A0A3Q0KU55_SCHMA Loading...

Putative transcription initiation factor IIE, alpha subunit

AlphaFold DB , UniProt , Accession A0A3Q0KU55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 513 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	44	Very low	49	Very low	243 Å²	243	135.5 Å²	135.5	100%	1.197	82%	0.822	S	S	*	*				0	113.9	0	-77.1	177.4	157	0	0	107.4
2	S	44.8	Very low	49	Very low	107 Å²	107	132.9 Å²	132.9	75%	0.748	81%	0.81	S	S	*	*			trans	58	94.7	166.9	-50.6	0	0	0	0	118.4
3	T	48	Very low	48.7	Very low	140 Å²	140	135.9 Å²	135.9	86%	0.859	82%	0.819	S	S	*	*				72.3	133.7	84.8	54.1	0	0	0	0	113.4
4	A	51.6	Low	48.2	Very low	82 Å²	82	131.4 Å²	131.4	68%	0.678	81%	0.813	S	S	*	*			cis	-160.5	135.7	8.7	0	0	0	0	0	107.4
5	I	49.8	Very low	47.9	Very low	152 Å²	152	128.9 Å²	128.9	78%	0.779	81%	0.811	S	S	*	*				48.5	109.8	85.8	-34.7	159.6	0	0	0	115.2
6	N	54	Low	47.7	Very low	162 Å²	162	133.6 Å²	133.6	87%	0.866	82%	0.816	S	S	*	*				-158.7	124.4	126.2	-118.4	-1.2	0	0	0	112.8
7	S	40.5	Very low	47.3	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	82%	0.815	S	S	*	*			trans	-125.6	138.5	177.2	-57.3	0	0	0	0	108.7
8	S	53.1	Low	47.1	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	82%	0.817	S	S	*	*			trans	-174.6	103	160.4	31.3	0	0	0	0	108
9	V	52.1	Low	47.1	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	81%	0.813	S	S	*	*				84.8	139.5	71.6	170.7	0	0	0	0	113.3
10	P	47.8	Very low	46.9	Very low	104 Å²	104	134.5 Å²	134.5	68%	0.675	81%	0.809	S	S	*	*			trans	-118.3	179	-146.7	41.5	-27.6	0	0	0	114.9
11	T	53.4	Low	46.4	Very low	144 Å²	144	135.6 Å²	135.6	88%	0.883	81%	0.811	S	S	*	*			trans	-177.8	158.8	142.7	17.8	0	0	0	0	114
12	P	48.7	Very low	46.2	Very low	105 Å²	105	129 Å²	129	68%	0.682	79%	0.789	S	S	*	*			trans	-114.6	172.6	-155.6	43.1	-34	0	0	0	115.6
13	N	44.7	Very low	46.3	Very low	172 Å²	172	129.3 Å²	129.3	92%	0.92	79%	0.791	S	S	*	*			trans	161.6	139.9	152.8	-84.4	-22.1	0	0	0	107.9
14	G	42	Very low	46.2	Very low	72 Å²	72	128.3 Å²	128.3	74%	0.742	79%	0.787	S	S	*	*			cis	177	133.5	-0.6	0	0	0	0	0	108.5
15	A	43.8	Very low	45.7	Very low	94 Å²	94	128.8 Å²	128.8	78%	0.777	79%	0.791	S	S	*	*			trans	50.1	114.3	150.6	0	0	0	0	0	122.3
16	K	44.9	Very low	45.1	Very low	204 Å²	204	126 Å²	126	89%	0.887	79%	0.791	S	S	*	*				168.6	106.8	100.3	-87.3	173.4	-175.7	177.6	0	112.7
17	N	40.3	Very low	44.7	Very low	150 Å²	150	125.2 Å²	125.2	80%	0.802	79%	0.791	S	S	*	*			trans	24.1	121.9	141.9	-111.1	-22.5	0	0	0	121.5
18	I	43.4	Very low	44.6	Very low	166 Å²	166	131.5 Å²	131.5	85%	0.851	80%	0.799	S	S	*	*				167.4	131.8	114.9	-79.7	151.3	0	0	0	109.5
19	V	48.6	Very low	43.9	Very low	124 Å²	124	133.6 Å²	133.6	75%	0.752	80%	0.801	S	S	*	*			trans	-94.6	179.4	-170.2	-145.3	0	0	0	0	111.2
20	P	42.7	Very low	43.5	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	80%	0.799	S	S	*	*				-127.8	165.2	-101.4	42.5	-25.1	0	0	0	113.9
21	D	35.4	Very low	42.8	Very low	157 Å²	157	133 Å²	133	84%	0.84	80%	0.803	S	S	*	*			trans	-167	134.1	141.1	-142.2	-14.3	0	0	0	111.2
22	S	40.7	Very low	42	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	80%	0.798	S	S	*	*			trans	-161	108.7	176	-73.1	0	0	0	0	112.4
23	S	46.1	Very low	41.5	Very low	114 Å²	114	131.6 Å²	131.6	80%	0.797	80%	0.801	S	S	*	*				70.4	153.8	129.2	-76.2	0	0	0	0	118.6
24	P	46.2	Very low	41	Very low	118 Å²	118	129 Å²	129	77%	0.766	80%	0.796	S	S	*	*			cis	-154.2	172.1	49	39.6	-16.3	0	0	0	120.7
25	A	41.8	Very low	40.9	Very low	92 Å²	92	131.9 Å²	131.9	76%	0.76	80%	0.799	S	S	*	*			trans	61.2	111.6	143.8	0	0	0	0	0	119.6
26	A	37.8	Very low	40.4	Very low	94 Å²	94	138.4 Å²	138.4	78%	0.777	80%	0.804	S	S	*	*				74.8	114	61	0	0	0	0	0	115.1
27	V	43.7	Very low	40.3	Very low	146 Å²	146	137.8 Å²	137.8	89%	0.885	80%	0.804	S	S	*	*				155.8	137.6	114.9	172.5	0	0	0	0	112.2
28	R	38.3	Very low	40	Very low	236 Å²	236	137.2 Å²	137.2	89%	0.891	81%	0.806	S	S	*	*			trans	-64.7	161	-165.9	-76.2	162.5	164.7	-168.3	-5.4	119.2
29	L	39.3	Very low	39.5	Very low	153 Å²	153	133.7 Å²	133.7	80%	0.801	80%	0.802	S	S	*	*			trans	-56.4	175.3	168.7	-67.6	89.4	0	0	0	115.7
30	P	43.7	Very low	38.7	Very low	128 Å²	128	134.9 Å²	134.9	83%	0.831	80%	0.804	S	S	*	*				-134.4	172.2	109.9	37.8	-26.2	0	0	0	115.6
31	S	32.4	Very low	38.4	Very low	106 Å²	106	134.5 Å²	134.5	74%	0.741	81%	0.81	S	S	*	*			trans	-103.9	177.9	-165.9	47.6	0	0	0	0	115
32	S	38.4	Very low	38.5	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	81%	0.809	S	S	*	*			trans	92.1	139.6	171.7	78.2	0	0	0	0	115.4
33	S	37.7	Very low	38.3	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	81%	0.811	S	S	*	*			cis	-176.1	149.5	-8	39.9	0	0	0	0	108.2
34	S	33.3	Very low	37.9	Very low	117 Å²	117	136.2 Å²	136.2	82%	0.818	82%	0.816	S	S	*	*			trans	55	119.4	155.8	-80	0	0	0	0	120.3
35	V	39.6	Very low	37.7	Very low	132 Å²	132	139.7 Å²	139.7	80%	0.8	82%	0.822	S	S	*	*				-163.3	132.1	110.5	163.4	0	0	0	0	109.1
36	R	34.1	Very low	37.6	Very low	232 Å²	232	144.5 Å²	144.5	88%	0.875	83%	0.826	S	S	*	*			trans	-62.7	139	171.1	-70.1	166.4	161.8	-171.4	-6.5	111.2
37	Q	42.6	Very low	37.7	Very low	191 Å²	191	147 Å²	147	89%	0.893	83%	0.826	S	S	*	*			trans	-154.2	105.7	144.4	-109.5	161.3	68.6	0	0	110.3
38	T	33.4	Very low	37.8	Very low	137 Å²	137	143.4 Å²	143.4	84%	0.84	81%	0.808	S	S	*	*			trans	-75.1	137.8	162.2	43.1	0	0	0	0	109.6
39	A	34	Very low	38.3	Very low	92 Å²	92	138.1 Å²	138.1	76%	0.76	80%	0.802	S	S	*	*			trans	133.6	141	151.4	0	0	0	0	0	113.5
40	D	32	Very low	39.1	Very low	150 Å²	150	138.8 Å²	138.8	80%	0.802	80%	0.798	S	S	*	*			trans	85.2	61.1	166.5	-59.6	-18.7	0	0	0	119.6
41	A	36.8	Very low	39.9	Very low	105 Å²	105	133.9 Å²	133.9	87%	0.868	77%	0.766	S	S	*	*			trans	-97.3	63.1	156.6	0	0	0	0	0	110.9
42	T	36	Very low	41.8	Very low	131 Å²	131	130 Å²	130	80%	0.804	74%	0.738	S	S	*	*			trans	-152.1	71.4	175.1	13.8	0	0	0	0	110.5
43	S	36.4	Very low	43.6	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	73%	0.732	S	S	*	*			trans	-148.2	-0	176.1	-178.3	0	0	0	0	115.2
44	N	38.3	Very low	45.5	Very low	169 Å²	169	126.8 Å²	126.8	90%	0.904	71%	0.705	S	S	*	*	S	Bend	trans	-110.2	25.3	-162.8	-112.2	1.3	0	0	0	116.4
45	Q	41.7	Very low	47.9	Very low	190 Å²	190	121.3 Å²	121.3	89%	0.888	67%	0.666	S	S	*	*	S	Bend	trans	-128.2	8.2	-175.3	-94.7	-171.9	-8.3	0	0	116.6
46	K	39.8	Very low	50.1	Low	194 Å²	194	116.2 Å²	116.2	84%	0.843	63%	0.634	S	S	*	*	S	Bend	trans	-117.6	14.5	-165.6	-140	174.2	-179	177.9	0	117.7
47	D	39.4	Very low	52.7	Low	146 Å²	146	111.3 Å²	111.3	78%	0.781	62%	0.619	S	S	*	*			trans	-120.8	36.6	179.1	-74.1	-36.1	0	0	0	113.7
48	S	47.3	Very low	54.8	Low	71 Å²	71	102.2 Å²	102.2	50%	0.497	58%	0.577	S	S	.	*			trans	-87.2	3.2	-174.3	56.9	0	0	0	0	115.9	I246	S48-I246 WeakPolarHBondContact O-CD1 3.33Å
49	T	48	Very low	57.5	Low	125 Å²	125	95.8 Å²	95.8	77%	0.767	54%	0.537	S	S	*	.	S	Bend	trans	-109.9	-8.8	-176.7	58.4	0	0	0	0	114.8
50	K	56	Low	60.2	Low	166 Å²	166	93.9 Å²	93.9	72%	0.722	51%	0.51	S	S	*	.	S	Bend	trans	-110	139.1	173.2	-69.5	173.5	-176	168.1	0	108	P52	K50-P52 VanDerWaalsContact O-CD 3.23Å; K50-P52 WeakPolarHBondContact O-CD 3.37Å; K50-P52 VanDerWaalsContact O-N 3.09Å
51	V	61.2	Low	62.9	Low	26 Å²	26	88.7 Å²	88.7	16%	0.158	49%	0.486	C	S	.	.			trans	-54	120.4	173.4	-179	0	0	0	0	107.9	L53 L55 I56 Y137 I246	V51-L53 PolarHBondContact O-N 3.43Å; V51-L55 HydrophobicContact CG1-CB 4.5Å; V51-I56 HydrophobicContact CB-CD1 4.06Å; V51-I56 HydrophobicContact CB-CG1 4.18Å; V51-I56 HydrophobicContact CG1-CD1 4.08Å; V51-I56 HydrophobicContact CG1-CG1 3.62Å; V51-Y137 HydrophobicContact CG1-CD2 4.48Å; V51-Y137 HydrophobicContact CG1-CE1 3.86Å; V51-Y137 HydrophobicContact CG1-CE2 3.79Å; V51-Y137 VanDerWaalsContact CG1-CZ 3.44Å; V51-Y137 WeakPolarHBondContact CG1-OH 3.47Å; V51-Y137 HydrophobicContact CG2-CE2 3.91Å; V51-I246 HydrophobicContact CG2-CG2 4.39Å
52	P	71.2	Confident	65.5	Low	25 Å²	25	83.9 Å²	83.9	16%	0.162	45%	0.445	C	S	.	.			trans	-49.9	130.2	-179.7	-29.6	32.8	0	0	0	111.6	K50 C54 L55 I56 I240	K50-P52 VanDerWaalsContact O-CD 3.23Å; K50-P52 WeakPolarHBondContact O-CD 3.37Å; K50-P52 VanDerWaalsContact O-N 3.09Å; P52-C54 PolarHBondContact O-N 3.28Å; P52-C54 VanDerWaalsContact O-N 3.09Å; P52-L55 HydrophobicContact CB-CD1 4.07Å; P52-L55 HydrophobicContact CB-CG 4.26Å; P52-L55 HydrophobicContact CG-CD1 3.86Å; P52-L55 PolarHBondContact O-N 3.28Å; P52-I56 PolarHBondContact O-N 3.34Å; P52-I56 VanDerWaalsContact O-N 3.15Å; P52-I240 HydrophobicContact CB-CD1 4.05Å; P52-I240 HydrophobicContact CB-CG2 4.42Å; P52-I240 HydrophobicContact CG-CG2 3.84Å
53	L	76.2	Confident	68.1	Low	127 Å²	127	77.7 Å²	77.7	67%	0.665	41%	0.408	S	S	*	.	H	α-helix	trans	-57.1	-29.2	-178.5	-65	176.7	0	0	0	112	V51 I56 K57	V51-L53 PolarHBondContact O-N 3.43Å; L53-I56 HydrophobicContact CD2-CD1 4.45Å; L53-I56 PolarHBondContact O-N 3.48Å; L53-K57 WeakPolarHBondContact O-CB 3.49Å; L53-K57 VanDerWaalsContact O-CG 3.25Å; L53-K57 WeakPolarHBondContact O-CG 3.34Å; L53-K57 PolarHBondContact O-N 3.19Å
54	C	78.3	Confident	70.8	Confident	25 Å²	25	78.8 Å²	78.8	17%	0.169	40%	0.395	C	S	.	.	H	α-helix	trans	-66.1	-44.3	177.6	-49.3	0	0	0	0	111.5	P52 I56 K57 L58 E236 C237 I240	P52-C54 PolarHBondContact O-N 3.28Å; P52-C54 VanDerWaalsContact O-N 3.09Å; C54-I56 VanDerWaalsContact C-N 3.35Å; C54-I56 PolarHBondContact O-N 3.43Å; C54-K57 WeakPolarHBondContact O-CB 3.44Å; C54-K57 PolarHBondContact O-N 3.43Å; C54-L58 WeakPolarHBondContact O-CB 3.45Å; C54-L58 PolarHBondContact O-N 3Å; C54-E236 HydrophobicContact CB-CG 4.49Å; C54-E236 PolarHBondContact SG-OE1 3.35Å; C54-C237 VanDerWaalsContact C-SG 3.54Å; C54-I240 HydrophobicContact CB-CD1 4.45Å
55	L	83.3	Confident	73.2	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-64.3	-41.6	175.4	-70.2	171	0	0	0	111.5	V51 P52 K57 L58 V59 Y137 V141 C237 L242	V51-L55 HydrophobicContact CG1-CB 4.5Å; P52-L55 HydrophobicContact CB-CD1 4.07Å; P52-L55 HydrophobicContact CB-CG 4.26Å; P52-L55 HydrophobicContact CG-CD1 3.86Å; P52-L55 PolarHBondContact O-N 3.28Å; L55-K57 VanDerWaalsContact C-N 3.31Å; L55-K57 PolarHBondContact O-N 3.32Å; L55-L58 WeakPolarHBondContact O-CB 3.36Å; L55-L58 PolarHBondContact O-N 3.34Å; L55-V59 VanDerWaalsContact O-CG2 3.29Å; L55-V59 WeakPolarHBondContact O-CG2 3.37Å; L55-V59 PolarHBondContact O-N 3.35Å; L55-Y137 HydrophobicContact CB-CD1 4.34Å; L55-V141 HydrophobicContact CD2-CG2 4.15Å; L55-C237 HydrophobicContact CD2-CB 3.75Å; L55-C237 HydrophobicContact CG-CB 4.48Å; L55-L242 HydrophobicContact CD1-CD1 3.92Å; L55-L242 HydrophobicContact CD1-CD2 3.8Å; L55-L242 HydrophobicContact CD1-CG 3.99Å
56	I	86.9	Confident	75.5	Confident	25 Å²	25	70 Å²	70	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-58.5	-45.6	174.6	-70.5	-179	0	0	0	111	V51 P52 L53 C54 R60 V79	V51-I56 HydrophobicContact CB-CD1 4.06Å; V51-I56 HydrophobicContact CB-CG1 4.18Å; V51-I56 HydrophobicContact CG1-CD1 4.08Å; V51-I56 HydrophobicContact CG1-CG1 3.62Å; P52-I56 PolarHBondContact O-N 3.34Å; P52-I56 VanDerWaalsContact O-N 3.15Å; L53-I56 HydrophobicContact CD2-CD1 4.45Å; L53-I56 PolarHBondContact O-N 3.48Å; C54-I56 VanDerWaalsContact C-N 3.35Å; C54-I56 PolarHBondContact O-N 3.43Å; I56-R60 VanDerWaalsContact O-CB 3.29Å; I56-R60 WeakPolarHBondContact O-CB 3.47Å; I56-R60 VanDerWaalsContact O-CG 3.26Å; I56-R60 WeakPolarHBondContact O-CG 3.33Å; I56-R60 PolarHBondContact O-N 3.09Å; I56-V79 HydrophobicContact CB-CG1 4.25Å; I56-V79 HydrophobicContact CD1-CG1 4.01Å; I56-V79 HydrophobicContact CG1-CG1 3.75Å; I56-V79 HydrophobicContact CG2-CG1 3.81Å
57	K	87.7	Confident	78	Confident	128 Å²	128	63 Å²	63	56%	0.557	32%	0.322	S	S	*	.	H	α-helix	trans	-63.9	-42.9	177.4	-74.1	171	-177.5	176.8	0	111	L53 C54 L55 R60 S61 M233	L53-K57 WeakPolarHBondContact O-CB 3.49Å; L53-K57 VanDerWaalsContact O-CG 3.25Å; L53-K57 WeakPolarHBondContact O-CG 3.34Å; L53-K57 PolarHBondContact O-N 3.19Å; C54-K57 WeakPolarHBondContact O-CB 3.44Å; C54-K57 PolarHBondContact O-N 3.43Å; L55-K57 VanDerWaalsContact C-N 3.31Å; L55-K57 PolarHBondContact O-N 3.32Å; K57-R60 PolarHBondContact O-N 3.28Å; K57-S61 WeakPolarHBondContact O-CB 3.44Å; K57-S61 PolarHBondContact O-N 3.06Å; K57-M233 HydrophobicContact CB-CE 3.87Å
58	L	87.6	Confident	80.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.5	-53.8	177.9	-178.9	71.4	0	0	0	111.4	C54 L55 R60 S61 I62 F140 V141 I230 M233 L234 C237	C54-L58 WeakPolarHBondContact O-CB 3.45Å; C54-L58 PolarHBondContact O-N 3Å; L55-L58 WeakPolarHBondContact O-CB 3.36Å; L55-L58 PolarHBondContact O-N 3.34Å; L58-R60 VanDerWaalsContact C-N 3.3Å; L58-R60 PolarHBondContact O-N 2.95Å; L58-S61 PolarHBondContact O-N 3.21Å; L58-I62 HydrophobicContact CD1-CD1 3.72Å; L58-I62 HydrophobicContact CD1-CG1 4.38Å; L58-I62 HydrophobicContact CD2-CD1 4.49Å; L58-I62 HydrophobicContact CG-CD1 3.71Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.39Å; L58-I62 PolarHBondContact O-N 3.46Å; L58-F140 HydrophobicContact CD2-CE1 4.44Å; L58-F140 HydrophobicContact CG-CE1 4.46Å; L58-V141 HydrophobicContact CD2-CG2 4.31Å; L58-I230 HydrophobicContact CD1-CG2 4.23Å; L58-M233 VanDerWaalsContact CA-CE 3.5Å; L58-M233 HydrophobicContact CB-CE 4.19Å; L58-M233 HydrophobicContact CD1-CB 3.82Å; L58-M233 HydrophobicContact CD1-CE 4.45Å; L58-L234 HydrophobicContact CD1-CD2 4.22Å; L58-L234 HydrophobicContact CD1-CG 4.17Å; L58-L234 HydrophobicContact CD2-CD2 3.73Å; L58-L234 HydrophobicContact CD2-CG 4.5Å; L58-C237 HydrophobicContact CD2-CB 4.46Å
59	V	90.2	Very high	82.8	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-56	-47.6	178.3	172.4	0	0	0	0	110.6	L55 S61 I62 V63 V75 V79 Y137 F140	L55-V59 VanDerWaalsContact O-CG2 3.29Å; L55-V59 WeakPolarHBondContact O-CG2 3.37Å; L55-V59 PolarHBondContact O-N 3.35Å; V59-S61 PolarHBondContact O-N 2.94Å; V59-I62 PolarHBondContact O-N 2.97Å; V59-V63 HydrophobicContact CG1-CG2 4.49Å; V59-V63 VanDerWaalsContact O-CG2 3.29Å; V59-V63 WeakPolarHBondContact O-CG2 3.43Å; V59-V63 PolarHBondContact O-N 3Å; V59-V75 HydrophobicContact CG1-CG1 3.39Å; V59-V79 HydrophobicContact CG1-CG2 4.19Å; V59-Y137 HydrophobicContact CG2-CD1 4.18Å; V59-Y137 HydrophobicContact CG2-CE1 4.03Å; V59-F140 HydrophobicContact CB-CE1 4.17Å; V59-F140 HydrophobicContact CB-CZ 4.07Å; V59-F140 HydrophobicContact CG1-CE2 4.39Å; V59-F140 HydrophobicContact CG1-CZ 4.25Å; V59-F140 HydrophobicContact CG2-CD1 3.7Å; V59-F140 HydrophobicContact CG2-CD2 4.47Å; V59-F140 HydrophobicContact CG2-CE1 3.42Å; V59-F140 VanDerWaalsContact CG2-CE1 3.42Å; V59-F140 HydrophobicContact CG2-CE2 4.24Å; V59-F140 HydrophobicContact CG2-CG 4.24Å; V59-F140 HydrophobicContact CG2-CZ 3.73Å
60	R	90.1	Very high	84.9	Confident	52 Å²	52	61.6 Å²	61.6	20%	0.196	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-38	179.3	-78.7	-178.8	163.6	126.3	14.2	113.6	I56 K57 L58 R64 D76	I56-R60 VanDerWaalsContact O-CB 3.29Å; I56-R60 WeakPolarHBondContact O-CB 3.47Å; I56-R60 VanDerWaalsContact O-CG 3.26Å; I56-R60 WeakPolarHBondContact O-CG 3.33Å; I56-R60 PolarHBondContact O-N 3.09Å; K57-R60 PolarHBondContact O-N 3.28Å; L58-R60 VanDerWaalsContact C-N 3.3Å; L58-R60 PolarHBondContact O-N 2.95Å; R60-R64 WeakPolarHBondContact O-CB 3.37Å; R60-R64 VanDerWaalsContact O-CG 3.23Å; R60-R64 WeakPolarHBondContact O-CG 3.16Å; R60-R64 PolarHBondContact O-N 2.85Å; R60-D76 WeakPolarHBondContact CD-OD1 3.36Å; R60-D76 WeakPolarHBondContact CG-OD1 3.35Å; R60-D76 IonicContact CZ-OD1 2.71Å; R60-D76 IonicContact NE-OD1 3.63Å; R60-D76 PolarHBondContact NE-OD1 3.37Å; R60-D76 IonicContact NH2-OD1 3.73Å
61	S	89.2	Confident	86.7	Confident	41 Å²	41	54.6 Å²	54.6	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-65.1	-53.1	178	-169.5	0	0	0	0	110.1	K57 L58 V59 V63 R64 T65	K57-S61 WeakPolarHBondContact O-CB 3.44Å; K57-S61 PolarHBondContact O-N 3.06Å; L58-S61 PolarHBondContact O-N 3.21Å; V59-S61 PolarHBondContact O-N 2.94Å; S61-V63 PolarHBondContact O-N 3.34Å; S61-R64 PolarHBondContact O-N 3.04Å; S61-T65 WeakPolarHBondContact O-CG2 3.32Å; S61-T65 PolarHBondContact O-N 3.34Å; S61-T65 PolarHBondContact O-OG1 3.46Å
62	I	91	Very high	88.1	Confident	4 Å²	4	54 Å²	54	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-46.3	-176.5	-67.1	167.9	0	0	0	111.7	L58 V59 R64 T65 F66 F140 V144	L58-I62 HydrophobicContact CD1-CD1 3.72Å; L58-I62 HydrophobicContact CD1-CG1 4.38Å; L58-I62 HydrophobicContact CD2-CD1 4.49Å; L58-I62 HydrophobicContact CG-CD1 3.71Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.39Å; L58-I62 PolarHBondContact O-N 3.46Å; V59-I62 PolarHBondContact O-N 2.97Å; I62-R64 VanDerWaalsContact C-N 3.28Å; I62-R64 PolarHBondContact O-N 3.39Å; I62-T65 WeakPolarHBondContact CA-OG1 3.41Å; I62-T65 PolarHBondContact O-N 2.87Å; I62-T65 PolarHBondContact O-OG1 3.47Å; I62-F66 HydrophobicContact CG2-CD2 3.9Å; I62-F66 HydrophobicContact CG2-CE2 4.35Å; I62-F66 WeakPolarHBondContact O-CD2 3.45Å; I62-F66 PolarHBondContact O-N 3.33Å; I62-F140 HydrophobicContact CB-CZ 4.26Å; I62-F140 HydrophobicContact CD1-CE1 3.84Å; I62-F140 HydrophobicContact CD1-CZ 3.84Å; I62-F140 HydrophobicContact CG2-CZ 4.24Å; I62-V144 HydrophobicContact CD1-CB 4.2Å; I62-V144 HydrophobicContact CD1-CG1 3.56Å; I62-V144 HydrophobicContact CD1-CG2 3.62Å; I62-V144 HydrophobicContact CG2-CG2 4.31Å
63	V	91.3	Very high	89.1	Confident	2 Å²	2	56 Å²	56	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-31.7	-177.6	-178.8	0	0	0	0	111	V59 S61 Y67 H71 V75	V59-V63 HydrophobicContact CG1-CG2 4.49Å; V59-V63 VanDerWaalsContact O-CG2 3.29Å; V59-V63 WeakPolarHBondContact O-CG2 3.43Å; V59-V63 PolarHBondContact O-N 3Å; S61-V63 PolarHBondContact O-N 3.34Å; V63-Y67 WeakPolarHBondContact O-CB 3.43Å; V63-Y67 PolarHBondContact O-N 3.41Å; V63-Y67 VanDerWaalsContact O-N 3.13Å; V63-H71 HydrophobicContact CG1-CB 4.49Å; V63-V75 HydrophobicContact CG1-CB 4.32Å; V63-V75 HydrophobicContact CG1-CG2 4.1Å; V63-V75 HydrophobicContact CG2-CB 4.39Å; V63-V75 HydrophobicContact CG2-CG1 4.18Å; V63-V75 HydrophobicContact CG2-CG2 4.13Å
64	R	91.3	Very high	89.9	Confident	135 Å²	135	50 Å²	50	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-76.6	-26	175.5	-72.2	-179.1	-169.4	126.2	8	113.9	R60 S61 I62 D76	R60-R64 WeakPolarHBondContact O-CB 3.37Å; R60-R64 VanDerWaalsContact O-CG 3.23Å; R60-R64 WeakPolarHBondContact O-CG 3.16Å; R60-R64 PolarHBondContact O-N 2.85Å; S61-R64 PolarHBondContact O-N 3.04Å; I62-R64 VanDerWaalsContact C-N 3.28Å; I62-R64 PolarHBondContact O-N 3.39Å; R64-D76 IonicContact CZ-OD2 2.68Å; R64-D76 IonicContact NE-OD2 3.99Å; R64-D76 IonicContact NH2-OD1 2.65Å; R64-D76 PolarHBondContact NH2-OD1 3.46Å; R64-D76 VanDerWaalsContact NH2-OD1 3.16Å; R64-D76 IonicContact NH2-OD2 2.85Å; R64-D76 PolarHBondContact NH2-OD2 3.45Å
65	T	89.5	Confident	90.5	Very high	87 Å²	87	49 Å²	49	53%	0.534	23%	0.23	S	C	.	.	H	α-helix	trans	-83.3	-39.1	178.9	53.6	0	0	0	0	112.6	S61 I62	S61-T65 WeakPolarHBondContact O-CG2 3.32Å; S61-T65 PolarHBondContact O-N 3.34Å; S61-T65 PolarHBondContact O-OG1 3.46Å; I62-T65 WeakPolarHBondContact CA-OG1 3.41Å; I62-T65 PolarHBondContact O-N 2.87Å; I62-T65 PolarHBondContact O-OG1 3.47Å
66	F	89.4	Confident	90.8	Very high	87 Å²	87	49.8 Å²	49.8	38%	0.382	23%	0.234	S	C	.	.	H	α-helix	trans	-105.5	-23.9	-171.3	-63.3	-71.5	0	0	0	114.9	I62 M151 V226 I230	I62-F66 HydrophobicContact CG2-CD2 3.9Å; I62-F66 HydrophobicContact CG2-CE2 4.35Å; I62-F66 WeakPolarHBondContact O-CD2 3.45Å; I62-F66 PolarHBondContact O-N 3.33Å; F66-M151 HydrophobicContact CE1-CE 4.22Å; F66-M151 HydrophobicContact CE1-SD 4.28Å; F66-V226 HydrophobicContact CE1-CG1 4.34Å; F66-V226 HydrophobicContact CZ-CG1 3.66Å; F66-I230 HydrophobicContact CE2-CD1 3.85Å; F66-I230 HydrophobicContact CZ-CD1 4.11Å
67	Y	93.4	Very high	90.9	Very high	48 Å²	48	50.1 Å²	50.1	19%	0.188	24%	0.236	C	C	.	.	S	Bend	trans	-112.1	158.7	-175.3	-67.4	-100.4	0	0	0	111.9	V63 H71 T106 D110 F112	V63-Y67 WeakPolarHBondContact O-CB 3.43Å; V63-Y67 PolarHBondContact O-N 3.41Å; V63-Y67 VanDerWaalsContact O-N 3.13Å; Y67-H71 HydrophobicContact CD1-CB 4.33Å; Y67-H71 AromaticContact CD1-CD2 3.86Å; Y67-H71 HydrophobicContact CG-CB 4.37Å; Y67-T106 HydrophobicContact CE1-CG2 4.38Å; Y67-D110 VanDerWaalsContact CE1-OD2 3.31Å; Y67-D110 WeakPolarHBondContact CE1-OD2 3.35Å; Y67-D110 PolarHBondContact OH-OD2 2.77Å; Y67-F112 HydrophobicContact CD2-CE2 4.19Å; Y67-F112 HydrophobicContact CE1-CE2 4.47Å; Y67-F112 HydrophobicContact CE2-CD2 4.39Å; Y67-F112 AromaticContact CE2-CE2 3.34Å; Y67-F112 HydrophobicContact CE2-CE2 3.34Å; Y67-F112 AromaticContact CE2-CZ 3.94Å; Y67-F112 HydrophobicContact CE2-CZ 3.94Å; Y67-F112 AromaticContact CZ-CE2 3.5Å; Y67-F112 VanDerWaalsContact CZ-CE2 3.5Å; Y67-F112 WeakPolarHBondContact OH-CE2 3.42Å
68	S	93.9	Very high	91	Very high	63 Å²	63	44.1 Å²	44.1	44%	0.441	21%	0.21	S	C	.	.			trans	-63.5	162.8	175.1	-164.4	0	0	0	0	112.2	E70 H71 S72	S68-E70 WeakPolarHBondContact CB-OE2 3.39Å; S68-E70 PolarHBondContact O-N 3.39Å; S68-E70 PolarHBondContact OG-OE2 2.96Å; S68-H71 PolarHBondContact O-N 2.71Å; S68-H71 VanDerWaalsContact O-N 3.16Å; S68-S72 PolarHBondContact O-N 3.22Å
69	R	92.5	Very high	91	Very high	192 Å²	192	44.8 Å²	44.8	73%	0.725	21%	0.213	S	C	*	.	H	α-helix	trans	-54.7	-39.6	-178.3	-176.2	-179.7	-66.2	-169.1	0.5	112	H71 S72 L73	R69-H71 PolarHBondContact O-N 3.45Å; R69-S72 PolarHBondContact O-N 3.24Å; R69-S72 VanDerWaalsContact O-N 3.17Å; R69-S72 PolarHBondContact O-OG 2.85Å; R69-L73 WeakPolarHBondContact O-CG 3.4Å; R69-L73 PolarHBondContact O-N 3.08Å; R69-L73 VanDerWaalsContact O-N 3.11Å
70	E	92.4	Very high	90.8	Very high	56 Å²	56	53 Å²	53	26%	0.262	24%	0.244	S	C	.	.	H	α-helix	trans	-62.6	-43.2	-177.7	-57.4	78.7	-167.1	0	0	111.5	S68 S72 L73 I74 F95 Y103	S68-E70 WeakPolarHBondContact CB-OE2 3.39Å; S68-E70 PolarHBondContact O-N 3.39Å; S68-E70 PolarHBondContact OG-OE2 2.96Å; E70-S72 VanDerWaalsContact C-N 3.34Å; E70-S72 PolarHBondContact O-N 3.13Å; E70-L73 PolarHBondContact O-N 2.93Å; E70-I74 WeakPolarHBondContact O-CG1 3.42Å; E70-I74 PolarHBondContact O-N 2.81Å; E70-F95 HydrophobicContact CB-CE2 4.48Å; E70-F95 HydrophobicContact CB-CZ 4.06Å; E70-F95 HydrophobicContact CG-CE1 4.43Å; E70-F95 HydrophobicContact CG-CZ 4.11Å; E70-Y103 HydrophobicContact CB-CD2 4.13Å; E70-Y103 HydrophobicContact CB-CE1 4.11Å; E70-Y103 HydrophobicContact CB-CE2 3.72Å; E70-Y103 HydrophobicContact CG-CE2 3.98Å
71	H	93.5	Very high	90.5	Very high	19 Å²	19	54.2 Å²	54.2	9%	0.088	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-39.8	174.4	-65.1	-60.5	0	0	0	112.1	V63 Y67 S68 R69 L73 I74 V75 Y103 L107	V63-H71 HydrophobicContact CG1-CB 4.49Å; Y67-H71 HydrophobicContact CD1-CB 4.33Å; Y67-H71 AromaticContact CD1-CD2 3.86Å; Y67-H71 HydrophobicContact CG-CB 4.37Å; S68-H71 PolarHBondContact O-N 2.71Å; S68-H71 VanDerWaalsContact O-N 3.16Å; R69-H71 PolarHBondContact O-N 3.45Å; H71-L73 VanDerWaalsContact C-N 3.3Å; H71-L73 PolarHBondContact O-N 2.79Å; H71-I74 PolarHBondContact O-N 2.89Å; H71-V75 PolarHBondContact O-N 2.92Å; H71-V75 VanDerWaalsContact O-N 3.16Å; H71-Y103 AromaticContact CE1-CD1 3.32Å; H71-Y103 WeakPolarHBondContact CE1-CD1 3.49Å; H71-Y103 AromaticContact CE1-CG 3.97Å; H71-Y103 AromaticContact ND1-CD1 3.81Å; H71-Y103 AromaticContact NE2-CD1 3.7Å; H71-L107 HydrophobicContact CB-CD2 4.42Å
72	S	92	Very high	90	Very high	14 Å²	14	56.7 Å²	56.7	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-36.4	178.2	77	0	0	0	0	112.9	S68 R69 E70 D76	S68-S72 PolarHBondContact O-N 3.22Å; R69-S72 PolarHBondContact O-N 3.24Å; R69-S72 VanDerWaalsContact O-N 3.17Å; R69-S72 PolarHBondContact O-OG 2.85Å; E70-S72 VanDerWaalsContact C-N 3.34Å; E70-S72 PolarHBondContact O-N 3.13Å; S72-D76 VanDerWaalsContact O-CB 3.32Å; S72-D76 WeakPolarHBondContact O-CB 3.42Å; S72-D76 PolarHBondContact O-N 2.94Å
73	L	91.9	Very high	89.8	Confident	67 Å²	67	59 Å²	59	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-67.7	-41.9	177.2	-67	172.9	0	0	0	112.1	R69 E70 H71 D76 M77 L93 F95	R69-L73 WeakPolarHBondContact O-CG 3.4Å; R69-L73 PolarHBondContact O-N 3.08Å; R69-L73 VanDerWaalsContact O-N 3.11Å; E70-L73 PolarHBondContact O-N 2.93Å; H71-L73 VanDerWaalsContact C-N 3.3Å; H71-L73 PolarHBondContact O-N 2.79Å; L73-D76 PolarHBondContact O-N 2.58Å; L73-M77 WeakPolarHBondContact O-CG 3.34Å; L73-M77 PolarHBondContact O-N 2.99Å; L73-M77 VanDerWaalsContact O-N 3.07Å; L73-L93 HydrophobicContact CB-CD2 3.94Å; L73-F95 HydrophobicContact CD1-CZ 4.27Å
74	I	91.9	Very high	89.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-47.8	178.3	-64.6	164.5	0	0	0	110.1	E70 H71 D76 M77 L78 L93 L100 Y103 L104 L107	E70-I74 WeakPolarHBondContact O-CG1 3.42Å; E70-I74 PolarHBondContact O-N 2.81Å; H71-I74 PolarHBondContact O-N 2.89Å; I74-D76 PolarHBondContact O-N 2.81Å; I74-M77 PolarHBondContact O-N 3.44Å; I74-L78 HydrophobicContact CG2-CD1 4.1Å; I74-L78 WeakPolarHBondContact O-CG 3.31Å; I74-L78 PolarHBondContact O-N 3Å; I74-L93 HydrophobicContact CB-CD1 4.46Å; I74-L93 HydrophobicContact CG1-CD1 3.63Å; I74-L100 HydrophobicContact CD1-CD1 3.89Å; I74-L100 HydrophobicContact CG1-CD1 4.17Å; I74-Y103 HydrophobicContact CD1-CD2 4.47Å; I74-Y103 HydrophobicContact CD1-CG 4.35Å; I74-L104 HydrophobicContact CG2-CD2 4.01Å; I74-L107 HydrophobicContact CB-CD1 4.25Å; I74-L107 HydrophobicContact CD1-CD1 4.47Å; I74-L107 HydrophobicContact CG2-CD1 3.93Å
75	V	90.8	Very high	89.5	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-38.6	178.9	177.7	0	0	0	0	111.2	V59 V63 H71 M77 L78 V79 L107 I135	V59-V75 HydrophobicContact CG1-CG1 3.39Å; V63-V75 HydrophobicContact CG1-CB 4.32Å; V63-V75 HydrophobicContact CG1-CG2 4.1Å; V63-V75 HydrophobicContact CG2-CB 4.39Å; V63-V75 HydrophobicContact CG2-CG1 4.18Å; V63-V75 HydrophobicContact CG2-CG2 4.13Å; H71-V75 PolarHBondContact O-N 2.92Å; H71-V75 VanDerWaalsContact O-N 3.16Å; V75-M77 PolarHBondContact O-N 3.07Å; V75-L78 PolarHBondContact O-N 2.89Å; V75-V79 HydrophobicContact CG1-CG2 4.16Å; V75-V79 VanDerWaalsContact O-CG2 3.31Å; V75-V79 WeakPolarHBondContact O-CG2 3.47Å; V75-V79 PolarHBondContact O-N 3.44Å; V75-L107 HydrophobicContact CG2-CD1 4.18Å; V75-L107 HydrophobicContact CG2-CD2 4.27Å; V75-I135 HydrophobicContact CG1-CD1 4.15Å
76	D	90.8	Very high	89.5	Confident	20 Å²	20	54 Å²	54	11%	0.107	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-32.9	176	-87.6	-29.2	0	0	0	113	R60 R64 S72 L73 I74 R80	R60-D76 WeakPolarHBondContact CD-OD1 3.36Å; R60-D76 WeakPolarHBondContact CG-OD1 3.35Å; R60-D76 IonicContact CZ-OD1 2.71Å; R60-D76 IonicContact NE-OD1 3.63Å; R60-D76 PolarHBondContact NE-OD1 3.37Å; R60-D76 IonicContact NH2-OD1 3.73Å; R64-D76 IonicContact CZ-OD2 2.68Å; R64-D76 IonicContact NE-OD2 3.99Å; R64-D76 IonicContact NH2-OD1 2.65Å; R64-D76 PolarHBondContact NH2-OD1 3.46Å; R64-D76 VanDerWaalsContact NH2-OD1 3.16Å; R64-D76 IonicContact NH2-OD2 2.85Å; R64-D76 PolarHBondContact NH2-OD2 3.45Å; S72-D76 VanDerWaalsContact O-CB 3.32Å; S72-D76 WeakPolarHBondContact O-CB 3.42Å; S72-D76 PolarHBondContact O-N 2.94Å; L73-D76 PolarHBondContact O-N 2.58Å; I74-D76 PolarHBondContact O-N 2.81Å; D76-R80 WeakPolarHBondContact O-CG 3.36Å
77	M	88.2	Confident	89.4	Confident	32 Å²	32	53.5 Å²	53.5	16%	0.158	26%	0.257	C	S	.	.	H	α-helix	trans	-72.2	-45	172.5	-65.9	-55.3	115.9	0	0	112	L73 I74 V75 V79 R80 N81 L89 R92 L93	L73-M77 WeakPolarHBondContact O-CG 3.34Å; L73-M77 PolarHBondContact O-N 2.99Å; L73-M77 VanDerWaalsContact O-N 3.07Å; I74-M77 PolarHBondContact O-N 3.44Å; V75-M77 PolarHBondContact O-N 3.07Å; M77-V79 VanDerWaalsContact C-N 3.29Å; M77-V79 PolarHBondContact O-N 3.43Å; M77-R80 PolarHBondContact O-N 3.44Å; M77-R80 VanDerWaalsContact O-N 3.1Å; M77-N81 PolarHBondContact O-N 2.89Å; M77-L89 HydrophobicContact CB-CD2 4.21Å; M77-R92 HydrophobicContact SD-CG 4.49Å; M77-L93 HydrophobicContact CG-CD2 3.95Å; M77-L93 HydrophobicContact CG-CG 4.46Å
78	L	89.2	Confident	89.3	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-27.4	179	-70.5	171.8	0	0	0	113.7	I74 V75 R80 N81 M84 I113 I135	I74-L78 HydrophobicContact CG2-CD1 4.1Å; I74-L78 WeakPolarHBondContact O-CG 3.31Å; I74-L78 PolarHBondContact O-N 3Å; V75-L78 PolarHBondContact O-N 2.89Å; L78-R80 VanDerWaalsContact C-N 3.33Å; L78-N81 CarbonylContact C-O 3.6Å; L78-N81 CarbonylContact O-C 3.58Å; L78-M84 HydrophobicContact CD2-CB 3.9Å; L78-M84 HydrophobicContact CD2-CG 4.12Å; L78-I113 HydrophobicContact CD1-CG2 3.77Å; L78-I135 HydrophobicContact CB-CD1 3.55Å; L78-I135 HydrophobicContact CB-CG1 3.98Å; L78-I135 HydrophobicContact CD1-CG1 4.3Å
79	V	88	Confident	89.1	Confident	13 Å²	13	51.3 Å²	51.3	8%	0.079	24%	0.244	C	C	.	.	H	α-helix	trans	-73.8	-27.8	174.1	171.9	0	0	0	0	111.7	I56 V59 V75 M77 I135	I56-V79 HydrophobicContact CB-CG1 4.25Å; I56-V79 HydrophobicContact CD1-CG1 4.01Å; I56-V79 HydrophobicContact CG1-CG1 3.75Å; I56-V79 HydrophobicContact CG2-CG1 3.81Å; V59-V79 HydrophobicContact CG1-CG2 4.19Å; V75-V79 HydrophobicContact CG1-CG2 4.16Å; V75-V79 VanDerWaalsContact O-CG2 3.31Å; V75-V79 WeakPolarHBondContact O-CG2 3.47Å; V75-V79 PolarHBondContact O-N 3.44Å; M77-V79 VanDerWaalsContact C-N 3.29Å; M77-V79 PolarHBondContact O-N 3.43Å; V79-I135 HydrophobicContact CG2-CD1 3.79Å
80	R	85.8	Confident	88.9	Confident	174 Å²	174	43.3 Å²	43.3	66%	0.657	22%	0.216	S	C	*	.	H	α-helix	trans	-81.5	-39	176.9	-69.8	176.8	-178.4	169.8	1.9	111.8	D76 M77 L78	D76-R80 WeakPolarHBondContact O-CG 3.36Å; M77-R80 PolarHBondContact O-N 3.44Å; M77-R80 VanDerWaalsContact O-N 3.1Å; L78-R80 VanDerWaalsContact C-N 3.33Å
81	N	83.7	Confident	88.7	Confident	79 Å²	79	46.9 Å²	46.9	42%	0.422	23%	0.233	S	C	.	.	S	Bend	trans	-117.1	109.5	-179.9	-60.5	-22.8	0	0	0	108.6	M77 L78 I83 M84	M77-N81 PolarHBondContact O-N 2.89Å; L78-N81 CarbonylContact C-O 3.6Å; L78-N81 CarbonylContact O-C 3.58Å; N81-I83 PolarHBondContact O-N 2.94Å; N81-M84 HydrophobicContact CB-CG 3.64Å; N81-M84 HydrophobicContact CB-SD 3.51Å; N81-M84 VanDerWaalsContact CB-SD 3.51Å; N81-M84 PolarHBondContact ND2-SD 3.18Å
82	T	80	Confident	88.5	Confident	92 Å²	92	55 Å²	55	56%	0.564	26%	0.263	S	S	*	.	S	Bend	trans	-59.5	-30.4	-171	49.2	0	0	0	0	114.3
83	I	85.2	Confident	88.3	Confident	54 Å²	54	55.7 Å²	55.7	28%	0.277	27%	0.265	S	S	.	.	S	Bend	trans	-133.8	130.2	175.7	-58.7	162.5	0	0	0	108.1	N81 H132 P249 I251	N81-I83 PolarHBondContact O-N 2.94Å; I83-H132 HydrophobicContact CG2-CB 3.94Å; I83-P249 HydrophobicContact CD1-CB 3.57Å; I83-P249 HydrophobicContact CD1-CG 3.48Å; I83-P249 VanDerWaalsContact CD1-CG 3.48Å; I83-P249 HydrophobicContact CG1-CB 4.2Å; I83-P249 HydrophobicContact CG1-CG 3.6Å; I83-I251 HydrophobicContact CD1-CG1 4.1Å; I83-I251 HydrophobicContact CG2-CD1 4.46Å
84	M	88.6	Confident	88.1	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.8	179.1	-73.5	-78.2	-65.6	0	0	111.4	L78 N81 D88 L89 Y133	L78-M84 HydrophobicContact CD2-CB 3.9Å; L78-M84 HydrophobicContact CD2-CG 4.12Å; N81-M84 HydrophobicContact CB-CG 3.64Å; N81-M84 HydrophobicContact CB-SD 3.51Å; N81-M84 VanDerWaalsContact CB-SD 3.51Å; N81-M84 PolarHBondContact ND2-SD 3.18Å; M84-D88 HydrophobicContact CE-CB 3.72Å; M84-L89 HydrophobicContact CB-CD1 4.41Å; M84-L89 HydrophobicContact CB-CD2 4.29Å; M84-L89 HydrophobicContact CB-CG 4.13Å; M84-L89 HydrophobicContact CE-CD2 3.83Å; M84-L89 HydrophobicContact CE-CG 4.08Å; M84-L89 HydrophobicContact CG-CD2 4.48Å; M84-Y133 PolarHBondContact N-O 3Å; M84-Y133 PolarHBondContact O-N 3.22Å
85	K	89.3	Confident	87.9	Confident	71 Å²	71	64.6 Å²	64.6	31%	0.309	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	153.9	171	-66.2	-176.9	-92.7	-169.4	0	111.2	D87 D88 L89 I130 H132	K85-D87 VanDerWaalsContact C-N 3.31Å; K85-D87 PolarHBondContact O-N 3.25Å; K85-D88 HydrophobicContact CB-CB 4.36Å; K85-D88 PolarHBondContact O-N 3Å; K85-L89 PolarHBondContact O-N 2.83Å; K85-L89 VanDerWaalsContact O-N 3.14Å; K85-I130 HydrophobicContact CB-CG2 4.3Å; K85-I130 HydrophobicContact CD-CG2 3.7Å; K85-I130 HydrophobicContact CG-CG2 3.77Å; K85-H132 VanDerWaalsContact CG-CD2 3.48Å; K85-H132 WeakPolarHBondContact CG-CD2 3.47Å; K85-H132 VanDerWaalsContact CG-NE2 3.28Å; K85-H132 WeakPolarHBondContact CG-NE2 3.43Å
86	E	88.2	Confident	88	Confident	30 Å²	30	69.5 Å²	69.5	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-42.6	175.9	-170.5	-179.4	154.4	0	0	111.8	L89 C90 L100 R101 L104 T131 Y133	E86-L89 PolarHBondContact O-N 3.49Å; E86-C90 PolarHBondContact O-N 3.01Å; E86-L100 HydrophobicContact CG-CD2 4.48Å; E86-R101 WeakPolarHBondContact OE1-CD 3.2Å; E86-R101 WeakPolarHBondContact OE1-CG 3.35Å; E86-R101 IonicContact OE1-CZ 2.78Å; E86-R101 IonicContact OE1-NH1 3.78Å; E86-R101 PolarHBondContact OE1-NH1 3.4Å; E86-L104 HydrophobicContact CG-CD1 4.15Å; E86-T131 PolarHBondContact N-O 3.09Å; E86-Y133 HydrophobicContact CB-CE2 4.13Å; E86-Y133 HydrophobicContact CG-CE2 4.48Å
87	D	88.2	Confident	87.9	Confident	78 Å²	78	74.6 Å²	74.6	42%	0.417	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-39.4	-179.6	-69.7	-51.6	0	0	0	112.1	K85 L89 C90 E91 R97	K85-D87 VanDerWaalsContact C-N 3.31Å; K85-D87 PolarHBondContact O-N 3.25Å; D87-L89 VanDerWaalsContact C-N 3.33Å; D87-L89 PolarHBondContact O-N 3.41Å; D87-C90 WeakPolarHBondContact O-CB 3.21Å; D87-C90 PolarHBondContact O-N 2.68Å; D87-C90 VanDerWaalsContact O-N 3.13Å; D87-E91 PolarHBondContact O-N 3.47Å; D87-R97 IonicContact OD1-CZ 3.65Å; D87-R97 IonicContact OD1-NE 3.81Å; D87-R97 IonicContact OD1-NH2 2.75Å; D87-R97 PolarHBondContact OD1-NH2 3.3Å
88	D	90.8	Very high	88.1	Confident	65 Å²	65	80.3 Å²	80.3	35%	0.348	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-39.7	176.2	-62	-16.8	0	0	0	111.4	M84 K85 C90 R92	M84-D88 HydrophobicContact CE-CB 3.72Å; K85-D88 HydrophobicContact CB-CB 4.36Å; K85-D88 PolarHBondContact O-N 3Å; D88-C90 VanDerWaalsContact C-N 3.33Å; D88-R92 VanDerWaalsContact O-CB 3.23Å; D88-R92 WeakPolarHBondContact O-CB 3.35Å; D88-R92 PolarHBondContact O-N 3.28Å
89	L	89.1	Confident	88.3	Confident	0 Å²	0	84.5 Å²	84.5	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-40.6	173.9	-72.3	169.8	0	0	0	111.3	M77 M84 K85 E86 D87 L93 L100 L104 Y133	M77-L89 HydrophobicContact CB-CD2 4.21Å; M84-L89 HydrophobicContact CB-CD1 4.41Å; M84-L89 HydrophobicContact CB-CD2 4.29Å; M84-L89 HydrophobicContact CB-CG 4.13Å; M84-L89 HydrophobicContact CE-CD2 3.83Å; M84-L89 HydrophobicContact CE-CG 4.08Å; M84-L89 HydrophobicContact CG-CD2 4.48Å; K85-L89 PolarHBondContact O-N 2.83Å; K85-L89 VanDerWaalsContact O-N 3.14Å; E86-L89 PolarHBondContact O-N 3.49Å; D87-L89 VanDerWaalsContact C-N 3.33Å; D87-L89 PolarHBondContact O-N 3.41Å; L89-L93 VanDerWaalsContact O-CB 3.29Å; L89-L93 WeakPolarHBondContact O-CB 3.37Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 3.09Å; L89-L100 HydrophobicContact CB-CD2 4.02Å; L89-L104 HydrophobicContact CD1-CD2 4.24Å; L89-Y133 HydrophobicContact CD1-CD2 4.44Å
90	C	88.7	Confident	88.5	Confident	23 Å²	23	83.9 Å²	83.9	16%	0.155	38%	0.376	C	S	.	.	H	α-helix	trans	-63.4	-46	178.1	-164.9	0	0	0	0	111.6	E86 D87 D88 R94 F95 L100	E86-C90 PolarHBondContact O-N 3.01Å; D87-C90 WeakPolarHBondContact O-CB 3.21Å; D87-C90 PolarHBondContact O-N 2.68Å; D87-C90 VanDerWaalsContact O-N 3.13Å; D88-C90 VanDerWaalsContact C-N 3.33Å; C90-R94 WeakPolarHBondContact O-CA 3.36Å; C90-R94 PolarHBondContact O-N 3.24Å; C90-F95 PolarHBondContact SG-O 2.93Å; C90-L100 HydrophobicContact CB-CD2 3.71Å
91	E	89.3	Confident	88.8	Confident	132 Å²	132	81 Å²	81	62%	0.617	37%	0.365	S	S	*	.	H	α-helix	trans	-68.7	-43.3	180	-173.5	173.6	-173.6	0	0	111.7	D87 R94	D87-E91 PolarHBondContact O-N 3.47Å; E91-R94 WeakPolarHBondContact O-CD 3.37Å; E91-R94 PolarHBondContact O-N 3.48Å
92	R	89	Confident	89.2	Confident	188 Å²	188	83 Å²	83	71%	0.709	37%	0.372	S	S	*	.	H	α-helix	trans	-70.9	-38.9	-175.3	-157.4	70.8	174.1	104.9	-7.5	113.1	M77 D88	M77-R92 HydrophobicContact SD-CG 4.49Å; D88-R92 VanDerWaalsContact O-CB 3.23Å; D88-R92 WeakPolarHBondContact O-CB 3.35Å; D88-R92 PolarHBondContact O-N 3.28Å
93	L	87.7	Confident	89.8	Confident	29 Å²	29	81.1 Å²	81.1	15%	0.152	36%	0.355	C	S	.	.	H	α-helix	trans	-86.7	-13.9	-179.8	-64.9	167	0	0	0	112.8	L73 I74 M77 L89 F95 L100	L73-L93 HydrophobicContact CB-CD2 3.94Å; I74-L93 HydrophobicContact CB-CD1 4.46Å; I74-L93 HydrophobicContact CG1-CD1 3.63Å; M77-L93 HydrophobicContact CG-CD2 3.95Å; M77-L93 HydrophobicContact CG-CG 4.46Å; L89-L93 VanDerWaalsContact O-CB 3.29Å; L89-L93 WeakPolarHBondContact O-CB 3.37Å; L89-L93 WeakPolarHBondContact O-CG 3.47Å; L89-L93 PolarHBondContact O-N 3.09Å; L93-F95 HydrophobicContact CB-CD2 3.52Å; L93-F95 HydrophobicContact CB-CE2 3.84Å; L93-F95 HydrophobicContact CB-CG 4.09Å; L93-F95 HydrophobicContact CD1-CD2 3.85Å; L93-F95 HydrophobicContact CD1-CE2 3.9Å; L93-F95 HydrophobicContact CD2-CE2 4.41Å; L93-F95 HydrophobicContact CG-CD2 4.25Å; L93-F95 HydrophobicContact CG-CE2 4.27Å; L93-F95 PolarHBondContact O-N 3.18Å; L93-L100 HydrophobicContact CD1-CD1 4.33Å
94	R	88.3	Confident	90.2	Very high	211 Å²	211	78.6 Å²	78.6	80%	0.796	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	32	-174.7	-59.1	-70.2	-174.5	165.7	-3.7	112.7	C90 E91	C90-R94 WeakPolarHBondContact O-CA 3.36Å; C90-R94 PolarHBondContact O-N 3.24Å; E91-R94 WeakPolarHBondContact O-CD 3.37Å; E91-R94 PolarHBondContact O-N 3.48Å
95	F	87.3	Confident	90.4	Very high	44 Å²	44	83 Å²	83	19%	0.193	36%	0.362	C	S	.	.			trans	-82.8	156.3	174.6	-73.4	-39.6	0	0	0	111.8	E70 L73 C90 L93 L100	E70-F95 HydrophobicContact CB-CE2 4.48Å; E70-F95 HydrophobicContact CB-CZ 4.06Å; E70-F95 HydrophobicContact CG-CE1 4.43Å; E70-F95 HydrophobicContact CG-CZ 4.11Å; L73-F95 HydrophobicContact CD1-CZ 4.27Å; C90-F95 PolarHBondContact SG-O 2.93Å; L93-F95 HydrophobicContact CB-CD2 3.52Å; L93-F95 HydrophobicContact CB-CE2 3.84Å; L93-F95 HydrophobicContact CB-CG 4.09Å; L93-F95 HydrophobicContact CD1-CD2 3.85Å; L93-F95 HydrophobicContact CD1-CE2 3.9Å; L93-F95 HydrophobicContact CD2-CE2 4.41Å; L93-F95 HydrophobicContact CG-CD2 4.25Å; L93-F95 HydrophobicContact CG-CE2 4.27Å; L93-F95 PolarHBondContact O-N 3.18Å; F95-L100 HydrophobicContact CB-CB 4.36Å; F95-L100 HydrophobicContact CD2-CD1 4.3Å
96	E	92.9	Very high	90.6	Very high	106 Å²	106	81.7 Å²	81.7	50%	0.495	36%	0.36	S	S	.	.			trans	-67.5	134.1	167.3	-170.8	-175.6	171	0	0	109.5	K98 Q99 L100	E96-K98 PolarHBondContact O-N 2.76Å; E96-K98 VanDerWaalsContact O-N 3.08Å; E96-Q99 HydrophobicContact CB-CB 4.38Å; E96-Q99 HydrophobicContact CB-CG 4.12Å; E96-Q99 PolarHBondContact O-N 3.44Å; E96-L100 PolarHBondContact O-N 3.09Å
97	R	89.6	Confident	90.8	Very high	128 Å²	128	80.2 Å²	80.2	48%	0.483	35%	0.353	S	S	.	.	H	α-helix	trans	-53.2	-34.3	-178.2	-172.8	-178.6	-91.7	172.4	-8	113.3	D87 R101	D87-R97 IonicContact OD1-CZ 3.65Å; D87-R97 IonicContact OD1-NE 3.81Å; D87-R97 IonicContact OD1-NH2 2.75Å; D87-R97 PolarHBondContact OD1-NH2 3.3Å; R97-R101 VanDerWaalsContact CG-NH1 3.34Å; R97-R101 PolarHBondContact O-N 2.87Å
98	K	92	Very high	90.9	Very high	152 Å²	152	81.3 Å²	81.3	66%	0.661	35%	0.354	S	S	*	.	H	α-helix	trans	-68.8	-44.4	175.9	-69.9	-178.4	179.9	176.4	0	112.5	E96 R101 Q102	E96-K98 PolarHBondContact O-N 2.76Å; E96-K98 VanDerWaalsContact O-N 3.08Å; K98-R101 PolarHBondContact O-N 3.39Å; K98-Q102 PolarHBondContact O-N 2.87Å
99	Q	93.1	Very high	91	Very high	90 Å²	90	81.9 Å²	81.9	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-67.1	-43.9	179.6	-65.1	-179.9	-2.6	0	0	111.1	E96 R101 Q102 Y103	E96-Q99 HydrophobicContact CB-CB 4.38Å; E96-Q99 HydrophobicContact CB-CG 4.12Å; E96-Q99 PolarHBondContact O-N 3.44Å; Q99-R101 VanDerWaalsContact C-N 3.29Å; Q99-R101 PolarHBondContact O-N 3.42Å; Q99-Q102 WeakPolarHBondContact O-CB 3.29Å; Q99-Q102 PolarHBondContact O-N 2.94Å; Q99-Q102 VanDerWaalsContact O-N 3.11Å; Q99-Y103 HydrophobicContact CB-CE2 4.15Å; Q99-Y103 WeakPolarHBondContact O-CD2 3.43Å; Q99-Y103 PolarHBondContact O-N 3.09Å
100	L	92.1	Very high	91.1	Very high	0 Å²	0	83 Å²	83	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-57.2	-43.4	176.5	-178.9	66	0	0	0	111.6	I74 E86 L89 C90 L93 F95 E96 Q102 Y103 L104	I74-L100 HydrophobicContact CD1-CD1 3.89Å; I74-L100 HydrophobicContact CG1-CD1 4.17Å; E86-L100 HydrophobicContact CG-CD2 4.48Å; L89-L100 HydrophobicContact CB-CD2 4.02Å; C90-L100 HydrophobicContact CB-CD2 3.71Å; L93-L100 HydrophobicContact CD1-CD1 4.33Å; F95-L100 HydrophobicContact CB-CB 4.36Å; F95-L100 HydrophobicContact CD2-CD1 4.3Å; E96-L100 PolarHBondContact O-N 3.09Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; L100-Q102 PolarHBondContact O-N 2.66Å; L100-Y103 PolarHBondContact O-N 2.98Å; L100-L104 HydrophobicContact CD1-CD1 4.25Å; L100-L104 HydrophobicContact CD1-CG 4.26Å; L100-L104 HydrophobicContact CD2-CD1 4.38Å; L100-L104 HydrophobicContact CG-CD1 3.86Å; L100-L104 HydrophobicContact CG-CG 4.3Å; L100-L104 WeakPolarHBondContact O-CB 3.34Å; L100-L104 WeakPolarHBondContact O-CG 3.44Å; L100-L104 PolarHBondContact O-N 3.46Å
101	R	91.1	Very high	91.2	Very high	113 Å²	113	87.3 Å²	87.3	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-40.7	176.2	-83.9	-167.1	-83.1	-99	12.2	113.3	E86 R97 K98 Q99 L104 H105	E86-R101 WeakPolarHBondContact OE1-CD 3.2Å; E86-R101 WeakPolarHBondContact OE1-CG 3.35Å; E86-R101 IonicContact OE1-CZ 2.78Å; E86-R101 IonicContact OE1-NH1 3.78Å; E86-R101 PolarHBondContact OE1-NH1 3.4Å; R97-R101 VanDerWaalsContact CG-NH1 3.34Å; R97-R101 PolarHBondContact O-N 2.87Å; K98-R101 PolarHBondContact O-N 3.39Å; Q99-R101 VanDerWaalsContact C-N 3.29Å; Q99-R101 PolarHBondContact O-N 3.42Å; R101-L104 PolarHBondContact O-N 3.42Å; R101-H105 VanDerWaalsContact O-CB 3.31Å; R101-H105 WeakPolarHBondContact O-CB 3.14Å; R101-H105 PolarHBondContact O-N 2.88Å
102	Q	93.2	Very high	91.2	Very high	120 Å²	120	81.6 Å²	81.6	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-62.7	-44.8	175.8	-173.7	63.1	29.5	0	0	110.9	K98 Q99 L100 H105 T106	K98-Q102 PolarHBondContact O-N 2.87Å; Q99-Q102 WeakPolarHBondContact O-CB 3.29Å; Q99-Q102 PolarHBondContact O-N 2.94Å; Q99-Q102 VanDerWaalsContact O-N 3.11Å; L100-Q102 VanDerWaalsContact C-N 3.34Å; L100-Q102 PolarHBondContact O-N 2.66Å; Q102-H105 PolarHBondContact O-N 3.49Å; Q102-T106 PolarHBondContact O-N 3.09Å; Q102-T106 VanDerWaalsContact O-N 3.08Å; Q102-T106 PolarHBondContact O-OG1 3.07Å
103	Y	93.3	Very high	91.3	Very high	53 Å²	53	72.8 Å²	72.8	21%	0.208	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-40.2	179.5	-63.5	-48.1	0	0	0	112.9	E70 H71 I74 Q99 L100 H105 T106 L107	E70-Y103 HydrophobicContact CB-CD2 4.13Å; E70-Y103 HydrophobicContact CB-CE1 4.11Å; E70-Y103 HydrophobicContact CB-CE2 3.72Å; E70-Y103 HydrophobicContact CG-CE2 3.98Å; H71-Y103 AromaticContact CE1-CD1 3.32Å; H71-Y103 WeakPolarHBondContact CE1-CD1 3.49Å; H71-Y103 AromaticContact CE1-CG 3.97Å; H71-Y103 AromaticContact ND1-CD1 3.81Å; H71-Y103 AromaticContact NE2-CD1 3.7Å; I74-Y103 HydrophobicContact CD1-CD2 4.47Å; I74-Y103 HydrophobicContact CD1-CG 4.35Å; Q99-Y103 HydrophobicContact CB-CE2 4.15Å; Q99-Y103 WeakPolarHBondContact O-CD2 3.43Å; Q99-Y103 PolarHBondContact O-N 3.09Å; L100-Y103 PolarHBondContact O-N 2.98Å; Y103-H105 VanDerWaalsContact C-N 3.34Å; Y103-T106 PolarHBondContact O-N 2.8Å; Y103-L107 WeakPolarHBondContact O-CG 3.33Å; Y103-L107 PolarHBondContact O-N 3.26Å; Y103-L107 VanDerWaalsContact O-N 3.14Å
104	L	92.2	Very high	91.3	Very high	2 Å²	2	74.9 Å²	74.9	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-65.1	-37.7	173.9	-72.6	171.9	0	0	0	111.8	I74 E86 L89 L100 R101 L107 K108 I113 Y133	I74-L104 HydrophobicContact CG2-CD2 4.01Å; E86-L104 HydrophobicContact CG-CD1 4.15Å; L89-L104 HydrophobicContact CD1-CD2 4.24Å; L100-L104 HydrophobicContact CD1-CD1 4.25Å; L100-L104 HydrophobicContact CD1-CG 4.26Å; L100-L104 HydrophobicContact CD2-CD1 4.38Å; L100-L104 HydrophobicContact CG-CD1 3.86Å; L100-L104 HydrophobicContact CG-CG 4.3Å; L100-L104 WeakPolarHBondContact O-CB 3.34Å; L100-L104 WeakPolarHBondContact O-CG 3.44Å; L100-L104 PolarHBondContact O-N 3.46Å; R101-L104 PolarHBondContact O-N 3.42Å; L104-L107 PolarHBondContact O-N 3.12Å; L104-K108 VanDerWaalsContact O-CB 3.24Å; L104-K108 WeakPolarHBondContact O-CB 3.31Å; L104-K108 PolarHBondContact O-N 3.46Å; L104-I113 HydrophobicContact CD2-CD1 3.82Å; L104-Y133 HydrophobicContact CD1-CD2 4.43Å; L104-Y133 HydrophobicContact CD1-CE2 3.81Å; L104-Y133 HydrophobicContact CD2-CD1 4.47Å; L104-Y133 HydrophobicContact CD2-CE1 4.45Å; L104-Y133 HydrophobicContact CD2-CG 4.49Å
105	H	93	Very high	91.3	Very high	109 Å²	109	66.8 Å²	66.8	51%	0.505	31%	0.31	S	S	.	.	H	α-helix	trans	-62.4	-46.5	175.8	-177.5	-87.2	0	0	0	111.4	R101 Q102 Y103 L107 K108 C109	R101-H105 VanDerWaalsContact O-CB 3.31Å; R101-H105 WeakPolarHBondContact O-CB 3.14Å; R101-H105 PolarHBondContact O-N 2.88Å; Q102-H105 PolarHBondContact O-N 3.49Å; Y103-H105 VanDerWaalsContact C-N 3.34Å; H105-L107 PolarHBondContact O-N 3.18Å; H105-K108 PolarHBondContact O-N 3.03Å; H105-C109 PolarHBondContact CE1-SG 2.99Å; H105-C109 PolarHBondContact O-N 3.43Å; H105-C109 PolarHBondContact O-SG 3.02Å; H105-C109 VanDerWaalsContact O-SG 3.35Å
106	T	93.4	Very high	91.2	Very high	42 Å²	42	68.3 Å²	68.3	26%	0.258	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-48.8	175.3	-55.3	0	0	0	0	111.6	Y67 Q102 Y103 K108 C109 D110	Y67-T106 HydrophobicContact CE1-CG2 4.38Å; Q102-T106 PolarHBondContact O-N 3.09Å; Q102-T106 VanDerWaalsContact O-N 3.08Å; Q102-T106 PolarHBondContact O-OG1 3.07Å; Y103-T106 PolarHBondContact O-N 2.8Å; T106-K108 VanDerWaalsContact C-N 3.27Å; T106-K108 PolarHBondContact O-N 3.19Å; T106-C109 PolarHBondContact O-N 3.07Å; T106-D110 PolarHBondContact O-N 3.47Å
107	L	91.8	Very high	90.9	Very high	0 Å²	0	68 Å²	68	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-32.1	178.9	-69	172.9	0	0	0	112.9	H71 I74 V75 Y103 L104 H105 Q111 F112 I113	H71-L107 HydrophobicContact CB-CD2 4.42Å; I74-L107 HydrophobicContact CB-CD1 4.25Å; I74-L107 HydrophobicContact CD1-CD1 4.47Å; I74-L107 HydrophobicContact CG2-CD1 3.93Å; V75-L107 HydrophobicContact CG2-CD1 4.18Å; V75-L107 HydrophobicContact CG2-CD2 4.27Å; Y103-L107 WeakPolarHBondContact O-CG 3.33Å; Y103-L107 PolarHBondContact O-N 3.26Å; Y103-L107 VanDerWaalsContact O-N 3.14Å; L104-L107 PolarHBondContact O-N 3.12Å; H105-L107 PolarHBondContact O-N 3.18Å; L107-Q111 PolarHBondContact O-N 2.77Å; L107-F112 HydrophobicContact CD2-CD2 4.06Å; L107-F112 PolarHBondContact O-N 2.78Å; L107-F112 VanDerWaalsContact O-N 3.15Å; L107-I113 HydrophobicContact CB-CD1 3.66Å; L107-I113 HydrophobicContact CB-CG1 3.91Å
108	K	92	Very high	90.5	Very high	101 Å²	101	63.8 Å²	63.8	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-72.9	-41.6	174.8	179.9	175.3	172.8	169.9	0	111.9	L104 H105 T106 D110 Q111 I113 S115	L104-K108 VanDerWaalsContact O-CB 3.24Å; L104-K108 WeakPolarHBondContact O-CB 3.31Å; L104-K108 PolarHBondContact O-N 3.46Å; H105-K108 PolarHBondContact O-N 3.03Å; T106-K108 VanDerWaalsContact C-N 3.27Å; T106-K108 PolarHBondContact O-N 3.19Å; K108-D110 VanDerWaalsContact C-N 3.28Å; K108-D110 PolarHBondContact O-N 3.11Å; K108-Q111 PolarHBondContact O-N 2.91Å; K108-I113 HydrophobicContact CB-CG1 4.27Å; K108-S115 WeakPolarHBondContact CE-OG 3.13Å; K108-S115 PolarHBondContact NZ-OG 3.41Å
109	C	92.4	Very high	90.1	Very high	77 Å²	77	61.8 Å²	61.8	52%	0.52	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-37.6	175.2	-74.3	0	0	0	0	112.1	H105 T106 Q111	H105-C109 PolarHBondContact CE1-SG 2.99Å; H105-C109 PolarHBondContact O-N 3.43Å; H105-C109 PolarHBondContact O-SG 3.02Å; H105-C109 VanDerWaalsContact O-SG 3.35Å; T106-C109 PolarHBondContact O-N 3.07Å; C109-Q111 PolarHBondContact O-N 3.23Å
110	D	91.7	Very high	89.5	Confident	24 Å²	24	61.1 Å²	61.1	13%	0.128	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	2.8	175	-72	-38	0	0	0	113.7	Y67 T106 K108 F112 V143 R147	Y67-D110 VanDerWaalsContact CE1-OD2 3.31Å; Y67-D110 WeakPolarHBondContact CE1-OD2 3.35Å; Y67-D110 PolarHBondContact OH-OD2 2.77Å; T106-D110 PolarHBondContact O-N 3.47Å; K108-D110 VanDerWaalsContact C-N 3.28Å; K108-D110 PolarHBondContact O-N 3.11Å; D110-F112 HydrophobicContact CB-CD2 4.45Å; D110-F112 PolarHBondContact O-N 3.05Å; D110-F112 VanDerWaalsContact O-N 3.15Å; D110-V143 WeakPolarHBondContact O-CG1 3.4Å; D110-R147 IonicContact OD1-CZ 2.93Å; D110-R147 IonicContact OD1-NH2 3.21Å; D110-R147 PolarHBondContact OD1-NH2 3.44Å
111	Q	89.8	Confident	89.1	Confident	113 Å²	113	65.7 Å²	65.7	53%	0.528	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	25.2	177	-52.9	-174.5	-62.9	0	0	114.5	L107 K108 C109 V143	L107-Q111 PolarHBondContact O-N 2.77Å; K108-Q111 PolarHBondContact O-N 2.91Å; C109-Q111 PolarHBondContact O-N 3.23Å; Q111-V143 HydrophobicContact CB-CG2 3.94Å
112	F	88.7	Confident	88.5	Confident	11 Å²	11	64.3 Å²	64.3	5%	0.048	33%	0.325	C	S	.	.	S	Bend	trans	-79	-30.3	172.2	-68.9	-15.4	0	0	0	112.6	Y67 L107 D110 F140 V143 V144	Y67-F112 HydrophobicContact CD2-CE2 4.19Å; Y67-F112 HydrophobicContact CE1-CE2 4.47Å; Y67-F112 HydrophobicContact CE2-CD2 4.39Å; Y67-F112 AromaticContact CE2-CE2 3.34Å; Y67-F112 HydrophobicContact CE2-CE2 3.34Å; Y67-F112 AromaticContact CE2-CZ 3.94Å; Y67-F112 HydrophobicContact CE2-CZ 3.94Å; Y67-F112 AromaticContact CZ-CE2 3.5Å; Y67-F112 VanDerWaalsContact CZ-CE2 3.5Å; Y67-F112 WeakPolarHBondContact OH-CE2 3.42Å; L107-F112 HydrophobicContact CD2-CD2 4.06Å; L107-F112 PolarHBondContact O-N 2.78Å; L107-F112 VanDerWaalsContact O-N 3.15Å; D110-F112 HydrophobicContact CB-CD2 4.45Å; D110-F112 PolarHBondContact O-N 3.05Å; D110-F112 VanDerWaalsContact O-N 3.15Å; F112-F140 HydrophobicContact CB-CD2 4.19Å; F112-F140 AromaticContact CD1-CD2 3.47Å; F112-F140 HydrophobicContact CD1-CD2 3.47Å; F112-F140 VanDerWaalsContact CD1-CD2 3.47Å; F112-F140 AromaticContact CD1-CE2 3.66Å; F112-F140 HydrophobicContact CD1-CE2 3.66Å; F112-F140 HydrophobicContact CD2-CE2 4.24Å; F112-F140 AromaticContact CE1-CD2 3.93Å; F112-F140 HydrophobicContact CE1-CD2 3.93Å; F112-F140 AromaticContact CE1-CE2 3.77Å; F112-F140 HydrophobicContact CE1-CE2 3.77Å; F112-F140 HydrophobicContact CE2-CE2 4.31Å; F112-F140 AromaticContact CG-CD2 3.88Å; F112-F140 HydrophobicContact CG-CD2 3.88Å; F112-F140 AromaticContact CG-CE2 3.91Å; F112-F140 HydrophobicContact CG-CE2 3.91Å; F112-F140 HydrophobicContact CZ-CE2 4.1Å; F112-V143 HydrophobicContact CD1-CG1 4.38Å; F112-V143 HydrophobicContact CE1-CB 4.49Å; F112-V143 HydrophobicContact CE1-CG1 3.89Å; F112-V144 HydrophobicContact CE1-CG2 4.31Å
113	I	90.9	Very high	87.8	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.021	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	144.1	178.6	64.1	177.8	0	0	0	110.4	L78 L104 L107 K108 Y133 F134 I135	L78-I113 HydrophobicContact CD1-CG2 3.77Å; L104-I113 HydrophobicContact CD2-CD1 3.82Å; L107-I113 HydrophobicContact CB-CD1 3.66Å; L107-I113 HydrophobicContact CB-CG1 3.91Å; K108-I113 HydrophobicContact CB-CG1 4.27Å; I113-Y133 HydrophobicContact CD1-CD1 3.8Å; I113-Y133 HydrophobicContact CD1-CE1 4.22Å; I113-Y133 HydrophobicContact CG1-CD1 4.42Å; I113-F134 WeakPolarHBondContact CA-O 3.32Å; I113-I135 HydrophobicContact CG2-CG1 4.13Å
114	K	88.6	Confident	87	Confident	72 Å²	72	68.1 Å²	68.1	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.6	168.9	-76.1	-178.7	175.4	172.4	0	109.5	Y133 F134 D136	K114-Y133 WeakPolarHBondContact O-CA 3.28Å; K114-F134 HydrophobicContact CB-CD1 4.23Å; K114-F134 HydrophobicContact CB-CD2 4.33Å; K114-F134 HydrophobicContact CB-CE1 3.66Å; K114-F134 HydrophobicContact CB-CE2 3.79Å; K114-F134 HydrophobicContact CB-CZ 3.43Å; K114-F134 VanDerWaalsContact CB-CZ 3.43Å; K114-F134 HydrophobicContact CD-CE2 3.86Å; K114-F134 HydrophobicContact CD-CZ 3.77Å; K114-F134 HydrophobicContact CG-CE2 4.39Å; K114-F134 HydrophobicContact CG-CZ 4.25Å; K114-F134 PolarHBondContact N-O 3.26Å; K114-F134 PolarHBondContact O-N 3.11Å; K114-F134 VanDerWaalsContact O-N 3.13Å; K114-D136 HydrophobicContact CD-CB 4.06Å; K114-D136 VanDerWaalsContact CE-OD2 3.32Å; K114-D136 WeakPolarHBondContact CE-OD2 3.48Å; K114-D136 HydrophobicContact CG-CB 4.48Å; K114-D136 IonicContact NZ-OD2 3.62Å; K114-D136 PolarHBondContact NZ-OD2 3.09Å
115	S	87.8	Confident	86.3	Confident	42 Å²	42	70.7 Å²	70.7	29%	0.294	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.3	175.9	62.5	0	0	0	0	109.4	K108 H132	K108-S115 WeakPolarHBondContact CE-OG 3.13Å; K108-S115 PolarHBondContact NZ-OG 3.41Å; S115-H132 CarbonylContact C-O 3.46Å; S115-H132 WeakPolarHBondContact CA-O 3.23Å
116	K	86.5	Confident	85.8	Confident	76 Å²	76	71.8 Å²	71.8	33%	0.33	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.2	171.3	-177.5	160.5	168.1	-177.9	0	108.8	H132 F134 I251	K116-H132 PolarHBondContact N-O 2.7Å; K116-H132 PolarHBondContact O-N 2.92Å; K116-F134 HydrophobicContact CB-CE1 4.13Å; K116-I251 HydrophobicContact CB-CD1 4.31Å; K116-I251 HydrophobicContact CD-CD1 3.67Å; K116-I251 HydrophobicContact CD-CG1 4.23Å; K116-I251 HydrophobicContact CG-CD1 4.12Å
117	L	85.9	Confident	85.4	Confident	100 Å²	100	74 Å²	74	52%	0.524	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	127.4	177.4	-174.2	65.5	0	0	0	109	K129	L117-K129 HydrophobicContact CD1-CB 3.82Å; L117-K129 HydrophobicContact CD1-CG 4.43Å; L117-K129 HydrophobicContact CD2-CD 4.46Å
118	Q	80.6	Confident	85	Confident	38 Å²	38	77.3 Å²	77.3	18%	0.178	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	130.8	172.7	-174.5	167.5	-8.7	0	0	108.5	I130 H132	Q118-I130 PolarHBondContact N-O 2.96Å; Q118-I130 PolarHBondContact O-N 3.45Å; Q118-I130 VanDerWaalsContact O-O 3.11Å; Q118-H132 PolarHBondContact OE1-CE1 3.23Å; Q118-H132 PolarHBondContact OE1-ND1 3.26Å
119	L	84.5	Confident	84.7	Confident	110 Å²	110	79.5 Å²	79.5	58%	0.576	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	111.4	171.2	-70.4	141.6	0	0	0	106.2	T127 K129	L119-T127 HydrophobicContact CB-CG2 4.21Å; L119-T127 HydrophobicContact CD2-CG2 3.66Å; L119-K129 HydrophobicContact CD2-CD 4.38Å; L119-K129 HydrophobicContact CD2-CG 3.54Å; L119-K129 HydrophobicContact CG-CG 4.38Å
120	E	79.9	Confident	84.4	Confident	76 Å²	76	77 Å²	77	36%	0.355	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.3	172.6	-168.5	170.8	166.3	0	0	107.3	D122 T128 I130	E120-D122 PolarHBondContact O-N 3.27Å; E120-T128 PolarHBondContact N-O 3.16Å; E120-T128 PolarHBondContact O-N 3.28Å; E120-I130 HydrophobicContact CB-CD1 3.8Å; E120-I130 HydrophobicContact CG-CD1 4.43Å; E120-I130 WeakPolarHBondContact OE2-CD1 3.43Å
121	T	83.7	Confident	84.4	Confident	96 Å²	96	77.5 Å²	77.5	59%	0.589	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	109.6	172.6	-56.7	0	0	0	0	106.8
122	D	79.2	Confident	84.3	Confident	84 Å²	84	73 Å²	73	45%	0.449	40%	0.396	S	S	.	.			trans	-64.4	161.9	175.2	-172.3	23.3	0	0	0	110.3	E120 D124 G125 K126	E120-D122 PolarHBondContact O-N 3.27Å; D122-D124 PolarHBondContact O-N 3.11Å; D122-G125 PolarHBondContact O-N 3.12Å; D122-K126 PolarHBondContact N-O 3.45Å; D122-K126 VanDerWaalsContact N-O 3.1Å
123	V	77.9	Confident	84.4	Confident	152 Å²	152	73.5 Å²	73.5	92%	0.921	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.4	179.7	-60.8	0	0	0	0	113.5	G125	V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.41Å
124	D	76.3	Confident	84.4	Confident	102 Å²	102	73.8 Å²	73.8	55%	0.545	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	8.7	176.5	-163.6	36.2	0	0	0	113	D122 K126	D122-D124 PolarHBondContact O-N 3.11Å; D124-K126 PolarHBondContact O-N 2.7Å; D124-K126 VanDerWaalsContact O-N 3.08Å; D124-K126 WeakPolarHBondContact OD2-CD 3.35Å; D124-K126 VanDerWaalsContact OD2-CE 3.28Å; D124-K126 WeakPolarHBondContact OD2-CE 3.45Å; D124-K126 IonicContact OD2-NZ 2.69Å; D124-K126 PolarHBondContact OD2-NZ 3.49Å
125	G	78	Confident	84.4	Confident	55 Å²	55	70.9 Å²	70.9	57%	0.567	39%	0.387	S	S	*	.	S	Bend	trans	69.9	1.6	-177.8	0	0	0	0	0	114.4	D122 V123	D122-G125 PolarHBondContact O-N 3.12Å; V123-G125 VanDerWaalsContact C-N 3.27Å; V123-G125 PolarHBondContact O-N 3.41Å
126	K	82.5	Confident	84.3	Confident	133 Å²	133	69.3 Å²	69.3	58%	0.578	38%	0.375	S	S	*	.			trans	-80.9	119.7	175	-70.6	172.8	-176.4	144	0	109.8	D122 D124 T128	D122-K126 PolarHBondContact N-O 3.45Å; D122-K126 VanDerWaalsContact N-O 3.1Å; D124-K126 PolarHBondContact O-N 2.7Å; D124-K126 VanDerWaalsContact O-N 3.08Å; D124-K126 WeakPolarHBondContact OD2-CD 3.35Å; D124-K126 VanDerWaalsContact OD2-CE 3.28Å; D124-K126 WeakPolarHBondContact OD2-CE 3.45Å; D124-K126 IonicContact OD2-NZ 2.69Å; D124-K126 PolarHBondContact OD2-NZ 3.49Å; K126-T128 PolarHBondContact O-N 3.39Å
127	T	84.1	Confident	84.2	Confident	89 Å²	89	66.3 Å²	66.3	55%	0.546	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	107.6	173.6	-43.6	0	0	0	0	110.2	L119	L119-T127 HydrophobicContact CB-CG2 4.21Å; L119-T127 HydrophobicContact CD2-CG2 3.66Å
128	T	83.7	Confident	84	Confident	68 Å²	68	67.4 Å²	67.4	42%	0.417	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	127	176.4	-60.2	0	0	0	0	110.1	E120 K126 I130	E120-T128 PolarHBondContact N-O 3.16Å; E120-T128 PolarHBondContact O-N 3.28Å; K126-T128 PolarHBondContact O-N 3.39Å; T128-I130 HydrophobicContact CG2-CG1 4.04Å; T128-I130 PolarHBondContact O-N 3.16Å
129	K	86.1	Confident	84.3	Confident	147 Å²	147	68 Å²	68	64%	0.639	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	101.9	173.8	-73.7	177.2	-175.1	178.6	0	108.9	L117 L119	L117-K129 HydrophobicContact CD1-CB 3.82Å; L117-K129 HydrophobicContact CD1-CG 4.43Å; L117-K129 HydrophobicContact CD2-CD 4.46Å; L119-K129 HydrophobicContact CD2-CD 4.38Å; L119-K129 HydrophobicContact CD2-CG 3.54Å; L119-K129 HydrophobicContact CG-CG 4.38Å
130	I	86.9	Confident	84.5	Confident	26 Å²	26	62.9 Å²	62.9	13%	0.133	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128.1	178.1	-61.2	175.3	0	0	0	109.1	K85 Q118 E120 T128	K85-I130 HydrophobicContact CB-CG2 4.3Å; K85-I130 HydrophobicContact CD-CG2 3.7Å; K85-I130 HydrophobicContact CG-CG2 3.77Å; Q118-I130 PolarHBondContact N-O 2.96Å; Q118-I130 PolarHBondContact O-N 3.45Å; Q118-I130 VanDerWaalsContact O-O 3.11Å; E120-I130 HydrophobicContact CB-CD1 3.8Å; E120-I130 HydrophobicContact CG-CD1 4.43Å; E120-I130 WeakPolarHBondContact OE2-CD1 3.43Å; T128-I130 HydrophobicContact CG2-CG1 4.04Å; T128-I130 PolarHBondContact O-N 3.16Å
131	T	90.1	Very high	84.9	Confident	33 Å²	33	59.9 Å²	59.9	20%	0.202	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.1	175.5	-55.6	0	0	0	0	109.6	E86 Y133	E86-T131 PolarHBondContact N-O 3.09Å; T131-Y133 HydrophobicContact CG2-CD2 4.41Å; T131-Y133 HydrophobicContact CG2-CE1 4.22Å; T131-Y133 HydrophobicContact CG2-CE2 3.82Å
132	H	89.5	Confident	85.1	Confident	19 Å²	19	59.8 Å²	59.8	9%	0.088	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.2	172.1	-68.1	96.2	0	0	0	109.9	I83 K85 S115 K116 Q118 I251	I83-H132 HydrophobicContact CG2-CB 3.94Å; K85-H132 VanDerWaalsContact CG-CD2 3.48Å; K85-H132 WeakPolarHBondContact CG-CD2 3.47Å; K85-H132 VanDerWaalsContact CG-NE2 3.28Å; K85-H132 WeakPolarHBondContact CG-NE2 3.43Å; S115-H132 CarbonylContact C-O 3.46Å; S115-H132 WeakPolarHBondContact CA-O 3.23Å; K116-H132 PolarHBondContact N-O 2.7Å; K116-H132 PolarHBondContact O-N 2.92Å; Q118-H132 PolarHBondContact OE1-CE1 3.23Å; Q118-H132 PolarHBondContact OE1-ND1 3.26Å; H132-I251 HydrophobicContact CB-CD1 4.04Å
133	Y	90.6	Very high	85.7	Confident	22 Å²	22	56.4 Å²	56.4	9%	0.086	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.4	176.5	-65.9	-84.4	0	0	0	110.7	M84 E86 L89 L104 I113 K114 T131	M84-Y133 PolarHBondContact N-O 3Å; M84-Y133 PolarHBondContact O-N 3.22Å; E86-Y133 HydrophobicContact CB-CE2 4.13Å; E86-Y133 HydrophobicContact CG-CE2 4.48Å; L89-Y133 HydrophobicContact CD1-CD2 4.44Å; L104-Y133 HydrophobicContact CD1-CD2 4.43Å; L104-Y133 HydrophobicContact CD1-CE2 3.81Å; L104-Y133 HydrophobicContact CD2-CD1 4.47Å; L104-Y133 HydrophobicContact CD2-CE1 4.45Å; L104-Y133 HydrophobicContact CD2-CG 4.49Å; I113-Y133 HydrophobicContact CD1-CD1 3.8Å; I113-Y133 HydrophobicContact CD1-CE1 4.22Å; I113-Y133 HydrophobicContact CG1-CD1 4.42Å; K114-Y133 WeakPolarHBondContact O-CA 3.28Å; T131-Y133 HydrophobicContact CG2-CD2 4.41Å; T131-Y133 HydrophobicContact CG2-CE1 4.22Å; T131-Y133 HydrophobicContact CG2-CE2 3.82Å
134	F	89.5	Confident	86.3	Confident	10 Å²	10	49.5 Å²	49.5	4%	0.044	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	154.1	175.1	65.5	-84	0	0	0	110.8	I113 K114 K116 D136	I113-F134 WeakPolarHBondContact CA-O 3.32Å; K114-F134 HydrophobicContact CB-CD1 4.23Å; K114-F134 HydrophobicContact CB-CD2 4.33Å; K114-F134 HydrophobicContact CB-CE1 3.66Å; K114-F134 HydrophobicContact CB-CE2 3.79Å; K114-F134 HydrophobicContact CB-CZ 3.43Å; K114-F134 VanDerWaalsContact CB-CZ 3.43Å; K114-F134 HydrophobicContact CD-CE2 3.86Å; K114-F134 HydrophobicContact CD-CZ 3.77Å; K114-F134 HydrophobicContact CG-CE2 4.39Å; K114-F134 HydrophobicContact CG-CZ 4.25Å; K114-F134 PolarHBondContact N-O 3.26Å; K114-F134 PolarHBondContact O-N 3.11Å; K114-F134 VanDerWaalsContact O-N 3.13Å; K116-F134 HydrophobicContact CB-CE1 4.13Å; F134-D136 HydrophobicContact CE2-CB 4.48Å
135	I	88.2	Confident	86.9	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.056	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120	176.6	-62.4	168.8	0	0	0	108.3	V75 L78 V79 I113 Y137	V75-I135 HydrophobicContact CG1-CD1 4.15Å; L78-I135 HydrophobicContact CB-CD1 3.55Å; L78-I135 HydrophobicContact CB-CG1 3.98Å; L78-I135 HydrophobicContact CD1-CG1 4.3Å; V79-I135 HydrophobicContact CG2-CD1 3.79Å; I113-I135 HydrophobicContact CG2-CG1 4.13Å; I135-Y137 HydrophobicContact CG2-CD1 4.16Å; I135-Y137 HydrophobicContact CG2-CE1 4.02Å; I135-Y137 HydrophobicContact CG2-CE2 4.49Å; I135-Y137 HydrophobicContact CG2-CG 4.46Å
136	D	85.9	Confident	87.5	Confident	9 Å²	9	52.1 Å²	52.1	5%	0.048	25%	0.251	C	S	.	.			trans	-92.2	101.6	169.8	-173.8	-23.2	0	0	0	109.3	K114 F134 K138 L139 F140	K114-D136 HydrophobicContact CD-CB 4.06Å; K114-D136 VanDerWaalsContact CE-OD2 3.32Å; K114-D136 WeakPolarHBondContact CE-OD2 3.48Å; K114-D136 HydrophobicContact CG-CB 4.48Å; K114-D136 IonicContact NZ-OD2 3.62Å; K114-D136 PolarHBondContact NZ-OD2 3.09Å; F134-D136 HydrophobicContact CE2-CB 4.48Å; D136-K138 PolarHBondContact O-N 3.49Å; D136-K138 WeakPolarHBondContact OD1-CB 3.5Å; D136-K138 PolarHBondContact OD1-N 3.5Å; D136-L139 HydrophobicContact CB-CB 4.44Å; D136-L139 PolarHBondContact O-N 2.72Å; D136-L139 PolarHBondContact OD1-N 2.92Å; D136-L139 VanDerWaalsContact OD2-CD1 3.25Å; D136-L139 WeakPolarHBondContact OD2-CD1 3.34Å; D136-F140 WeakPolarHBondContact O-CB 3.42Å; D136-F140 PolarHBondContact O-N 2.78Å
137	Y	85	Confident	88	Confident	12 Å²	12	51.3 Å²	51.3	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-26.4	-177.4	-65.8	-77.9	0	0	0	113.3	V51 L55 V59 I135 V141 L242 I246	V51-Y137 HydrophobicContact CG1-CD2 4.48Å; V51-Y137 HydrophobicContact CG1-CE1 3.86Å; V51-Y137 HydrophobicContact CG1-CE2 3.79Å; V51-Y137 VanDerWaalsContact CG1-CZ 3.44Å; V51-Y137 WeakPolarHBondContact CG1-OH 3.47Å; V51-Y137 HydrophobicContact CG2-CE2 3.91Å; L55-Y137 HydrophobicContact CB-CD1 4.34Å; V59-Y137 HydrophobicContact CG2-CD1 4.18Å; V59-Y137 HydrophobicContact CG2-CE1 4.03Å; I135-Y137 HydrophobicContact CG2-CD1 4.16Å; I135-Y137 HydrophobicContact CG2-CE1 4.02Å; I135-Y137 HydrophobicContact CG2-CE2 4.49Å; I135-Y137 HydrophobicContact CG2-CG 4.46Å; Y137-V141 WeakPolarHBondContact O-CG2 3.29Å; Y137-V141 PolarHBondContact O-N 3.01Å; Y137-V141 VanDerWaalsContact O-N 3.16Å; Y137-L242 HydrophobicContact CD2-CD2 4.43Å; Y137-L242 HydrophobicContact CG-CD2 4.28Å; Y137-I246 HydrophobicContact CD2-CG2 4.15Å; Y137-I246 HydrophobicContact CE2-CG2 4.38Å
138	K	82.6	Confident	88.2	Confident	124 Å²	124	48.2 Å²	48.2	54%	0.539	22%	0.224	S	C	.	.	H	α-helix	trans	-72.8	-46.4	179.4	176.7	176.2	177.1	179.2	0	111.3	D136 F140 N142 L247	D136-K138 PolarHBondContact O-N 3.49Å; D136-K138 WeakPolarHBondContact OD1-CB 3.5Å; D136-K138 PolarHBondContact OD1-N 3.5Å; K138-F140 VanDerWaalsContact C-N 3.3Å; K138-N142 PolarHBondContact O-N 3.06Å; K138-N142 PolarHBondContact O-ND2 3.05Å; K138-L247 HydrophobicContact CB-CD2 3.43Å; K138-L247 VanDerWaalsContact CB-CD2 3.43Å; K138-L247 HydrophobicContact CB-CG 4.22Å; K138-L247 HydrophobicContact CD-CD2 3.45Å; K138-L247 VanDerWaalsContact CD-CD2 3.45Å; K138-L247 HydrophobicContact CG-CD2 4.08Å
139	L	87	Confident	88.5	Confident	50 Å²	50	47.7 Å²	47.7	26%	0.262	22%	0.219	S	C	.	.	H	α-helix	trans	-65.4	-39.9	173.9	-90.4	82.1	0	0	0	110.5	D136 V141 N142 V143	D136-L139 HydrophobicContact CB-CB 4.44Å; D136-L139 PolarHBondContact O-N 2.72Å; D136-L139 PolarHBondContact OD1-N 2.92Å; D136-L139 VanDerWaalsContact OD2-CD1 3.25Å; D136-L139 WeakPolarHBondContact OD2-CD1 3.34Å; L139-V141 PolarHBondContact O-N 3.27Å; L139-N142 PolarHBondContact O-N 2.94Å; L139-V143 WeakPolarHBondContact O-CB 3.45Å; L139-V143 WeakPolarHBondContact O-CG2 3.48Å; L139-V143 PolarHBondContact O-N 3.21Å
140	F	88.3	Confident	88.9	Confident	3 Å²	3	44.9 Å²	44.9	1%	0.013	21%	0.208	C	C	.	.	H	α-helix	trans	-54.1	-53.2	179	-178	-93.3	0	0	0	112.5	L58 V59 I62 F112 D136 K138 N142 V143 V144	L58-F140 HydrophobicContact CD2-CE1 4.44Å; L58-F140 HydrophobicContact CG-CE1 4.46Å; V59-F140 HydrophobicContact CB-CE1 4.17Å; V59-F140 HydrophobicContact CB-CZ 4.07Å; V59-F140 HydrophobicContact CG1-CE2 4.39Å; V59-F140 HydrophobicContact CG1-CZ 4.25Å; V59-F140 HydrophobicContact CG2-CD1 3.7Å; V59-F140 HydrophobicContact CG2-CD2 4.47Å; V59-F140 HydrophobicContact CG2-CE1 3.42Å; V59-F140 VanDerWaalsContact CG2-CE1 3.42Å; V59-F140 HydrophobicContact CG2-CE2 4.24Å; V59-F140 HydrophobicContact CG2-CG 4.24Å; V59-F140 HydrophobicContact CG2-CZ 3.73Å; I62-F140 HydrophobicContact CB-CZ 4.26Å; I62-F140 HydrophobicContact CD1-CE1 3.84Å; I62-F140 HydrophobicContact CD1-CZ 3.84Å; I62-F140 HydrophobicContact CG2-CZ 4.24Å; F112-F140 HydrophobicContact CB-CD2 4.19Å; F112-F140 AromaticContact CD1-CD2 3.47Å; F112-F140 HydrophobicContact CD1-CD2 3.47Å; F112-F140 VanDerWaalsContact CD1-CD2 3.47Å; F112-F140 AromaticContact CD1-CE2 3.66Å; F112-F140 HydrophobicContact CD1-CE2 3.66Å; F112-F140 HydrophobicContact CD2-CE2 4.24Å; F112-F140 AromaticContact CE1-CD2 3.93Å; F112-F140 HydrophobicContact CE1-CD2 3.93Å; F112-F140 AromaticContact CE1-CE2 3.77Å; F112-F140 HydrophobicContact CE1-CE2 3.77Å; F112-F140 HydrophobicContact CE2-CE2 4.31Å; F112-F140 AromaticContact CG-CD2 3.88Å; F112-F140 HydrophobicContact CG-CD2 3.88Å; F112-F140 AromaticContact CG-CE2 3.91Å; F112-F140 HydrophobicContact CG-CE2 3.91Å; F112-F140 HydrophobicContact CZ-CE2 4.1Å; D136-F140 WeakPolarHBondContact O-CB 3.42Å; D136-F140 PolarHBondContact O-N 2.78Å; K138-F140 VanDerWaalsContact C-N 3.3Å; F140-N142 VanDerWaalsContact C-N 3.34Å; F140-N142 PolarHBondContact O-N 2.9Å; F140-V143 PolarHBondContact O-N 2.95Å; F140-V144 HydrophobicContact CD1-CG2 4.21Å; F140-V144 HydrophobicContact CE1-CG2 3.81Å; F140-V144 HydrophobicContact CE2-CG2 4.27Å; F140-V144 HydrophobicContact CZ-CG2 3.83Å; F140-V144 WeakPolarHBondContact O-CG2 3.32Å; F140-V144 PolarHBondContact O-N 2.75Å
141	V	87.3	Confident	89	Confident	13 Å²	13	47.2 Å²	47.2	8%	0.079	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-42.1	-179.6	173.9	0	0	0	0	111.5	L55 L58 Y137 L139 V144 K145 L234	L55-V141 HydrophobicContact CD2-CG2 4.15Å; L58-V141 HydrophobicContact CD2-CG2 4.31Å; Y137-V141 WeakPolarHBondContact O-CG2 3.29Å; Y137-V141 PolarHBondContact O-N 3.01Å; Y137-V141 VanDerWaalsContact O-N 3.16Å; L139-V141 PolarHBondContact O-N 3.27Å; V141-V144 PolarHBondContact O-N 3.08Å; V141-K145 HydrophobicContact CG1-CD 4.13Å; V141-K145 WeakPolarHBondContact O-CG 3.15Å; V141-K145 PolarHBondContact O-N 3.03Å; V141-L234 HydrophobicContact CG1-CD2 4.02Å
142	N	88.3	Confident	88.9	Confident	93 Å²	93	47.6 Å²	47.6	50%	0.497	22%	0.218	S	C	.	.	H	α-helix	trans	-64.3	-42.9	178.9	-71.6	-18.1	0	0	0	112.4	K138 L139 F140 K145 Y146	K138-N142 PolarHBondContact O-N 3.06Å; K138-N142 PolarHBondContact O-ND2 3.05Å; L139-N142 PolarHBondContact O-N 2.94Å; F140-N142 VanDerWaalsContact C-N 3.34Å; F140-N142 PolarHBondContact O-N 2.9Å; N142-K145 PolarHBondContact O-N 3.36Å; N142-Y146 WeakPolarHBondContact O-CB 3.48Å; N142-Y146 PolarHBondContact O-N 3.36Å
143	V	91.4	Very high	89.1	Confident	14 Å²	14	53.7 Å²	53.7	9%	0.085	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-44.4	177.2	172.3	0	0	0	0	110.2	D110 Q111 F112 L139 F140 K145 Y146 R147	D110-V143 WeakPolarHBondContact O-CG1 3.4Å; Q111-V143 HydrophobicContact CB-CG2 3.94Å; F112-V143 HydrophobicContact CD1-CG1 4.38Å; F112-V143 HydrophobicContact CE1-CB 4.49Å; F112-V143 HydrophobicContact CE1-CG1 3.89Å; L139-V143 WeakPolarHBondContact O-CB 3.45Å; L139-V143 WeakPolarHBondContact O-CG2 3.48Å; L139-V143 PolarHBondContact O-N 3.21Å; F140-V143 PolarHBondContact O-N 2.95Å; V143-K145 PolarHBondContact O-N 2.69Å; V143-Y146 PolarHBondContact O-N 3.3Å; V143-R147 HydrophobicContact CG1-CG 4.05Å; V143-R147 WeakPolarHBondContact O-CB 3.31Å; V143-R147 VanDerWaalsContact O-CG 3.23Å; V143-R147 WeakPolarHBondContact O-CG 3.44Å; V143-R147 PolarHBondContact O-N 3.11Å
144	V	90.3	Very high	89.1	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-46.7	178.1	170.3	0	0	0	0	110.8	I62 F112 F140 V141 Y146 R147 L148 I230 L234	I62-V144 HydrophobicContact CD1-CB 4.2Å; I62-V144 HydrophobicContact CD1-CG1 3.56Å; I62-V144 HydrophobicContact CD1-CG2 3.62Å; I62-V144 HydrophobicContact CG2-CG2 4.31Å; F112-V144 HydrophobicContact CE1-CG2 4.31Å; F140-V144 HydrophobicContact CD1-CG2 4.21Å; F140-V144 HydrophobicContact CE1-CG2 3.81Å; F140-V144 HydrophobicContact CE2-CG2 4.27Å; F140-V144 HydrophobicContact CZ-CG2 3.83Å; F140-V144 WeakPolarHBondContact O-CG2 3.32Å; F140-V144 PolarHBondContact O-N 2.75Å; V141-V144 PolarHBondContact O-N 3.08Å; V144-Y146 PolarHBondContact O-N 2.93Å; V144-R147 PolarHBondContact O-N 3.35Å; V144-L148 HydrophobicContact CG1-CD1 4.08Å; V144-L148 WeakPolarHBondContact O-CB 3.28Å; V144-L148 WeakPolarHBondContact O-CG 3.37Å; V144-L148 PolarHBondContact O-N 3.13Å; V144-I230 HydrophobicContact CG1-CG2 4.49Å; V144-L234 HydrophobicContact CG1-CD1 4.36Å; V144-L234 HydrophobicContact CG1-CD2 4.38Å
145	K	89.3	Confident	89.2	Confident	78 Å²	78	61.3 Å²	61.3	34%	0.339	27%	0.271	S	S	.	.	H	α-helix	trans	-58.1	-47.1	175.3	-75.3	174.5	172.3	177.4	0	111.9	V141 N142 V143 L148 D149 L234 D238	V141-K145 HydrophobicContact CG1-CD 4.13Å; V141-K145 WeakPolarHBondContact O-CG 3.15Å; V141-K145 PolarHBondContact O-N 3.03Å; N142-K145 PolarHBondContact O-N 3.36Å; V143-K145 PolarHBondContact O-N 2.69Å; K145-L148 PolarHBondContact O-N 3.17Å; K145-D149 PolarHBondContact O-N 2.64Å; K145-L234 HydrophobicContact CG-CD1 4.4Å; K145-D238 WeakPolarHBondContact CE-OD2 3.4Å; K145-D238 IonicContact NZ-OD1 3.64Å; K145-D238 PolarHBondContact NZ-OD1 3.44Å; K145-D238 IonicContact NZ-OD2 2.73Å; K145-D238 PolarHBondContact NZ-OD2 3.43Å
146	Y	91.8	Very high	89.2	Confident	134 Å²	134	64 Å²	64	53%	0.525	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-44.6	177.9	174	-105.9	0	0	0	112.6	N142 V143 V144 D149 Q150	N142-Y146 WeakPolarHBondContact O-CB 3.48Å; N142-Y146 PolarHBondContact O-N 3.36Å; V143-Y146 PolarHBondContact O-N 3.3Å; V144-Y146 PolarHBondContact O-N 2.93Å; Y146-D149 PolarHBondContact O-N 3.32Å; Y146-Q150 WeakPolarHBondContact O-CB 3.26Å; Y146-Q150 PolarHBondContact O-N 3.49Å
147	R	91.5	Very high	89.4	Confident	116 Å²	116	66 Å²	66	44%	0.438	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-41.4	179.2	-69.9	-70.2	-164.8	-168.5	6.6	111.5	D110 V143 V144 Q150 M151	D110-R147 IonicContact OD1-CZ 2.93Å; D110-R147 IonicContact OD1-NH2 3.21Å; D110-R147 PolarHBondContact OD1-NH2 3.44Å; V143-R147 HydrophobicContact CG1-CG 4.05Å; V143-R147 WeakPolarHBondContact O-CB 3.31Å; V143-R147 VanDerWaalsContact O-CG 3.23Å; V143-R147 WeakPolarHBondContact O-CG 3.44Å; V143-R147 PolarHBondContact O-N 3.11Å; V144-R147 PolarHBondContact O-N 3.35Å; R147-Q150 PolarHBondContact O-N 3.39Å; R147-M151 VanDerWaalsContact O-CG 3.28Å; R147-M151 WeakPolarHBondContact O-CG 3.29Å; R147-M151 PolarHBondContact O-N 3.14Å
148	L	89.2	Confident	89.5	Confident	24 Å²	24	69.2 Å²	69.2	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-44.3	176.1	-74	174.3	0	0	0	112	V144 K145 Q150 M151 Q152 V226 I230 L234	V144-L148 HydrophobicContact CG1-CD1 4.08Å; V144-L148 WeakPolarHBondContact O-CB 3.28Å; V144-L148 WeakPolarHBondContact O-CG 3.37Å; V144-L148 PolarHBondContact O-N 3.13Å; K145-L148 PolarHBondContact O-N 3.17Å; L148-Q150 VanDerWaalsContact C-N 3.35Å; L148-Q150 PolarHBondContact O-N 3.46Å; L148-M151 PolarHBondContact O-N 2.91Å; L148-Q152 WeakPolarHBondContact O-CB 3.48Å; L148-Q152 PolarHBondContact O-N 2.78Å; L148-V226 HydrophobicContact CD2-CG1 3.99Å; L148-I230 HydrophobicContact CD1-CB 4.48Å; L148-I230 HydrophobicContact CD1-CG2 3.87Å; L148-L234 HydrophobicContact CD1-CD1 3.98Å
149	D	90.4	Very high	89.7	Confident	56 Å²	56	66.4 Å²	66.4	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-61.5	-43.1	174.3	179.6	56.6	0	0	0	111.3	K145 Y146 M151 Q152 R153	K145-D149 PolarHBondContact O-N 2.64Å; Y146-D149 PolarHBondContact O-N 3.32Å; D149-M151 PolarHBondContact O-N 3.14Å; D149-Q152 PolarHBondContact O-N 2.93Å; D149-R153 VanDerWaalsContact CG-NE 3.34Å; D149-R153 WeakPolarHBondContact O-CB 3.25Å; D149-R153 VanDerWaalsContact O-CG 3.32Å; D149-R153 WeakPolarHBondContact O-CG 3.49Å; D149-R153 PolarHBondContact O-N 3.29Å; D149-R153 IonicContact OD1-CZ 3.62Å; D149-R153 IonicContact OD1-NE 2.98Å; D149-R153 PolarHBondContact OD1-NE 3.25Å; D149-R153 IonicContact OD1-NH2 2.77Å; D149-R153 IonicContact OD2-CZ 2.79Å; D149-R153 IonicContact OD2-NE 3.76Å; D149-R153 PolarHBondContact OD2-NE 3.07Å; D149-R153 IonicContact OD2-NH2 3.12Å; D149-R153 PolarHBondContact OD2-NH2 3.31Å
150	Q	93	Very high	89.7	Confident	89 Å²	89	71.2 Å²	71.2	42%	0.416	32%	0.32	S	S	.	.	H	α-helix	trans	-62.8	-41.4	177	-172.8	63.8	27.3	0	0	112.4	Y146 R147 L148 R154	Y146-Q150 WeakPolarHBondContact O-CB 3.26Å; Y146-Q150 PolarHBondContact O-N 3.49Å; R147-Q150 PolarHBondContact O-N 3.39Å; L148-Q150 VanDerWaalsContact C-N 3.35Å; L148-Q150 PolarHBondContact O-N 3.46Å; Q150-R154 WeakPolarHBondContact O-CB 3.49Å; Q150-R154 PolarHBondContact O-N 3.49Å
151	M	89.8	Confident	89.5	Confident	74 Å²	74	76.5 Å²	76.5	37%	0.365	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-44.4	175.6	-73	179.4	76.3	0	0	111.3	F66 R147 L148 D149 R154 L155 F222	F66-M151 HydrophobicContact CE1-CE 4.22Å; F66-M151 HydrophobicContact CE1-SD 4.28Å; R147-M151 VanDerWaalsContact O-CG 3.28Å; R147-M151 WeakPolarHBondContact O-CG 3.29Å; R147-M151 PolarHBondContact O-N 3.14Å; L148-M151 PolarHBondContact O-N 2.91Å; D149-M151 PolarHBondContact O-N 3.14Å; M151-R154 PolarHBondContact O-N 3.32Å; M151-L155 WeakPolarHBondContact O-CG 3.23Å; M151-L155 PolarHBondContact O-N 3.1Å; M151-F222 HydrophobicContact CB-CE2 4.41Å; M151-F222 HydrophobicContact CB-CZ 3.86Å; M151-F222 HydrophobicContact CE-CE2 3.62Å; M151-F222 HydrophobicContact CE-CZ 4.19Å; M151-F222 HydrophobicContact SD-CE2 4.4Å; M151-F222 HydrophobicContact SD-CZ 4.46Å
152	Q	89.3	Confident	89.3	Confident	41 Å²	41	77.4 Å²	77.4	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-60.5	-50.8	176.9	-174.8	-172.6	-28.3	0	0	111	L148 D149 R154 L155 E156	L148-Q152 WeakPolarHBondContact O-CB 3.48Å; L148-Q152 PolarHBondContact O-N 2.78Å; D149-Q152 PolarHBondContact O-N 2.93Å; Q152-R154 VanDerWaalsContact C-N 3.28Å; Q152-R154 PolarHBondContact O-N 2.9Å; Q152-L155 PolarHBondContact O-N 3.37Å; Q152-E156 HydrophobicContact CG-CG 4.48Å; Q152-E156 WeakPolarHBondContact CG-OE1 3.45Å; Q152-E156 PolarHBondContact NE2-OE1 3.02Å; Q152-E156 WeakPolarHBondContact O-CG 3.16Å; Q152-E156 PolarHBondContact O-N 3.15Å
153	R	91.9	Very high	88.9	Confident	147 Å²	147	76.3 Å²	76.3	56%	0.555	35%	0.348	S	S	*	.	H	α-helix	trans	-59.1	-38.9	178.5	-71.7	179.1	-166.8	-149.4	10.7	112.5	D149 A157	D149-R153 VanDerWaalsContact CG-NE 3.34Å; D149-R153 WeakPolarHBondContact O-CB 3.25Å; D149-R153 VanDerWaalsContact O-CG 3.32Å; D149-R153 WeakPolarHBondContact O-CG 3.49Å; D149-R153 PolarHBondContact O-N 3.29Å; D149-R153 IonicContact OD1-CZ 3.62Å; D149-R153 IonicContact OD1-NE 2.98Å; D149-R153 PolarHBondContact OD1-NE 3.25Å; D149-R153 IonicContact OD1-NH2 2.77Å; D149-R153 IonicContact OD2-CZ 2.79Å; D149-R153 IonicContact OD2-NE 3.76Å; D149-R153 PolarHBondContact OD2-NE 3.07Å; D149-R153 IonicContact OD2-NH2 3.12Å; D149-R153 PolarHBondContact OD2-NH2 3.31Å; R153-A157 VanDerWaalsContact O-CB 3.3Å; R153-A157 WeakPolarHBondContact O-CB 3.34Å; R153-A157 PolarHBondContact O-N 3.16Å
154	R	92.4	Very high	87.9	Confident	165 Å²	165	79.3 Å²	79.3	62%	0.623	37%	0.37	S	S	*	.	H	α-helix	trans	-64.2	-48.3	177.2	-179.4	177.4	174.3	167.1	1.8	111.4	Q150 M151 Q152 A157 E158	Q150-R154 WeakPolarHBondContact O-CB 3.49Å; Q150-R154 PolarHBondContact O-N 3.49Å; M151-R154 PolarHBondContact O-N 3.32Å; Q152-R154 VanDerWaalsContact C-N 3.28Å; Q152-R154 PolarHBondContact O-N 2.9Å; R154-A157 WeakPolarHBondContact O-CB 3.49Å; R154-A157 PolarHBondContact O-N 3.17Å; R154-E158 WeakPolarHBondContact CG-OE1 3.48Å; R154-E158 IonicContact CZ-OE1 2.84Å; R154-E158 IonicContact NE-OE1 3.9Å; R154-E158 PolarHBondContact NE-OE1 3.43Å; R154-E158 IonicContact NH2-OE1 3.91Å; R154-E158 WeakPolarHBondContact O-CG 3.1Å; R154-E158 PolarHBondContact O-N 3.07Å
155	L	89.8	Confident	87	Confident	27 Å²	27	85.3 Å²	85.3	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-63.4	-42.7	178.3	-73.4	168.7	0	0	0	111.5	M151 Q152 A157 E158 Q159 L218 I219 F222	M151-L155 WeakPolarHBondContact O-CG 3.23Å; M151-L155 PolarHBondContact O-N 3.1Å; Q152-L155 PolarHBondContact O-N 3.37Å; L155-A157 VanDerWaalsContact C-N 3.3Å; L155-A157 PolarHBondContact O-N 3.01Å; L155-E158 PolarHBondContact O-N 3.22Å; L155-Q159 PolarHBondContact O-N 3.14Å; L155-L218 HydrophobicContact CD2-CD2 3.91Å; L155-L218 HydrophobicContact CD2-CG 4.35Å; L155-I219 HydrophobicContact CB-CD1 4.38Å; L155-I219 HydrophobicContact CB-CG1 3.84Å; L155-F222 HydrophobicContact CD1-CB 3.84Å; L155-F222 HydrophobicContact CD1-CD1 3.64Å; L155-F222 HydrophobicContact CD1-CD2 4.02Å; L155-F222 HydrophobicContact CD1-CE1 4.2Å; L155-F222 HydrophobicContact CD1-CG 3.54Å
156	E	89	Confident	86.1	Confident	69 Å²	69	82.9 Å²	82.9	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-62.4	-36.5	174.7	-72.2	176.3	-169.3	0	0	112.5	Q152 R160	Q152-E156 HydrophobicContact CG-CG 4.48Å; Q152-E156 WeakPolarHBondContact CG-OE1 3.45Å; Q152-E156 PolarHBondContact NE2-OE1 3.02Å; Q152-E156 WeakPolarHBondContact O-CG 3.16Å; Q152-E156 PolarHBondContact O-N 3.15Å; E156-R160 WeakPolarHBondContact O-CB 3.17Å; E156-R160 PolarHBondContact O-N 3.09Å; E156-R160 PolarHBondContact O-NH1 3.03Å
157	A	90	Very high	85.5	Confident	50 Å²	50	77.2 Å²	77.2	41%	0.413	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-42.2	173.7	0	0	0	0	0	111.8	R153 R154 L155 R160 Q161	R153-A157 VanDerWaalsContact O-CB 3.3Å; R153-A157 WeakPolarHBondContact O-CB 3.34Å; R153-A157 PolarHBondContact O-N 3.16Å; R154-A157 WeakPolarHBondContact O-CB 3.49Å; R154-A157 PolarHBondContact O-N 3.17Å; L155-A157 VanDerWaalsContact C-N 3.3Å; L155-A157 PolarHBondContact O-N 3.01Å; A157-R160 PolarHBondContact O-N 3.29Å; A157-Q161 WeakPolarHBondContact O-CB 3.29Å; A157-Q161 PolarHBondContact O-N 2.73Å
158	E	87.6	Confident	85.1	Confident	79 Å²	79	72.6 Å²	72.6	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-40.8	175.8	-73.5	172.4	-169.1	0	0	111.7	R154 L155 Q161 S162	R154-E158 WeakPolarHBondContact CG-OE1 3.48Å; R154-E158 IonicContact CZ-OE1 2.84Å; R154-E158 IonicContact NE-OE1 3.9Å; R154-E158 PolarHBondContact NE-OE1 3.43Å; R154-E158 IonicContact NH2-OE1 3.91Å; R154-E158 WeakPolarHBondContact O-CG 3.1Å; R154-E158 PolarHBondContact O-N 3.07Å; L155-E158 PolarHBondContact O-N 3.22Å; E158-Q161 PolarHBondContact O-N 3.18Å; E158-S162 WeakPolarHBondContact O-CB 3.45Å; E158-S162 PolarHBondContact O-N 2.97Å; E158-S162 PolarHBondContact O-OG 3.08Å
159	Q	86.9	Confident	85.1	Confident	66 Å²	66	75.3 Å²	75.3	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-44.6	171.8	-179.1	-167.3	-13.4	0	0	111.2	L155 Q161 S162 T163 I219	L155-Q159 PolarHBondContact O-N 3.14Å; Q159-Q161 VanDerWaalsContact C-N 3.29Å; Q159-Q161 PolarHBondContact O-N 3.21Å; Q159-S162 PolarHBondContact O-N 2.96Å; Q159-T163 WeakPolarHBondContact O-CB 3.23Å; Q159-T163 VanDerWaalsContact O-CG2 3.28Å; Q159-T163 WeakPolarHBondContact O-CG2 3.37Å; Q159-T163 PolarHBondContact O-N 2.94Å; Q159-I219 HydrophobicContact CB-CD1 3.43Å; Q159-I219 VanDerWaalsContact CB-CD1 3.43Å; Q159-I219 HydrophobicContact CG-CD1 4.03Å
160	R	86.4	Confident	85	Confident	151 Å²	151	72.6 Å²	72.6	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-61.5	-40.4	178.3	-171.1	178.9	-66.8	89.8	-0.3	111.4	E156 A157 T163 S164	E156-R160 WeakPolarHBondContact O-CB 3.17Å; E156-R160 PolarHBondContact O-N 3.09Å; E156-R160 PolarHBondContact O-NH1 3.03Å; A157-R160 PolarHBondContact O-N 3.29Å; R160-T163 WeakPolarHBondContact O-CG2 3.37Å; R160-S164 WeakPolarHBondContact O-CB 3.44Å; R160-S164 PolarHBondContact O-N 3.26Å; R160-S164 PolarHBondContact O-OG 2.98Å
161	Q	84.2	Confident	84.8	Confident	114 Å²	114	72.5 Å²	72.5	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-69.1	-37.8	177.1	-175	57.9	44.3	0	0	112.3	A157 E158 Q159 S164 R165	A157-Q161 WeakPolarHBondContact O-CB 3.29Å; A157-Q161 PolarHBondContact O-N 2.73Å; E158-Q161 PolarHBondContact O-N 3.18Å; Q159-Q161 VanDerWaalsContact C-N 3.29Å; Q159-Q161 PolarHBondContact O-N 3.21Å; Q161-S164 PolarHBondContact O-OG 3.04Å; Q161-R165 VanDerWaalsContact O-CB 3.25Å; Q161-R165 WeakPolarHBondContact O-CB 3.37Å; Q161-R165 PolarHBondContact O-N 3.15Å
162	S	82.6	Confident	84.7	Confident	32 Å²	32	73.1 Å²	73.1	22%	0.224	37%	0.366	C	S	.	.	H	α-helix	trans	-73.9	-34	178.4	-51.8	0	0	0	0	111.7	E158 Q159 R212	E158-S162 WeakPolarHBondContact O-CB 3.45Å; E158-S162 PolarHBondContact O-N 2.97Å; E158-S162 PolarHBondContact O-OG 3.08Å; Q159-S162 PolarHBondContact O-N 2.96Å; S162-R212 WeakPolarHBondContact O-CG 3.39Å
163	T	80.1	Confident	84.7	Confident	69 Å²	69	73.5 Å²	73.5	42%	0.423	37%	0.373	S	S	.	.	H	α-helix	trans	-80.6	-26.7	176.4	-166.9	0	0	0	0	113.4	Q159 R160 R212	Q159-T163 WeakPolarHBondContact O-CB 3.23Å; Q159-T163 VanDerWaalsContact O-CG2 3.28Å; Q159-T163 WeakPolarHBondContact O-CG2 3.37Å; Q159-T163 PolarHBondContact O-N 2.94Å; R160-T163 WeakPolarHBondContact O-CG2 3.37Å; T163-R212 VanDerWaalsContact O-CZ 3.31Å; T163-R212 PolarHBondContact O-NH1 3.3Å; T163-R212 PolarHBondContact O-NH2 2.89Å; T163-R212 PolarHBondContact OG1-NH2 3.49Å
164	S	69.6	Low	84.5	Confident	78 Å²	78	72.7 Å²	72.7	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-86.5	-17	178.7	68.3	0	0	0	0	113.3	R160 Q161 A166	R160-S164 WeakPolarHBondContact O-CB 3.44Å; R160-S164 PolarHBondContact O-N 3.26Å; R160-S164 PolarHBondContact O-OG 2.98Å; Q161-S164 PolarHBondContact O-OG 3.04Å; S164-A166 PolarHBondContact O-N 3.1Å; S164-A166 VanDerWaalsContact O-N 3.09Å
165	R	73	Confident	84.2	Confident	132 Å²	132	66.9 Å²	66.9	50%	0.498	36%	0.363	S	S	.	.			trans	-82.3	86.1	178	-170.6	179.1	-177.3	137.6	-0.5	110.2	Q161 S167	Q161-R165 VanDerWaalsContact O-CB 3.25Å; Q161-R165 WeakPolarHBondContact O-CB 3.37Å; Q161-R165 PolarHBondContact O-N 3.15Å; R165-S167 PolarHBondContact NE-OG 3.19Å
166	A	69.2	Low	84.1	Confident	28 Å²	28	68.3 Å²	68.3	23%	0.231	38%	0.379	C	S	.	.			trans	-93.2	102.9	158	0	0	0	0	0	107.5	S164 D179	S164-A166 PolarHBondContact O-N 3.1Å; S164-A166 VanDerWaalsContact O-N 3.09Å; A166-D179 WeakPolarHBondContact CB-OD1 3.25Å; A166-D179 WeakPolarHBondContact CB-OD2 3.47Å
167	S	79.2	Confident	84	Confident	15 Å²	15	65.6 Å²	65.6	11%	0.105	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	115.6	177	38.6	0	0	0	0	110.7	R165 Y177 E206	R165-S167 PolarHBondContact NE-OG 3.19Å; S167-Y177 CarbonylContact C-O 3.5Å; S167-Y177 VanDerWaalsContact CA-O 3.28Å; S167-Y177 WeakPolarHBondContact CA-O 3.42Å; S167-E206 WeakPolarHBondContact O-CB 3.34Å; S167-E206 PolarHBondContact O-N 3.25Å; S167-E206 PolarHBondContact OG-OE2 3.15Å
168	F	84.7	Confident	83.9	Confident	19 Å²	19	66.3 Å²	66.3	8%	0.083	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.4	163.5	-59.2	-94.4	0	0	0	108.5	A176 Y177 D179 V182 L194 V203 C204 E205	F168-A176 CarbonylContact O-C 3.59Å; F168-A176 WeakPolarHBondContact O-CA 3.34Å; F168-Y177 PolarHBondContact N-O 2.55Å; F168-Y177 PolarHBondContact O-N 3.03Å; F168-D179 WeakPolarHBondContact CE2-OD1 3.23Å; F168-V182 HydrophobicContact CD2-CG2 3.65Å; F168-V182 HydrophobicContact CE1-CG2 4.43Å; F168-V182 HydrophobicContact CE2-CG2 3.12Å; F168-V182 HydrophobicContact CZ-CG2 3.59Å; F168-L194 HydrophobicContact CD1-CD1 3.52Å; F168-L194 HydrophobicContact CE1-CD1 3.54Å; F168-L194 HydrophobicContact CG-CD1 4.27Å; F168-L194 HydrophobicContact CZ-CD1 4.33Å; F168-V203 HydrophobicContact CB-CG1 3.41Å; F168-V203 VanDerWaalsContact CB-CG1 3.41Å; F168-V203 HydrophobicContact CG-CG1 4.34Å; F168-C204 CarbonylContact C-O 3.6Å; F168-C204 WeakPolarHBondContact CA-O 3.18Å; F168-E205 HydrophobicContact CD1-CB 4.43Å; F168-E205 HydrophobicContact CD1-CG 3.46Å; F168-E205 VanDerWaalsContact CD1-CG 3.46Å; F168-E205 HydrophobicContact CE1-CG 3.24Å; F168-E205 HydrophobicContact CZ-CG 4.24Å
169	K	88.8	Confident	83.9	Confident	80 Å²	80	67.1 Å²	67.1	35%	0.348	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.7	179.2	59.3	-176.5	172.9	-166.8	0	110.8	S171 T175 C204 E206	K169-S171 PolarHBondContact O-N 3.43Å; K169-T175 WeakPolarHBondContact CA-O 3.29Å; K169-C204 PolarHBondContact N-O 2.9Å; K169-C204 PolarHBondContact O-N 3.11Å; K169-E206 HydrophobicContact CD-CB 4.12Å; K169-E206 HydrophobicContact CD-CG 4.21Å; K169-E206 HydrophobicContact CG-CB 4.3Å; K169-E206 IonicContact NZ-OE1 3.89Å; K169-E206 PolarHBondContact NZ-OE1 3.34Å
170	C	88.8	Confident	83.8	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.9	172	-176.8	0	0	0	0	110.4	S172 C173 N174 T175 C196 C199 V203	C170-S172 PolarHBondContact O-N 3.33Å; C170-S172 PolarHBondContact SG-N 2.78Å; C170-S172 VanDerWaalsContact SG-N 3.44Å; C170-C173 WeakPolarHBondContact CB-SG 3.49Å; C170-C173 VanDerWaalsContact SG-SG 3.63Å; C170-N174 VanDerWaalsContact O-CA 3.28Å; C170-N174 WeakPolarHBondContact O-CA 3.45Å; C170-N174 PolarHBondContact O-N 3.2Å; C170-T175 PolarHBondContact N-O 3.22Å; C170-C196 HydrophobicContact CB-CB 3.85Å; C170-C196 WeakPolarHBondContact SG-CB 3.32Å; C170-C199 PolarHBondContact SG-SG 3.05Å; C170-V203 HydrophobicContact CB-CG2 3.94Å
171	S	88.1	Confident	83.9	Confident	87 Å²	87	67.2 Å²	67.2	61%	0.608	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.2	178.7	-177.5	0	0	0	0	113.7	K169 E202	K169-S171 PolarHBondContact O-N 3.43Å; S171-E202 PolarHBondContact N-O 2.87Å
172	S	88.1	Confident	83.9	Confident	86 Å²	86	63 Å²	63	60%	0.601	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-37.8	-174.3	-50.3	0	0	0	0	113.3	C170	C170-S172 PolarHBondContact O-N 3.33Å; C170-S172 PolarHBondContact SG-N 2.78Å; C170-S172 VanDerWaalsContact SG-N 3.44Å
173	C	89	Confident	84.1	Confident	50 Å²	50	67.4 Å²	67.4	34%	0.338	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	-1.3	-177	65.7	0	0	0	0	114.5	C170 T175 C196 C199	C170-C173 WeakPolarHBondContact CB-SG 3.49Å; C170-C173 VanDerWaalsContact SG-SG 3.63Å; C173-T175 PolarHBondContact O-N 2.97Å; C173-T175 PolarHBondContact SG-OG1 2.83Å; C173-C196 PolarHBondContact SG-SG 3.49Å; C173-C199 VanDerWaalsContact SG-SG 3.64Å
174	N	86.5	Confident	84.3	Confident	130 Å²	130	73.6 Å²	73.6	70%	0.695	40%	0.402	S	S	*	.			trans	53.5	22	-177.5	-68.9	-26.3	0	0	0	114.6	C170 A176	C170-N174 VanDerWaalsContact O-CA 3.28Å; C170-N174 WeakPolarHBondContact O-CA 3.45Å; C170-N174 PolarHBondContact O-N 3.2Å; N174-A176 PolarHBondContact O-N 3.16Å
175	T	86.9	Confident	85	Confident	43 Å²	43	70 Å²	70	26%	0.264	38%	0.376	S	S	.	.			trans	-70.5	124	170.8	-52.6	0	0	0	0	108.8	K169 C170 C173 Y177 Y198	K169-T175 WeakPolarHBondContact CA-O 3.29Å; C170-T175 PolarHBondContact N-O 3.22Å; C173-T175 PolarHBondContact O-N 2.97Å; C173-T175 PolarHBondContact SG-OG1 2.83Å; T175-Y177 HydrophobicContact CG2-CD2 4.48Å; T175-Y177 HydrophobicContact CG2-CE1 3.99Å; T175-Y177 HydrophobicContact CG2-CE2 3.92Å; T175-Y198 HydrophobicContact CG2-CD2 4.44Å; T175-Y198 HydrophobicContact CG2-CE2 4.19Å
176	A	88.3	Confident	85.4	Confident	57 Å²	57	68.3 Å²	68.3	47%	0.471	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.5	173.8	0	0	0	0	0	109.5	F168 N174	F168-A176 CarbonylContact O-C 3.59Å; F168-A176 WeakPolarHBondContact O-CA 3.34Å; N174-A176 PolarHBondContact O-N 3.16Å
177	Y	86.9	Confident	86.1	Confident	11 Å²	11	69.3 Å²	69.3	4%	0.043	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	145.6	177.2	-63.9	-77.4	0	0	0	109.7	S167 F168 T175 E181 L185 C196 V197 Y198 V203	S167-Y177 CarbonylContact C-O 3.5Å; S167-Y177 VanDerWaalsContact CA-O 3.28Å; S167-Y177 WeakPolarHBondContact CA-O 3.42Å; F168-Y177 PolarHBondContact N-O 2.55Å; F168-Y177 PolarHBondContact O-N 3.03Å; T175-Y177 HydrophobicContact CG2-CD2 4.48Å; T175-Y177 HydrophobicContact CG2-CE1 3.99Å; T175-Y177 HydrophobicContact CG2-CE2 3.92Å; Y177-E181 WeakPolarHBondContact CA-OE2 3.32Å; Y177-E181 HydrophobicContact CD1-CB 4.24Å; Y177-E181 WeakPolarHBondContact CD1-OE2 3.31Å; Y177-L185 HydrophobicContact CD1-CD1 4.18Å; Y177-L185 HydrophobicContact CD1-CD2 4.24Å; Y177-L185 HydrophobicContact CD2-CD1 3.8Å; Y177-L185 HydrophobicContact CD2-CD2 4.03Å; Y177-L185 HydrophobicContact CE1-CD2 4.06Å; Y177-L185 HydrophobicContact CE2-CD1 4.46Å; Y177-L185 HydrophobicContact CE2-CD2 3.84Å; Y177-L185 HydrophobicContact CG-CD1 3.63Å; Y177-L185 HydrophobicContact CG-CD2 4.21Å; Y177-L185 HydrophobicContact CG-CG 4.44Å; Y177-C196 HydrophobicContact CE2-CB 4.39Å; Y177-C196 PolarHBondContact OH-SG 3.21Å; Y177-V197 HydrophobicContact CE1-CG2 4.32Å; Y177-V197 PolarHBondContact OH-N 3.4Å; Y177-Y198 WeakPolarHBondContact OH-CD2 3.29Å; Y177-V203 HydrophobicContact CD2-CG1 4.38Å; Y177-V203 HydrophobicContact CD2-CG2 4.34Å; Y177-V203 HydrophobicContact CE2-CG2 4.2Å
178	T	88.1	Confident	86.1	Confident	66 Å²	66	78.2 Å²	78.2	41%	0.405	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	164.2	175.7	60	0	0	0	0	111.4	L180 E181	T178-L180 PolarHBondContact O-N 3.2Å; T178-E181 PolarHBondContact N-OE2 2.84Å; T178-E181 PolarHBondContact O-N 3.43Å
179	D	86.3	Confident	85.9	Confident	96 Å²	96	82.5 Å²	82.5	51%	0.513	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-49.7	-31.7	173.4	-65.8	-16.5	0	0	0	113.4	A166 F168 E181 V182	A166-D179 WeakPolarHBondContact CB-OD1 3.25Å; A166-D179 WeakPolarHBondContact CB-OD2 3.47Å; F168-D179 WeakPolarHBondContact CE2-OD1 3.23Å; D179-E181 PolarHBondContact O-N 3.01Å; D179-V182 WeakPolarHBondContact O-CB 3.41Å; D179-V182 VanDerWaalsContact O-CG2 3.31Å; D179-V182 WeakPolarHBondContact O-CG2 3.24Å; D179-V182 PolarHBondContact O-N 2.8Å
180	L	85.6	Confident	85.5	Confident	152 Å²	152	82.8 Å²	82.8	80%	0.796	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-68.3	-21.4	178.7	-66.4	162.3	0	0	0	113.4	T178	T178-L180 PolarHBondContact O-N 3.2Å
181	E	87	Confident	85	Confident	66 Å²	66	88.9 Å²	88.9	31%	0.308	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-98.2	-6.9	-177.3	-64.9	171.8	141	0	0	112.5	Y177 T178 D179 D183 R184 L185	Y177-E181 WeakPolarHBondContact CA-OE2 3.32Å; Y177-E181 HydrophobicContact CD1-CB 4.24Å; Y177-E181 WeakPolarHBondContact CD1-OE2 3.31Å; T178-E181 PolarHBondContact N-OE2 2.84Å; T178-E181 PolarHBondContact O-N 3.43Å; D179-E181 PolarHBondContact O-N 3.01Å; E181-D183 PolarHBondContact O-N 3.11Å; E181-R184 WeakPolarHBondContact O-CB 3.48Å; E181-R184 PolarHBondContact O-N 3.41Å; E181-L185 PolarHBondContact O-N 2.97Å
182	V	85.7	Confident	84.7	Confident	27 Å²	27	88.8 Å²	88.8	16%	0.164	50%	0.499	C	S	.	.	H	α-helix	trans	-55.9	-37.6	179.7	177.5	0	0	0	0	111.5	F168 D179 R184 L185 M186 L194	F168-V182 HydrophobicContact CD2-CG2 3.65Å; F168-V182 HydrophobicContact CE1-CG2 4.43Å; F168-V182 HydrophobicContact CE2-CG2 3.12Å; F168-V182 HydrophobicContact CZ-CG2 3.59Å; D179-V182 WeakPolarHBondContact O-CB 3.41Å; D179-V182 VanDerWaalsContact O-CG2 3.31Å; D179-V182 WeakPolarHBondContact O-CG2 3.24Å; D179-V182 PolarHBondContact O-N 2.8Å; V182-R184 PolarHBondContact O-N 3.28Å; V182-R184 VanDerWaalsContact O-N 3.08Å; V182-L185 PolarHBondContact O-N 3.39Å; V182-M186 HydrophobicContact CG1-CG 4.44Å; V182-M186 PolarHBondContact O-N 3.18Å; V182-M186 VanDerWaalsContact O-N 3.14Å; V182-L194 HydrophobicContact CG1-CD1 4.28Å; V182-L194 HydrophobicContact CG1-CD2 3.81Å
183	D	85.4	Confident	84.5	Confident	124 Å²	124	89.8 Å²	89.8	66%	0.663	49%	0.493	S	S	*	.	H	α-helix	trans	-55	-29.5	176.5	-71.6	-14.8	0	0	0	113.5	E181 M186	E181-D183 PolarHBondContact O-N 3.11Å; D183-M186 HydrophobicContact CB-CE 4.46Å; D183-M186 WeakPolarHBondContact OD1-CE 3.37Å
184	R	84.1	Confident	84.5	Confident	199 Å²	199	88.8 Å²	88.8	75%	0.751	48%	0.484	S	S	*	.	H	α-helix	trans	-88.6	-18.7	178.8	-58.1	179.6	-176.8	174.3	1.8	113.2	E181 V182	E181-R184 WeakPolarHBondContact O-CB 3.48Å; E181-R184 PolarHBondContact O-N 3.41Å; V182-R184 PolarHBondContact O-N 3.28Å; V182-R184 VanDerWaalsContact O-N 3.08Å
185	L	84.8	Confident	84.6	Confident	2 Å²	2	84.3 Å²	84.3	1%	0.01	46%	0.461	C	S	.	.	H	α-helix	trans	-91.8	-16.9	-177.7	-61.5	170.2	0	0	0	112.1	Y177 E181 V182 D187 L194 V195 V197 V203	Y177-L185 HydrophobicContact CD1-CD1 4.18Å; Y177-L185 HydrophobicContact CD1-CD2 4.24Å; Y177-L185 HydrophobicContact CD2-CD1 3.8Å; Y177-L185 HydrophobicContact CD2-CD2 4.03Å; Y177-L185 HydrophobicContact CE1-CD2 4.06Å; Y177-L185 HydrophobicContact CE2-CD1 4.46Å; Y177-L185 HydrophobicContact CE2-CD2 3.84Å; Y177-L185 HydrophobicContact CG-CD1 3.63Å; Y177-L185 HydrophobicContact CG-CD2 4.21Å; Y177-L185 HydrophobicContact CG-CG 4.44Å; E181-L185 PolarHBondContact O-N 2.97Å; V182-L185 PolarHBondContact O-N 3.39Å; L185-D187 PolarHBondContact O-N 3.27Å; L185-L194 HydrophobicContact CB-CB 4.21Å; L185-L194 HydrophobicContact CB-CD2 4.08Å; L185-L194 WeakPolarHBondContact O-CA 3.32Å; L185-V195 WeakPolarHBondContact CA-O 3.47Å; L185-V195 WeakPolarHBondContact CD2-O 3.3Å; L185-V195 PolarHBondContact O-N 3.49Å; L185-V197 HydrophobicContact CD2-CG2 3.9Å; L185-V203 HydrophobicContact CD1-CG1 4.28Å; L185-V203 HydrophobicContact CD2-CG2 4.36Å
186	M	82.6	Confident	84.8	Confident	97 Å²	97	82.3 Å²	82.3	48%	0.478	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-67.2	114.8	176.5	-71.9	-168.7	-79.5	0	0	110.9	V182 D183 L194	V182-M186 HydrophobicContact CG1-CG 4.44Å; V182-M186 PolarHBondContact O-N 3.18Å; V182-M186 VanDerWaalsContact O-N 3.14Å; D183-M186 HydrophobicContact CB-CE 4.46Å; D183-M186 WeakPolarHBondContact OD1-CE 3.37Å; M186-L194 HydrophobicContact CG-CD2 3.82Å
187	D	83.8	Confident	84.7	Confident	48 Å²	48	83.8 Å²	83.8	26%	0.257	45%	0.452	S	S	.	.			trans	-82	118.7	172.7	-176.6	11.9	0	0	0	110	L185 T189 N190 V195	L185-D187 PolarHBondContact O-N 3.27Å; D187-T189 PolarHBondContact O-N 3.13Å; D187-T189 VanDerWaalsContact OD1-CB 3.26Å; D187-T189 WeakPolarHBondContact OD1-CB 3.31Å; D187-T189 PolarHBondContact OD1-N 3.16Å; D187-T189 PolarHBondContact OD1-OG1 3.13Å; D187-T189 WeakPolarHBondContact OD2-CB 3.44Å; D187-N190 CarbonylContact O-C 3.47Å; D187-N190 PolarHBondContact O-N 2.92Å; D187-N190 PolarHBondContact OD2-ND2 2.84Å; D187-V195 HydrophobicContact CB-CB 4.38Å; D187-V195 HydrophobicContact CB-CG2 3.81Å
188	F	78.5	Confident	84.8	Confident	203 Å²	203	91.8 Å²	91.8	89%	0.89	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.3	174.8	-64	-79	0	0	0	112.8
189	T	80.5	Confident	84.8	Confident	108 Å²	108	91.4 Å²	91.4	66%	0.663	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-34.4	-179.3	-38.1	0	0	0	0	112	D187	D187-T189 PolarHBondContact O-N 3.13Å; D187-T189 VanDerWaalsContact OD1-CB 3.26Å; D187-T189 WeakPolarHBondContact OD1-CB 3.31Å; D187-T189 PolarHBondContact OD1-N 3.16Å; D187-T189 PolarHBondContact OD1-OG1 3.13Å; D187-T189 WeakPolarHBondContact OD2-CB 3.44Å
190	N	79.8	Confident	84.7	Confident	87 Å²	87	97 Å²	97	47%	0.465	50%	0.497	S	S	.	.	S	Bend	trans	-128.9	87.1	-177.2	-63.3	-66.3	0	0	0	109.3	D187 G192 K193	D187-N190 CarbonylContact O-C 3.47Å; D187-N190 PolarHBondContact O-N 2.92Å; D187-N190 PolarHBondContact OD2-ND2 2.84Å; N190-G192 PolarHBondContact O-N 3.27Å; N190-G192 VanDerWaalsContact O-N 3.09Å; N190-K193 PolarHBondContact O-N 2.99Å
191	P	79.4	Confident	84.6	Confident	128 Å²	128	90.4 Å²	90.4	83%	0.831	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	119.4	-179.1	24.5	-33.1	0	0	0	110
192	G	80.5	Confident	84.7	Confident	85 Å²	85	92 Å²	92	88%	0.876	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	111	-3.7	175.4	0	0	0	0	0	116.3	N190	N190-G192 PolarHBondContact O-N 3.27Å; N190-G192 VanDerWaalsContact O-N 3.09Å
193	K	85.4	Confident	84.8	Confident	106 Å²	106	91.1 Å²	91.1	46%	0.461	47%	0.467	S	S	.	.			trans	-110.6	134	172	-69.9	-178.7	171.6	-105	0	111.1	N190 E202	N190-K193 PolarHBondContact O-N 2.99Å; K193-E202 IonicContact NZ-OE1 2.79Å; K193-E202 PolarHBondContact NZ-OE1 2.83Å; K193-E202 IonicContact NZ-OE2 3.56Å
194	L	87.8	Confident	84.7	Confident	30 Å²	30	88 Å²	88	16%	0.157	45%	0.454	C	S	.	.	B	Isolated β-bridge	trans	-88.8	128.6	171	-61.4	179	0	0	0	109.1	F168 V182 L185 M186 V203	F168-L194 HydrophobicContact CD1-CD1 3.52Å; F168-L194 HydrophobicContact CE1-CD1 3.54Å; F168-L194 HydrophobicContact CG-CD1 4.27Å; F168-L194 HydrophobicContact CZ-CD1 4.33Å; V182-L194 HydrophobicContact CG1-CD1 4.28Å; V182-L194 HydrophobicContact CG1-CD2 3.81Å; L185-L194 HydrophobicContact CB-CB 4.21Å; L185-L194 HydrophobicContact CB-CD2 4.08Å; L185-L194 WeakPolarHBondContact O-CA 3.32Å; M186-L194 HydrophobicContact CG-CD2 3.82Å; L194-V203 HydrophobicContact CB-CB 3.81Å; L194-V203 HydrophobicContact CB-CG1 4.25Å; L194-V203 PolarHBondContact O-N 2.85Å
195	V	89.6	Confident	84.5	Confident	35 Å²	35	85.3 Å²	85.3	21%	0.212	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-119	127.4	-174.2	178	0	0	0	0	108.9	L185 D187 R200	L185-V195 WeakPolarHBondContact CA-O 3.47Å; L185-V195 WeakPolarHBondContact CD2-O 3.3Å; L185-V195 PolarHBondContact O-N 3.49Å; D187-V195 HydrophobicContact CB-CB 4.38Å; D187-V195 HydrophobicContact CB-CG2 3.81Å; V195-R200 VanDerWaalsContact CG1-CA 3.45Å; V195-R200 HydrophobicContact CG1-CB 3.85Å; V195-R200 HydrophobicContact CG1-CG 4.39Å; V195-R200 WeakPolarHBondContact CG1-O 3.37Å
196	C	90.2	Very high	84	Confident	2 Å²	2	88.3 Å²	88.3	1%	0.014	46%	0.464	C	S	.	.			trans	-64.1	137.7	-179.8	172.8	0	0	0	0	111.8	C170 C173 Y177 Y198 R200 G201 V203	C170-C196 HydrophobicContact CB-CB 3.85Å; C170-C196 WeakPolarHBondContact SG-CB 3.32Å; C173-C196 PolarHBondContact SG-SG 3.49Å; Y177-C196 HydrophobicContact CE2-CB 4.39Å; Y177-C196 PolarHBondContact OH-SG 3.21Å; C196-Y198 VanDerWaalsContact C-N 3.26Å; C196-Y198 PolarHBondContact O-N 3.17Å; C196-Y198 PolarHBondContact SG-N 2.86Å; C196-Y198 VanDerWaalsContact SG-N 3.36Å; C196-R200 VanDerWaalsContact O-CA 3.25Å; C196-R200 WeakPolarHBondContact O-CA 3.28Å; C196-R200 PolarHBondContact O-N 3.41Å; C196-G201 PolarHBondContact N-O 3.06Å; C196-V203 HydrophobicContact CB-CG2 3.7Å
197	V	87.4	Confident	83.2	Confident	88 Å²	88	92.3 Å²	92.3	53%	0.533	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-35	178.5	-176	0	0	0	0	112.6	Y177 L185	Y177-V197 HydrophobicContact CE1-CG2 4.32Å; Y177-V197 PolarHBondContact OH-N 3.4Å; L185-V197 HydrophobicContact CD2-CG2 3.9Å
198	Y	87.7	Confident	82.3	Confident	179 Å²	179	92.4 Å²	92.4	70%	0.702	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-48.3	-171.6	-59.8	-70.5	0	0	0	113.6	T175 Y177 C196	T175-Y198 HydrophobicContact CG2-CD2 4.44Å; T175-Y198 HydrophobicContact CG2-CE2 4.19Å; Y177-Y198 WeakPolarHBondContact OH-CD2 3.29Å; C196-Y198 VanDerWaalsContact C-N 3.26Å; C196-Y198 PolarHBondContact O-N 3.17Å; C196-Y198 PolarHBondContact SG-N 2.86Å; C196-Y198 VanDerWaalsContact SG-N 3.36Å
199	C	88.9	Confident	81.6	Confident	57 Å²	57	88.3 Å²	88.3	39%	0.385	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-4.7	-172.9	63	0	0	0	0	113.9	C170 C173 G201	C170-C199 PolarHBondContact SG-SG 3.05Å; C173-C199 VanDerWaalsContact SG-SG 3.64Å; C199-G201 PolarHBondContact O-N 3.46Å; C199-G201 PolarHBondContact SG-N 3.35Å
200	R	83.9	Confident	81	Confident	215 Å²	215	86.8 Å²	86.8	81%	0.811	47%	0.468	S	S	*	.			trans	52.6	20.3	-170.4	-56.3	-174.6	-179.6	-135.8	1.2	114.4	V195 C196	V195-R200 VanDerWaalsContact CG1-CA 3.45Å; V195-R200 HydrophobicContact CG1-CB 3.85Å; V195-R200 HydrophobicContact CG1-CG 4.39Å; V195-R200 WeakPolarHBondContact CG1-O 3.37Å; C196-R200 VanDerWaalsContact O-CA 3.25Å; C196-R200 WeakPolarHBondContact O-CA 3.28Å; C196-R200 PolarHBondContact O-N 3.41Å
201	G	83.9	Confident	80.7	Confident	12 Å²	12	84.4 Å²	84.4	12%	0.124	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-76.8	160.7	171.9	0	0	0	0	0	111.7	C196 C199	C196-G201 PolarHBondContact N-O 3.06Å; C199-G201 PolarHBondContact O-N 3.46Å; C199-G201 PolarHBondContact SG-N 3.35Å
202	E	88	Confident	80.3	Confident	99 Å²	99	82.5 Å²	82.5	46%	0.463	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-65.6	132.3	176.7	-169.2	160.1	-148.6	0	0	110.5	S171 K193	S171-E202 PolarHBondContact N-O 2.87Å; K193-E202 IonicContact NZ-OE1 2.79Å; K193-E202 PolarHBondContact NZ-OE1 2.83Å; K193-E202 IonicContact NZ-OE2 3.56Å
203	V	88.3	Confident	80.2	Confident	9 Å²	9	83.2 Å²	83.2	6%	0.055	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.4	177	171.1	0	0	0	0	107.9	F168 C170 Y177 L185 L194 C196	F168-V203 HydrophobicContact CB-CG1 3.41Å; F168-V203 VanDerWaalsContact CB-CG1 3.41Å; F168-V203 HydrophobicContact CG-CG1 4.34Å; C170-V203 HydrophobicContact CB-CG2 3.94Å; Y177-V203 HydrophobicContact CD2-CG1 4.38Å; Y177-V203 HydrophobicContact CD2-CG2 4.34Å; Y177-V203 HydrophobicContact CE2-CG2 4.2Å; L185-V203 HydrophobicContact CD1-CG1 4.28Å; L185-V203 HydrophobicContact CD2-CG2 4.36Å; L194-V203 HydrophobicContact CB-CB 3.81Å; L194-V203 HydrophobicContact CB-CG1 4.25Å; L194-V203 PolarHBondContact O-N 2.85Å; C196-V203 HydrophobicContact CB-CG2 3.7Å
204	C	82.7	Confident	80.1	Confident	60 Å²	60	83.1 Å²	83.1	41%	0.405	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	145.9	-179.9	-61	0	0	0	0	109.8	F168 K169 E206	F168-C204 CarbonylContact C-O 3.6Å; F168-C204 WeakPolarHBondContact CA-O 3.18Å; K169-C204 PolarHBondContact N-O 2.9Å; K169-C204 PolarHBondContact O-N 3.11Å; C204-E206 PolarHBondContact O-N 2.87Å
205	E	79.9	Confident	79.9	Confident	142 Å²	142	82.4 Å²	82.4	66%	0.664	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	130.1	165.3	-73.6	174	-165	0	0	109	F168 E207	F168-E205 HydrophobicContact CD1-CB 4.43Å; F168-E205 HydrophobicContact CD1-CG 3.46Å; F168-E205 VanDerWaalsContact CD1-CG 3.46Å; F168-E205 HydrophobicContact CE1-CG 3.24Å; F168-E205 HydrophobicContact CZ-CG 4.24Å; E205-E207 PolarHBondContact O-N 3.47Å
206	E	75.1	Confident	79.7	Confident	64 Å²	64	89.5 Å²	89.5	30%	0.299	45%	0.448	S	S	.	.			trans	-68.3	113	168.2	-176.6	152.6	-126.7	0	0	108.3	S167 K169 C204 D208	S167-E206 WeakPolarHBondContact O-CB 3.34Å; S167-E206 PolarHBondContact O-N 3.25Å; S167-E206 PolarHBondContact OG-OE2 3.15Å; K169-E206 HydrophobicContact CD-CB 4.12Å; K169-E206 HydrophobicContact CD-CG 4.21Å; K169-E206 HydrophobicContact CG-CB 4.3Å; K169-E206 IonicContact NZ-OE1 3.89Å; K169-E206 PolarHBondContact NZ-OE1 3.34Å; C204-E206 PolarHBondContact O-N 2.87Å; E206-D208 HydrophobicContact CG-CB 4.42Å; E206-D208 PolarHBondContact O-N 3.45Å
207	E	66.5	Low	79.5	Confident	181 Å²	181	92 Å²	92	85%	0.846	47%	0.469	S	S	*	.			trans	-66.9	72.4	174.1	-75.1	-174	145.9	0	0	110.8	E205 N209	E205-E207 PolarHBondContact O-N 3.47Å; E207-N209 VanDerWaalsContact C-N 3.32Å
208	D	64.6	Low	79.5	Confident	50 Å²	50	91.7 Å²	91.7	27%	0.267	46%	0.463	S	S	.	.			trans	-94.9	12	176.3	-143.1	5.6	0	0	0	111.7	E206 A210 S211 R212	E206-D208 HydrophobicContact CG-CB 4.42Å; E206-D208 PolarHBondContact O-N 3.45Å; D208-A210 PolarHBondContact O-N 3.49Å; D208-S211 PolarHBondContact O-N 3.07Å; D208-S211 VanDerWaalsContact O-N 3.14Å; D208-S211 PolarHBondContact O-OG 3.47Å; D208-S211 VanDerWaalsContact OD1-CB 3.23Å; D208-S211 WeakPolarHBondContact OD1-CB 3.43Å; D208-S211 PolarHBondContact OD1-OG 3.43Å; D208-S211 PolarHBondContact OD2-OG 3.25Å; D208-R212 WeakPolarHBondContact O-CG 3.38Å; D208-R212 PolarHBondContact O-N 3.23Å; D208-R212 VanDerWaalsContact O-N 3.15Å
209	N	63.4	Low	79.4	Confident	118 Å²	118	84.4 Å²	84.4	63%	0.631	44%	0.436	S	S	*	.	H	α-helix	trans	-59.3	-31.1	177.5	-81.9	-30.8	0	0	0	112.6	E207 T213	E207-N209 VanDerWaalsContact C-N 3.32Å; N209-T213 PolarHBondContact O-N 3.13Å; N209-T213 PolarHBondContact O-OG1 3.47Å
210	A	67	Low	79.4	Confident	75 Å²	75	84.6 Å²	84.6	62%	0.62	44%	0.442	S	S	*	.	H	α-helix	trans	-64.3	-44.5	175.8	0	0	0	0	0	111.7	D208 T213 D214	D208-A210 PolarHBondContact O-N 3.49Å; A210-T213 PolarHBondContact O-OG1 3.04Å; A210-T213 VanDerWaalsContact O-OG1 3.09Å; A210-D214 VanDerWaalsContact O-CB 3.28Å; A210-D214 WeakPolarHBondContact O-CB 3.3Å; A210-D214 PolarHBondContact O-N 3.1Å
211	S	74.7	Confident	79.7	Confident	37 Å²	37	79.9 Å²	79.9	26%	0.259	43%	0.428	S	S	.	.	H	α-helix	trans	-72.7	-32.2	-179.6	74.6	0	0	0	0	112.3	D208 D214 A215	D208-S211 PolarHBondContact O-N 3.07Å; D208-S211 VanDerWaalsContact O-N 3.14Å; D208-S211 PolarHBondContact O-OG 3.47Å; D208-S211 VanDerWaalsContact OD1-CB 3.23Å; D208-S211 WeakPolarHBondContact OD1-CB 3.43Å; D208-S211 PolarHBondContact OD1-OG 3.43Å; D208-S211 PolarHBondContact OD2-OG 3.25Å; S211-D214 PolarHBondContact O-N 3.3Å; S211-A215 VanDerWaalsContact O-CB 3.23Å; S211-A215 WeakPolarHBondContact O-CB 3.43Å; S211-A215 PolarHBondContact O-N 3Å
212	R	71.7	Confident	79.9	Confident	88 Å²	88	80.4 Å²	80.4	33%	0.332	43%	0.426	S	S	.	.	H	α-helix	trans	-65.5	-45.2	177	-67.9	176.2	79	132.1	2.9	112.4	S162 T163 D208 R216	S162-R212 WeakPolarHBondContact O-CG 3.39Å; T163-R212 VanDerWaalsContact O-CZ 3.31Å; T163-R212 PolarHBondContact O-NH1 3.3Å; T163-R212 PolarHBondContact O-NH2 2.89Å; T163-R212 PolarHBondContact OG1-NH2 3.49Å; D208-R212 WeakPolarHBondContact O-CG 3.38Å; D208-R212 PolarHBondContact O-N 3.23Å; D208-R212 VanDerWaalsContact O-N 3.15Å; R212-R216 PolarHBondContact O-N 3.08Å
213	T	76.7	Confident	79.8	Confident	100 Å²	100	78.3 Å²	78.3	61%	0.613	42%	0.417	S	S	*	.	H	α-helix	trans	-68.7	-40.7	177.6	47.9	0	0	0	0	111.1	N209 A210 R216 A217	N209-T213 PolarHBondContact O-N 3.13Å; N209-T213 PolarHBondContact O-OG1 3.47Å; A210-T213 PolarHBondContact O-OG1 3.04Å; A210-T213 VanDerWaalsContact O-OG1 3.09Å; T213-R216 PolarHBondContact O-N 3.14Å; T213-A217 WeakPolarHBondContact O-CB 3.29Å; T213-A217 PolarHBondContact O-N 3.45Å
214	D	83.9	Confident	79.8	Confident	104 Å²	104	84.4 Å²	84.4	56%	0.556	44%	0.444	S	S	*	.	H	α-helix	trans	-64.4	-44.4	175.8	-169.8	35	0	0	0	112.4	A210 S211 R216 A217 L218	A210-D214 VanDerWaalsContact O-CB 3.28Å; A210-D214 WeakPolarHBondContact O-CB 3.3Å; A210-D214 PolarHBondContact O-N 3.1Å; S211-D214 PolarHBondContact O-N 3.3Å; D214-R216 VanDerWaalsContact C-N 3.32Å; D214-R216 PolarHBondContact O-N 3.42Å; D214-A217 CarbonylContact O-C 3.5Å; D214-A217 PolarHBondContact O-N 2.89Å; D214-A217 VanDerWaalsContact O-N 3.12Å; D214-L218 WeakPolarHBondContact O-CB 3.42Å; D214-L218 PolarHBondContact O-N 3Å
215	A	83	Confident	80	Confident	16 Å²	16	87.3 Å²	87.3	13%	0.132	45%	0.452	C	S	.	.	H	α-helix	trans	-59.7	-41	178.7	0	0	0	0	0	112.6	S211 L218 I219	S211-A215 VanDerWaalsContact O-CB 3.23Å; S211-A215 WeakPolarHBondContact O-CB 3.43Å; S211-A215 PolarHBondContact O-N 3Å; A215-L218 PolarHBondContact O-N 3.37Å; A215-I219 PolarHBondContact O-N 2.99Å
216	R	85.4	Confident	80.2	Confident	184 Å²	184	82 Å²	82	69%	0.694	43%	0.429	S	S	*	.	H	α-helix	trans	-68.4	-41.4	175.6	-172.8	176.9	-178.1	166.4	0.9	111.7	R212 T213 D214 L218 I219 A220	R212-R216 PolarHBondContact O-N 3.08Å; T213-R216 PolarHBondContact O-N 3.14Å; D214-R216 VanDerWaalsContact C-N 3.32Å; D214-R216 PolarHBondContact O-N 3.42Å; R216-L218 VanDerWaalsContact C-N 3.33Å; R216-I219 PolarHBondContact O-N 3.24Å; R216-A220 PolarHBondContact O-N 3.37Å
217	A	87.6	Confident	80.6	Confident	55 Å²	55	82.8 Å²	82.8	46%	0.455	43%	0.429	S	S	.	.	H	α-helix	trans	-64.8	-37.9	176.5	0	0	0	0	0	111.8	T213 D214 I219 A220 K221	T213-A217 WeakPolarHBondContact O-CB 3.29Å; T213-A217 PolarHBondContact O-N 3.45Å; D214-A217 CarbonylContact O-C 3.5Å; D214-A217 PolarHBondContact O-N 2.89Å; D214-A217 VanDerWaalsContact O-N 3.12Å; A217-I219 PolarHBondContact O-N 3.41Å; A217-A220 PolarHBondContact O-N 3.04Å; A217-K221 VanDerWaalsContact O-CB 3.27Å; A217-K221 WeakPolarHBondContact O-CB 3.49Å; A217-K221 PolarHBondContact O-N 2.92Å
218	L	85.7	Confident	81.5	Confident	80 Å²	80	78 Å²	78	42%	0.419	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-41.8	178.6	-172.1	67.4	0	0	0	111.9	L155 D214 A215 R216 K221 F222	L155-L218 HydrophobicContact CD2-CD2 3.91Å; L155-L218 HydrophobicContact CD2-CG 4.35Å; D214-L218 WeakPolarHBondContact O-CB 3.42Å; D214-L218 PolarHBondContact O-N 3Å; A215-L218 PolarHBondContact O-N 3.37Å; R216-L218 VanDerWaalsContact C-N 3.33Å; L218-K221 PolarHBondContact O-N 3.28Å; L218-F222 WeakPolarHBondContact O-CB 3.43Å; L218-F222 PolarHBondContact O-N 3.16Å
219	I	87.4	Confident	82.6	Confident	26 Å²	26	78.6 Å²	78.6	13%	0.133	42%	0.416	C	S	.	.	H	α-helix	trans	-65.3	-46.4	175.9	-73.4	164.4	0	0	0	111.5	L155 Q159 A215 R216 A217 K221 F222 H223	L155-I219 HydrophobicContact CB-CD1 4.38Å; L155-I219 HydrophobicContact CB-CG1 3.84Å; Q159-I219 HydrophobicContact CB-CD1 3.43Å; Q159-I219 VanDerWaalsContact CB-CD1 3.43Å; Q159-I219 HydrophobicContact CG-CD1 4.03Å; A215-I219 PolarHBondContact O-N 2.99Å; R216-I219 PolarHBondContact O-N 3.24Å; A217-I219 PolarHBondContact O-N 3.41Å; I219-K221 VanDerWaalsContact C-N 3.28Å; I219-K221 PolarHBondContact O-N 3.35Å; I219-F222 PolarHBondContact O-N 3.13Å; I219-H223 PolarHBondContact O-N 3.46Å
220	A	88	Confident	83.7	Confident	62 Å²	62	73.4 Å²	73.4	51%	0.512	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-42.1	177.4	0	0	0	0	0	111.1	R216 A217 H223 H224	R216-A220 PolarHBondContact O-N 3.37Å; A217-A220 PolarHBondContact O-N 3.04Å; A220-H223 PolarHBondContact O-N 2.96Å; A220-H224 PolarHBondContact O-N 3.43Å; A220-H224 VanDerWaalsContact O-N 3.12Å
221	K	89.7	Confident	84.5	Confident	115 Å²	115	73.7 Å²	73.7	50%	0.5	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-42.9	175.7	-173.3	179.1	179.5	-176.7	0	111.9	A217 L218 I219 H224 Q225	A217-K221 VanDerWaalsContact O-CB 3.27Å; A217-K221 WeakPolarHBondContact O-CB 3.49Å; A217-K221 PolarHBondContact O-N 2.92Å; L218-K221 PolarHBondContact O-N 3.28Å; I219-K221 VanDerWaalsContact C-N 3.28Å; I219-K221 PolarHBondContact O-N 3.35Å; K221-H224 PolarHBondContact O-N 3.46Å; K221-Q225 VanDerWaalsContact CE-NE2 3.25Å; K221-Q225 VanDerWaalsContact CE-OE1 3.3Å; K221-Q225 HydrophobicContact CG-CG 4.15Å; K221-Q225 VanDerWaalsContact O-CB 3.28Å; K221-Q225 WeakPolarHBondContact O-CB 3.2Å; K221-Q225 VanDerWaalsContact O-CG 3.29Å; K221-Q225 WeakPolarHBondContact O-CG 3.47Å; K221-Q225 PolarHBondContact O-N 3.46Å
222	F	88.5	Confident	85	Confident	23 Å²	23	77.7 Å²	77.7	10%	0.101	40%	0.397	C	S	.	.	H	α-helix	trans	-62.2	-44.9	177.3	174.4	-103	0	0	0	112	M151 L155 L218 I219 H224 V226 R227	M151-F222 HydrophobicContact CB-CE2 4.41Å; M151-F222 HydrophobicContact CB-CZ 3.86Å; M151-F222 HydrophobicContact CE-CE2 3.62Å; M151-F222 HydrophobicContact CE-CZ 4.19Å; M151-F222 HydrophobicContact SD-CE2 4.4Å; M151-F222 HydrophobicContact SD-CZ 4.46Å; L155-F222 HydrophobicContact CD1-CB 3.84Å; L155-F222 HydrophobicContact CD1-CD1 3.64Å; L155-F222 HydrophobicContact CD1-CD2 4.02Å; L155-F222 HydrophobicContact CD1-CE1 4.2Å; L155-F222 HydrophobicContact CD1-CG 3.54Å; L218-F222 WeakPolarHBondContact O-CB 3.43Å; L218-F222 PolarHBondContact O-N 3.16Å; I219-F222 PolarHBondContact O-N 3.13Å; F222-H224 PolarHBondContact O-N 3.21Å; F222-V226 HydrophobicContact CD2-CB 3.88Å; F222-V226 HydrophobicContact CD2-CG1 4.39Å; F222-V226 HydrophobicContact CD2-CG2 3.86Å; F222-V226 HydrophobicContact CE2-CB 3.69Å; F222-V226 HydrophobicContact CE2-CG1 3.7Å; F222-V226 HydrophobicContact CE2-CG2 3.96Å; F222-V226 HydrophobicContact CZ-CB 4.33Å; F222-V226 HydrophobicContact CZ-CG1 4.16Å; F222-V226 WeakPolarHBondContact O-CB 3.44Å; F222-V226 PolarHBondContact O-N 3.3Å; F222-R227 PolarHBondContact O-N 2.78Å
223	H	86.2	Confident	85.4	Confident	56 Å²	56	75.4 Å²	75.4	26%	0.259	39%	0.391	S	S	.	.	I	π-helix	trans	-56.5	-50.9	175.3	-100.5	-127.9	0	0	0	111.4	I219 A220 R227 D228	I219-H223 PolarHBondContact O-N 3.46Å; A220-H223 PolarHBondContact O-N 2.96Å; H223-R227 PolarHBondContact CE1-NH1 2.78Å; H223-R227 PolarHBondContact NE2-NH1 3.06Å; H223-R227 VanDerWaalsContact NE2-NH1 3.15Å; H223-R227 WeakPolarHBondContact O-CB 3.46Å; H223-R227 PolarHBondContact O-N 3.22Å; H223-D228 VanDerWaalsContact O-CG 3.27Å; H223-D228 PolarHBondContact O-N 2.84Å
224	H	87.8	Confident	85.7	Confident	137 Å²	137	70.8 Å²	70.8	63%	0.634	36%	0.362	S	S	*	.	I	π-helix	trans	-70.2	-37.8	-176.2	-168.5	55.4	0	0	0	113.9	A220 K221 F222 D228	A220-H224 PolarHBondContact O-N 3.43Å; A220-H224 VanDerWaalsContact O-N 3.12Å; K221-H224 PolarHBondContact O-N 3.46Å; F222-H224 PolarHBondContact O-N 3.21Å; H224-D228 WeakPolarHBondContact CA-OD2 3.27Å; H224-D228 IonicContact ND1-OD2 3.16Å
225	Q	86.7	Confident	85.5	Confident	121 Å²	121	74.5 Å²	74.5	57%	0.565	37%	0.369	S	S	*	.	I	π-helix	trans	-87.2	-34.7	-173.4	-67.6	-173	-13.4	0	0	113.7	K221	K221-Q225 VanDerWaalsContact CE-NE2 3.25Å; K221-Q225 VanDerWaalsContact CE-OE1 3.3Å; K221-Q225 HydrophobicContact CG-CG 4.15Å; K221-Q225 VanDerWaalsContact O-CB 3.28Å; K221-Q225 WeakPolarHBondContact O-CB 3.2Å; K221-Q225 VanDerWaalsContact O-CG 3.29Å; K221-Q225 WeakPolarHBondContact O-CG 3.47Å; K221-Q225 PolarHBondContact O-N 3.46Å
226	V	84.2	Confident	85.4	Confident	30 Å²	30	78.3 Å²	78.3	18%	0.182	38%	0.383	C	S	.	.	I	π-helix	trans	-113	-52.2	-170.3	-178.9	0	0	0	0	110.8	F66 L148 F222 I230	F66-V226 HydrophobicContact CE1-CG1 4.34Å; F66-V226 HydrophobicContact CZ-CG1 3.66Å; L148-V226 HydrophobicContact CD2-CG1 3.99Å; F222-V226 HydrophobicContact CD2-CB 3.88Å; F222-V226 HydrophobicContact CD2-CG1 4.39Å; F222-V226 HydrophobicContact CD2-CG2 3.86Å; F222-V226 HydrophobicContact CE2-CB 3.69Å; F222-V226 HydrophobicContact CE2-CG1 3.7Å; F222-V226 HydrophobicContact CE2-CG2 3.96Å; F222-V226 HydrophobicContact CZ-CB 4.33Å; F222-V226 HydrophobicContact CZ-CG1 4.16Å; F222-V226 WeakPolarHBondContact O-CB 3.44Å; F222-V226 PolarHBondContact O-N 3.3Å; V226-I230 HydrophobicContact CG1-CD1 3.81Å; V226-I230 WeakPolarHBondContact O-CB 3.32Å; V226-I230 WeakPolarHBondContact O-CD1 3.41Å; V226-I230 WeakPolarHBondContact O-CG1 3.47Å; V226-I230 PolarHBondContact O-N 3.12Å
227	R	84.2	Confident	84.7	Confident	81 Å²	81	69.7 Å²	69.7	31%	0.306	35%	0.352	S	S	.	.	I	π-helix	trans	-68.9	-55.8	-173.4	-174.8	-176.9	172.3	164.2	2.6	111.2	F222 H223 I230 D231	F222-R227 PolarHBondContact O-N 2.78Å; H223-R227 PolarHBondContact CE1-NH1 2.78Å; H223-R227 PolarHBondContact NE2-NH1 3.06Å; H223-R227 VanDerWaalsContact NE2-NH1 3.15Å; H223-R227 WeakPolarHBondContact O-CB 3.46Å; H223-R227 PolarHBondContact O-N 3.22Å; R227-I230 PolarHBondContact O-N 3.11Å; R227-D231 WeakPolarHBondContact O-CB 3.42Å; R227-D231 PolarHBondContact O-N 3.27Å
228	D	85.8	Confident	84	Confident	80 Å²	80	70.6 Å²	70.6	43%	0.428	35%	0.349	S	S	.	.	H	α-helix	trans	-59.4	-45.4	-172.1	-60	-22.6	0	0	0	112.8	H223 H224 L232	H223-D228 VanDerWaalsContact O-CG 3.27Å; H223-D228 PolarHBondContact O-N 2.84Å; H224-D228 WeakPolarHBondContact CA-OD2 3.27Å; H224-D228 IonicContact ND1-OD2 3.16Å; D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 PolarHBondContact O-N 2.8Å; D228-L232 VanDerWaalsContact O-N 3.13Å
229	P	86.8	Confident	82.8	Confident	63 Å²	63	73.7 Å²	73.7	41%	0.409	36%	0.361	S	S	.	.	H	α-helix	trans	-68.6	-39.5	179.4	-21.3	35.4	0	0	0	113	M233	P229-M233 WeakPolarHBondContact O-CG 3.25Å; P229-M233 PolarHBondContact O-N 3.44Å
230	I	86.6	Confident	81.7	Confident	8 Å²	8	75.5 Å²	75.5	4%	0.041	37%	0.37	C	S	.	.	H	α-helix	trans	-75.3	-38	-178.2	-60.9	174	0	0	0	110.6	L58 F66 V144 L148 V226 R227 M233 L234	L58-I230 HydrophobicContact CD1-CG2 4.23Å; F66-I230 HydrophobicContact CE2-CD1 3.85Å; F66-I230 HydrophobicContact CZ-CD1 4.11Å; V144-I230 HydrophobicContact CG1-CG2 4.49Å; L148-I230 HydrophobicContact CD1-CB 4.48Å; L148-I230 HydrophobicContact CD1-CG2 3.87Å; V226-I230 HydrophobicContact CG1-CD1 3.81Å; V226-I230 WeakPolarHBondContact O-CB 3.32Å; V226-I230 WeakPolarHBondContact O-CD1 3.41Å; V226-I230 WeakPolarHBondContact O-CG1 3.47Å; V226-I230 PolarHBondContact O-N 3.12Å; R227-I230 PolarHBondContact O-N 3.11Å; I230-M233 CarbonylContact O-C 3.57Å; I230-M233 PolarHBondContact O-N 3.22Å; I230-L234 HydrophobicContact CG2-CD1 3.82Å; I230-L234 HydrophobicContact CG2-CG 4.12Å; I230-L234 WeakPolarHBondContact O-CB 3.21Å; I230-L234 VanDerWaalsContact O-CG 3.29Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 2.84Å
231	D	84.3	Confident	80	Confident	81 Å²	81	80.7 Å²	80.7	43%	0.433	38%	0.384	S	S	.	.	H	α-helix	trans	-68.1	-36.6	179.5	-162.4	35	0	0	0	111.6	R227 M233 L234 R235	R227-D231 WeakPolarHBondContact O-CB 3.42Å; R227-D231 PolarHBondContact O-N 3.27Å; D231-M233 VanDerWaalsContact C-N 3.33Å; D231-M233 PolarHBondContact O-N 3.01Å; D231-L234 PolarHBondContact O-N 3.21Å; D231-R235 VanDerWaalsContact O-CB 3.3Å; D231-R235 WeakPolarHBondContact O-CB 3.38Å; D231-R235 PolarHBondContact O-N 3.1Å
232	L	84.4	Confident	78.6	Confident	122 Å²	122	77.5 Å²	77.5	64%	0.639	37%	0.372	S	S	*	.	H	α-helix	trans	-60.5	-43.8	171.2	-172.4	145.7	0	0	0	111.5	D228 E236	D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 PolarHBondContact O-N 2.8Å; D228-L232 VanDerWaalsContact O-N 3.13Å; L232-E236 PolarHBondContact O-N 3.4Å
233	M	81	Confident	76.8	Confident	39 Å²	39	79.1 Å²	79.1	19%	0.192	39%	0.386	C	S	.	.	H	α-helix	trans	-69.1	-37.8	175.9	-66.3	178.1	71.3	0	0	112.7	K57 L58 P229 I230 D231 E236 C237	K57-M233 HydrophobicContact CB-CE 3.87Å; L58-M233 VanDerWaalsContact CA-CE 3.5Å; L58-M233 HydrophobicContact CB-CE 4.19Å; L58-M233 HydrophobicContact CD1-CB 3.82Å; L58-M233 HydrophobicContact CD1-CE 4.45Å; P229-M233 WeakPolarHBondContact O-CG 3.25Å; P229-M233 PolarHBondContact O-N 3.44Å; I230-M233 CarbonylContact O-C 3.57Å; I230-M233 PolarHBondContact O-N 3.22Å; D231-M233 VanDerWaalsContact C-N 3.33Å; D231-M233 PolarHBondContact O-N 3.01Å; M233-E236 PolarHBondContact O-N 3.22Å; M233-C237 WeakPolarHBondContact O-CB 3.13Å; M233-C237 PolarHBondContact O-N 3.32Å; M233-C237 PolarHBondContact O-SG 2.85Å
234	L	82.2	Confident	75.1	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.016	41%	0.406	C	S	.	.	H	α-helix	trans	-64.5	-41.5	176.4	-77.8	166.8	0	0	0	110.9	L58 V141 V144 K145 L148 I230 D231 C237 D238	L58-L234 HydrophobicContact CD1-CD2 4.22Å; L58-L234 HydrophobicContact CD1-CG 4.17Å; L58-L234 HydrophobicContact CD2-CD2 3.73Å; L58-L234 HydrophobicContact CD2-CG 4.5Å; V141-L234 HydrophobicContact CG1-CD2 4.02Å; V144-L234 HydrophobicContact CG1-CD1 4.36Å; V144-L234 HydrophobicContact CG1-CD2 4.38Å; K145-L234 HydrophobicContact CG-CD1 4.4Å; L148-L234 HydrophobicContact CD1-CD1 3.98Å; I230-L234 HydrophobicContact CG2-CD1 3.82Å; I230-L234 HydrophobicContact CG2-CG 4.12Å; I230-L234 WeakPolarHBondContact O-CB 3.21Å; I230-L234 VanDerWaalsContact O-CG 3.29Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 2.84Å; D231-L234 PolarHBondContact O-N 3.21Å; L234-C237 CarbonylContact O-C 3.41Å; L234-C237 PolarHBondContact O-N 2.86Å; L234-C237 VanDerWaalsContact O-N 3.12Å; L234-D238 WeakPolarHBondContact O-CB 3.41Å; L234-D238 PolarHBondContact O-N 3.15Å
235	R	80.5	Confident	73.3	Confident	183 Å²	183	79 Å²	79	69%	0.691	41%	0.409	S	S	*	.	H	α-helix	trans	-61.9	-43.2	177	-171.2	173.6	-175.9	170.3	2.1	112	D231 C237 D238	D231-R235 VanDerWaalsContact O-CB 3.3Å; D231-R235 WeakPolarHBondContact O-CB 3.38Å; D231-R235 PolarHBondContact O-N 3.1Å; R235-C237 VanDerWaalsContact C-N 3.28Å; R235-C237 PolarHBondContact O-N 2.58Å; R235-D238 PolarHBondContact O-N 3.15Å
236	E	80.3	Confident	71.9	Confident	95 Å²	95	74.9 Å²	74.9	44%	0.444	39%	0.391	S	S	.	.	H	α-helix	trans	-63.1	-34.9	173.9	-170.1	-175.6	172	0	0	112	C54 L232 M233	C54-E236 HydrophobicContact CB-CG 4.49Å; C54-E236 PolarHBondContact SG-OE1 3.35Å; L232-E236 PolarHBondContact O-N 3.4Å; M233-E236 PolarHBondContact O-N 3.22Å
237	C	71.6	Confident	70.4	Confident	4 Å²	4	74.7 Å²	74.7	3%	0.027	39%	0.389	C	S	.	.	H	α-helix	trans	-79.3	-32.5	179.3	-66.4	0	0	0	0	113.6	C54 L55 L58 M233 L234 R235 E239 I240	C54-C237 VanDerWaalsContact C-SG 3.54Å; L55-C237 HydrophobicContact CD2-CB 3.75Å; L55-C237 HydrophobicContact CG-CB 4.48Å; L58-C237 HydrophobicContact CD2-CB 4.46Å; M233-C237 WeakPolarHBondContact O-CB 3.13Å; M233-C237 PolarHBondContact O-N 3.32Å; M233-C237 PolarHBondContact O-SG 2.85Å; L234-C237 CarbonylContact O-C 3.41Å; L234-C237 PolarHBondContact O-N 2.86Å; L234-C237 VanDerWaalsContact O-N 3.12Å; R235-C237 VanDerWaalsContact C-N 3.28Å; R235-C237 PolarHBondContact O-N 2.58Å; C237-E239 VanDerWaalsContact C-N 3.25Å; C237-E239 PolarHBondContact O-N 3.4Å; C237-I240 PolarHBondContact O-N 3.33Å; C237-I240 VanDerWaalsContact O-N 3.1Å
238	D	71.5	Confident	69	Low	73 Å²	73	76.5 Å²	76.5	39%	0.39	40%	0.401	S	S	.	.	H	α-helix	trans	-67.6	-25.8	-179.7	-82	-19	0	0	0	112.5	K145 L234 R235 I240	K145-D238 WeakPolarHBondContact CE-OD2 3.4Å; K145-D238 IonicContact NZ-OD1 3.64Å; K145-D238 PolarHBondContact NZ-OD1 3.44Å; K145-D238 IonicContact NZ-OD2 2.73Å; K145-D238 PolarHBondContact NZ-OD2 3.43Å; L234-D238 WeakPolarHBondContact O-CB 3.41Å; L234-D238 PolarHBondContact O-N 3.15Å; R235-D238 PolarHBondContact O-N 3.15Å; D238-I240 PolarHBondContact O-N 3.05Å
239	E	61.1	Low	67.6	Low	146 Å²	146	74.4 Å²	74.4	68%	0.682	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.6	173.7	-68.3	179.4	-177	0	0	112.2	C237	C237-E239 VanDerWaalsContact C-N 3.25Å; C237-E239 PolarHBondContact O-N 3.4Å
240	I	64.2	Low	65.9	Low	63 Å²	63	79.6 Å²	79.6	32%	0.323	41%	0.41	S	S	.	.	S	Bend	trans	-100.9	93.1	-177.4	-50.3	172.1	0	0	0	109.3	P52 C54 C237 D238 L242	P52-I240 HydrophobicContact CB-CD1 4.05Å; P52-I240 HydrophobicContact CB-CG2 4.42Å; P52-I240 HydrophobicContact CG-CG2 3.84Å; C54-I240 HydrophobicContact CB-CD1 4.45Å; C237-I240 PolarHBondContact O-N 3.33Å; C237-I240 VanDerWaalsContact O-N 3.1Å; D238-I240 PolarHBondContact O-N 3.05Å; I240-L242 PolarHBondContact O-N 3.46Å; I240-L242 VanDerWaalsContact O-N 3.11Å
241	H	52	Low	64.4	Low	172 Å²	172	80.5 Å²	80.5	80%	0.796	42%	0.415	S	S	*	.			trans	-68.9	108.1	173.9	-68.3	85.6	0	0	0	110.3	S243	H241-S243 PolarHBondContact O-N 2.68Å
242	L	59.7	Low	62.7	Low	48 Å²	48	86.2 Å²	86.2	25%	0.251	43%	0.43	S	S	.	.			trans	-65.8	131.3	179.4	-70.4	96	0	0	0	111.7	L55 Y137 I240 I246 L247	L55-L242 HydrophobicContact CD1-CD1 3.92Å; L55-L242 HydrophobicContact CD1-CD2 3.8Å; L55-L242 HydrophobicContact CD1-CG 3.99Å; Y137-L242 HydrophobicContact CD2-CD2 4.43Å; Y137-L242 HydrophobicContact CG-CD2 4.28Å; I240-L242 PolarHBondContact O-N 3.46Å; I240-L242 VanDerWaalsContact O-N 3.11Å; L242-I246 HydrophobicContact CD2-CG2 4.47Å; L242-L247 HydrophobicContact CB-CD1 3.61Å; L242-L247 HydrophobicContact CD2-CD1 4.32Å
243	S	50.9	Low	60.9	Low	57 Å²	57	84.8 Å²	84.8	40%	0.399	43%	0.428	S	S	.	.			trans	-74.2	139.1	170.7	-66.7	0	0	0	0	111.1	H241 A245 I246 L247	H241-S243 PolarHBondContact O-N 2.68Å; S243-A245 PolarHBondContact O-N 3.42Å; S243-I246 PolarHBondContact O-N 3.12Å; S243-I246 VanDerWaalsContact O-N 3.07Å; S243-L247 VanDerWaalsContact O-CD1 3.25Å; S243-L247 WeakPolarHBondContact O-CD1 3.43Å
244	P	51	Low	59.3	Low	105 Å²	105	89.7 Å²	89.7	68%	0.682	46%	0.455	S	S	*	.	H	α-helix	trans	-56.8	-21.2	-175.4	19.5	-30.6	0	0	0	115	I246 L247 E248	P244-I246 VanDerWaalsContact C-N 3.25Å; P244-I246 PolarHBondContact O-N 3.45Å; P244-L247 PolarHBondContact O-N 3.46Å; P244-L247 VanDerWaalsContact O-N 3.13Å; P244-E248 PolarHBondContact O-N 3.39Å
245	A	51	Low	57.7	Low	85 Å²	85	97.7 Å²	97.7	70%	0.702	49%	0.492	S	S	*	.	H	α-helix	trans	-64.8	-23.5	176.3	0	0	0	0	0	114.3	S243	S243-A245 PolarHBondContact O-N 3.42Å
246	I	55.6	Low	55.8	Low	35 Å²	35	94 Å²	94	18%	0.179	49%	0.492	C	S	.	.	H	α-helix	trans	-87.6	-27	173.7	-65.1	172.2	0	0	0	111.3	S48 V51 Y137 L242 S243 P244 E248	S48-I246 WeakPolarHBondContact O-CD1 3.33Å; V51-I246 HydrophobicContact CG2-CG2 4.39Å; Y137-I246 HydrophobicContact CD2-CG2 4.15Å; Y137-I246 HydrophobicContact CE2-CG2 4.38Å; L242-I246 HydrophobicContact CD2-CG2 4.47Å; S243-I246 PolarHBondContact O-N 3.12Å; S243-I246 VanDerWaalsContact O-N 3.07Å; P244-I246 VanDerWaalsContact C-N 3.25Å; P244-I246 PolarHBondContact O-N 3.45Å; I246-E248 VanDerWaalsContact C-N 3.32Å; I246-E248 PolarHBondContact O-N 2.91Å
247	L	53.3	Low	54	Low	26 Å²	26	97 Å²	97	14%	0.136	51%	0.51	C	S	.	.	H	α-helix	trans	-71.5	-30.8	-174.5	-82.9	85.4	0	0	0	112.6	K138 L242 S243 P244	K138-L247 HydrophobicContact CB-CD2 3.43Å; K138-L247 VanDerWaalsContact CB-CD2 3.43Å; K138-L247 HydrophobicContact CB-CG 4.22Å; K138-L247 HydrophobicContact CD-CD2 3.45Å; K138-L247 VanDerWaalsContact CD-CD2 3.45Å; K138-L247 HydrophobicContact CG-CD2 4.08Å; L242-L247 HydrophobicContact CB-CD1 3.61Å; L242-L247 HydrophobicContact CD2-CD1 4.32Å; S243-L247 VanDerWaalsContact O-CD1 3.25Å; S243-L247 WeakPolarHBondContact O-CD1 3.43Å; P244-L247 PolarHBondContact O-N 3.46Å; P244-L247 VanDerWaalsContact O-N 3.13Å
248	E	55	Low	52.2	Low	119 Å²	119	103.7 Å²	103.7	56%	0.556	55%	0.546	S	S	*	.	S	Bend	trans	-146.5	88.1	-177.1	-164.6	152	-148.2	0	0	108	P244 I246 E250	P244-E248 PolarHBondContact O-N 3.39Å; I246-E248 VanDerWaalsContact C-N 3.32Å; I246-E248 PolarHBondContact O-N 2.91Å; E248-E250 PolarHBondContact O-N 3.26Å
249	P	56.7	Low	50.6	Low	35 Å²	35	107.9 Å²	107.9	23%	0.227	57%	0.568	C	S	.	*			trans	-57.8	119.9	171.3	24.4	-32.1	0	0	0	107.5	I83 I251	I83-P249 HydrophobicContact CD1-CB 3.57Å; I83-P249 HydrophobicContact CD1-CG 3.48Å; I83-P249 VanDerWaalsContact CD1-CG 3.48Å; I83-P249 HydrophobicContact CG1-CB 4.2Å; I83-P249 HydrophobicContact CG1-CG 3.6Å; P249-I251 VanDerWaalsContact C-N 3.32Å; P249-I251 PolarHBondContact O-N 2.93Å
250	E	51.1	Low	49.7	Very low	173 Å²	173	107.8 Å²	107.8	81%	0.808	57%	0.572	S	S	*	*			trans	-63.2	97.3	176.2	-172.1	176.1	-176.8	0	0	107.6	E248 R252	E248-E250 PolarHBondContact O-N 3.26Å; E250-R252 PolarHBondContact O-N 2.95Å
251	I	55.1	Low	48.3	Very low	27 Å²	27	111.4 Å²	111.4	14%	0.138	60%	0.597	C	S	.	*			trans	-67.3	91.4	163.9	-49.2	-176.3	0	0	0	104.8	I83 K116 H132 P249 P253	I83-I251 HydrophobicContact CD1-CG1 4.1Å; I83-I251 HydrophobicContact CG2-CD1 4.46Å; K116-I251 HydrophobicContact CB-CD1 4.31Å; K116-I251 HydrophobicContact CD-CD1 3.67Å; K116-I251 HydrophobicContact CD-CG1 4.23Å; K116-I251 HydrophobicContact CG-CD1 4.12Å; H132-I251 HydrophobicContact CB-CD1 4.04Å; P249-I251 VanDerWaalsContact C-N 3.32Å; P249-I251 PolarHBondContact O-N 2.93Å; I251-P253 VanDerWaalsContact O-CD 3.23Å; I251-P253 WeakPolarHBondContact O-CD 3.36Å; I251-P253 VanDerWaalsContact O-N 3.12Å
252	R	48.7	Very low	47.6	Very low	200 Å²	200	108 Å²	108	76%	0.755	59%	0.593	S	S	*	*			trans	-53.7	115.6	168.8	-163.2	176	-169.2	170.1	1	105.7	E250 L254	E250-R252 PolarHBondContact O-N 2.95Å; R252-L254 PolarHBondContact O-N 3.28Å; R252-L254 VanDerWaalsContact O-N 3.14Å
253	P	46.9	Very low	46.5	Very low	92 Å²	92	112.7 Å²	112.7	60%	0.597	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-55.7	123.5	165.6	-16.4	30.3	0	0	0	105.5	I251 E255	I251-P253 VanDerWaalsContact O-CD 3.23Å; I251-P253 WeakPolarHBondContact O-CD 3.36Å; I251-P253 VanDerWaalsContact O-N 3.12Å; P253-E255 PolarHBondContact O-N 2.94Å
254	L	47.6	Very low	45.9	Very low	143 Å²	143	118.7 Å²	118.7	75%	0.749	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-53.3	119	162.1	-72.9	164.6	0	0	0	105	R252	R252-L254 PolarHBondContact O-N 3.28Å; R252-L254 VanDerWaalsContact O-N 3.14Å
255	E	47.1	Very low	45.2	Very low	170 Å²	170	117.7 Å²	117.7	79%	0.794	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-52.3	130.5	-179.9	-77.4	-169.8	158.1	0	0	107.8	P253 L257	P253-E255 PolarHBondContact O-N 2.94Å; E255-L257 PolarHBondContact O-N 3.23Å; E255-L257 VanDerWaalsContact O-N 3.15Å
256	P	40.9	Very low	44.7	Very low	106 Å²	106	121.9 Å²	121.9	69%	0.688	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-56	124.8	168	-13.9	26.5	0	0	0	106.7	N258	P256-N258 PolarHBondContact O-N 2.98Å
257	L	42	Very low	43.7	Very low	159 Å²	159	126.1 Å²	126.1	83%	0.832	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-53.9	117.5	163.2	-81.5	157.8	0	0	0	106.3	E255 D259	E255-L257 PolarHBondContact O-N 3.23Å; E255-L257 VanDerWaalsContact O-N 3.15Å; L257-D259 VanDerWaalsContact C-N 3.32Å; L257-D259 PolarHBondContact O-N 3.41Å
258	N	35.3	Very low	42.9	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	70%	0.695	S	S	*	*			trans	-61.9	99.1	171.4	-65.7	-21.2	0	0	0	106.8	P256 D260	P256-N258 PolarHBondContact O-N 2.98Å; N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 PolarHBondContact O-N 2.96Å; N258-D260 VanDerWaalsContact O-N 3.14Å
259	D	38.3	Very low	42.2	Very low	161 Å²	161	128.7 Å²	128.7	86%	0.861	70%	0.702	S	S	*	*			trans	-71.6	100.1	157.3	-100.1	-32.4	0	0	0	106.2	L257 T261	L257-D259 VanDerWaalsContact C-N 3.32Å; L257-D259 PolarHBondContact O-N 3.41Å; D259-T261 PolarHBondContact O-N 3.46Å; D259-T261 VanDerWaalsContact O-N 3.11Å
260	D	40.7	Very low	41.4	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	73%	0.729	S	S	*	*			trans	-54.9	115.3	169.2	-86.6	-49.3	0	0	0	109.2	N258 S262	N258-D260 VanDerWaalsContact C-N 3.33Å; N258-D260 PolarHBondContact O-N 2.96Å; N258-D260 VanDerWaalsContact O-N 3.14Å; D260-S262 PolarHBondContact O-N 3.37Å
261	T	35.7	Very low	40.7	Very low	138 Å²	138	133.3 Å²	133.3	85%	0.847	72%	0.724	S	S	*	*			trans	-37.8	124.3	161.1	41.3	0	0	0	0	112.8	D259	D259-T261 PolarHBondContact O-N 3.46Å; D259-T261 VanDerWaalsContact O-N 3.11Å
262	S	36.6	Very low	39.7	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	76%	0.759	S	S	*	*			trans	-119.3	127.9	147	37	0	0	0	0	108.8	D260	D260-S262 PolarHBondContact O-N 3.37Å
263	D	36.9	Very low	39.2	Very low	148 Å²	148	133.1 Å²	133.1	79%	0.791	76%	0.763	S	S	*	*			trans	75	89.8	156.8	-53	-32	0	0	0	119.1
264	E	37.8	Very low	38.7	Very low	182 Å²	182	139.7 Å²	139.7	85%	0.85	78%	0.775	S	S	*	*				173.6	128.9	100.7	-103.1	-178.4	64.8	0	0	113
265	S	37.6	Very low	38.2	Very low	85 Å²	85	140 Å²	140	59%	0.594	78%	0.778	S	S	*	*			trans	75.6	96.8	138.1	-56.5	0	0	0	0	121.3
266	Q	40.1	Very low	37.8	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	77%	0.773	S	S	*	*				78.5	125.3	127.6	-60.1	-178.5	27	0	0	120.6
267	T	35.1	Very low	37.5	Very low	124 Å²	124	138.4 Å²	138.4	76%	0.761	78%	0.775	S	S	*	*			trans	99	93.8	145.5	70.8	0	0	0	0	119.6
268	S	36.5	Very low	37.2	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	78%	0.779	S	S	*	*				69.8	106.8	124.4	57.6	0	0	0	0	121
269	S	39.3	Very low	37.2	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	78%	0.781	S	S	*	*				94.4	105.9	113.5	-60.7	0	0	0	0	120.6
270	Q	40.1	Very low	37	Very low	170 Å²	170	133 Å²	133	79%	0.794	77%	0.77	S	S	*	*				85.6	130.4	121.4	-67.7	-175.3	2.7	0	0	121.5
271	N	36.9	Very low	37	Very low	134 Å²	134	134.2 Å²	134.2	72%	0.717	78%	0.776	S	S	*	*			trans	97.8	103	144.8	-71.2	-11.4	0	0	0	118
272	V	34.6	Very low	37.1	Very low	142 Å²	142	137.4 Å²	137.4	86%	0.861	78%	0.778	S	S	*	*				84.6	114.5	76.8	168.6	0	0	0	0	110.6
273	G	37.9	Very low	37.2	Very low	81 Å²	81	140.1 Å²	140.1	84%	0.835	79%	0.785	S	S	*	*			trans	176.8	78	172.9	0	0	0	0	0	112.3
274	R	35.3	Very low	37.1	Very low	230 Å²	230	140.6 Å²	140.6	87%	0.868	79%	0.787	S	S	*	*			trans	-101.5	158.6	-176.9	-153.1	175.5	165.4	131.1	-2.8	109.4
275	N	37	Very low	37.2	Very low	150 Å²	150	140.3 Å²	140.3	80%	0.802	78%	0.783	S	S	*	*			trans	97.7	131.7	166	-44.9	-19.2	0	0	0	113.2
276	S	38.7	Very low	37.1	Very low	98 Å²	98	144 Å²	144	69%	0.685	80%	0.796	S	S	*	*			cis	-168.9	115.2	46.3	178.2	0	0	0	0	108.1
277	I	34.5	Very low	37.2	Very low	145 Å²	145	141.3 Å²	141.3	74%	0.744	80%	0.797	S	S	*	*				31	112.4	97.5	-55.3	175.9	0	0	0	113.5
278	L	37.2	Very low	37.2	Very low	175 Å²	175	140.9 Å²	140.9	92%	0.916	80%	0.799	S	S	*	*			trans	-149.4	125.3	140.7	-121.6	97.3	0	0	0	110.2
279	S	33.8	Very low	37.4	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	81%	0.806	S	S	*	*			trans	-96.5	166.1	-175.4	-65.4	0	0	0	0	112.6
280	G	35.7	Very low	37.1	Very low	61 Å²	61	149.6 Å²	149.6	63%	0.629	82%	0.819	S	S	*	*			trans	123.5	124.5	159.6	0	0	0	0	0	111.1
281	D	39.9	Very low	36.8	Very low	170 Å²	170	144.1 Å²	144.1	91%	0.909	81%	0.808	S	S	*	*			cis	-156.6	145.9	20	-86.9	-49.7	0	0	0	111.3
282	K	36.8	Very low	37.1	Very low	205 Å²	205	144 Å²	144	89%	0.891	82%	0.817	S	S	*	*			trans	-89.7	114.8	167.6	-67.3	171.7	176.7	173.8	0	108.3
283	N	38.6	Very low	37.4	Very low	157 Å²	157	143.4 Å²	143.4	84%	0.84	81%	0.814	S	S	*	*			trans	-173.6	110.8	147.5	-127.2	-2.5	0	0	0	110.4
284	N	35.4	Very low	37.5	Very low	157 Å²	157	147.1 Å²	147.1	84%	0.84	81%	0.81	S	S	*	*				173.2	131.9	107.8	-158.5	0.6	0	0	0	110.1
285	K	39.8	Very low	38	Very low	176 Å²	176	142 Å²	142	77%	0.765	81%	0.81	S	S	*	*			trans	-79.9	152.2	-178.7	-66.6	166.6	176.3	174.3	0	109.6
286	N	36.2	Very low	38.8	Very low	162 Å²	162	138 Å²	138	87%	0.866	79%	0.794	S	S	*	*			trans	65.1	93.3	160	-66.4	-0.5	0	0	0	117.6
287	S	41.6	Very low	39.7	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	79%	0.787	S	S	*	*				-151.4	113.4	130	55.7	0	0	0	0	110.5	L289	S287-L289 PolarHBondContact O-N 2.98Å
288	S	34.8	Very low	40.5	Very low	115 Å²	115	136.7 Å²	136.7	80%	0.804	77%	0.774	S	S	*	*			trans	-66.2	116.5	174.1	50.5	0	0	0	0	110.8
289	L	40.9	Very low	41.7	Very low	164 Å²	164	133.5 Å²	133.5	86%	0.859	76%	0.757	S	S	*	*			trans	-162.1	98.5	157.8	-141.4	67.2	0	0	0	112.4	S287 G291	S287-L289 PolarHBondContact O-N 2.98Å; L289-G291 PolarHBondContact O-N 3.33Å
290	F	32.9	Very low	43.1	Very low	219 Å²	219	132.4 Å²	132.4	96%	0.961	75%	0.745	S	S	*	*			trans	21.8	92.2	151.2	-78.9	-93.5	0	0	0	117.8
291	G	35.2	Very low	43.9	Very low	55 Å²	55	136.7 Å²	136.7	57%	0.567	75%	0.753	S	S	*	*			trans	-136.9	143.8	154.9	0	0	0	0	0	106.8	L289 T293	L289-G291 PolarHBondContact O-N 3.33Å; G291-T293 VanDerWaalsContact C-N 3.31Å; G291-T293 PolarHBondContact O-N 2.88Å
292	S	42.1	Very low	44.6	Very low	131 Å²	131	133.5 Å²	133.5	92%	0.916	74%	0.744	S	S	*	*			trans	-53.7	84.2	-170.1	-46.7	0	0	0	0	113.3
293	T	40.8	Very low	45.1	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	73%	0.734	S	S	*	*			trans	-90.1	115.4	169.6	57.3	0	0	0	0	107	G291 S295	G291-T293 VanDerWaalsContact C-N 3.31Å; G291-T293 PolarHBondContact O-N 2.88Å; T293-S295 PolarHBondContact O-N 3.4Å; T293-S295 VanDerWaalsContact O-N 3.07Å
294	E	41.4	Very low	45.2	Very low	160 Å²	160	127.2 Å²	127.2	75%	0.748	74%	0.736	S	S	*	*			trans	-52.9	108.1	-175.4	-61.5	160	-154.6	0	0	110.5	S296	E294-S296 PolarHBondContact O-N 3.24Å
295	S	45	Very low	45.6	Very low	123 Å²	123	125.3 Å²	125.3	86%	0.86	74%	0.735	S	S	*	*			trans	-84.3	88.2	175.8	-171.4	0	0	0	0	108.2	T293	T293-S295 PolarHBondContact O-N 3.4Å; T293-S295 VanDerWaalsContact O-N 3.07Å
296	S	54.5	Low	45.6	Very low	66 Å²	66	122.1 Å²	122.1	46%	0.462	74%	0.735	S	S	.	*			trans	-113	131.2	173.7	-172	0	0	0	0	110.7	E294	E294-S296 PolarHBondContact O-N 3.24Å
297	V	56.7	Low	45.7	Very low	91 Å²	91	117.9 Å²	117.9	55%	0.552	73%	0.729	S	S	*	*			trans	-98.9	120.8	-170	-178.5	0	0	0	0	109.8	I299	V297-I299 HydrophobicContact CG1-CD1 4.35Å; V297-I299 HydrophobicContact CG1-CG1 3.85Å; V297-I299 PolarHBondContact O-N 3.38Å
298	R	51.8	Low	45.5	Very low	123 Å²	123	117.6 Å²	117.6	46%	0.464	73%	0.727	S	S	.	*			trans	-84.3	108.4	175.8	-166.8	-179.5	-158	-114.6	1.1	110.4	V300 T508 N509	R298-V300 HydrophobicContact CG-CG2 4.44Å; R298-T508 HydrophobicContact CB-CG2 4.31Å; R298-T508 HydrophobicContact CG-CG2 3.93Å; R298-N509 PolarHBondContact NH2-OD1 3.42Å
299	I	61.4	Low	45.6	Very low	108 Å²	108	119.4 Å²	119.4	55%	0.554	73%	0.728	S	S	*	*			trans	-108	107.3	-179.6	-54.5	174.8	0	0	0	109.5	V297 L301	V297-I299 HydrophobicContact CG1-CD1 4.35Å; V297-I299 HydrophobicContact CG1-CG1 3.85Å; V297-I299 PolarHBondContact O-N 3.38Å; I299-L301 HydrophobicContact CG2-CD1 3.43Å; I299-L301 VanDerWaalsContact CG2-CD1 3.43Å
300	V	64.1	Low	45.8	Very low	92 Å²	92	120.1 Å²	120.1	56%	0.558	73%	0.727	S	S	*	*			trans	-116.8	99.5	173.2	-177.7	0	0	0	0	109	R298	R298-V300 HydrophobicContact CG-CG2 4.44Å
301	L	52.2	Low	46.4	Very low	151 Å²	151	116.3 Å²	116.3	79%	0.791	72%	0.721	S	S	*	*			trans	-94.2	92.9	167	-85.7	78.9	0	0	0	108.3	I299	I299-L301 HydrophobicContact CG2-CD1 3.43Å; I299-L301 VanDerWaalsContact CG2-CD1 3.43Å
302	S	53.9	Low	47.5	Very low	102 Å²	102	120 Å²	120	71%	0.713	73%	0.732	S	S	*	*			trans	157.7	108	156.3	-86.2	0	0	0	0	108.9
303	G	47.9	Very low	48.2	Very low	67 Å²	67	123.1 Å²	123.1	69%	0.691	73%	0.729	S	S	*	*			trans	-165.3	55.2	-178.6	0	0	0	0	0	112.9
304	N	39.9	Very low	49.6	Very low	163 Å²	163	125.6 Å²	125.6	87%	0.872	73%	0.732	S	S	*	*			trans	-105.6	70.2	163.1	-85.8	76	0	0	0	108.5
305	S	45.1	Very low	51	Low	118 Å²	118	127.7 Å²	127.7	83%	0.825	73%	0.733	S	S	*	*			trans	-103.1	83.6	166.5	32	0	0	0	0	109.2
306	S	39.9	Very low	52.3	Low	109 Å²	109	125.3 Å²	125.3	76%	0.762	72%	0.715	S	S	*	*			trans	-75.4	115	162.2	-37.6	0	0	0	0	108.4
307	G	38.4	Very low	52.9	Low	72 Å²	72	128.5 Å²	128.5	74%	0.742	73%	0.725	S	S	*	*			trans	76.8	104.2	152.8	0	0	0	0	0	118.5
308	S	36.3	Very low	53.4	Low	110 Å²	110	133.7 Å²	133.7	77%	0.769	74%	0.735	S	S	*	*				163	146.2	117.4	53.6	0	0	0	0	111.5
309	N	36.4	Very low	54.3	Low	153 Å²	153	133.8 Å²	133.8	82%	0.818	74%	0.742	S	S	*	*			trans	95	61.4	167.8	-54.4	-23.9	0	0	0	118
310	Q	45.7	Very low	54.5	Low	180 Å²	180	131.8 Å²	131.8	84%	0.841	74%	0.738	S	S	*	*			trans	-111.7	103.4	136.1	-77.4	-165.2	-6.3	0	0	109.2
311	V	45.9	Very low	54.3	Low	138 Å²	138	133.7 Å²	133.7	84%	0.836	75%	0.745	S	S	*	*			trans	-122.9	76.5	148.5	-176.7	0	0	0	0	105.9
312	V	57.8	Low	54.8	Low	132 Å²	132	131.9 Å²	131.9	80%	0.8	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-78.6	121.5	160.4	177.6	0	0	0	0	105.5	E314	V312-E314 PolarHBondContact O-N 3.35Å
313	K	57.4	Low	54.7	Low	197 Å²	197	133.7 Å²	133.7	86%	0.857	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-58.4	122.7	-163.6	-63.1	169.7	180	177	0	112.7
314	E	69.5	Low	54.9	Low	183 Å²	183	138.3 Å²	138.3	86%	0.855	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-74.6	140.4	166.7	-151.7	176	-160.8	0	0	109.7	V312	V312-E314 PolarHBondContact O-N 3.35Å
315	R	71.1	Confident	55	Low	204 Å²	204	134.8 Å²	134.8	77%	0.77	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.7	127.3	-179.2	50.5	176.8	173.9	175	-1.3	110.5	M319	R315-M319 HydrophobicContact CB-CE 3.67Å
316	P	72.5	Confident	55	Low	73 Å²	73	136.7 Å²	136.7	47%	0.474	75%	0.747	S	S	.	*	P	Polyproline II helix	trans	-72.3	148	-176.2	13.8	-14.3	0	0	0	113.5	W318 M319	P316-W318 PolarHBondContact O-N 2.65Å; P316-M319 PolarHBondContact O-N 2.71Å
317	I	67.7	Low	55.4	Low	132 Å²	132	138.5 Å²	138.5	68%	0.677	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-68.8	-20.8	-159.2	-145.9	161.6	0	0	0	116.4	M319 S320	I317-M319 PolarHBondContact O-N 3.49Å; I317-M319 VanDerWaalsContact O-N 3.11Å; I317-S320 VanDerWaalsContact CA-OG 3.31Å; I317-S320 WeakPolarHBondContact CA-OG 3.5Å; I317-S320 WeakPolarHBondContact O-CA 3.28Å; I317-S320 WeakPolarHBondContact O-CB 3.23Å; I317-S320 PolarHBondContact O-N 3.27Å; I317-S320 PolarHBondContact O-OG 3.49Å
318	W	66.8	Low	55.6	Low	201 Å²	201	140 Å²	140	76%	0.761	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-59.9	-14.4	171.8	64.6	-56	0	0	0	114.7	P316 S320	P316-W318 PolarHBondContact O-N 2.65Å; W318-S320 VanDerWaalsContact C-N 3.3Å
319	M	70.4	Confident	56	Low	124 Å²	124	139 Å²	139	61%	0.611	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-87.4	5	167.9	-63.6	-166.9	-57	0	0	113.3	R315 P316 I317	R315-M319 HydrophobicContact CB-CE 3.67Å; P316-M319 PolarHBondContact O-N 2.71Å; I317-M319 PolarHBondContact O-N 3.49Å; I317-M319 VanDerWaalsContact O-N 3.11Å
320	S	65.7	Low	56.4	Low	67 Å²	67	138 Å²	138	47%	0.469	75%	0.745	S	S	.	*	S	Bend	trans	-113.5	-14	-173.2	-21.9	0	0	0	0	113.9	I317 W318	I317-S320 VanDerWaalsContact CA-OG 3.31Å; I317-S320 WeakPolarHBondContact CA-OG 3.5Å; I317-S320 WeakPolarHBondContact O-CA 3.28Å; I317-S320 WeakPolarHBondContact O-CB 3.23Å; I317-S320 PolarHBondContact O-N 3.27Å; I317-S320 PolarHBondContact O-OG 3.49Å; W318-S320 VanDerWaalsContact C-N 3.3Å
321	D	59.7	Low	55.8	Low	131 Å²	131	132.5 Å²	132.5	70%	0.701	74%	0.737	S	S	*	*			trans	-96.1	112.8	179.6	-73.1	-28.8	0	0	0	110.8
322	S	62.7	Low	55.6	Low	114 Å²	114	134 Å²	134	80%	0.797	74%	0.739	S	S	*	*			trans	-92.6	120.5	171.6	-69.6	0	0	0	0	110.8	I324	S322-I324 PolarHBondContact O-N 2.77Å
323	T	52.1	Low	54.6	Low	139 Å²	139	130.7 Å²	130.7	85%	0.853	73%	0.73	S	S	*	*			trans	-72.4	56.9	179.6	-0.1	0	0	0	0	113.1	S325	T323-S325 PolarHBondContact O-N 3.49Å
324	I	52.4	Low	53.8	Low	164 Å²	164	128.1 Å²	128.1	84%	0.841	73%	0.726	S	S	*	*			trans	-81.4	73.8	165.5	-157.4	121.8	0	0	0	110.3	S322	S322-I324 PolarHBondContact O-N 2.77Å
325	S	40.8	Very low	52.6	Low	89 Å²	89	125.6 Å²	125.6	62%	0.622	72%	0.723	S	S	*	*			trans	-41.5	122.1	157.6	50.4	0	0	0	0	112.9	T323	T323-S325 PolarHBondContact O-N 3.49Å
326	L	46.5	Very low	51.2	Low	158 Å²	158	122.6 Å²	122.6	83%	0.827	72%	0.723	S	S	*	*				178.5	102.9	125.6	-94.7	142.3	0	0	0	110.9
327	N	46.4	Very low	49.6	Very low	148 Å²	148	123.5 Å²	123.5	79%	0.791	73%	0.731	S	S	*	*				116.1	123.8	126.6	-121.8	48.5	0	0	0	118.4
328	P	44	Very low	48.2	Very low	104 Å²	104	126 Å²	126	68%	0.675	74%	0.739	S	S	*	*			trans	-100.8	174.6	-167.1	41.1	-34.8	0	0	0	113.4
329	A	45.1	Very low	46.6	Very low	88 Å²	88	122.2 Å²	122.2	73%	0.727	74%	0.738	S	S	*	*			trans	90.4	160.3	145.3	0	0	0	0	0	116.7
330	P	44.2	Very low	44.8	Very low	131 Å²	131	122.7 Å²	122.7	85%	0.851	74%	0.743	S	S	*	*				-136.4	174.9	-95.6	29.3	-6.7	0	0	0	112.2
331	G	33.4	Very low	43.1	Very low	66 Å²	66	125.4 Å²	125.4	68%	0.68	75%	0.751	S	S	*	*			trans	130.3	158.1	142.7	0	0	0	0	0	117.9
332	I	41.3	Very low	41.8	Very low	170 Å²	170	128 Å²	128	87%	0.872	76%	0.757	S	S	*	*			trans	81.8	93.5	160.3	-53.3	162.6	0	0	0	111.7
333	G	36.5	Very low	40.4	Very low	61 Å²	61	126.9 Å²	126.9	63%	0.629	75%	0.749	S	S	*	*				103.2	135.2	85.7	0	0	0	0	0	106.1
334	D	41.5	Very low	39.3	Very low	144 Å²	144	127.8 Å²	127.8	77%	0.77	75%	0.748	S	S	*	*			cis	-165.3	166.1	22.1	-83.7	-59.5	0	0	0	108.3
335	T	44.7	Very low	38.5	Very low	129 Å²	129	124.6 Å²	124.6	79%	0.791	75%	0.747	S	S	*	*			trans	78	128.4	161.7	75.5	0	0	0	0	116.8
336	D	41.4	Very low	38.4	Very low	141 Å²	141	125 Å²	125	75%	0.754	75%	0.75	S	S	*	*			cis	-163.9	115	-5.8	-131.3	-13.9	0	0	0	103.8
337	S	39.3	Very low	37.9	Very low	93 Å²	93	125.1 Å²	125.1	65%	0.65	75%	0.746	S	S	*	*				76.9	127.2	98.9	-62.8	0	0	0	0	114.3
338	Q	38.1	Very low	37.3	Very low	183 Å²	183	126.5 Å²	126.5	86%	0.855	75%	0.745	S	S	*	*			cis	-167.4	134.1	-0.1	-122.3	-178.5	10.3	0	0	107.1
339	V	32.5	Very low	37	Very low	122 Å²	122	129.9 Å²	129.9	74%	0.739	75%	0.752	S	S	*	*			trans	-91	129.3	159.2	172.6	0	0	0	0	106.7
340	N	33.2	Very low	36.8	Very low	134 Å²	134	128.9 Å²	128.9	72%	0.717	74%	0.744	S	S	*	*			trans	177.3	117.4	144	-100.1	-11.9	0	0	0	108.4
341	I	30.2	Very low	36.5	Very low	124 Å²	124	129.7 Å²	129.7	64%	0.636	74%	0.741	S	S	*	*				49.3	97.6	79.2	-51.6	175.7	0	0	0	109.8
342	F	31.9	Very low	36.7	Very low	187 Å²	187	133.9 Å²	133.9	82%	0.82	74%	0.742	S	S	*	*				161.5	136.1	129.8	-101	-80.6	0	0	0	112.3
343	S	33.5	Very low	36.8	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	73%	0.734	S	S	*	*			trans	89	102.3	142.2	-56.6	0	0	0	0	121.3
344	N	29.6	Very low	37.3	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	74%	0.736	S	S	*	*				63.9	136.4	114.8	-71.4	-11.4	0	0	0	122.9
345	A	34.8	Very low	37.3	Very low	98 Å²	98	134 Å²	134	81%	0.81	74%	0.735	S	S	*	*			trans	78.9	133.4	157	0	0	0	0	0	116.1
346	S	38.8	Very low	37.3	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	74%	0.736	S	S	*	*			cis	-174.8	145.5	5.9	34.1	0	0	0	0	108.8
347	E	34.9	Very low	37.6	Very low	159 Å²	159	132.1 Å²	132.1	74%	0.743	73%	0.731	S	S	*	*			trans	67.7	103.3	149.6	-67.9	176.8	140.6	0	0	121.3
348	F	35.4	Very low	37.8	Very low	177 Å²	177	135.2 Å²	135.2	78%	0.776	74%	0.739	S	S	*	*				175	121.3	92.4	-102.8	-80.7	0	0	0	112
349	H	38	Very low	38	Very low	175 Å²	175	131.9 Å²	131.9	81%	0.81	73%	0.731	S	S	*	*			trans	23.9	143.3	149.7	-81.2	-55.9	0	0	0	122.5
350	A	40	Very low	38.4	Very low	68 Å²	68	134 Å²	134	56%	0.562	73%	0.733	S	S	*	*			cis	-169.4	149	-1.9	0	0	0	0	0	111.2
351	N	38.6	Very low	38.8	Very low	148 Å²	148	132.1 Å²	132.1	79%	0.791	73%	0.727	S	S	*	*			trans	72.1	129.4	150.8	-63.5	-4	0	0	0	119.1
352	H	35.8	Very low	39.1	Very low	153 Å²	153	134.1 Å²	134.1	71%	0.708	74%	0.738	S	S	*	*			cis	-165.3	122.4	4.3	-148.9	-92.4	0	0	0	110
353	T	45.3	Very low	40	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.693	74%	0.735	S	S	*	*			trans	57	144.5	142.5	61.6	0	0	0	0	125.8
354	P	47	Very low	40.5	Very low	103 Å²	103	131.6 Å²	131.6	67%	0.669	75%	0.745	S	S	*	*			trans	-136.9	-161.8	-146	28.2	0.7	0	0	0	115.4
355	E	41	Very low	40.8	Very low	163 Å²	163	127.6 Å²	127.6	76%	0.762	74%	0.742	S	S	*	*			trans	92.5	126.3	152.3	-43.7	-168.3	-179.9	0	0	116.5
356	D	44.5	Very low	41	Very low	151 Å²	151	134 Å²	134	81%	0.807	75%	0.745	S	S	*	*			cis	-146.6	142.4	42.4	-85.7	-48.9	0	0	0	116.7
357	A	47.7	Very low	41.6	Very low	79 Å²	79	136.1 Å²	136.1	65%	0.653	75%	0.754	S	S	*	*			trans	31.5	115.3	146.7	0	0	0	0	0	122.6
358	I	43.3	Very low	42	Very low	157 Å²	157	134.1 Å²	134.1	81%	0.805	75%	0.754	S	S	*	*				73.8	122.5	66.6	-59.3	158.8	0	0	0	110.6
359	T	41.3	Very low	42.2	Very low	113 Å²	113	131.5 Å²	131.5	69%	0.693	76%	0.758	S	S	*	*			cis	-169.4	135.1	30.9	-12.7	0	0	0	0	106.3
360	Q	42.6	Very low	42.2	Very low	166 Å²	166	126.2 Å²	126.2	78%	0.776	75%	0.751	S	S	*	*				45	138.4	81.4	-84.6	-169.4	-2.9	0	0	113.6
361	T	39.9	Very low	42.1	Very low	96 Å²	96	133.1 Å²	133.1	59%	0.589	77%	0.769	S	S	*	*			cis	-179.3	133.5	19.7	14.9	0	0	0	0	104.7
362	L	37	Very low	42	Very low	166 Å²	166	129.5 Å²	129.5	87%	0.869	77%	0.766	S	S	*	*				52.7	127.7	96.8	-76.4	148.4	0	0	0	115.1
363	A	51	Low	42.1	Very low	92 Å²	92	126.8 Å²	126.8	76%	0.76	76%	0.764	S	S	*	*				175.4	165.6	127.3	0	0	0	0	0	110.7
364	P	44.7	Very low	41.7	Very low	131 Å²	131	127.8 Å²	127.8	85%	0.851	77%	0.765	S	S	*	*				-147.4	-172.1	-90.6	35.2	-10.3	0	0	0	114.5
365	G	35.3	Very low	41.1	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	77%	0.773	S	S	*	*			trans	124.5	135.1	161.3	0	0	0	0	0	112.1
366	R	38.9	Very low	41	Very low	232 Å²	232	128 Å²	128	88%	0.875	77%	0.774	S	S	*	*			cis	-175.5	132.4	34.1	179.4	-175.9	-162.9	120.6	-0.3	107.9
367	V	51.4	Low	40.5	Very low	143 Å²	143	128.3 Å²	128.3	87%	0.867	78%	0.775	S	S	*	*				-167.3	143.7	128.1	-93.2	0	0	0	0	110.7
368	P	42.5	Very low	39.7	Very low	117 Å²	117	129.4 Å²	129.4	76%	0.76	78%	0.778	S	S	*	*			trans	-96.3	147	-165.3	2.7	20.4	0	0	0	113.3
369	S	39.5	Very low	39.1	Very low	122 Å²	122	127.3 Å²	127.3	85%	0.853	77%	0.773	S	S	*	*			trans	-79.3	143.6	162.6	-61.8	0	0	0	0	110.9
370	G	38.8	Very low	38.8	Very low	64 Å²	64	129.6 Å²	129.6	66%	0.66	78%	0.779	S	S	*	*			trans	-123.9	110.7	174.7	0	0	0	0	0	111.8
371	F	37.9	Very low	38.2	Very low	213 Å²	213	124.8 Å²	124.8	93%	0.934	77%	0.774	S	S	*	*			trans	48.4	125.5	141.9	-53.7	-80.6	0	0	0	118.3
372	G	36.9	Very low	37.9	Very low	71 Å²	71	125.8 Å²	125.8	73%	0.732	79%	0.785	S	S	*	*			cis	128.6	154.5	39.9	0	0	0	0	0	105.4
373	S	37.3	Very low	38	Very low	97 Å²	97	123.5 Å²	123.5	68%	0.678	78%	0.778	S	S	*	*			cis	-179.7	162.1	2.2	45.2	0	0	0	0	106.8
374	N	36.4	Very low	37.4	Very low	134 Å²	134	123.7 Å²	123.7	72%	0.717	77%	0.773	S	S	*	*			trans	97.6	100	157.8	-49.1	-29.3	0	0	0	116.1
375	L	35.2	Very low	37.2	Very low	158 Å²	158	125.4 Å²	125.4	83%	0.827	77%	0.769	S	S	*	*				72.5	105.8	83.8	-97.6	78.6	0	0	0	113.4
376	S	39.3	Very low	37.5	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	77%	0.767	S	S	*	*				151.1	129.7	100.8	54.3	0	0	0	0	113.1
377	N	33.7	Very low	37.5	Very low	157 Å²	157	127.6 Å²	127.6	84%	0.84	77%	0.765	S	S	*	*			trans	39.4	114.1	150.6	-77.3	-1.2	0	0	0	122
378	S	30.6	Very low	36.8	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	76%	0.762	S	S	*	*				72.7	125.9	110.1	-157.1	0	0	0	0	119.2
379	V	31.4	Very low	36.8	Very low	113 Å²	113	126.9 Å²	126.9	69%	0.685	76%	0.761	S	S	*	*			trans	86.2	123.9	146.8	165.1	0	0	0	0	117.3
380	I	33.7	Very low	36.7	Very low	162 Å²	162	128.6 Å²	128.6	83%	0.831	76%	0.761	S	S	*	*			trans	77.1	120.9	154.7	-65.4	162.2	0	0	0	118.5
381	G	31.7	Very low	36.5	Very low	64 Å²	64	131.2 Å²	131.2	66%	0.66	76%	0.764	S	S	*	*				79.3	104.6	125.8	0	0	0	0	0	119.2
382	S	33.3	Very low	36.6	Very low	117 Å²	117	127.1 Å²	127.1	82%	0.818	76%	0.757	S	S	*	*				72	131.7	124.3	-133.1	0	0	0	0	121.6
383	V	39.1	Very low	36.7	Very low	119 Å²	119	129.9 Å²	129.9	72%	0.721	76%	0.76	S	S	*	*			trans	81.7	99.2	147.5	-160.2	0	0	0	0	120.4
384	S	38.1	Very low	36.8	Very low	95 Å²	95	131 Å²	131	66%	0.664	77%	0.768	S	S	*	*				51.5	138.1	121.1	-39	0	0	0	0	124.9
385	H	41	Very low	37.1	Very low	167 Å²	167	133.5 Å²	133.5	77%	0.773	78%	0.775	S	S	*	*			trans	102.8	93.1	144.3	-68.8	-67.2	0	0	0	121.8
386	N	40.8	Very low	37.6	Very low	135 Å²	135	132.6 Å²	132.6	72%	0.722	78%	0.776	S	S	*	*				84.7	133.8	109.8	-111.1	5.3	0	0	0	124.8
387	R	38.1	Very low	37.6	Very low	218 Å²	218	134.9 Å²	134.9	82%	0.823	78%	0.779	S	S	*	*			trans	87	137.6	151.1	-65.7	-171.2	168.8	-177.7	-1.8	118.4
388	L	37.8	Very low	38	Very low	156 Å²	156	135.6 Å²	135.6	82%	0.817	78%	0.782	S	S	*	*			cis	-168.8	144	3.9	-144.4	84.2	0	0	0	108.8
389	A	42.5	Very low	38.3	Very low	89 Å²	89	139.4 Å²	139.4	74%	0.736	79%	0.791	S	S	*	*			trans	157.3	117.6	139.4	0	0	0	0	0	113.1
390	D	36.3	Very low	38.7	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	80%	0.798	S	S	*	*			trans	29.7	133.9	137.1	-68.8	-3.8	0	0	0	119.5
391	T	36.5	Very low	38.7	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	80%	0.799	S	S	*	*			cis	-167.8	117.6	15.1	-67.9	0	0	0	0	104.8
392	T	38.9	Very low	39	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	81%	0.805	S	S	*	*			trans	174.9	144.4	164.2	21.4	0	0	0	0	110.9
393	T	38.9	Very low	39.3	Very low	130 Å²	130	144.1 Å²	144.1	80%	0.798	81%	0.805	S	S	*	*			trans	56.3	94.3	157.8	58.7	0	0	0	0	117.8
394	S	40.1	Very low	39.2	Very low	121 Å²	121	144.6 Å²	144.6	85%	0.846	81%	0.813	S	S	*	*			trans	-101.7	88.8	167.4	-53.4	0	0	0	0	110.3
395	E	42.6	Very low	39.4	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	81%	0.807	S	S	*	*			trans	-99.4	106.4	158.6	-68.9	-171	152.9	0	0	107.7	N397	E395-N397 PolarHBondContact O-N 3.35Å
396	T	44.9	Very low	39.7	Very low	139 Å²	139	141.4 Å²	141.4	85%	0.853	81%	0.812	S	S	*	*			trans	-82.6	108.1	173.7	43.4	0	0	0	0	109.9
397	N	40.9	Very low	40.4	Very low	159 Å²	159	143.8 Å²	143.8	85%	0.85	82%	0.819	S	S	*	*			trans	-70.1	119.3	165	-87.2	-47.8	0	0	0	110.6	E395	E395-N397 PolarHBondContact O-N 3.35Å
398	L	41.3	Very low	41.3	Very low	172 Å²	172	139.8 Å²	139.8	90%	0.901	82%	0.819	S	S	*	*			trans	-126.5	122.7	147.3	-141.7	78.8	0	0	0	107.2	T400	L398-T400 PolarHBondContact O-N 2.86Å
399	M	36.2	Very low	42.6	Very low	182 Å²	182	135.2 Å²	135.2	90%	0.897	80%	0.803	S	S	*	*			trans	-54.8	117.2	-172.9	-71.4	131.9	77.5	0	0	112.7
400	T	39.7	Very low	44.2	Very low	136 Å²	136	133.6 Å²	133.6	83%	0.834	79%	0.787	S	S	*	*			trans	-169.1	129.8	133.6	42.6	0	0	0	0	108.9	L398 T402	L398-T400 PolarHBondContact O-N 2.86Å; T400-T402 PolarHBondContact O-N 3.12Å
401	N	35.2	Very low	46.3	Very low	159 Å²	159	130.7 Å²	130.7	85%	0.85	78%	0.778	S	S	*	*			trans	-23.4	123.1	172.1	-67.2	-20	0	0	0	115.5
402	T	37.8	Very low	48.7	Very low	128 Å²	128	128.3 Å²	128.3	79%	0.785	77%	0.767	S	S	*	*				166	117.6	123.2	41.3	0	0	0	0	110.8	T400	T400-T402 PolarHBondContact O-N 3.12Å
403	T	39.8	Very low	50.9	Low	133 Å²	133	125.6 Å²	125.6	82%	0.816	75%	0.748	S	S	*	*			trans	32.7	103.8	147	30.7	0	0	0	0	119.2	G405	T403-G405 PolarHBondContact O-N 3.05Å
404	S	35.2	Very low	53.2	Low	129 Å²	129	123.9 Å²	123.9	90%	0.902	73%	0.733	S	S	*	*			trans	-55.5	115.7	154.2	49.6	0	0	0	0	111.8
405	G	42.2	Very low	55.4	Low	52 Å²	52	123.9 Å²	123.9	54%	0.536	72%	0.72	S	S	.	*			trans	-161	120.7	172.7	0	0	0	0	0	110.3	T403 H407	T403-G405 PolarHBondContact O-N 3.05Å; G405-H407 PolarHBondContact O-N 3.31Å
406	T	47.9	Very low	57.3	Low	143 Å²	143	120.8 Å²	120.8	88%	0.877	71%	0.706	S	S	*	*			trans	-45.5	109.3	175	45.5	0	0	0	0	111	T408	T406-T408 PolarHBondContact O-N 2.85Å; T406-T408 VanDerWaalsContact O-N 3.08Å
407	H	55.5	Low	59.2	Low	185 Å²	185	120.4 Å²	120.4	86%	0.856	70%	0.698	S	S	*	*			trans	-63.4	111.5	-172.2	-73.6	-85	0	0	0	111.9	G405 A409	G405-H407 PolarHBondContact O-N 3.31Å; H407-A409 PolarHBondContact O-N 3.41Å
408	T	57	Low	61.3	Low	134 Å²	134	118.3 Å²	118.3	82%	0.822	69%	0.686	S	S	*	*			trans	-68.4	77.4	160.1	53	0	0	0	0	108.6	T406 S410	T406-T408 PolarHBondContact O-N 2.85Å; T406-T408 VanDerWaalsContact O-N 3.08Å; T408-S410 PolarHBondContact O-N 3.28Å; T408-S410 VanDerWaalsContact O-N 3.13Å
409	A	64.6	Low	63.4	Low	59 Å²	59	113.9 Å²	113.9	49%	0.488	66%	0.663	S	S	.	*			trans	-68.3	110.1	173.2	0	0	0	0	0	108.6	H407 D413 I414	H407-A409 PolarHBondContact O-N 3.41Å; A409-D413 HydrophobicContact CB-CB 4.44Å; A409-I414 HydrophobicContact CB-CG1 4.25Å
410	S	77.6	Confident	65.6	Low	56 Å²	56	109.5 Å²	109.5	39%	0.392	65%	0.647	S	S	.	*			trans	-67.4	156.7	174.4	70.4	0	0	0	0	109.8	T408 S412 D413 I414	T408-S410 PolarHBondContact O-N 3.28Å; T408-S410 VanDerWaalsContact O-N 3.13Å; S410-S412 PolarHBondContact O-N 2.95Å; S410-D413 WeakPolarHBondContact CB-OD2 3.41Å; S410-D413 PolarHBondContact N-OD2 3.33Å; S410-D413 PolarHBondContact O-N 2.91Å; S410-D413 PolarHBondContact OG-N 3.44Å; S410-D413 PolarHBondContact OG-OD2 3.34Å; S410-I414 PolarHBondContact O-N 2.82Å
411	S	80.1	Confident	67.4	Low	96 Å²	96	109.7 Å²	109.7	67%	0.671	64%	0.637	S	S	*	*	H	α-helix	trans	-52.7	-25.7	175.5	-178	0	0	0	0	112.7	M415	S411-M415 PolarHBondContact O-N 3.33Å
412	S	85.5	Confident	69.6	Low	69 Å²	69	108.8 Å²	108.8	48%	0.483	63%	0.628	S	S	.	*	H	α-helix	trans	-70.8	-42.4	174.1	-178.5	0	0	0	0	112.3	S410 M415 Q416	S410-S412 PolarHBondContact O-N 2.95Å; S412-M415 PolarHBondContact O-N 3.26Å; S412-Q416 PolarHBondContact O-N 3.41Å
413	D	86.8	Confident	71.3	Confident	70 Å²	70	111.1 Å²	111.1	37%	0.374	62%	0.623	S	S	.	*	H	α-helix	trans	-66.3	-40.4	-179.3	-58.2	-41.6	0	0	0	111.2	A409 S410 M415 Q416 L417	A409-D413 HydrophobicContact CB-CB 4.44Å; S410-D413 WeakPolarHBondContact CB-OD2 3.41Å; S410-D413 PolarHBondContact N-OD2 3.33Å; S410-D413 PolarHBondContact O-N 2.91Å; S410-D413 PolarHBondContact OG-N 3.44Å; S410-D413 PolarHBondContact OG-OD2 3.34Å; D413-M415 VanDerWaalsContact C-N 3.31Å; D413-M415 PolarHBondContact O-N 3.47Å; D413-Q416 PolarHBondContact O-N 3.05Å; D413-L417 WeakPolarHBondContact O-CB 3.49Å; D413-L417 PolarHBondContact O-N 3.44Å
414	I	85.7	Confident	72.6	Confident	94 Å²	94	114.3 Å²	114.3	48%	0.482	62%	0.62	S	S	.	*	H	α-helix	trans	-61	-43.8	175.2	-60.3	170.6	0	0	0	110.1	A409 S410 L417 L418	A409-I414 HydrophobicContact CB-CG1 4.25Å; S410-I414 PolarHBondContact O-N 2.82Å; I414-L417 PolarHBondContact O-N 2.89Å; I414-L418 HydrophobicContact CG2-CD1 4.09Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 WeakPolarHBondContact O-CG 3.28Å; I414-L418 PolarHBondContact O-N 2.94Å
415	M	86.3	Confident	73.7	Confident	120 Å²	120	111.5 Å²	111.5	59%	0.591	60%	0.6	S	S	*	*	H	α-helix	trans	-67.5	-40	179.3	-166.9	174.1	-70.6	0	0	112	S411 S412 D413 L418 L419	S411-M415 PolarHBondContact O-N 3.33Å; S412-M415 PolarHBondContact O-N 3.26Å; D413-M415 VanDerWaalsContact C-N 3.31Å; D413-M415 PolarHBondContact O-N 3.47Å; M415-L418 PolarHBondContact O-N 3.23Å; M415-L419 HydrophobicContact CG-CD1 4.39Å; M415-L419 PolarHBondContact O-N 3.15Å
416	Q	84.1	Confident	74.4	Confident	121 Å²	121	116 Å²	116	57%	0.565	61%	0.611	S	S	*	*	H	α-helix	trans	-65.2	-42.5	174.3	-79.5	-176.5	-14.3	0	0	112.1	S412 D413 L418 L419 V420	S412-Q416 PolarHBondContact O-N 3.41Å; D413-Q416 PolarHBondContact O-N 3.05Å; Q416-L418 VanDerWaalsContact C-N 3.32Å; Q416-L418 PolarHBondContact O-N 3.5Å; Q416-L419 WeakPolarHBondContact O-CB 3.23Å; Q416-L419 PolarHBondContact O-N 2.98Å; Q416-V420 WeakPolarHBondContact O-CG2 3.5Å; Q416-V420 PolarHBondContact O-N 3.21Å
417	L	83.8	Confident	75	Confident	132 Å²	132	116.4 Å²	116.4	69%	0.691	61%	0.607	S	S	*	*	H	α-helix	trans	-63.1	-40.5	178.3	-150.7	84.8	0	0	0	111.3	D413 I414 V420 H421	D413-L417 WeakPolarHBondContact O-CB 3.49Å; D413-L417 PolarHBondContact O-N 3.44Å; I414-L417 PolarHBondContact O-N 2.89Å; L417-V420 PolarHBondContact O-N 3.49Å; L417-H421 WeakPolarHBondContact O-CB 3.48Å; L417-H421 PolarHBondContact O-N 3.14Å
418	L	85.2	Confident	74.9	Confident	114 Å²	114	112.7 Å²	112.7	60%	0.597	60%	0.598	S	S	*	*	H	α-helix	trans	-60.2	-45.3	173.3	-79.3	164	0	0	0	111.6	I414 M415 Q416 V420 H421 E422	I414-L418 HydrophobicContact CG2-CD1 4.09Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 WeakPolarHBondContact O-CG 3.28Å; I414-L418 PolarHBondContact O-N 2.94Å; M415-L418 PolarHBondContact O-N 3.23Å; Q416-L418 VanDerWaalsContact C-N 3.32Å; Q416-L418 PolarHBondContact O-N 3.5Å; L418-V420 PolarHBondContact O-N 2.82Å; L418-H421 PolarHBondContact O-N 3.07Å; L418-E422 PolarHBondContact O-N 3.09Å
419	L	86	Confident	74.3	Confident	80 Å²	80	117.5 Å²	117.5	42%	0.419	60%	0.601	S	S	.	*	H	α-helix	trans	-63.1	-38.2	176.7	-106.9	122	0	0	0	113.1	M415 Q416 R423	M415-L419 HydrophobicContact CG-CD1 4.39Å; M415-L419 PolarHBondContact O-N 3.15Å; Q416-L419 WeakPolarHBondContact O-CB 3.23Å; Q416-L419 PolarHBondContact O-N 2.98Å; L419-R423 PolarHBondContact O-N 2.91Å
420	V	81.2	Confident	73.7	Confident	90 Å²	90	122.7 Å²	122.7	55%	0.545	62%	0.62	S	S	.	*	H	α-helix	trans	-68.3	-40.8	176.2	172.5	0	0	0	0	110.7	Q416 L417 L418 R423 R424	Q416-V420 WeakPolarHBondContact O-CG2 3.5Å; Q416-V420 PolarHBondContact O-N 3.21Å; L417-V420 PolarHBondContact O-N 3.49Å; L418-V420 PolarHBondContact O-N 2.82Å; V420-R423 PolarHBondContact O-N 3.19Å; V420-R424 WeakPolarHBondContact O-CB 3.36Å; V420-R424 PolarHBondContact O-N 3.48Å; V420-R424 VanDerWaalsContact O-N 3.09Å
421	H	77.8	Confident	72.2	Confident	139 Å²	139	125.6 Å²	125.6	64%	0.644	64%	0.641	S	S	*	*	H	α-helix	trans	-66	-38	178	-167.5	-88.2	0	0	0	112	L417 L418 R424 S425	L417-H421 WeakPolarHBondContact O-CB 3.48Å; L417-H421 PolarHBondContact O-N 3.14Å; L418-H421 PolarHBondContact O-N 3.07Å; H421-R424 PolarHBondContact O-N 3.33Å; H421-S425 WeakPolarHBondContact O-CB 3.37Å; H421-S425 PolarHBondContact O-N 2.86Å
422	E	81.5	Confident	70.3	Confident	141 Å²	141	125.4 Å²	125.4	66%	0.659	65%	0.645	S	S	*	*	H	α-helix	trans	-64.1	-45.2	175.2	-168.4	179.3	-178.8	0	0	112.1	L418 R424 S425	L418-E422 PolarHBondContact O-N 3.09Å; E422-R424 VanDerWaalsContact C-N 3.28Å; E422-R424 PolarHBondContact O-N 2.93Å; E422-S425 PolarHBondContact O-N 3.22Å
423	R	74.2	Confident	68.3	Low	177 Å²	177	131.1 Å²	131.1	67%	0.668	66%	0.661	S	S	*	*	H	α-helix	trans	-63.8	-31.3	176.6	-75.6	-172.3	170.7	125.2	-0.2	113.2	L419 V420	L419-R423 PolarHBondContact O-N 2.91Å; V420-R423 PolarHBondContact O-N 3.19Å
424	R	66.1	Low	66.3	Low	199 Å²	199	135.3 Å²	135.3	75%	0.751	68%	0.684	S	S	*	*	H	α-helix	trans	-81.7	-27.7	179.8	-148.1	173.1	-161.5	-176.4	4.3	112.9	V420 H421 E422 L426 L427	V420-R424 WeakPolarHBondContact O-CB 3.36Å; V420-R424 PolarHBondContact O-N 3.48Å; V420-R424 VanDerWaalsContact O-N 3.09Å; H421-R424 PolarHBondContact O-N 3.33Å; E422-R424 VanDerWaalsContact C-N 3.28Å; E422-R424 PolarHBondContact O-N 2.93Å; R424-L426 PolarHBondContact O-N 2.91Å; R424-L427 PolarHBondContact O-N 3.41Å
425	S	58.7	Low	64.4	Low	71 Å²	71	135.5 Å²	135.5	50%	0.497	70%	0.699	S	S	.	*	H	α-helix	trans	-68.4	-19.8	178.4	-163.6	0	0	0	0	113.4	H421 E422 L427	H421-S425 WeakPolarHBondContact O-CB 3.37Å; H421-S425 PolarHBondContact O-N 2.86Å; E422-S425 PolarHBondContact O-N 3.22Å; S425-L427 VanDerWaalsContact C-N 3.25Å; S425-L427 PolarHBondContact O-N 3.03Å
426	L	56.5	Low	62.4	Low	146 Å²	146	135 Å²	135	76%	0.764	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-17	177.5	-77	155.8	0	0	0	114.4	R424	R424-L426 PolarHBondContact O-N 2.91Å
427	L	60	Low	60.6	Low	152 Å²	152	135.8 Å²	135.8	80%	0.796	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-3.9	-176.2	-78.5	93.7	0	0	0	115	R424 S425	R424-L427 PolarHBondContact O-N 3.41Å; S425-L427 VanDerWaalsContact C-N 3.25Å; S425-L427 PolarHBondContact O-N 3.03Å
428	T	53.7	Low	58.5	Low	107 Å²	107	135.2 Å²	135.2	66%	0.656	73%	0.725	S	S	*	*			trans	-115.1	76.7	-176.2	64.3	0	0	0	0	111.6
429	R	44.3	Very low	56	Low	235 Å²	235	132.7 Å²	132.7	89%	0.887	73%	0.726	S	S	*	*			trans	-81.5	115	155.1	-80.9	-179.8	-179.3	166.9	1	107.3
430	N	51.7	Low	53.8	Low	167 Å²	167	140.8 Å²	140.8	89%	0.893	75%	0.751	S	S	*	*			trans	168.5	125.2	157.9	-80.3	-17.2	0	0	0	105
431	S	47.8	Very low	51.9	Low	117 Å²	117	143.5 Å²	143.5	82%	0.818	76%	0.763	S	S	*	*			cis	-156.6	129.1	22	-172.7	0	0	0	0	107
432	A	39.3	Very low	50	Low	93 Å²	93	143.7 Å²	143.7	77%	0.769	77%	0.768	S	S	*	*			trans	-85.1	133	-179	0	0	0	0	0	111
433	K	44	Very low	48	Very low	188 Å²	188	140 Å²	140	82%	0.817	76%	0.762	S	S	*	*			trans	-150.8	113.8	144.7	-68.8	-166	-179.3	172.3	0	109.8
434	N	43.7	Very low	46.6	Very low	159 Å²	159	140.2 Å²	140.2	85%	0.85	77%	0.77	S	S	*	*			trans	44.8	128.6	137	-52.7	-10.4	0	0	0	117.1
435	A	46.6	Very low	45.2	Very low	98 Å²	98	139.8 Å²	139.8	81%	0.81	77%	0.774	S	S	*	*			cis	-171.1	164.5	35.1	0	0	0	0	0	110.7
436	S	43.8	Very low	44.2	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	77%	0.771	S	S	*	*			trans	80.4	89.5	155.8	-164.4	0	0	0	0	119
437	V	47.3	Very low	43.1	Very low	137 Å²	137	138.7 Å²	138.7	83%	0.83	77%	0.77	S	S	*	*				53.2	125.9	129.5	-173.1	0	0	0	0	118.9
438	P	38.3	Very low	42	Very low	121 Å²	121	140.4 Å²	140.4	79%	0.786	78%	0.779	S	S	*	*			trans	-112.6	151.5	-144.5	19.7	2.9	0	0	0	114
439	G	34.3	Very low	41.3	Very low	61 Å²	61	139.3 Å²	139.3	63%	0.629	78%	0.781	S	S	*	*			trans	60.5	79.6	138.8	0	0	0	0	0	116.7	N441	G439-N441 VanDerWaalsContact C-N 3.26Å; G439-N441 PolarHBondContact O-N 3.22Å
440	R	38.9	Very low	40.8	Very low	249 Å²	249	133.4 Å²	133.4	94%	0.94	76%	0.763	S	S	*	*			trans	-63	100.9	148	-125.7	177.4	176	174.4	-2.4	105.6	N442	R440-N442 PolarHBondContact O-N 3.22Å
441	N	41.4	Very low	39.9	Very low	148 Å²	148	128.9 Å²	128.9	79%	0.791	74%	0.743	S	S	*	*			trans	-47.7	107.8	171.5	-64.2	-33.1	0	0	0	107.4	G439 A443	G439-N441 VanDerWaalsContact C-N 3.26Å; G439-N441 PolarHBondContact O-N 3.22Å; N441-A443 PolarHBondContact O-N 2.91Å
442	N	37.7	Very low	39.3	Very low	143 Å²	143	129.5 Å²	129.5	77%	0.765	74%	0.737	S	S	*	*			trans	-60.6	96.4	160.9	-94.3	-3.2	0	0	0	104.6	R440 H444	R440-N442 PolarHBondContact O-N 3.22Å; N442-H444 PolarHBondContact O-N 3.36Å
443	A	40.1	Very low	39.4	Very low	63 Å²	63	130.2 Å²	130.2	52%	0.521	73%	0.734	S	S	.	*			trans	-66.9	88.5	-177.8	0	0	0	0	0	108.2	N441 K445	N441-A443 PolarHBondContact O-N 2.91Å; A443-K445 PolarHBondContact O-N 3.31Å
444	H	45	Very low	38.8	Very low	181 Å²	181	128.5 Å²	128.5	84%	0.838	73%	0.733	S	S	*	*			trans	-68.6	46.5	150.8	-64.1	-72.2	0	0	0	109.7	N442	N442-H444 PolarHBondContact O-N 3.36Å
445	K	35.6	Very low	38.5	Very low	191 Å²	191	127.3 Å²	127.3	83%	0.83	73%	0.731	S	S	*	*			trans	-140.7	68	172.8	-166.8	-179.9	-177	179.7	0	107.5	A443	A443-K445 PolarHBondContact O-N 3.31Å
446	T	38.4	Very low	37.7	Very low	70 Å²	70	129.7 Å²	129.7	43%	0.429	73%	0.73	S	S	.	*	S	Bend	trans	-132.4	125.3	155.1	-41.6	0	0	0	0	102.8	L448 Q450	T446-L448 PolarHBondContact O-N 2.78Å; T446-Q450 VanDerWaalsContact CG2-CD 3.48Å; T446-Q450 HydrophobicContact CG2-CG 3.4Å; T446-Q450 VanDerWaalsContact CG2-NE2 3.34Å; T446-Q450 PolarHBondContact OG1-NE2 2.88Å; T446-Q450 PolarHBondContact OG1-OE1 3.21Å
447	T	33.7	Very low	37.5	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	73%	0.73	S	S	*	*			trans	-25.1	130.9	174.6	-41.7	0	0	0	0	111.1	A449	T447-A449 CarbonylContact O-C 3.36Å; T447-A449 WeakPolarHBondContact O-CA 3.36Å; T447-A449 PolarHBondContact O-N 3Å; T447-A449 VanDerWaalsContact O-O 3.08Å
448	L	37.6	Very low	36.9	Very low	188 Å²	188	132 Å²	132	98%	0.984	73%	0.729	S	S	*	*	S	Bend	trans	-40.1	74.9	179.8	-155.3	80.1	0	0	0	112.9	T446	T446-L448 PolarHBondContact O-N 2.78Å
449	A	37.4	Very low	36.5	Very low	83 Å²	83	134.1 Å²	134.1	69%	0.686	73%	0.733	S	S	*	*			trans	166.6	86.6	-168.6	0	0	0	0	0	106.4	T447	T447-A449 CarbonylContact O-C 3.36Å; T447-A449 WeakPolarHBondContact O-CA 3.36Å; T447-A449 PolarHBondContact O-N 3Å; T447-A449 VanDerWaalsContact O-O 3.08Å
450	Q	34.1	Very low	36.6	Very low	111 Å²	111	137.4 Å²	137.4	52%	0.519	74%	0.741	S	S	.	*			trans	-142	155.2	-176.4	-93.7	-132.2	-79.4	0	0	116.5	T446	T446-Q450 VanDerWaalsContact CG2-CD 3.48Å; T446-Q450 HydrophobicContact CG2-CG 3.4Å; T446-Q450 VanDerWaalsContact CG2-NE2 3.34Å; T446-Q450 PolarHBondContact OG1-NE2 2.88Å; T446-Q450 PolarHBondContact OG1-OE1 3.21Å
451	P	33.3	Very low	36.3	Very low	72 Å²	72	131.4 Å²	131.4	47%	0.468	74%	0.737	S	S	.	*			trans	-123.6	175.4	-140.7	38.3	-20	0	0	0	115.3
452	D	35.4	Very low	36.1	Very low	130 Å²	130	127.4 Å²	127.4	70%	0.695	73%	0.732	S	S	*	*			trans	70.9	157.8	155.9	-54.6	-32.2	0	0	0	120.4
453	P	41.2	Very low	36.1	Very low	108 Å²	108	128 Å²	128	70%	0.701	74%	0.735	S	S	*	*			cis	-137.4	159.2	10.3	39.4	-19.5	0	0	0	118.6
454	L	31.7	Very low	36.5	Very low	152 Å²	152	130.8 Å²	130.8	80%	0.796	74%	0.74	S	S	*	*			trans	27	108	141.1	-66.5	156.2	0	0	0	120.5
455	V	37.5	Very low	36.7	Very low	135 Å²	135	128 Å²	128	82%	0.818	73%	0.727	S	S	*	*			trans	-141	129	135.8	172.6	0	0	0	0	109.4
456	N	30.2	Very low	37.7	Very low	147 Å²	147	122.8 Å²	122.8	79%	0.786	71%	0.713	S	S	*	*			trans	-66.7	128	176.6	-64	-23.6	0	0	0	110.9
457	T	38.1	Very low	38.7	Very low	122 Å²	122	126.3 Å²	126.3	75%	0.748	72%	0.722	S	S	*	*			trans	-145.9	94.6	158.3	-47.9	0	0	0	0	109.9
458	E	34.5	Very low	40.2	Very low	174 Å²	174	126.2 Å²	126.2	81%	0.813	71%	0.711	S	S	*	*			trans	30.8	101.6	140.6	-60.2	-176.8	133.5	0	0	118.4	T460	E458-T460 PolarHBondContact O-N 2.84Å
459	N	29.8	Very low	42	Very low	164 Å²	164	118.9 Å²	118.9	88%	0.877	67%	0.671	S	S	*	*			trans	3.2	100.7	138.1	-60.2	-13.8	0	0	0	115.8
460	T	36.2	Very low	44.1	Very low	131 Å²	131	118.2 Å²	118.2	80%	0.804	65%	0.654	S	S	*	*			trans	-129.2	98.1	150.4	-55.6	0	0	0	0	107.7	E458 G462	E458-T460 PolarHBondContact O-N 2.84Å; T460-G462 PolarHBondContact O-N 2.77Å
461	S	32.7	Very low	46.4	Very low	122 Å²	122	113 Å²	113	85%	0.853	63%	0.63	S	S	*	*			trans	-43.2	117.3	158.6	44.1	0	0	0	0	109.7
462	G	38.3	Very low	48.7	Very low	65 Å²	65	111.5 Å²	111.5	67%	0.67	62%	0.619	S	S	*	*			trans	-156.4	117.4	178.7	0	0	0	0	0	109.6	T460	T460-G462 PolarHBondContact O-N 2.77Å
463	D	38	Very low	51	Low	155 Å²	155	106.1 Å²	106.1	83%	0.829	59%	0.591	S	S	*	*			trans	-27.1	138.5	172.5	-69.7	-56.6	0	0	0	114	H465	D463-H465 PolarHBondContact O-N 2.74Å
464	L	47.7	Very low	52.7	Low	122 Å²	122	104.3 Å²	104.3	64%	0.639	59%	0.592	S	S	*	*			trans	-57.3	89	166.1	-90.9	81.1	0	0	0	108.7	P466 F469 E513	L464-P466 VanDerWaalsContact O-CD 3.32Å; L464-P466 WeakPolarHBondContact O-CD 3.37Å; L464-F469 HydrophobicContact CD2-CE2 4.49Å; L464-E513 WeakPolarHBondContact CD1-OE1 3.26Å
465	H	49.2	Very low	54.8	Low	123 Å²	123	99.9 Å²	99.9	57%	0.569	58%	0.583	S	S	*	*			trans	-72.9	118.6	173.1	-136.8	-64.1	0	0	0	106.9	D463 K467 K468	D463-H465 PolarHBondContact O-N 2.74Å; H465-K467 PolarHBondContact O-N 3.15Å; H465-K468 PolarHBondContact O-N 3.44Å; H465-K468 VanDerWaalsContact O-N 3.12Å
466	P	57.2	Low	56.8	Low	81 Å²	81	99.6 Å²	99.6	53%	0.526	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-57.4	-19.7	-173.4	18.5	-31.4	0	0	0	113.6	L464 K468 F469 L479	L464-P466 VanDerWaalsContact O-CD 3.32Å; L464-P466 WeakPolarHBondContact O-CD 3.37Å; P466-K468 PolarHBondContact O-N 2.54Å; P466-K468 VanDerWaalsContact O-N 3.11Å; P466-F469 PolarHBondContact O-N 2.99Å; P466-L479 HydrophobicContact CB-CD1 4.35Å; P466-L479 WeakPolarHBondContact O-CD1 3.37Å
467	K	58.3	Low	59.2	Low	144 Å²	144	97.8 Å²	97.8	63%	0.626	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-59.7	-20.2	176.7	-67.3	-176.1	173.7	179.3	0	115.2	H465 F469 E470	H465-K467 PolarHBondContact O-N 3.15Å; K467-F469 PolarHBondContact O-N 2.73Å; K467-E470 WeakPolarHBondContact CA-OE1 3.32Å
468	K	65.8	Low	61.1	Low	122 Å²	122	95 Å²	95	53%	0.53	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-76.8	-13.4	-177.4	-154	173.8	-173.4	173.6	0	113.2	H465 P466 L505	H465-K468 PolarHBondContact O-N 3.44Å; H465-K468 VanDerWaalsContact O-N 3.12Å; P466-K468 PolarHBondContact O-N 2.54Å; P466-K468 VanDerWaalsContact O-N 3.11Å; K468-L505 HydrophobicContact CG-CD2 4.13Å
469	F	75.2	Confident	63.3	Low	33 Å²	33	89.2 Å²	89.2	15%	0.145	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-118.4	32.4	-177	-54.9	-72.1	0	0	0	112.5	L464 P466 K467 Y480 V502 L505 M506 N509	L464-F469 HydrophobicContact CD2-CE2 4.49Å; P466-F469 PolarHBondContact O-N 2.99Å; K467-F469 PolarHBondContact O-N 2.73Å; F469-Y480 WeakPolarHBondContact O-CB 3.43Å; F469-Y480 PolarHBondContact O-N 2.94Å; F469-V502 HydrophobicContact CB-CG1 4.31Å; F469-V502 HydrophobicContact CD1-CG1 4.32Å; F469-L505 HydrophobicContact CE1-CD2 4.49Å; F469-L505 HydrophobicContact CE1-CG 4.32Å; F469-M506 HydrophobicContact CD1-CB 4.01Å; F469-M506 HydrophobicContact CD1-CG 4.37Å; F469-M506 HydrophobicContact CE1-CB 4Å; F469-M506 HydrophobicContact CE1-CG 4.35Å; F469-N509 HydrophobicContact CZ-CB 4.44Å; F469-N509 WeakPolarHBondContact CZ-ND2 3.46Å
470	E	81.7	Confident	65.8	Low	70 Å²	70	84 Å²	84	33%	0.327	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	137.7	175.4	-65.3	174	-175.3	0	0	111.2	K467 L477 M478 L479	K467-E470 WeakPolarHBondContact CA-OE1 3.32Å; E470-L477 HydrophobicContact CB-CD2 4.03Å; E470-L477 WeakPolarHBondContact OE2-CD2 3.23Å; E470-M478 CarbonylContact C-O 3.57Å; E470-M478 WeakPolarHBondContact CA-O 3.45Å; E470-L479 HydrophobicContact CG-CD1 4.36Å
471	V	82.8	Confident	68	Low	0 Å²	0	82.1 Å²	82.1	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138.3	177.9	-179.1	0	0	0	0	109.1	V473 M478 Y480 V483 Y499 V502	V471-V473 HydrophobicContact CG1-CG2 4.26Å; V471-M478 PolarHBondContact N-O 3.27Å; V471-M478 PolarHBondContact O-N 3.43Å; V471-Y480 HydrophobicContact CG2-CD2 3.89Å; V471-V483 HydrophobicContact CB-CG2 4.4Å; V471-Y499 HydrophobicContact CG1-CD2 4.11Å; V471-Y499 HydrophobicContact CG1-CG 4.48Å; V471-Y499 HydrophobicContact CG2-CD2 4.25Å; V471-V502 HydrophobicContact CG2-CB 3.86Å; V471-V502 HydrophobicContact CG2-CG1 3.96Å; V471-V502 HydrophobicContact CG2-CG2 4.05Å
472	T	81.5	Confident	70.3	Confident	41 Å²	41	80.5 Å²	80.5	25%	0.252	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	125.3	174.4	-45.3	0	0	0	0	110.4	Q476 E495	T472-Q476 CarbonylContact C-O 3.58Å; T472-Q476 WeakPolarHBondContact CA-O 3.49Å; T472-E495 WeakPolarHBondContact O-CB 3.28Å; T472-E495 VanDerWaalsContact O-CG 3.31Å; T472-E495 WeakPolarHBondContact O-CG 3.33Å
473	V	82.4	Confident	72.4	Confident	17 Å²	17	77.9 Å²	77.9	10%	0.103	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	113.9	177.7	-174.8	0	0	0	0	109.2	V471 G475 Q476 V483 M487 M491	V471-V473 HydrophobicContact CG1-CG2 4.26Å; V473-G475 PolarHBondContact O-N 2.83Å; V473-Q476 PolarHBondContact N-O 3.27Å; V473-Q476 PolarHBondContact O-N 2.88Å; V473-Q476 VanDerWaalsContact O-N 3.11Å; V473-V483 HydrophobicContact CG2-CG1 4.48Å; V473-V483 HydrophobicContact CG2-CG2 4.18Å; V473-M487 HydrophobicContact CG1-CB 4.08Å; V473-M487 HydrophobicContact CG1-CE 4.4Å; V473-M487 HydrophobicContact CG1-CG 4.35Å; V473-M491 HydrophobicContact CB-CE 4.09Å; V473-M491 HydrophobicContact CG1-CE 3.81Å; V473-M491 HydrophobicContact CG1-CG 4Å; V473-M491 HydrophobicContact CG2-CE 3.22Å; V473-M491 HydrophobicContact CG2-SD 4.32Å
474	G	77.4	Confident	74.6	Confident	70 Å²	70	73.7 Å²	73.7	72%	0.722	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	29.6	-177.5	0	0	0	0	0	113.5	Q476 E495	G474-Q476 VanDerWaalsContact C-N 3.33Å; G474-E495 WeakPolarHBondContact CA-OE1 3.09Å; G474-E495 PolarHBondContact N-OE1 2.96Å
475	G	77.2	Confident	76.2	Confident	59 Å²	59	73.4 Å²	73.4	61%	0.608	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-2.7	-174.6	0	0	0	0	0	116	V473 E495	V473-G475 PolarHBondContact O-N 2.83Å; G475-E495 PolarHBondContact N-OE1 3.38Å; G475-E495 VanDerWaalsContact N-OE1 3.09Å
476	Q	79.4	Confident	77.8	Confident	129 Å²	129	71 Å²	71	60%	0.603	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	135	176.6	-168.9	69.8	-7.2	0	0	111.2	T472 V473 G474 M478	T472-Q476 CarbonylContact C-O 3.58Å; T472-Q476 WeakPolarHBondContact CA-O 3.49Å; V473-Q476 PolarHBondContact N-O 3.27Å; V473-Q476 PolarHBondContact O-N 2.88Å; V473-Q476 VanDerWaalsContact O-N 3.11Å; G474-Q476 VanDerWaalsContact C-N 3.33Å; Q476-M478 HydrophobicContact CG-CG 4.46Å; Q476-M478 HydrophobicContact CG-SD 4.33Å
477	L	80.3	Confident	79.1	Confident	110 Å²	110	69.6 Å²	69.6	58%	0.576	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	120.6	171.6	-80.4	125.3	0	0	0	110	E470	E470-L477 HydrophobicContact CB-CD2 4.03Å; E470-L477 WeakPolarHBondContact OE2-CD2 3.23Å
478	M	78.2	Confident	80.3	Confident	62 Å²	62	64.2 Å²	64.2	31%	0.305	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.8	178.6	-66.6	-66.4	-60.2	0	0	110	E470 V471 Q476 D482	E470-M478 CarbonylContact C-O 3.57Å; E470-M478 WeakPolarHBondContact CA-O 3.45Å; V471-M478 PolarHBondContact N-O 3.27Å; V471-M478 PolarHBondContact O-N 3.43Å; Q476-M478 HydrophobicContact CG-CG 4.46Å; Q476-M478 HydrophobicContact CG-SD 4.33Å; M478-D482 HydrophobicContact CE-CB 3.94Å
479	L	79.9	Confident	81.2	Confident	54 Å²	54	67 Å²	67	28%	0.283	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	145.1	174.6	-152.1	74.4	0	0	0	110.2	P466 E470 T481 D482	P466-L479 HydrophobicContact CB-CD1 4.35Å; P466-L479 WeakPolarHBondContact O-CD1 3.37Å; E470-L479 HydrophobicContact CG-CD1 4.36Å; L479-T481 PolarHBondContact O-N 2.85Å; L479-T481 VanDerWaalsContact O-N 3.16Å; L479-D482 WeakPolarHBondContact CB-OD2 3.33Å; L479-D482 PolarHBondContact O-N 3.26Å
480	Y	82.7	Confident	81.7	Confident	53 Å²	53	70.8 Å²	70.8	21%	0.208	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-55.7	-35.3	-178.5	-178.7	-87	0	0	0	112.6	F469 V471 D482 V483 Y499 V502 G503 M506	F469-Y480 WeakPolarHBondContact O-CB 3.43Å; F469-Y480 PolarHBondContact O-N 2.94Å; V471-Y480 HydrophobicContact CG2-CD2 3.89Å; Y480-D482 VanDerWaalsContact C-N 3.29Å; Y480-D482 PolarHBondContact O-N 3.38Å; Y480-V483 PolarHBondContact O-N 2.92Å; Y480-Y499 AromaticContact CD2-CD2 3.98Å; Y480-Y499 HydrophobicContact CD2-CD2 3.98Å; Y480-Y499 AromaticContact CD2-CE2 3.85Å; Y480-Y499 HydrophobicContact CD2-CE2 3.85Å; Y480-Y499 AromaticContact CE2-CD2 3.75Å; Y480-Y499 HydrophobicContact CE2-CD2 3.75Å; Y480-Y499 AromaticContact CE2-CE2 3.43Å; Y480-Y499 HydrophobicContact CE2-CE2 3.43Å; Y480-Y499 VanDerWaalsContact CE2-CE2 3.43Å; Y480-Y499 HydrophobicContact CE2-CG 4.44Å; Y480-Y499 AromaticContact CE2-CZ 3.88Å; Y480-V502 HydrophobicContact CD2-CB 4.19Å; Y480-V502 HydrophobicContact CD2-CG1 3.85Å; Y480-V502 HydrophobicContact CG-CG1 4.21Å; Y480-G503 WeakPolarHBondContact OH-CA 3.28Å; Y480-M506 HydrophobicContact CD1-CE 4.44Å; Y480-M506 HydrophobicContact CD1-SD 3.21Å; Y480-M506 WeakPolarHBondContact CD1-SD 3.49Å; Y480-M506 HydrophobicContact CE1-SD 3.47Å; Y480-M506 WeakPolarHBondContact CE1-SD 3.43Å; Y480-M506 HydrophobicContact CG-SD 4.21Å
481	T	81.9	Confident	81.7	Confident	92 Å²	92	67.8 Å²	67.8	56%	0.564	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-65.8	-29.3	177.6	-44.3	0	0	0	0	112.9	L479 V483	L479-T481 PolarHBondContact O-N 2.85Å; L479-T481 VanDerWaalsContact O-N 3.16Å; T481-V483 VanDerWaalsContact C-N 3.35Å
482	D	81.8	Confident	82	Confident	88 Å²	88	71.5 Å²	71.5	47%	0.471	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-88.7	-5.7	-175.2	-53.6	-23.4	0	0	0	112.5	M478 L479 Y480 T484	M478-D482 HydrophobicContact CE-CB 3.94Å; L479-D482 WeakPolarHBondContact CB-OD2 3.33Å; L479-D482 PolarHBondContact O-N 3.26Å; Y480-D482 VanDerWaalsContact C-N 3.29Å; Y480-D482 PolarHBondContact O-N 3.38Å; D482-T484 PolarHBondContact O-N 2.79Å; D482-T484 VanDerWaalsContact O-N 3.16Å
483	V	82.6	Confident	82.2	Confident	11 Å²	11	77.1 Å²	77.1	7%	0.067	45%	0.447	C	S	.	.			trans	-77.7	103.8	-179.1	-178.9	0	0	0	0	110.1	V471 V473 Y480 T481 M487 V488 M491 Y499	V471-V483 HydrophobicContact CB-CG2 4.4Å; V473-V483 HydrophobicContact CG2-CG1 4.48Å; V473-V483 HydrophobicContact CG2-CG2 4.18Å; Y480-V483 PolarHBondContact O-N 2.92Å; T481-V483 VanDerWaalsContact C-N 3.35Å; V483-M487 HydrophobicContact CG1-CB 4.42Å; V483-V488 HydrophobicContact CG1-CG2 3.63Å; V483-M491 HydrophobicContact CG1-CE 3.31Å; V483-Y499 HydrophobicContact CB-CD2 4.45Å; V483-Y499 HydrophobicContact CB-CE2 3.95Å; V483-Y499 HydrophobicContact CG1-CD2 4.05Å; V483-Y499 HydrophobicContact CG1-CE2 3.7Å; V483-Y499 HydrophobicContact CG2-CE2 4.43Å
484	T	83.1	Confident	82.4	Confident	66 Å²	66	83.9 Å²	83.9	41%	0.405	48%	0.478	S	S	.	.			trans	-71	152.9	176.3	67.7	0	0	0	0	112.7	D482 A486 M487 V488	D482-T484 PolarHBondContact O-N 2.79Å; D482-T484 VanDerWaalsContact O-N 3.16Å; T484-A486 PolarHBondContact O-N 3.18Å; T484-A486 VanDerWaalsContact O-N 3.12Å; T484-M487 HydrophobicContact CG2-SD 4.33Å; T484-M487 WeakPolarHBondContact O-CB 3.3Å; T484-M487 PolarHBondContact O-N 3.4Å; T484-M487 PolarHBondContact OG1-N 3.23Å; T484-M487 PolarHBondContact OG1-SD 3.46Å; T484-V488 PolarHBondContact O-N 3.17Å
485	P	82	Confident	82.9	Confident	116 Å²	116	81.7 Å²	81.7	75%	0.753	45%	0.448	S	S	*	.	H	α-helix	trans	-57.7	-27.2	175.9	-25.5	34.1	0	0	0	114.1	K489	P485-K489 PolarHBondContact O-N 3.37Å
486	A	83.2	Confident	83.3	Confident	72 Å²	72	84.6 Å²	84.6	60%	0.595	44%	0.441	S	S	*	.	H	α-helix	trans	-68	-42.4	175.5	0	0	0	0	0	111.8	T484 K489	T484-A486 PolarHBondContact O-N 3.18Å; T484-A486 VanDerWaalsContact O-N 3.12Å; A486-K489 WeakPolarHBondContact O-CB 3.25Å; A486-K489 PolarHBondContact O-N 2.9Å
487	M	83.2	Confident	83.7	Confident	52 Å²	52	83.5 Å²	83.5	26%	0.256	44%	0.436	S	S	.	.	H	α-helix	trans	-64.1	-39.1	175	-83.4	148.2	66.6	0	0	112.1	V473 V483 T484 K489 T490 M491	V473-M487 HydrophobicContact CG1-CB 4.08Å; V473-M487 HydrophobicContact CG1-CE 4.4Å; V473-M487 HydrophobicContact CG1-CG 4.35Å; V483-M487 HydrophobicContact CG1-CB 4.42Å; T484-M487 HydrophobicContact CG2-SD 4.33Å; T484-M487 WeakPolarHBondContact O-CB 3.3Å; T484-M487 PolarHBondContact O-N 3.4Å; T484-M487 PolarHBondContact OG1-N 3.23Å; T484-M487 PolarHBondContact OG1-SD 3.46Å; M487-K489 PolarHBondContact O-N 2.84Å; M487-T490 PolarHBondContact O-N 3.37Å; M487-T490 VanDerWaalsContact O-N 3.09Å; M487-T490 PolarHBondContact O-OG1 2.89Å; M487-M491 WeakPolarHBondContact O-CG 3.13Å; M487-M491 PolarHBondContact O-N 2.91Å
488	V	83.4	Confident	84	Confident	31 Å²	31	80.1 Å²	80.1	19%	0.188	42%	0.418	C	S	.	.	H	α-helix	trans	-57.8	-32.3	176.2	-178.8	0	0	0	0	112.1	V483 T484 M491 Y499	V483-V488 HydrophobicContact CG1-CG2 3.63Å; T484-V488 PolarHBondContact O-N 3.17Å; V488-M491 HydrophobicContact CB-CE 4.41Å; V488-M491 HydrophobicContact CG2-CE 4.02Å; V488-Y499 HydrophobicContact CG1-CD1 4.31Å; V488-Y499 HydrophobicContact CG1-CE1 4.13Å; V488-Y499 HydrophobicContact CG2-CD1 4.44Å; V488-Y499 HydrophobicContact CG2-CE1 3.91Å; V488-Y499 HydrophobicContact CG2-CE2 4.13Å
489	K	85	Confident	84.4	Confident	181 Å²	181	79.5 Å²	79.5	79%	0.787	41%	0.413	S	S	*	.	H	α-helix	trans	-71.6	-32.4	179	-167.2	176.5	179.8	-178.6	0	112.9	P485 A486 M487	P485-K489 PolarHBondContact O-N 3.37Å; A486-K489 WeakPolarHBondContact O-CB 3.25Å; A486-K489 PolarHBondContact O-N 2.9Å; M487-K489 PolarHBondContact O-N 2.84Å
490	T	85.7	Confident	84.8	Confident	112 Å²	112	80.3 Å²	80.3	69%	0.687	42%	0.42	S	S	*	.	H	α-helix	trans	-87.7	-8.4	-178.8	53.5	0	0	0	0	113.8	M487	M487-T490 PolarHBondContact O-N 3.37Å; M487-T490 VanDerWaalsContact O-N 3.09Å; M487-T490 PolarHBondContact O-OG1 2.89Å
491	M	82.4	Confident	85	Confident	8 Å²	8	83.8 Å²	83.8	4%	0.039	43%	0.433	C	S	.	.			trans	-63.7	144.3	-179.9	-73	177.3	-163.9	0	0	113.2	V473 V483 M487 V488 E495 R496 Y499	V473-M491 HydrophobicContact CB-CE 4.09Å; V473-M491 HydrophobicContact CG1-CE 3.81Å; V473-M491 HydrophobicContact CG1-CG 4Å; V473-M491 HydrophobicContact CG2-CE 3.22Å; V473-M491 HydrophobicContact CG2-SD 4.32Å; V483-M491 HydrophobicContact CG1-CE 3.31Å; M487-M491 WeakPolarHBondContact O-CG 3.13Å; M487-M491 PolarHBondContact O-N 2.91Å; V488-M491 HydrophobicContact CB-CE 4.41Å; V488-M491 HydrophobicContact CG2-CE 4.02Å; M491-E495 HydrophobicContact CB-CB 4.05Å; M491-E495 HydrophobicContact CG-CB 4.25Å; M491-R496 PolarHBondContact O-NH2 3.45Å; M491-Y499 HydrophobicContact CE-CD2 4.4Å; M491-Y499 HydrophobicContact SD-CG 4.42Å
492	T	89.2	Confident	85.3	Confident	77 Å²	77	80 Å²	80	47%	0.472	41%	0.41	S	S	.	.			trans	-64.8	164.9	167.1	63.4	0	0	0	0	111.1	E494 E495 R496	T492-E494 VanDerWaalsContact C-N 3.3Å; T492-E494 PolarHBondContact O-N 3.42Å; T492-E495 PolarHBondContact N-OE2 2.94Å; T492-E495 PolarHBondContact O-N 3.44Å; T492-E495 WeakPolarHBondContact OG1-CB 3.49Å; T492-E495 WeakPolarHBondContact OG1-CG 3.38Å; T492-E495 PolarHBondContact OG1-N 3.17Å; T492-E495 PolarHBondContact OG1-OE2 3.2Å; T492-R496 WeakPolarHBondContact O-CB 3.06Å; T492-R496 PolarHBondContact O-N 2.82Å
493	K	85.6	Confident	85.5	Confident	160 Å²	160	76.3 Å²	76.3	70%	0.696	39%	0.392	S	S	*	.	H	α-helix	trans	-59.8	-40.5	-179.4	-172.1	-175.4	172.6	-167.3	0	112	R496 E497	K493-R496 PolarHBondContact O-N 2.73Å; K493-E497 WeakPolarHBondContact CE-OE1 3.36Å; K493-E497 WeakPolarHBondContact O-CG 3.18Å; K493-E497 PolarHBondContact O-N 2.94Å
494	E	85.6	Confident	85.6	Confident	159 Å²	159	82.5 Å²	82.5	74%	0.743	42%	0.418	S	S	*	.	H	α-helix	trans	-69.1	-43.8	-179.5	-63.4	179.4	-175.8	0	0	112.2	T492 R496 E497 N498	T492-E494 VanDerWaalsContact C-N 3.3Å; T492-E494 PolarHBondContact O-N 3.42Å; E494-R496 VanDerWaalsContact C-N 3.31Å; E494-R496 PolarHBondContact O-N 2.81Å; E494-E497 PolarHBondContact O-N 3.35Å; E494-N498 PolarHBondContact O-N 2.84Å
495	E	87.8	Confident	85.7	Confident	23 Å²	23	81 Å²	81	11%	0.107	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-40.5	174.8	-71.4	171.2	150.5	0	0	111.4	T472 G474 G475 M491 T492 E497 N498 Y499	T472-E495 WeakPolarHBondContact O-CB 3.28Å; T472-E495 VanDerWaalsContact O-CG 3.31Å; T472-E495 WeakPolarHBondContact O-CG 3.33Å; G474-E495 WeakPolarHBondContact CA-OE1 3.09Å; G474-E495 PolarHBondContact N-OE1 2.96Å; G475-E495 PolarHBondContact N-OE1 3.38Å; G475-E495 VanDerWaalsContact N-OE1 3.09Å; M491-E495 HydrophobicContact CB-CB 4.05Å; M491-E495 HydrophobicContact CG-CB 4.25Å; T492-E495 PolarHBondContact N-OE2 2.94Å; T492-E495 PolarHBondContact O-N 3.44Å; T492-E495 WeakPolarHBondContact OG1-CB 3.49Å; T492-E495 WeakPolarHBondContact OG1-CG 3.38Å; T492-E495 PolarHBondContact OG1-N 3.17Å; T492-E495 PolarHBondContact OG1-OE2 3.2Å; E495-E497 PolarHBondContact O-N 3.18Å; E495-N498 WeakPolarHBondContact O-CB 3.39Å; E495-N498 PolarHBondContact O-N 2.86Å; E495-Y499 PolarHBondContact O-N 3.03Å
496	R	86.3	Confident	85.8	Confident	120 Å²	120	77.6 Å²	77.6	45%	0.453	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-39.8	176.1	-169.2	-178.5	-61.1	161.2	5.9	112.2	M491 T492 K493 E494 N498 Y499 V500	M491-R496 PolarHBondContact O-NH2 3.45Å; T492-R496 WeakPolarHBondContact O-CB 3.06Å; T492-R496 PolarHBondContact O-N 2.82Å; K493-R496 PolarHBondContact O-N 2.73Å; E494-R496 VanDerWaalsContact C-N 3.31Å; E494-R496 PolarHBondContact O-N 2.81Å; R496-N498 VanDerWaalsContact C-N 3.31Å; R496-Y499 PolarHBondContact O-N 3.09Å; R496-V500 WeakPolarHBondContact O-CG2 3.5Å; R496-V500 PolarHBondContact O-N 3.33Å
497	E	87.1	Confident	85.7	Confident	107 Å²	107	80.7 Å²	80.7	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-37.2	173.9	-73.8	175.1	-165.9	0	0	111.5	K493 E494 E495 R501	K493-E497 WeakPolarHBondContact CE-OE1 3.36Å; K493-E497 WeakPolarHBondContact O-CG 3.18Å; K493-E497 PolarHBondContact O-N 2.94Å; E494-E497 PolarHBondContact O-N 3.35Å; E495-E497 PolarHBondContact O-N 3.18Å; E497-R501 WeakPolarHBondContact O-CB 3.48Å; E497-R501 PolarHBondContact O-N 3.04Å; E497-R501 VanDerWaalsContact O-N 3.09Å
498	N	86.5	Confident	85.7	Confident	38 Å²	38	79.7 Å²	79.7	20%	0.203	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-47.8	173.1	-165	15.6	0	0	0	112.1	E494 E495 R496 V500 R501 V502	E494-N498 PolarHBondContact O-N 2.84Å; E495-N498 WeakPolarHBondContact O-CB 3.39Å; E495-N498 PolarHBondContact O-N 2.86Å; R496-N498 VanDerWaalsContact C-N 3.31Å; N498-V500 VanDerWaalsContact C-N 3.35Å; N498-V500 PolarHBondContact O-N 3.02Å; N498-R501 WeakPolarHBondContact O-CB 3.49Å; N498-R501 PolarHBondContact O-N 2.79Å; N498-R501 VanDerWaalsContact O-N 3.09Å; N498-R501 PolarHBondContact OD1-NH1 3.36Å; N498-V502 WeakPolarHBondContact O-CG2 3.47Å; N498-V502 PolarHBondContact O-N 2.96Å
499	Y	88.2	Confident	85.4	Confident	50 Å²	50	80 Å²	80	20%	0.196	38%	0.379	C	S	.	.	H	α-helix	trans	-54.4	-47.6	175.3	176.9	-104.1	0	0	0	112	V471 Y480 V483 V488 M491 E495 R496 R501 V502 G503	V471-Y499 HydrophobicContact CG1-CD2 4.11Å; V471-Y499 HydrophobicContact CG1-CG 4.48Å; V471-Y499 HydrophobicContact CG2-CD2 4.25Å; Y480-Y499 AromaticContact CD2-CD2 3.98Å; Y480-Y499 HydrophobicContact CD2-CD2 3.98Å; Y480-Y499 AromaticContact CD2-CE2 3.85Å; Y480-Y499 HydrophobicContact CD2-CE2 3.85Å; Y480-Y499 AromaticContact CE2-CD2 3.75Å; Y480-Y499 HydrophobicContact CE2-CD2 3.75Å; Y480-Y499 AromaticContact CE2-CE2 3.43Å; Y480-Y499 HydrophobicContact CE2-CE2 3.43Å; Y480-Y499 VanDerWaalsContact CE2-CE2 3.43Å; Y480-Y499 HydrophobicContact CE2-CG 4.44Å; Y480-Y499 AromaticContact CE2-CZ 3.88Å; V483-Y499 HydrophobicContact CB-CD2 4.45Å; V483-Y499 HydrophobicContact CB-CE2 3.95Å; V483-Y499 HydrophobicContact CG1-CD2 4.05Å; V483-Y499 HydrophobicContact CG1-CE2 3.7Å; V483-Y499 HydrophobicContact CG2-CE2 4.43Å; V488-Y499 HydrophobicContact CG1-CD1 4.31Å; V488-Y499 HydrophobicContact CG1-CE1 4.13Å; V488-Y499 HydrophobicContact CG2-CD1 4.44Å; V488-Y499 HydrophobicContact CG2-CE1 3.91Å; V488-Y499 HydrophobicContact CG2-CE2 4.13Å; M491-Y499 HydrophobicContact CE-CD2 4.4Å; M491-Y499 HydrophobicContact SD-CG 4.42Å; E495-Y499 PolarHBondContact O-N 3.03Å; R496-Y499 PolarHBondContact O-N 3.09Å; Y499-R501 VanDerWaalsContact C-N 3.33Å; Y499-R501 PolarHBondContact O-N 3.36Å; Y499-V502 PolarHBondContact O-N 2.87Å; Y499-G503 PolarHBondContact O-N 3.04Å
500	V	87.7	Confident	84.7	Confident	70 Å²	70	76.3 Å²	76.3	42%	0.424	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-37.2	177.7	172.8	0	0	0	0	111.8	R496 N498 K504	R496-V500 WeakPolarHBondContact O-CG2 3.5Å; R496-V500 PolarHBondContact O-N 3.33Å; N498-V500 VanDerWaalsContact C-N 3.35Å; N498-V500 PolarHBondContact O-N 3.02Å; V500-K504 HydrophobicContact CG1-CD 4.47Å; V500-K504 WeakPolarHBondContact O-CG 3.41Å; V500-K504 PolarHBondContact O-N 3.04Å
501	R	87.1	Confident	83.5	Confident	127 Å²	127	76.5 Å²	76.5	48%	0.479	36%	0.362	S	S	.	.	H	α-helix	trans	-66.4	-46.9	178.4	-164	-172.5	-40.3	101.2	7.5	111.7	E497 N498 Y499 K504 L505	E497-R501 WeakPolarHBondContact O-CB 3.48Å; E497-R501 PolarHBondContact O-N 3.04Å; E497-R501 VanDerWaalsContact O-N 3.09Å; N498-R501 WeakPolarHBondContact O-CB 3.49Å; N498-R501 PolarHBondContact O-N 2.79Å; N498-R501 VanDerWaalsContact O-N 3.09Å; N498-R501 PolarHBondContact OD1-NH1 3.36Å; Y499-R501 VanDerWaalsContact C-N 3.33Å; Y499-R501 PolarHBondContact O-N 3.36Å; R501-K504 PolarHBondContact O-N 2.8Å; R501-L505 PolarHBondContact O-N 3.09Å; R501-L505 VanDerWaalsContact O-N 3.07Å
502	V	86.8	Confident	82	Confident	13 Å²	13	80 Å²	80	8%	0.079	38%	0.381	C	S	.	.	H	α-helix	trans	-66.9	-38.7	177.4	178	0	0	0	0	110.7	F469 V471 Y480 N498 Y499 K504 L505 M506	F469-V502 HydrophobicContact CB-CG1 4.31Å; F469-V502 HydrophobicContact CD1-CG1 4.32Å; V471-V502 HydrophobicContact CG2-CB 3.86Å; V471-V502 HydrophobicContact CG2-CG1 3.96Å; V471-V502 HydrophobicContact CG2-CG2 4.05Å; Y480-V502 HydrophobicContact CD2-CB 4.19Å; Y480-V502 HydrophobicContact CD2-CG1 3.85Å; Y480-V502 HydrophobicContact CG-CG1 4.21Å; N498-V502 WeakPolarHBondContact O-CG2 3.47Å; N498-V502 PolarHBondContact O-N 2.96Å; Y499-V502 PolarHBondContact O-N 2.87Å; V502-K504 PolarHBondContact O-N 3.23Å; V502-L505 CarbonylContact O-C 3.58Å; V502-L505 WeakPolarHBondContact O-CA 3.2Å; V502-L505 WeakPolarHBondContact O-CB 3.28Å; V502-L505 PolarHBondContact O-N 3.14Å; V502-L505 VanDerWaalsContact O-N 3.09Å; V502-M506 PolarHBondContact O-N 3.27Å
503	G	86.6	Confident	79.8	Confident	9 Å²	9	84.9 Å²	84.9	9%	0.093	40%	0.398	C	S	.	.	H	α-helix	trans	-62.8	-40.3	175.5	0	0	0	0	0	113.3	Y480 Y499 L505 M506 F507	Y480-G503 WeakPolarHBondContact OH-CA 3.28Å; Y499-G503 PolarHBondContact O-N 3.04Å; G503-L505 VanDerWaalsContact C-N 3.32Å; G503-L505 PolarHBondContact O-N 3.42Å; G503-M506 PolarHBondContact O-N 3.12Å; G503-F507 WeakPolarHBondContact O-CB 3.48Å; G503-F507 PolarHBondContact O-N 3.2Å
504	K	86.1	Confident	79.5	Confident	142 Å²	142	81.2 Å²	81.2	62%	0.617	38%	0.383	S	S	*	.	H	α-helix	trans	-62.2	-40.8	170.7	-74.8	177.5	-179.5	-177.3	0	111.8	V500 R501 V502 T508	V500-K504 HydrophobicContact CG1-CD 4.47Å; V500-K504 WeakPolarHBondContact O-CG 3.41Å; V500-K504 PolarHBondContact O-N 3.04Å; R501-K504 PolarHBondContact O-N 2.8Å; V502-K504 PolarHBondContact O-N 3.23Å; K504-T508 WeakPolarHBondContact O-CB 3.31Å; K504-T508 PolarHBondContact O-N 2.92Å; K504-T508 PolarHBondContact O-OG1 3.47Å
505	L	84.5	Confident	79.1	Confident	34 Å²	34	77.1 Å²	77.1	18%	0.178	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-44.4	177.2	-173.5	67	0	0	0	111.6	K468 F469 R501 V502 G503 T508 N509	K468-L505 HydrophobicContact CG-CD2 4.13Å; F469-L505 HydrophobicContact CE1-CD2 4.49Å; F469-L505 HydrophobicContact CE1-CG 4.32Å; R501-L505 PolarHBondContact O-N 3.09Å; R501-L505 VanDerWaalsContact O-N 3.07Å; V502-L505 CarbonylContact O-C 3.58Å; V502-L505 WeakPolarHBondContact O-CA 3.2Å; V502-L505 WeakPolarHBondContact O-CB 3.28Å; V502-L505 PolarHBondContact O-N 3.14Å; V502-L505 VanDerWaalsContact O-N 3.09Å; G503-L505 VanDerWaalsContact C-N 3.32Å; G503-L505 PolarHBondContact O-N 3.42Å; L505-T508 PolarHBondContact O-N 2.78Å; L505-N509 PolarHBondContact O-N 3.08Å; L505-N509 PolarHBondContact O-ND2 2.96Å
506	M	83.2	Confident	78.7	Confident	44 Å²	44	80.1 Å²	80.1	22%	0.217	38%	0.379	C	S	.	.	H	α-helix	trans	-63.4	-50.8	176.2	-170	-169.1	-169.8	0	0	110.9	F469 Y480 V502 G503 T508 N509 L510	F469-M506 HydrophobicContact CD1-CB 4.01Å; F469-M506 HydrophobicContact CD1-CG 4.37Å; F469-M506 HydrophobicContact CE1-CB 4Å; F469-M506 HydrophobicContact CE1-CG 4.35Å; Y480-M506 HydrophobicContact CD1-CE 4.44Å; Y480-M506 HydrophobicContact CD1-SD 3.21Å; Y480-M506 WeakPolarHBondContact CD1-SD 3.49Å; Y480-M506 HydrophobicContact CE1-SD 3.47Å; Y480-M506 WeakPolarHBondContact CE1-SD 3.43Å; Y480-M506 HydrophobicContact CG-SD 4.21Å; V502-M506 PolarHBondContact O-N 3.27Å; G503-M506 PolarHBondContact O-N 3.12Å; M506-T508 PolarHBondContact O-N 3.23Å; M506-N509 CarbonylContact O-C 3.53Å; M506-N509 PolarHBondContact O-N 3.4Å; M506-L510 HydrophobicContact CE-CD1 3.62Å; M506-L510 HydrophobicContact CG-CD1 4.15Å; M506-L510 WeakPolarHBondContact O-CB 3.17Å; M506-L510 PolarHBondContact O-N 3.34Å
507	F	81.3	Confident	78.2	Confident	137 Å²	137	77.7 Å²	77.7	60%	0.601	37%	0.374	S	S	*	.	H	α-helix	trans	-58.3	-38.5	178.4	-173.3	-94.3	0	0	0	112.3	G503 M511	G503-F507 WeakPolarHBondContact O-CB 3.48Å; G503-F507 PolarHBondContact O-N 3.2Å; F507-M511 HydrophobicContact CD1-CG 4.47Å; F507-M511 HydrophobicContact CE1-CE 4.18Å; F507-M511 HydrophobicContact CE1-CG 4.17Å; F507-M511 HydrophobicContact CE2-CE 4.04Å; F507-M511 HydrophobicContact CE2-CG 4.43Å; F507-M511 HydrophobicContact CZ-CE 3.5Å; F507-M511 VanDerWaalsContact CZ-CE 3.5Å; F507-M511 HydrophobicContact CZ-CG 4.16Å; F507-M511 WeakPolarHBondContact O-CB 3.25Å; F507-M511 WeakPolarHBondContact O-CG 3.49Å; F507-M511 PolarHBondContact O-N 3.34Å
508	T	82.7	Confident	77.7	Confident	32 Å²	32	75.9 Å²	75.9	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-66.7	-41.8	176.3	-51.4	0	0	0	0	111.2	R298 K504 L505 M506 L512	R298-T508 HydrophobicContact CB-CG2 4.31Å; R298-T508 HydrophobicContact CG-CG2 3.93Å; K504-T508 WeakPolarHBondContact O-CB 3.31Å; K504-T508 PolarHBondContact O-N 2.92Å; K504-T508 PolarHBondContact O-OG1 3.47Å; L505-T508 PolarHBondContact O-N 2.78Å; M506-T508 PolarHBondContact O-N 3.23Å; T508-L512 HydrophobicContact CG2-CD1 4.21Å; T508-L512 WeakPolarHBondContact O-CD1 3.15Å; T508-L512 WeakPolarHBondContact O-CG 3.35Å
509	N	77.5	Confident	77.1	Confident	36 Å²	36	78.4 Å²	78.4	19%	0.193	38%	0.377	C	S	.	.	H	α-helix	trans	-77.6	-32.4	-179.1	-61.3	-36.1	0	0	0	113.4	R298 F469 L505 M506 L512 E513	R298-N509 PolarHBondContact NH2-OD1 3.42Å; F469-N509 HydrophobicContact CZ-CB 4.44Å; F469-N509 WeakPolarHBondContact CZ-ND2 3.46Å; L505-N509 PolarHBondContact O-N 3.08Å; L505-N509 PolarHBondContact O-ND2 2.96Å; M506-N509 CarbonylContact O-C 3.53Å; M506-N509 PolarHBondContact O-N 3.4Å; N509-L512 WeakPolarHBondContact O-CA 3.49Å; N509-L512 VanDerWaalsContact O-CB 3.29Å; N509-L512 WeakPolarHBondContact O-CB 3.46Å; N509-L512 PolarHBondContact O-N 3.21Å; N509-L512 VanDerWaalsContact O-N 3.09Å; N509-E513 PolarHBondContact O-N 2.96Å
510	L	70.7	Confident	76.3	Confident	105 Å²	105	80.4 Å²	80.4	55%	0.55	39%	0.39	S	S	.	.	H	α-helix	trans	-80.9	-20.4	-177.6	-142.1	142.4	0	0	0	112.3	M506 L512	M506-L510 HydrophobicContact CE-CD1 3.62Å; M506-L510 HydrophobicContact CG-CD1 4.15Å; M506-L510 WeakPolarHBondContact O-CB 3.17Å; M506-L510 PolarHBondContact O-N 3.34Å; L510-L512 VanDerWaalsContact C-N 3.28Å
511	M	60.6	Low	75.4	Confident	115 Å²	115	81.2 Å²	81.2	57%	0.567	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.2	164.5	-72.2	-77.5	-140.4	0	0	112.7	F507	F507-M511 HydrophobicContact CD1-CG 4.47Å; F507-M511 HydrophobicContact CE1-CE 4.18Å; F507-M511 HydrophobicContact CE1-CG 4.17Å; F507-M511 HydrophobicContact CE2-CE 4.04Å; F507-M511 HydrophobicContact CE2-CG 4.43Å; F507-M511 HydrophobicContact CZ-CE 3.5Å; F507-M511 VanDerWaalsContact CZ-CE 3.5Å; F507-M511 HydrophobicContact CZ-CG 4.16Å; F507-M511 WeakPolarHBondContact O-CB 3.25Å; F507-M511 WeakPolarHBondContact O-CG 3.49Å; F507-M511 PolarHBondContact O-N 3.34Å
512	L	50.9	Low	74.4	Confident	82 Å²	82	77.4 Å²	77.4	43%	0.429	38%	0.38	S	S	.	.			trans	-102.4	-9.6	177.5	-86.5	163.6	0	0	0	112.6	T508 N509 L510	T508-L512 HydrophobicContact CG2-CD1 4.21Å; T508-L512 WeakPolarHBondContact O-CD1 3.15Å; T508-L512 WeakPolarHBondContact O-CG 3.35Å; N509-L512 WeakPolarHBondContact O-CA 3.49Å; N509-L512 VanDerWaalsContact O-CB 3.29Å; N509-L512 WeakPolarHBondContact O-CB 3.46Å; N509-L512 PolarHBondContact O-N 3.21Å; N509-L512 VanDerWaalsContact O-N 3.09Å; L510-L512 VanDerWaalsContact C-N 3.28Å
513	E	42.2	Very low	73.3	Confident	180 Å²	180	83.3 Å²	83.3	84%	0.841	41%	0.407	S	S	*	.			trans	-102.6	0	170.5	-71.3	-177.6	165.6	0	0	110.1	L464 N509	L464-E513 WeakPolarHBondContact CD1-OE1 3.26Å; N509-E513 PolarHBondContact O-N 2.96Å

Retrieved 513 of 513 residues in 83 ms (Link to these results)

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