 4.04Å; F387-L559 HydrophobicContact CD2-CD1 4.26Å; F387-L559 HydrophobicContact CE2-CB 4.3Å; F389-L559 HydrophobicContact CE2-CD1 4.28Å; F389-L559 HydrophobicContact CZ-CD1 4.31Å; L531-L559 HydrophobicContact CD2-CD1 4.25Å; P547-L559 HydrophobicContact CB-CD2 3.95Å; P547-L559 HydrophobicContact CG-CD2 4.2Å; L551-L559 HydrophobicContact CD1-CD2 4.4Å; T555-L559 WeakPolarHBondContact O-CB 3.36Å; T555-L559 PolarHBondContact O-N 3.48Å; I556-L559 WeakPolarHBondContact O-CB 3.32Å; I556-L559 PolarHBondContact O-N 3Å; D557-L559 VanDerWaalsContact C-N 3.28Å; D557-L559 PolarHBondContact O-N 3.12Å; L559-A562 PolarHBondContact O-N 3.44Å; L559-I563 HydrophobicContact CD1-CD1 3.94Å; L559-I563 HydrophobicContact CD1-CG1 4.2Å; L559-I563 HydrophobicContact CD2-CD1 4.49Å; L559-I563 HydrophobicContact CG-CD1 3.81Å; L559-I563 HydrophobicContact CG-CG1 4.45Å; L559-I563 WeakPolarHBondContact O-CB 3.46Å; L559-I563 WeakPolarHBondContact O-CG1 3.49Å; L559-I563 PolarHBondContact O-N 3.09Å
560	A	92.6	Very high	89.1	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-45.8	177.4	0	0	0	0	0	111.5	I556 D557 A562 I563 N564 L579 Q582 V583	I556-A560 PolarHBondContact O-N 3.21Å; D557-A560 WeakPolarHBondContact O-CB 3.37Å; D557-A560 PolarHBondContact O-N 3.04Å; D557-A560 VanDerWaalsContact O-N 3.16Å; A560-A562 PolarHBondContact O-N 3.35Å; A560-I563 PolarHBondContact O-N 3.19Å; A560-N564 PolarHBondContact O-N 3.38Å; A560-N564 PolarHBondContact O-ND2 3.38Å; A560-L579 HydrophobicContact CB-CD1 3.82Å; A560-Q582 HydrophobicContact CB-CB 4.28Å; A560-V583 HydrophobicContact CB-CG1 4.03Å
561	D	93	Very high	90	Very high	99 Å²	99	28.9 Å²	28.9	53%	0.529	14%	0.144	S	C	.	.	H	α-helix	trans	-59.9	-46.5	176.3	-70.3	-19.3	0	0	0	111.4	D557 I563 N564 E565	D557-D561 PolarHBondContact O-N 3.01Å; D561-I563 VanDerWaalsContact C-N 3.32Å; D561-I563 PolarHBondContact O-N 3.4Å; D561-N564 PolarHBondContact O-N 2.96Å; D561-E565 PolarHBondContact O-N 3.19Å
562	A	92.8	Very high	90.6	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	14%	0.144	C	C	.	.	H	α-helix	trans	-64.5	-35.7	179.3	0	0	0	0	0	113.2	F387 F389 A558 L559 A560 F566	F387-A562 VanDerWaalsContact C-CB 3.49Å; F387-A562 HydrophobicContact CB-CB 3.52Å; F387-A562 WeakPolarHBondContact O-CB 3.09Å; F389-A562 HydrophobicContact CD2-CB 3.8Å; F389-A562 HydrophobicContact CE2-CB 3.86Å; A558-A562 WeakPolarHBondContact O-CB 3.43Å; A558-A562 PolarHBondContact O-N 2.88Å; A558-A562 VanDerWaalsContact O-N 3.13Å; L559-A562 PolarHBondContact O-N 3.44Å; A560-A562 PolarHBondContact O-N 3.35Å; A562-F566 PolarHBondContact O-N 3.39Å; A562-F566 VanDerWaalsContact O-N 3.13Å
563	I	93.4	Very high	91.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-69.3	-37.3	175.6	-74.1	171.6	0	0	0	111.1	F389 L544 L559 A560 D561 E565 F566 M570 V583	F389-I563 HydrophobicContact CE2-CG1 4.19Å; L544-I563 HydrophobicContact CD1-CD1 3.58Å; L544-I563 HydrophobicContact CD1-CG1 4.35Å; L559-I563 HydrophobicContact CD1-CD1 3.94Å; L559-I563 HydrophobicContact CD1-CG1 4.2Å; L559-I563 HydrophobicContact CD2-CD1 4.49Å; L559-I563 HydrophobicContact CG-CD1 3.81Å; L559-I563 HydrophobicContact CG-CG1 4.45Å; L559-I563 WeakPolarHBondContact O-CB 3.46Å; L559-I563 WeakPolarHBondContact O-CG1 3.49Å; L559-I563 PolarHBondContact O-N 3.09Å; A560-I563 PolarHBondContact O-N 3.19Å; D561-I563 VanDerWaalsContact C-N 3.32Å; D561-I563 PolarHBondContact O-N 3.4Å; I563-E565 VanDerWaalsContact C-N 3.31Å; I563-F566 WeakPolarHBondContact O-CB 3.18Å; I563-F566 PolarHBondContact O-N 3.36Å; I563-M570 HydrophobicContact CG2-CE 3.15Å; I563-V583 HydrophobicContact CB-CB 4.48Å; I563-V583 HydrophobicContact CB-CG1 4.01Å; I563-V583 HydrophobicContact CD1-CG1 4.45Å; I563-V583 HydrophobicContact CG2-CB 3.6Å; I563-V583 HydrophobicContact CG2-CG1 3.67Å; I563-V583 HydrophobicContact CG2-CG2 4.23Å
564	N	93.2	Very high	91.3	Very high	93 Å²	93	27.8 Å²	27.8	50%	0.497	14%	0.138	S	C	.	.	H	α-helix	trans	-68.1	-32	176.9	-78.2	-28.8	0	0	0	112.5	A560 D561 F566 Q582	A560-N564 PolarHBondContact O-N 3.38Å; A560-N564 PolarHBondContact O-ND2 3.38Å; D561-N564 PolarHBondContact O-N 2.96Å; N564-F566 VanDerWaalsContact C-N 3.34Å; N564-Q582 PolarHBondContact ND2-O 3.41Å; N564-Q582 PolarHBondContact OD1-O 3.46Å
565	E	92.4	Very high	91.4	Very high	134 Å²	134	26.2 Å²	26.2	63%	0.626	13%	0.131	S	C	*	.	H	α-helix	trans	-79.1	-15	172.1	-68.2	-174.5	173.2	0	0	113.5	D561 I563 E567	D561-E565 PolarHBondContact O-N 3.19Å; I563-E565 VanDerWaalsContact C-N 3.31Å; E565-E567 PolarHBondContact O-N 3.36Å
566	F	92.7	Very high	91.3	Very high	5 Å²	5	26.8 Å²	26.8	2%	0.022	13%	0.134	C	C	.	.			trans	-72	126.7	-178.2	178.4	-117.5	0	0	0	111.6	F389 R429 P539 L542 A562 I563 N564 G568	F389-F566 HydrophobicContact CB-CB 4.28Å; F389-F566 HydrophobicContact CB-CD2 3.58Å; F389-F566 HydrophobicContact CB-CE2 4.31Å; F389-F566 HydrophobicContact CB-CG 4.25Å; F389-F566 HydrophobicContact CD2-CB 4.47Å; F389-F566 HydrophobicContact CG-CD2 4.24Å; R429-F566 PolarHBondContact NH2-O 2.69Å; P539-F566 WeakPolarHBondContact O-CE2 3.23Å; P539-F566 VanDerWaalsContact O-CZ 3.28Å; P539-F566 WeakPolarHBondContact O-CZ 3.43Å; L542-F566 HydrophobicContact CB-CE1 4.09Å; L542-F566 HydrophobicContact CD1-CD1 3.57Å; L542-F566 HydrophobicContact CD1-CD2 4.22Å; L542-F566 HydrophobicContact CD1-CE1 3.53Å; L542-F566 HydrophobicContact CD1-CE2 4.2Å; L542-F566 HydrophobicContact CD1-CG 3.91Å; L542-F566 HydrophobicContact CD1-CZ 3.87Å; L542-F566 HydrophobicContact CG-CD1 4.15Å; L542-F566 HydrophobicContact CG-CE1 3.57Å; L542-F566 HydrophobicContact CG-CE2 4.4Å; L542-F566 HydrophobicContact CG-CZ 3.72Å; A562-F566 PolarHBondContact O-N 3.39Å; A562-F566 VanDerWaalsContact O-N 3.13Å; I563-F566 WeakPolarHBondContact O-CB 3.18Å; I563-F566 PolarHBondContact O-N 3.36Å; N564-F566 VanDerWaalsContact C-N 3.34Å; F566-G568 WeakPolarHBondContact CD1-O 3.28Å; F566-G568 WeakPolarHBondContact CE1-O 3.47Å
567	E	90.8	Very high	91.2	Very high	135 Å²	135	26.9 Å²	26.9	63%	0.631	14%	0.135	S	C	*	.			trans	-84.3	-15.9	-176	-62.9	-175.8	165.1	0	0	114.2	E565	E565-E567 PolarHBondContact O-N 3.36Å
568	G	91.8	Very high	91.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	-89.3	171.6	-176.9	0	0	0	0	0	114.1	L426 R429 H540 F566	L426-G568 CarbonylContact O-C 3.06Å; R429-G568 PolarHBondContact NH1-O 2.75Å; R429-G568 PolarHBondContact NH2-O 2.84Å; H540-G568 CarbonylContact O-C 3.58Å; H540-G568 VanDerWaalsContact O-CA 3.24Å; H540-G568 WeakPolarHBondContact O-CA 3.28Å; F566-G568 WeakPolarHBondContact CD1-O 3.28Å; F566-G568 WeakPolarHBondContact CE1-O 3.47Å
569	G	93.6	Very high	91	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	150.9	-176.6	0	0	0	0	0	112.3	L426 T428 H540 M541 L542	L426-G569 WeakPolarHBondContact O-CA 3.5Å; L426-G569 PolarHBondContact O-N 2.96Å; T428-G569 WeakPolarHBondContact O-CA 3.39Å; H540-G569 PolarHBondContact O-N 2.94Å; M541-G569 CarbonylContact C-O 3.46Å; M541-G569 WeakPolarHBondContact CA-O 3.46Å; M541-G569 WeakPolarHBondContact SD-CA 3.01Å; L542-G569 PolarHBondContact N-O 3.36Å
570	M	94.7	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.5	-177.2	176	-92.4	-85.9	0	0	112.8	T428 V430 L542 I563 L572 V583	T428-M570 PolarHBondContact O-N 3.44Å; V430-M570 PolarHBondContact N-O 2.83Å; L542-M570 HydrophobicContact CB-CB 4.35Å; L542-M570 HydrophobicContact CB-CG 4.23Å; L542-M570 CarbonylContact O-C 3.58Å; L542-M570 VanDerWaalsContact O-CA 3.3Å; L542-M570 WeakPolarHBondContact O-CA 3.42Å; I563-M570 HydrophobicContact CG2-CE 3.15Å; M570-L572 HydrophobicContact SD-CB 3.74Å; M570-V583 HydrophobicContact CE-CB 3.69Å; M570-V583 HydrophobicContact CE-CG2 3.43Å; M570-V583 VanDerWaalsContact CE-CG2 3.43Å
571	M	95.5	Very high	91	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.1	166.3	-65.1	-153.5	-63.1	0	0	110.5	I424 V430 L444 L447 L542 F543 L544	I424-M571 HydrophobicContact CD1-CE 3.85Å; I424-M571 HydrophobicContact CD1-SD 3.64Å; V430-M571 HydrophobicContact CB-CG 4.35Å; V430-M571 CarbonylContact O-C 3.58Å; V430-M571 VanDerWaalsContact O-CA 3.29Å; V430-M571 WeakPolarHBondContact O-CA 3.47Å; L444-M571 HydrophobicContact CD2-CB 4.39Å; L444-M571 HydrophobicContact CD2-CE 3.51Å; L447-M571 HydrophobicContact CD1-CE 3.14Å; L447-M571 HydrophobicContact CD1-SD 4.33Å; L542-M571 PolarHBondContact O-N 3.14Å; F543-M571 WeakPolarHBondContact CA-O 3.36Å; F543-M571 HydrophobicContact CD1-CB 3.83Å; F543-M571 HydrophobicContact CD1-CE 3.8Å; F543-M571 HydrophobicContact CD1-CG 4.15Å; F543-M571 HydrophobicContact CE1-CB 4.19Å; F543-M571 HydrophobicContact CE1-CE 3.42Å; F543-M571 VanDerWaalsContact CE1-CE 3.42Å; F543-M571 HydrophobicContact CE1-CG 3.99Å; F543-M571 HydrophobicContact CE1-SD 4.49Å; F543-M571 HydrophobicContact CE2-CE 4.2Å; F543-M571 HydrophobicContact CG-CE 4.36Å; F543-M571 HydrophobicContact CZ-CE 3.65Å; L544-M571 PolarHBondContact N-O 3.2Å
572	L	95.2	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.3	-178.8	177	66.1	0	0	0	110.2	V430 A431 L432 L544 P547 M570 L579 I580 V583	V430-L572 PolarHBondContact O-N 3.04Å; A431-L572 CarbonylContact C-O 3.58Å; A431-L572 VanDerWaalsContact CA-O 3.25Å; A431-L572 WeakPolarHBondContact CA-O 3.4Å; L432-L572 PolarHBondContact N-O 3.4Å; L544-L572 HydrophobicContact CB-CD1 3.8Å; L544-L572 HydrophobicContact CD1-CD1 4.34Å; P547-L572 HydrophobicContact CG-CD1 3.6Å; M570-L572 HydrophobicContact SD-CB 3.74Å; L572-L579 HydrophobicContact CD1-CD2 4.1Å; L572-L579 HydrophobicContact CD2-CD2 3.92Å; L572-L579 HydrophobicContact CD2-CG 3.88Å; L572-I580 HydrophobicContact CD2-CG1 4.02Å; L572-V583 HydrophobicContact CD2-CG2 3.65Å
573	V	92.7	Very high	90.9	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116	161.1	-178	0	0	0	0	105.7	L432 K440 L444 L544 E546	L432-V573 HydrophobicContact CB-CG2 4.05Å; L432-V573 HydrophobicContact CD2-CG2 4.07Å; K440-V573 HydrophobicContact CB-CG1 4.18Å; K440-V573 HydrophobicContact CB-CG2 4.23Å; K440-V573 HydrophobicContact CD-CG1 3.92Å; L444-V573 HydrophobicContact CD1-CG2 3.92Å; L544-V573 PolarHBondContact O-N 3.09Å; E546-V573 WeakPolarHBondContact CA-O 3.37Å; E546-V573 PolarHBondContact N-O 3.33Å
574	S	87.9	Confident	90.9	Very high	2 Å²	2	32 Å²	32	1%	0.014	16%	0.155	C	C	.	.			trans	-149.5	155.8	177.9	-171.7	0	0	0	0	110.8	E546 D576 I580	E546-S574 VanDerWaalsContact OE1-CA 3.31Å; E546-S574 WeakPolarHBondContact OE1-CA 3.46Å; E546-S574 WeakPolarHBondContact OE2-CA 3.47Å; S574-D576 PolarHBondContact OG-N 3.06Å; S574-I580 WeakPolarHBondContact O-CD1 3.41Å
575	H	82.8	Confident	90.9	Very high	26 Å²	26	35 Å²	35	12%	0.12	17%	0.165	C	C	.	.	S	Bend	trans	-100.3	0.1	166.7	-57	-44.3	0	0	0	113.4	L263 D264 L265 E546	L263-H575 PolarHBondContact O-CD2 2.94Å; L263-H575 PolarHBondContact O-NE2 3.43Å; D264-H575 VanDerWaalsContact CA-CE1 3.42Å; D264-H575 WeakPolarHBondContact CA-CE1 3.5Å; L265-H575 HydrophobicContact CD2-CB 4.36Å; L265-H575 VanDerWaalsContact CD2-O 3.31Å; L265-H575 WeakPolarHBondContact CD2-O 3.4Å; L265-H575 PolarHBondContact N-ND1 2.65Å; E546-H575 VanDerWaalsContact CD-CD2 3.42Å; E546-H575 IonicContact OE1-CD2 2.63Å; E546-H575 PolarHBondContact OE1-CD2 3.26Å; E546-H575 IonicContact OE1-CE1 3.18Å; E546-H575 PolarHBondContact OE1-CE1 3.16Å; E546-H575 VanDerWaalsContact OE1-CE1 3.3Å; E546-H575 IonicContact OE1-CG 2.77Å; E546-H575 IonicContact OE1-ND1 3.05Å; E546-H575 IonicContact OE1-NE2 2.63Å; E546-H575 PolarHBondContact OE1-NE2 3.46Å; E546-H575 VanDerWaalsContact OE1-NE2 3.08Å; E546-H575 IonicContact OE2-CD2 2.86Å; E546-H575 PolarHBondContact OE2-CD2 3.43Å; E546-H575 IonicContact OE2-CG 2.92Å; E546-H575 PolarHBondContact OE2-N 2.93Å
576	D	84.8	Confident	91	Very high	13 Å²	13	31.4 Å²	31.4	7%	0.07	15%	0.148	C	C	.	.			trans	-88.7	109.3	177.8	-166.5	-73.1	0	0	0	111.4	S288 T548 S574 R578 L579 I580	S288-D576 PolarHBondContact OG-OD2 2.78Å; T548-D576 HydrophobicContact CG2-CB 4.08Å; S574-D576 PolarHBondContact OG-N 3.06Å; D576-R578 VanDerWaalsContact C-N 3.27Å; D576-R578 PolarHBondContact O-N 2.97Å; D576-R578 WeakPolarHBondContact OD1-CA 3.46Å; D576-R578 WeakPolarHBondContact OD1-CB 3.23Å; D576-R578 PolarHBondContact OD1-N 2.85Å; D576-L579 HydrophobicContact CB-CB 4.11Å; D576-L579 PolarHBondContact O-N 2.84Å; D576-L579 PolarHBondContact OD1-N 2.99Å; D576-I580 VanDerWaalsContact O-CG1 3.31Å; D576-I580 WeakPolarHBondContact O-CG1 3.26Å; D576-I580 PolarHBondContact O-N 3.34Å; D576-I580 VanDerWaalsContact O-N 3.13Å
577	F	85.5	Confident	91.1	Very high	7 Å²	7	31.4 Å²	31.4	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-38.1	179.4	-77	-85.3	0	0	0	113	L265 V269 D290 Q581 I602 K606	L265-F577 HydrophobicContact CB-CZ 4.4Å; L265-F577 HydrophobicContact CD2-CD2 4.03Å; L265-F577 HydrophobicContact CD2-CE1 4.04Å; L265-F577 HydrophobicContact CD2-CE2 3.55Å; L265-F577 HydrophobicContact CD2-CG 4.48Å; L265-F577 HydrophobicContact CD2-CZ 3.55Å; L265-F577 HydrophobicContact CG-CZ 4.5Å; V269-F577 HydrophobicContact CG2-CE2 3.95Å; V269-F577 HydrophobicContact CG2-CZ 3.6Å; D290-F577 HydrophobicContact CB-CB 4.23Å; D290-F577 VanDerWaalsContact OD2-CD2 3.22Å; D290-F577 WeakPolarHBondContact OD2-CD2 3.39Å; F577-Q581 VanDerWaalsContact O-CB 3.25Å; F577-Q581 WeakPolarHBondContact O-CB 3.44Å; F577-Q581 PolarHBondContact O-N 2.82Å; F577-I602 HydrophobicContact CD1-CD1 4.38Å; F577-I602 HydrophobicContact CD1-CG1 3.71Å; F577-I602 HydrophobicContact CE1-CD1 4.38Å; F577-I602 HydrophobicContact CE1-CG1 4.16Å; F577-K606 HydrophobicContact CD1-CB 4.14Å; F577-K606 HydrophobicContact CD1-CD 4.03Å; F577-K606 HydrophobicContact CD1-CG 4.37Å; F577-K606 HydrophobicContact CE1-CB 3.54Å; F577-K606 HydrophobicContact CE1-CD 3.87Å; F577-K606 HydrophobicContact CE1-CG 3.74Å; F577-K606 HydrophobicContact CE2-CD 4.32Å; F577-K606 HydrophobicContact CG-CD 4.39Å; F577-K606 HydrophobicContact CZ-CB 4.14Å; F577-K606 HydrophobicContact CZ-CD 4.01Å; F577-K606 HydrophobicContact CZ-CG 3.86Å
578	R	84.5	Confident	91.3	Very high	57 Å²	57	25.9 Å²	25.9	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-74.4	-44.1	-175.1	-179.7	167.8	169.4	-108.6	7.2	111	D557 D576 I580 Q581 Q582	D557-R578 VanDerWaalsContact CG-NH2 3.34Å; D557-R578 IonicContact OD1-CZ 3.76Å; D557-R578 IonicContact OD1-NH1 3.37Å; D557-R578 PolarHBondContact OD1-NH1 3.44Å; D557-R578 IonicContact OD1-NH2 2.74Å; D557-R578 PolarHBondContact OD1-NH2 3.18Å; D557-R578 IonicContact OD2-CZ 3.6Å; D557-R578 IonicContact OD2-NH1 2.61Å; D557-R578 IonicContact OD2-NH2 3.97Å; D557-R578 PolarHBondContact OD2-NH2 3.37Å; D557-R578 VanDerWaalsContact OD2-NH2 3.08Å; D576-R578 VanDerWaalsContact C-N 3.27Å; D576-R578 PolarHBondContact O-N 2.97Å; D576-R578 WeakPolarHBondContact OD1-CA 3.46Å; D576-R578 WeakPolarHBondContact OD1-CB 3.23Å; D576-R578 PolarHBondContact OD1-N 2.85Å; R578-I580 VanDerWaalsContact C-N 3.34Å; R578-I580 PolarHBondContact O-N 3.16Å; R578-Q581 PolarHBondContact O-N 3.21Å; R578-Q582 HydrophobicContact CG-CG 4.48Å; R578-Q582 WeakPolarHBondContact O-CB 3.3Å; R578-Q582 VanDerWaalsContact O-CG 3.26Å; R578-Q582 WeakPolarHBondContact O-CG 3.4Å; R578-Q582 PolarHBondContact O-N 2.8Å
579	L	89.8	Confident	91.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57.9	-50.3	174	179.6	64.2	0	0	0	109.9	P547 T548 I556 A560 L572 D576 Q581 Q582 V583	P547-L579 HydrophobicContact CG-CD2 4.19Å; T548-L579 HydrophobicContact CG2-CB 4.48Å; T548-L579 HydrophobicContact CG2-CD2 3.4Å; T548-L579 VanDerWaalsContact CG2-CD2 3.4Å; I556-L579 HydrophobicContact CG2-CB 4.3Å; I556-L579 HydrophobicContact CG2-CD1 4.39Å; A560-L579 HydrophobicContact CB-CD1 3.82Å; L572-L579 HydrophobicContact CD1-CD2 4.1Å; L572-L579 HydrophobicContact CD2-CD2 3.92Å; L572-L579 HydrophobicContact CD2-CG 3.88Å; D576-L579 HydrophobicContact CB-CB 4.11Å; D576-L579 PolarHBondContact O-N 2.84Å; D576-L579 PolarHBondContact OD1-N 2.99Å; L579-Q581 VanDerWaalsContact C-N 3.33Å; L579-Q581 PolarHBondContact O-N 3.23Å; L579-Q582 PolarHBondContact O-N 2.89Å; L579-Q582 VanDerWaalsContact O-N 3.14Å; L579-V583 HydrophobicContact CD1-CG1 4.04Å; L579-V583 VanDerWaalsContact O-CG2 3.31Å; L579-V583 WeakPolarHBondContact O-CG2 3.27Å; L579-V583 PolarHBondContact O-N 2.74Å; L579-V583 VanDerWaalsContact O-N 3.12Å
580	I	92.4	Very high	91.3	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-57.1	-47.8	178.4	-67	167.7	0	0	0	110.9	L265 A431 V433 L572 S574 D576 R578 Q582 V583 A584 I587 I602	L265-I580 HydrophobicContact CD1-CD1 4.49Å; A431-I580 HydrophobicContact CB-CB 4.4Å; A431-I580 HydrophobicContact CB-CG1 4.11Å; A431-I580 HydrophobicContact CB-CG2 3.55Å; V433-I580 HydrophobicContact CG1-CD1 4.42Å; L572-I580 HydrophobicContact CD2-CG1 4.02Å; S574-I580 WeakPolarHBondContact O-CD1 3.41Å; D576-I580 VanDerWaalsContact O-CG1 3.31Å; D576-I580 WeakPolarHBondContact O-CG1 3.26Å; D576-I580 PolarHBondContact O-N 3.34Å; D576-I580 VanDerWaalsContact O-N 3.13Å; R578-I580 VanDerWaalsContact C-N 3.34Å; R578-I580 PolarHBondContact O-N 3.16Å; I580-Q582 VanDerWaalsContact C-N 3.25Å; I580-Q582 PolarHBondContact O-N 2.72Å; I580-V583 PolarHBondContact O-N 3.39Å; I580-A584 HydrophobicContact CG2-CB 4.03Å; I580-A584 VanDerWaalsContact O-CB 3.25Å; I580-A584 WeakPolarHBondContact O-CB 3.45Å; I580-A584 PolarHBondContact O-N 3.04Å; I580-I587 HydrophobicContact CG2-CD1 3.52Å; I580-I602 HydrophobicContact CB-CG1 4.2Å; I580-I602 HydrophobicContact CD1-CD1 4.27Å; I580-I602 HydrophobicContact CG2-CB 3.87Å; I580-I602 HydrophobicContact CG2-CD1 3.92Å; I580-I602 HydrophobicContact CG2-CG1 3.69Å; I580-I602 HydrophobicContact CG2-CG2 4.26Å
581	Q	91.6	Very high	91	Very high	103 Å²	103	28.6 Å²	28.6	48%	0.481	14%	0.136	S	C	.	.	H	α-helix	trans	-60.4	-35.9	179.6	-172.2	178.9	5.3	0	0	112.6	F577 R578 L579 I602	F577-Q581 VanDerWaalsContact O-CB 3.25Å; F577-Q581 WeakPolarHBondContact O-CB 3.44Å; F577-Q581 PolarHBondContact O-N 2.82Å; R578-Q581 PolarHBondContact O-N 3.21Å; L579-Q581 VanDerWaalsContact C-N 3.33Å; L579-Q581 PolarHBondContact O-N 3.23Å; Q581-I602 HydrophobicContact CB-CG2 3.68Å; Q581-I602 HydrophobicContact CG-CG2 4.18Å
582	Q	90.6	Very high	90.6	Very high	69 Å²	69	37.5 Å²	37.5	32%	0.322	17%	0.174	S	C	.	.	H	α-helix	trans	-76.2	-30.7	-177.9	-76.3	174.1	-26.3	0	0	113.4	A560 N564 R578 L579 I580	A560-Q582 HydrophobicContact CB-CB 4.28Å; N564-Q582 PolarHBondContact ND2-O 3.41Å; N564-Q582 PolarHBondContact OD1-O 3.46Å; R578-Q582 HydrophobicContact CG-CG 4.48Å; R578-Q582 WeakPolarHBondContact O-CB 3.3Å; R578-Q582 VanDerWaalsContact O-CG 3.26Å; R578-Q582 WeakPolarHBondContact O-CG 3.4Å; R578-Q582 PolarHBondContact O-N 2.8Å; L579-Q582 PolarHBondContact O-N 2.89Å; L579-Q582 VanDerWaalsContact O-N 3.14Å; I580-Q582 VanDerWaalsContact C-N 3.25Å; I580-Q582 PolarHBondContact O-N 2.72Å
583	V	93.3	Very high	90.4	Very high	6 Å²	6	41.8 Å²	41.8	4%	0.036	19%	0.194	C	C	.	.	H	α-helix	trans	-119.6	-23.7	-167.9	-51.9	0	0	0	0	115.6	A560 I563 M570 L572 L579 I580	A560-V583 HydrophobicContact CB-CG1 4.03Å; I563-V583 HydrophobicContact CB-CB 4.48Å; I563-V583 HydrophobicContact CB-CG1 4.01Å; I563-V583 HydrophobicContact CD1-CG1 4.45Å; I563-V583 HydrophobicContact CG2-CB 3.6Å; I563-V583 HydrophobicContact CG2-CG1 3.67Å; I563-V583 HydrophobicContact CG2-CG2 4.23Å; M570-V583 HydrophobicContact CE-CB 3.69Å; M570-V583 HydrophobicContact CE-CG2 3.43Å; M570-V583 VanDerWaalsContact CE-CG2 3.43Å; L572-V583 HydrophobicContact CD2-CG2 3.65Å; L579-V583 HydrophobicContact CD1-CG1 4.04Å; L579-V583 VanDerWaalsContact O-CG2 3.31Å; L579-V583 WeakPolarHBondContact O-CG2 3.27Å; L579-V583 PolarHBondContact O-N 2.74Å; L579-V583 VanDerWaalsContact O-N 3.12Å; I580-V583 PolarHBondContact O-N 3.39Å
584	A	92.8	Very high	90.4	Very high	19 Å²	19	44 Å²	44	16%	0.157	21%	0.208	C	C	.	.			trans	-94.5	134.9	-175.5	0	0	0	0	0	111.2	A431 I580 I587	A431-A584 HydrophobicContact CB-CB 3.59Å; I580-A584 HydrophobicContact CG2-CB 4.03Å; I580-A584 VanDerWaalsContact O-CB 3.25Å; I580-A584 WeakPolarHBondContact O-CB 3.45Å; I580-A584 PolarHBondContact O-N 3.04Å; A584-I587 HydrophobicContact CB-CD1 4.22Å
585	Q	93	Very high	90.7	Very high	155 Å²	155	45 Å²	45	72%	0.724	21%	0.213	S	C	*	.	S	Bend	trans	-95.7	-29.8	173.5	-64.9	178.1	2.2	0	0	111.5	R429	R429-Q585 HydrophobicContact CB-CB 4.1Å; R429-Q585 HydrophobicContact CB-CG 3.9Å; R429-Q585 HydrophobicContact CG-CG 4.35Å; R429-Q585 PolarHBondContact O-N 3.22Å
586	E	94.2	Very high	91.2	Very high	58 Å²	58	47.3 Å²	47.3	27%	0.271	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.8	178.9	-56	-167.7	176.6	0	0	111	R429 V430 A431 W588 K597	R429-E586 PolarHBondContact O-N 3.08Å; V430-E586 CarbonylContact C-O 3.58Å; V430-E586 WeakPolarHBondContact CA-O 3.44Å; V430-E586 HydrophobicContact CG2-CB 4.1Å; A431-E586 PolarHBondContact N-O 3.12Å; E586-W588 PolarHBondContact OE2-NE1 3.48Å; E586-K597 IonicContact OE1-NZ 2.65Å; E586-K597 PolarHBondContact OE1-NZ 2.81Å; E586-K597 WeakPolarHBondContact OE2-CD 3.21Å; E586-K597 WeakPolarHBondContact OE2-CE 3.47Å; E586-K597 IonicContact OE2-NZ 3.01Å; E586-K597 PolarHBondContact OE2-NZ 2.92Å
587	I	94.8	Very high	91.6	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.1	173.1	-52.3	-56.1	0	0	0	108.3	A431 V433 I580 A584 W598 I602	A431-I587 HydrophobicContact CB-CD1 3.79Å; A431-I587 WeakPolarHBondContact O-CA 3.43Å; V433-I587 HydrophobicContact CB-CG2 4.43Å; V433-I587 HydrophobicContact CG1-CG2 4.02Å; V433-I587 HydrophobicContact CG2-CG2 3.51Å; I580-I587 HydrophobicContact CG2-CD1 3.52Å; A584-I587 HydrophobicContact CB-CD1 4.22Å; I587-W598 HydrophobicContact CB-CB 4.06Å; I587-W598 HydrophobicContact CG2-CB 4.25Å; I587-W598 WeakPolarHBondContact O-CB 3.41Å; I587-W598 PolarHBondContact O-N 3.34Å; I587-I602 HydrophobicContact CD1-CB 4.17Å; I587-I602 HydrophobicContact CD1-CD1 4.23Å; I587-I602 HydrophobicContact CG1-CB 4.48Å
588	W	95.3	Very high	92	Very high	19 Å²	19	55.2 Å²	55.2	7%	0.072	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.9	176.6	-73.6	16.4	0	0	0	109.3	F422 I424 V430 A431 L432 V433 E586 I595 T596	F422-W588 HydrophobicContact CB-CH2 4.03Å; F422-W588 HydrophobicContact CB-CZ3 4.44Å; F422-W588 HydrophobicContact CD1-CZ3 4.33Å; F422-W588 AromaticContact CD2-CH2 3.57Å; F422-W588 HydrophobicContact CD2-CH2 3.57Å; F422-W588 AromaticContact CD2-CZ3 3.58Å; F422-W588 HydrophobicContact CD2-CZ3 3.58Å; F422-W588 HydrophobicContact CE2-CH2 4.21Å; F422-W588 AromaticContact CE2-CZ3 3.79Å; F422-W588 HydrophobicContact CE2-CZ3 3.79Å; F422-W588 AromaticContact CG-CH2 3.88Å; F422-W588 HydrophobicContact CG-CH2 3.88Å; F422-W588 AromaticContact CG-CZ3 3.87Å; F422-W588 HydrophobicContact CG-CZ3 3.87Å; F422-W588 HydrophobicContact CZ-CZ3 4.25Å; I424-W588 HydrophobicContact CG1-CH2 4.29Å; V430-W588 HydrophobicContact CB-CD2 4.47Å; V430-W588 HydrophobicContact CG1-CB 3.77Å; V430-W588 HydrophobicContact CG1-CD2 3.51Å; V430-W588 HydrophobicContact CG1-CE3 3.95Å; V430-W588 HydrophobicContact CG1-CG 3.42Å; V430-W588 VanDerWaalsContact CG1-CG 3.42Å; V430-W588 HydrophobicContact CG2-CD2 4.11Å; V430-W588 HydrophobicContact CG2-CG 4.44Å; V430-W588 HydrophobicContact CG2-CZ2 3.88Å; A431-W588 PolarHBondContact O-N 3.06Å; L432-W588 WeakPolarHBondContact CA-O 3.24Å; L432-W588 HydrophobicContact CD1-CB 4.03Å; V433-W588 WeakPolarHBondContact CG2-O 3.42Å; V433-W588 PolarHBondContact N-O 3.5Å; E586-W588 PolarHBondContact OE2-NE1 3.48Å; W588-I595 HydrophobicContact CB-CG2 3.88Å; W588-I595 HydrophobicContact CD2-CG2 4.17Å; W588-I595 HydrophobicContact CE3-CG2 3.76Å; W588-I595 HydrophobicContact CG-CG2 4.28Å; W588-T596 CarbonylContact C-O 3.59Å; W588-T596 WeakPolarHBondContact CA-O 3.23Å
589	V	94.1	Very high	92.4	Very high	8 Å²	8	58.5 Å²	58.5	5%	0.048	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.1	-177.9	-175.7	0	0	0	0	109.3	V433 E591 I595 T596 W598 Y605	V433-V589 HydrophobicContact CG2-CB 4.34Å; V433-V589 HydrophobicContact CG2-CG2 3.79Å; V589-E591 HydrophobicContact CG1-CB 4.33Å; V589-E591 HydrophobicContact CG1-CG 3.85Å; V589-I595 WeakPolarHBondContact O-CA 3.01Å; V589-T596 PolarHBondContact N-O 2.76Å; V589-T596 PolarHBondContact O-N 2.71Å; V589-W598 HydrophobicContact CG2-CB 4.04Å; V589-Y605 HydrophobicContact CG2-CD2 4.36Å; V589-Y605 HydrophobicContact CG2-CE2 3.71Å
590	C	92.3	Very high	92.4	Very high	1 Å²	1	60 Å²	60	1%	0.007	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	95	176.6	-175	0	0	0	0	109.7	Y417 L432 V433 A438 K440	Y417-C590 PolarHBondContact OH-SG 3.36Å; L432-C590 HydrophobicContact CD1-CB 4.04Å; L432-C590 HydrophobicContact CG-CB 4.47Å; V433-C590 WeakPolarHBondContact O-CB 3.46Å; V433-C590 PolarHBondContact O-N 3.46Å; A438-C590 HydrophobicContact CB-CB 4.43Å; A438-C590 VanDerWaalsContact CB-O 3.26Å; A438-C590 WeakPolarHBondContact CB-O 3.26Å; A438-C590 PolarHBondContact O-SG 2.75Å; K440-C590 HydrophobicContact CG-CB 4.18Å
591	E	88.4	Confident	92.4	Very high	48 Å²	48	64 Å²	64	22%	0.224	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162	179.8	-75.5	-175.6	-170	0	0	110.4	P435 V589 Q593 T594	P435-E591 HydrophobicContact CG-CG 4.4Å; V589-E591 HydrophobicContact CG1-CB 4.33Å; V589-E591 HydrophobicContact CG1-CG 3.85Å; E591-Q593 PolarHBondContact O-N 2.79Å; E591-Q593 VanDerWaalsContact O-N 3.1Å; E591-T594 PolarHBondContact N-O 3.35Å; E591-T594 CarbonylContact O-C 3.58Å; E591-T594 WeakPolarHBondContact O-CG2 3.18Å; E591-T594 PolarHBondContact O-N 3.49Å
592	K	87.2	Confident	92.3	Very high	188 Å²	188	59.3 Å²	59.3	82%	0.817	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.4	172.7	-57.2	175.9	-176.2	174.1	0	113.7	T594	K592-T594 PolarHBondContact O-N 3.01Å
593	Q	89.7	Confident	92.2	Very high	89 Å²	89	59.2 Å²	59.2	42%	0.416	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	20.5	-179.8	-50.4	172.6	-14.3	0	0	114.6	C415 I416 Y417 N418 E591	C415-Q593 WeakPolarHBondContact O-CG 3.27Å; C415-Q593 PolarHBondContact O-NE2 2.87Å; C415-Q593 VanDerWaalsContact O-NE2 3.09Å; I416-Q593 VanDerWaalsContact O-CA 3.23Å; I416-Q593 WeakPolarHBondContact O-CA 3.37Å; Y417-Q593 CarbonylContact C-O 3.59Å; Y417-Q593 WeakPolarHBondContact CA-O 3.4Å; N418-Q593 PolarHBondContact N-O 2.72Å; E591-Q593 PolarHBondContact O-N 2.79Å; E591-Q593 VanDerWaalsContact O-N 3.1Å
594	T	92.8	Very high	92.1	Very high	50 Å²	50	60.7 Å²	60.7	31%	0.307	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	174.8	178.6	-168.5	0	0	0	0	110.6	E591 K592 T596	E591-T594 PolarHBondContact N-O 3.35Å; E591-T594 CarbonylContact O-C 3.58Å; E591-T594 WeakPolarHBondContact O-CG2 3.18Å; E591-T594 PolarHBondContact O-N 3.49Å; K592-T594 PolarHBondContact O-N 3.01Å; T594-T596 HydrophobicContact CG2-CG2 4.07Å
595	I	94	Very high	92	Very high	23 Å²	23	59.9 Å²	59.9	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.4	175.1	-61.7	167.2	0	0	0	107	Y417 L420 F422 L432 L443 W588 V589	Y417-I595 HydrophobicContact CE1-CD1 4.07Å; Y417-I595 HydrophobicContact CE1-CG1 3.95Å; L420-I595 HydrophobicContact CD1-CD1 4Å; L420-I595 HydrophobicContact CD2-CB 4.21Å; L420-I595 HydrophobicContact CD2-CD1 4.21Å; L420-I595 HydrophobicContact CD2-CG1 4.06Å; F422-I595 HydrophobicContact CE1-CD1 4.05Å; L432-I595 HydrophobicContact CD1-CG2 4.31Å; L443-I595 HydrophobicContact CD1-CD1 3.65Å; L443-I595 HydrophobicContact CD2-CD1 3.38Å; L443-I595 HydrophobicContact CG-CD1 4.04Å; W588-I595 HydrophobicContact CB-CG2 3.88Å; W588-I595 HydrophobicContact CD2-CG2 4.17Å; W588-I595 HydrophobicContact CE3-CG2 3.76Å; W588-I595 HydrophobicContact CG-CG2 4.28Å; V589-I595 WeakPolarHBondContact O-CA 3.01Å
596	T	93.6	Very high	91.8	Very high	74 Å²	74	53.2 Å²	53.2	45%	0.454	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140.2	-178.4	55.3	0	0	0	0	110.4	W588 V589 T594	W588-T596 CarbonylContact C-O 3.59Å; W588-T596 WeakPolarHBondContact CA-O 3.23Å; V589-T596 PolarHBondContact N-O 2.76Å; V589-T596 PolarHBondContact O-N 2.71Å; T594-T596 HydrophobicContact CG2-CG2 4.07Å
597	K	94.3	Very high	91.6	Very high	128 Å²	128	57.2 Å²	57.2	56%	0.557	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.5	175.1	-176.5	172	176.8	168.1	0	109.6	E586	E586-K597 IonicContact OE1-NZ 2.65Å; E586-K597 PolarHBondContact OE1-NZ 2.81Å; E586-K597 WeakPolarHBondContact OE2-CD 3.21Å; E586-K597 WeakPolarHBondContact OE2-CE 3.47Å; E586-K597 IonicContact OE2-NZ 3.01Å; E586-K597 PolarHBondContact OE2-NZ 2.92Å
598	W	93.8	Very high	91.4	Very high	57 Å²	57	60 Å²	60	22%	0.216	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	134	173.6	-178.2	-111.9	0	0	0	109.8	I587 V589 G600 D601 Y605 H608	I587-W598 HydrophobicContact CB-CB 4.06Å; I587-W598 HydrophobicContact CG2-CB 4.25Å; I587-W598 WeakPolarHBondContact O-CB 3.41Å; I587-W598 PolarHBondContact O-N 3.34Å; V589-W598 HydrophobicContact CG2-CB 4.04Å; W598-G600 VanDerWaalsContact C-N 3.34Å; W598-G600 VanDerWaalsContact CD1-N 3.3Å; W598-D601 PolarHBondContact NE1-O 3.02Å; W598-Y605 AromaticContact CD2-CD2 3.85Å; W598-Y605 HydrophobicContact CD2-CD2 3.85Å; W598-Y605 AromaticContact CE2-CD2 3.86Å; W598-Y605 HydrophobicContact CE3-CD2 4.2Å; W598-Y605 HydrophobicContact CG-CD2 4.19Å; W598-Y605 HydrophobicContact CZ2-CD2 4.24Å; W598-H608 HydrophobicContact CH2-CB 3.89Å; W598-H608 AromaticContact CH2-CD2 3.46Å; W598-H608 VanDerWaalsContact CH2-CD2 3.46Å; W598-H608 WeakPolarHBondContact CH2-CD2 3.45Å; W598-H608 AromaticContact CH2-CG 3.53Å; W598-H608 AromaticContact CH2-ND1 3.92Å; W598-H608 AromaticContact CH2-NE2 3.77Å; W598-H608 HydrophobicContact CZ2-CB 3.96Å; W598-H608 AromaticContact CZ3-CD2 3.87Å; W598-H608 AromaticContact CZ3-NE2 3.88Å
599	P	92.4	Very high	91	Very high	126 Å²	126	59.3 Å²	59.3	82%	0.818	31%	0.31	S	S	*	.	S	Bend	trans	-78.1	-15.4	-176.9	30	-35.7	0	0	0	114.3
600	G	90.4	Very high	90.6	Very high	31 Å²	31	61.5 Å²	61.5	32%	0.32	32%	0.318	S	S	.	.	S	Bend	trans	-101.7	-177.8	-179.2	0	0	0	0	0	113.5	W598	W598-G600 VanDerWaalsContact C-N 3.34Å; W598-G600 VanDerWaalsContact CD1-N 3.3Å
601	D	91.4	Very high	90.4	Very high	87 Å²	87	64 Å²	64	47%	0.465	34%	0.336	S	S	.	.			trans	-81.3	-178.8	167.6	67.2	9.3	0	0	0	111.3	W598 L603 A604 Y605	W598-D601 PolarHBondContact NE1-O 3.02Å; D601-L603 VanDerWaalsContact C-N 3.29Å; D601-L603 PolarHBondContact O-N 3.24Å; D601-L603 PolarHBondContact OD1-N 3.08Å; D601-L603 VanDerWaalsContact OD1-N 3.17Å; D601-A604 VanDerWaalsContact OD1-CB 3.31Å; D601-A604 WeakPolarHBondContact OD1-CB 3.34Å; D601-A604 PolarHBondContact OD1-N 2.87Å; D601-Y605 PolarHBondContact O-N 2.99Å
602	I	89.7	Confident	90.2	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-25.8	-180	-167	62.2	0	0	0	113	V433 F577 I580 Q581 I587 Y605 K606	V433-I602 HydrophobicContact CG1-CD1 4.26Å; F577-I602 HydrophobicContact CD1-CD1 4.38Å; F577-I602 HydrophobicContact CD1-CG1 3.71Å; F577-I602 HydrophobicContact CE1-CD1 4.38Å; F577-I602 HydrophobicContact CE1-CG1 4.16Å; I580-I602 HydrophobicContact CB-CG1 4.2Å; I580-I602 HydrophobicContact CD1-CD1 4.27Å; I580-I602 HydrophobicContact CG2-CB 3.87Å; I580-I602 HydrophobicContact CG2-CD1 3.92Å; I580-I602 HydrophobicContact CG2-CG1 3.69Å; I580-I602 HydrophobicContact CG2-CG2 4.26Å; Q581-I602 HydrophobicContact CB-CG2 3.68Å; Q581-I602 HydrophobicContact CG-CG2 4.18Å; I587-I602 HydrophobicContact CD1-CB 4.17Å; I587-I602 HydrophobicContact CD1-CD1 4.23Å; I587-I602 HydrophobicContact CG1-CB 4.48Å; I602-Y605 HydrophobicContact CD1-CD1 4.08Å; I602-Y605 WeakPolarHBondContact O-CB 3.25Å; I602-Y605 PolarHBondContact O-N 3.37Å; I602-K606 PolarHBondContact O-N 3.38Å
603	L	88.8	Confident	89.7	Confident	67 Å²	67	58.5 Å²	58.5	35%	0.351	31%	0.313	S	S	.	.	H	α-helix	trans	-72.3	-44.9	176.8	-65.8	178.6	0	0	0	110.8	D601 Y605 K606 E607	D601-L603 VanDerWaalsContact C-N 3.29Å; D601-L603 PolarHBondContact O-N 3.24Å; D601-L603 PolarHBondContact OD1-N 3.08Å; D601-L603 VanDerWaalsContact OD1-N 3.17Å; L603-Y605 PolarHBondContact O-N 3.34Å; L603-K606 WeakPolarHBondContact O-CA 3.49Å; L603-K606 VanDerWaalsContact O-CB 3.31Å; L603-K606 WeakPolarHBondContact O-CB 3.47Å; L603-K606 PolarHBondContact O-N 3.44Å; L603-K606 VanDerWaalsContact O-N 3.07Å; L603-E607 PolarHBondContact O-N 2.89Å
604	A	91.4	Very high	88.8	Confident	36 Å²	36	58.6 Å²	58.6	30%	0.298	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-36	171.7	0	0	0	0	0	111.4	D601 E607 H608	D601-A604 VanDerWaalsContact OD1-CB 3.31Å; D601-A604 WeakPolarHBondContact OD1-CB 3.34Å; D601-A604 PolarHBondContact OD1-N 2.87Å; A604-E607 PolarHBondContact O-N 3.36Å; A604-H608 WeakPolarHBondContact O-CB 3.46Å; A604-H608 PolarHBondContact O-N 2.87Å
605	Y	91.1	Very high	87.4	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-43.7	171.6	-171.3	-106.9	0	0	0	111.8	L265 V433 V589 W598 D601 I602 L603 E607 H608 L609	L265-Y605 HydrophobicContact CD1-CE1 4.43Å; V433-Y605 HydrophobicContact CB-CE1 4.23Å; V433-Y605 HydrophobicContact CG2-CD1 4.41Å; V433-Y605 HydrophobicContact CG2-CE1 3.84Å; V433-Y605 HydrophobicContact CG2-CE2 4.39Å; V589-Y605 HydrophobicContact CG2-CD2 4.36Å; V589-Y605 HydrophobicContact CG2-CE2 3.71Å; W598-Y605 AromaticContact CD2-CD2 3.85Å; W598-Y605 HydrophobicContact CD2-CD2 3.85Å; W598-Y605 AromaticContact CE2-CD2 3.86Å; W598-Y605 HydrophobicContact CE3-CD2 4.2Å; W598-Y605 HydrophobicContact CG-CD2 4.19Å; W598-Y605 HydrophobicContact CZ2-CD2 4.24Å; D601-Y605 PolarHBondContact O-N 2.99Å; I602-Y605 HydrophobicContact CD1-CD1 4.08Å; I602-Y605 WeakPolarHBondContact O-CB 3.25Å; I602-Y605 PolarHBondContact O-N 3.37Å; L603-Y605 PolarHBondContact O-N 3.34Å; Y605-E607 VanDerWaalsContact C-N 3.35Å; Y605-E607 PolarHBondContact O-N 2.91Å; Y605-H608 WeakPolarHBondContact O-CB 3.34Å; Y605-H608 PolarHBondContact O-N 3.15Å; Y605-L609 HydrophobicContact CD1-CD1 4.01Å; Y605-L609 HydrophobicContact CD1-CG 4.26Å; Y605-L609 HydrophobicContact CE1-CD1 3.59Å; Y605-L609 HydrophobicContact CE1-CD2 4.2Å; Y605-L609 HydrophobicContact CE1-CG 3.95Å; Y605-L609 WeakPolarHBondContact O-CG 3.38Å; Y605-L609 PolarHBondContact O-N 2.95Å
606	K	89	Confident	85.8	Confident	16 Å²	16	64.4 Å²	64.4	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-57.3	-45.7	174.4	-170.7	174	174.7	168.7	0	111.8	V269 E272 D290 F577 I602 L603 L609 K610	V269-K606 HydrophobicContact CG2-CG 4Å; E272-K606 IonicContact OE1-NZ 3.62Å; E272-K606 WeakPolarHBondContact OE2-CE 3.44Å; E272-K606 IonicContact OE2-NZ 3.15Å; E272-K606 PolarHBondContact OE2-NZ 3.19Å; D290-K606 IonicContact OD1-NZ 2.75Å; D290-K606 PolarHBondContact OD1-NZ 3.25Å; D290-K606 IonicContact OD2-NZ 3.4Å; D290-K606 PolarHBondContact OD2-NZ 3.38Å; F577-K606 HydrophobicContact CD1-CB 4.14Å; F577-K606 HydrophobicContact CD1-CD 4.03Å; F577-K606 HydrophobicContact CD1-CG 4.37Å; F577-K606 HydrophobicContact CE1-CB 3.54Å; F577-K606 HydrophobicContact CE1-CD 3.87Å; F577-K606 HydrophobicContact CE1-CG 3.74Å; F577-K606 HydrophobicContact CE2-CD 4.32Å; F577-K606 HydrophobicContact CG-CD 4.39Å; F577-K606 HydrophobicContact CZ-CB 4.14Å; F577-K606 HydrophobicContact CZ-CD 4.01Å; F577-K606 HydrophobicContact CZ-CG 3.86Å; I602-K606 PolarHBondContact O-N 3.38Å; L603-K606 WeakPolarHBondContact O-CA 3.49Å; L603-K606 VanDerWaalsContact O-CB 3.31Å; L603-K606 WeakPolarHBondContact O-CB 3.47Å; L603-K606 PolarHBondContact O-N 3.44Å; L603-K606 VanDerWaalsContact O-N 3.07Å; K606-L609 PolarHBondContact O-N 3.44Å; K606-K610 WeakPolarHBondContact O-CG 3.35Å; K606-K610 PolarHBondContact O-N 3.04Å
607	E	89.7	Confident	83.9	Confident	141 Å²	141	67 Å²	67	66%	0.659	35%	0.353	S	S	*	.	H	α-helix	trans	-62.8	-41.9	177.1	-71.5	-177.2	174.2	0	0	112.1	L603 A604 Y605 L609 K610 S611	L603-E607 PolarHBondContact O-N 2.89Å; A604-E607 PolarHBondContact O-N 3.36Å; Y605-E607 VanDerWaalsContact C-N 3.35Å; Y605-E607 PolarHBondContact O-N 2.91Å; E607-L609 VanDerWaalsContact C-N 3.32Å; E607-L609 PolarHBondContact O-N 3.31Å; E607-K610 PolarHBondContact O-N 2.89Å; E607-K610 VanDerWaalsContact O-N 3.17Å; E607-S611 PolarHBondContact O-N 3.44Å; E607-S611 PolarHBondContact O-OG 3.11Å
608	H	90.2	Very high	81.4	Confident	64 Å²	64	64.1 Å²	64.1	30%	0.296	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-38.3	174.4	175.3	70.4	0	0	0	112.7	W598 A604 Y605 S611 K612	W598-H608 HydrophobicContact CH2-CB 3.89Å; W598-H608 AromaticContact CH2-CD2 3.46Å; W598-H608 VanDerWaalsContact CH2-CD2 3.46Å; W598-H608 WeakPolarHBondContact CH2-CD2 3.45Å; W598-H608 AromaticContact CH2-CG 3.53Å; W598-H608 AromaticContact CH2-ND1 3.92Å; W598-H608 AromaticContact CH2-NE2 3.77Å; W598-H608 HydrophobicContact CZ2-CB 3.96Å; W598-H608 AromaticContact CZ3-CD2 3.87Å; W598-H608 AromaticContact CZ3-NE2 3.88Å; A604-H608 WeakPolarHBondContact O-CB 3.46Å; A604-H608 PolarHBondContact O-N 2.87Å; Y605-H608 WeakPolarHBondContact O-CB 3.34Å; Y605-H608 PolarHBondContact O-N 3.15Å; H608-S611 WeakPolarHBondContact CA-OG 3.36Å; H608-S611 PolarHBondContact O-OG 3.36Å; H608-K612 VanDerWaalsContact NE2-CE 3.26Å; H608-K612 WeakPolarHBondContact NE2-CE 3.47Å; H608-K612 WeakPolarHBondContact O-CG 3.42Å; H608-K612 PolarHBondContact O-N 3.02Å; H608-K612 VanDerWaalsContact O-N 3.1Å
609	L	87.6	Confident	79	Confident	6 Å²	6	66.4 Å²	66.4	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-44	172.4	-66.2	-176.1	0	0	0	111.4	L265 D266 V269 Y605 K606 E607 S611 K612 L613	L265-L609 HydrophobicContact CB-CD1 4.26Å; D266-L609 WeakPolarHBondContact OD1-CD1 3.16Å; D266-L609 WeakPolarHBondContact OD1-CD2 3.27Å; V269-L609 HydrophobicContact CG1-CB 4.46Å; V269-L609 HydrophobicContact CG2-CD1 4.38Å; Y605-L609 HydrophobicContact CD1-CD1 4.01Å; Y605-L609 HydrophobicContact CD1-CG 4.26Å; Y605-L609 HydrophobicContact CE1-CD1 3.59Å; Y605-L609 HydrophobicContact CE1-CD2 4.2Å; Y605-L609 HydrophobicContact CE1-CG 3.95Å; Y605-L609 WeakPolarHBondContact O-CG 3.38Å; Y605-L609 PolarHBondContact O-N 2.95Å; K606-L609 PolarHBondContact O-N 3.44Å; E607-L609 VanDerWaalsContact C-N 3.32Å; E607-L609 PolarHBondContact O-N 3.31Å; L609-S611 PolarHBondContact O-N 3.45Å; L609-K612 HydrophobicContact CD2-CD 4.47Å; L609-K612 PolarHBondContact O-N 2.88Å; L609-L613 WeakPolarHBondContact O-CG 3.33Å; L609-L613 PolarHBondContact O-N 3.47Å
610	K	86.1	Confident	76.7	Confident	53 Å²	53	63.7 Å²	63.7	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-60.4	-43	175.9	-71.5	-171.7	-179.3	-157.4	0	112	V269 E272 E273 K606 E607 L613 V614	V269-K610 HydrophobicContact CG1-CD 4.32Å; V269-K610 HydrophobicContact CG1-CG 3.39Å; E272-K610 IonicContact OE1-NZ 3.45Å; E272-K610 PolarHBondContact OE1-NZ 3.4Å; E273-K610 WeakPolarHBondContact OE1-CE 3.33Å; E273-K610 IonicContact OE1-NZ 3.84Å; E273-K610 PolarHBondContact OE1-NZ 3.01Å; K606-K610 WeakPolarHBondContact O-CG 3.35Å; K606-K610 PolarHBondContact O-N 3.04Å; E607-K610 PolarHBondContact O-N 2.89Å; E607-K610 VanDerWaalsContact O-N 3.17Å; K610-L613 PolarHBondContact O-N 3.12Å; K610-V614 PolarHBondContact O-N 3.23Å
611	S	87.1	Confident	74.2	Confident	55 Å²	55	66 Å²	66	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-39.9	178.9	60.5	0	0	0	0	112.4	E607 H608 L609 L613 V614 D615	E607-S611 PolarHBondContact O-N 3.44Å; E607-S611 PolarHBondContact O-OG 3.11Å; H608-S611 WeakPolarHBondContact CA-OG 3.36Å; H608-S611 PolarHBondContact O-OG 3.36Å; L609-S611 PolarHBondContact O-N 3.45Å; S611-L613 VanDerWaalsContact C-N 3.28Å; S611-L613 PolarHBondContact O-N 2.85Å; S611-V614 PolarHBondContact O-N 3.44Å; S611-D615 PolarHBondContact O-N 3.48Å
612	K	84.3	Confident	71.6	Confident	73 Å²	73	69.5 Å²	69.5	32%	0.317	36%	0.359	S	S	.	.	H	α-helix	trans	-56.8	-42.2	174.2	-80.5	177.3	169.7	178.1	0	112	H608 L609 V614 D615 E616	H608-K612 VanDerWaalsContact NE2-CE 3.26Å; H608-K612 WeakPolarHBondContact NE2-CE 3.47Å; H608-K612 WeakPolarHBondContact O-CG 3.42Å; H608-K612 PolarHBondContact O-N 3.02Å; H608-K612 VanDerWaalsContact O-N 3.1Å; L609-K612 HydrophobicContact CD2-CD 4.47Å; L609-K612 PolarHBondContact O-N 2.88Å; K612-V614 VanDerWaalsContact C-N 3.35Å; K612-V614 PolarHBondContact O-N 3.31Å; K612-D615 PolarHBondContact O-N 3Å; K612-E616 WeakPolarHBondContact O-CG 3.23Å; K612-E616 PolarHBondContact O-N 3.13Å; K612-E616 VanDerWaalsContact O-N 3.17Å
613	L	76.1	Confident	69.2	Low	46 Å²	46	78.2 Å²	78.2	24%	0.241	39%	0.391	C	S	.	.	H	α-helix	trans	-63.1	-40.5	179.3	-66.4	172.2	0	0	0	112	V269 W270 L609 K610 S611 E616 E617	V269-L613 HydrophobicContact CG1-CD1 4.07Å; W270-L613 HydrophobicContact CB-CD1 3.94Å; W270-L613 HydrophobicContact CB-CD2 4.4Å; L609-L613 WeakPolarHBondContact O-CG 3.33Å; L609-L613 PolarHBondContact O-N 3.47Å; K610-L613 PolarHBondContact O-N 3.12Å; S611-L613 VanDerWaalsContact C-N 3.28Å; S611-L613 PolarHBondContact O-N 2.85Å; L613-E616 PolarHBondContact O-N 3.35Å; L613-E617 PolarHBondContact O-N 3.38Å
614	V	70.5	Confident	66.9	Low	92 Å²	92	78.4 Å²	78.4	56%	0.558	40%	0.395	S	S	*	.	H	α-helix	trans	-67.4	-39.7	178.2	178	0	0	0	0	111.6	K610 S611 K612 E616 P618	K610-V614 PolarHBondContact O-N 3.23Å; S611-V614 PolarHBondContact O-N 3.44Å; K612-V614 VanDerWaalsContact C-N 3.35Å; K612-V614 PolarHBondContact O-N 3.31Å; V614-E616 VanDerWaalsContact C-N 3.29Å; V614-E616 PolarHBondContact O-N 3.35Å; V614-P618 VanDerWaalsContact O-CD 3.28Å; V614-P618 WeakPolarHBondContact O-CD 3.38Å
615	D	63.6	Low	64.5	Low	109 Å²	109	84.1 Å²	84.1	58%	0.583	42%	0.415	S	S	*	.	H	α-helix	trans	-70.4	-24.2	179.9	-73.4	-23.2	0	0	0	113.2	S611 K612 P618	S611-D615 PolarHBondContact O-N 3.48Å; K612-D615 PolarHBondContact O-N 3Å; D615-P618 WeakPolarHBondContact O-CD 3.5Å; D615-P618 WeakPolarHBondContact O-CG 3.46Å
616	E	61.6	Low	61.8	Low	86 Å²	86	91.1 Å²	91.1	40%	0.402	45%	0.453	S	S	.	.	H	α-helix	trans	-83	-27.1	179	-74.6	-176.2	168	0	0	113.8	H217 K612 L613 V614 Q619 L620	H217-E616 IonicContact NE2-OE2 2.78Å; K612-E616 WeakPolarHBondContact O-CG 3.23Å; K612-E616 PolarHBondContact O-N 3.13Å; K612-E616 VanDerWaalsContact O-N 3.17Å; L613-E616 PolarHBondContact O-N 3.35Å; V614-E616 VanDerWaalsContact C-N 3.29Å; V614-E616 PolarHBondContact O-N 3.35Å; E616-Q619 PolarHBondContact O-N 3.1Å; E616-L620 PolarHBondContact O-N 2.94Å
617	E	54.1	Low	59.1	Low	127 Å²	127	99.4 Å²	99.4	59%	0.593	50%	0.504	S	S	*	.	H	α-helix	trans	-51.4	-44.9	176.7	-75.3	-166.7	150.4	0	0	114.4	L613 Q619	L613-E617 PolarHBondContact O-N 3.38Å; E617-Q619 VanDerWaalsContact C-N 3.35Å; E617-Q619 PolarHBondContact O-N 3.44Å
618	P	41.7	Very low	57.6	Low	69 Å²	69	97.3 Å²	97.3	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-76	-14.7	177.7	26.2	-32.8	0	0	0	114.7	V614 D615 T621	V614-P618 VanDerWaalsContact O-CD 3.28Å; V614-P618 WeakPolarHBondContact O-CD 3.38Å; D615-P618 WeakPolarHBondContact O-CD 3.5Å; D615-P618 WeakPolarHBondContact O-CG 3.46Å; P618-T621 PolarHBondContact O-OG1 3.07Å
619	Q	42.9	Very low	55.9	Low	105 Å²	105	99.1 Å²	99.1	49%	0.491	51%	0.507	S	S	.	.	H	α-helix	trans	-87.6	-33	-179.6	-64.6	-166.7	31.3	0	0	112.8	E616 E617 K622 R623	E616-Q619 PolarHBondContact O-N 3.1Å; E617-Q619 VanDerWaalsContact C-N 3.35Å; E617-Q619 PolarHBondContact O-N 3.44Å; Q619-K622 PolarHBondContact O-N 3.5Å; Q619-R623 PolarHBondContact O-N 3.48Å; Q619-R623 VanDerWaalsContact O-N 3.16Å
620	L	44.1	Very low	54.1	Low	68 Å²	68	104.2 Å²	104.2	36%	0.356	53%	0.534	S	S	.	.	H	α-helix	trans	-65.7	-36.9	176.3	-81.7	148	0	0	0	112.2	E616 K622 T624	E616-L620 PolarHBondContact O-N 2.94Å; L620-K622 VanDerWaalsContact C-N 3.33Å; L620-K622 PolarHBondContact O-N 3.48Å; L620-T624 PolarHBondContact O-OG1 3.49Å
621	T	37.6	Very low	52.3	Low	81 Å²	81	107.2 Å²	107.2	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-69.7	-26.8	176.8	45.2	0	0	0	0	113.5	P618	P618-T621 PolarHBondContact O-OG1 3.07Å
622	K	35.8	Very low	50.1	Low	160 Å²	160	110.5 Å²	110.5	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-88.8	-29.8	-179.7	-72.3	-178.5	179.6	177.2	0	114	Q619 L620	Q619-K622 PolarHBondContact O-N 3.5Å; L620-K622 VanDerWaalsContact C-N 3.33Å; L620-K622 PolarHBondContact O-N 3.48Å
623	R	41	Very low	47.8	Very low	186 Å²	186	113 Å²	113	70%	0.702	58%	0.578	S	S	*	*	H	α-helix	trans	-78.5	-21.9	-176.8	-75.3	-176.5	176.4	175.7	2.7	113.9	Q619	Q619-R623 PolarHBondContact O-N 3.48Å; Q619-R623 VanDerWaalsContact O-N 3.16Å
624	T	39.9	Very low	45.8	Very low	72 Å²	72	117.8 Å²	117.8	44%	0.442	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-2.6	176.5	51.4	0	0	0	0	114.5	L620	L620-T624 PolarHBondContact O-OG1 3.49Å
625	H	39.7	Very low	43.9	Very low	155 Å²	155	119.8 Å²	119.8	72%	0.718	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	1.4	173.3	-83.5	3.2	0	0	0	113.8
626	N	36.1	Very low	42.3	Very low	149 Å²	149	120.7 Å²	120.7	80%	0.797	61%	0.608	S	S	*	*			trans	-116.8	20.2	-179.9	-79.7	-13.6	0	0	0	113.7
627	V	32.6	Very low	40.5	Very low	190 Å²	190	123.8 Å²	123.8	100%	1.152	63%	0.626	S	S	*	*			trans	-134.9	0	166.6	-173.5	0	0	0	0	106.7

Retrieved 627 of 627 residues in 730 ms (Link to these results)

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