A0A096MMB9_PAPAN Loading...

Dihydrolipoamide acetyltransferase component of pyruvate dehydrogenase complex

AlphaFold DB , UniProt , Accession A0A096MMB9, Species PAPAN (Papio anubis, Olive baboon), Gene PDHX, Length 501 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	37.7	Very low	32.7	Very low	239 Å²	239	145.5 Å²	145.5	100%	1.177	82%	0.822	S	S	*	*				0	103.7	0	-54.9	168.6	-169.2	0	0	104.8
2	A	33.6	Very low	32.5	Very low	105 Å²	105	152.9 Å²	152.9	87%	0.868	83%	0.828	S	S	*	*				64.6	127.7	62.5	0	0	0	0	0	111.3
3	A	32.1	Very low	32.4	Very low	88 Å²	88	154.1 Å²	154.1	73%	0.727	83%	0.832	S	S	*	*			cis	-148	141.7	-0.1	0	0	0	0	0	108.5
4	S	32.6	Very low	32.3	Very low	101 Å²	101	154.9 Å²	154.9	71%	0.706	83%	0.834	S	S	*	*				53.6	107.1	76.7	173.8	0	0	0	0	115.6
5	W	28.6	Very low	32	Very low	239 Å²	239	158.3 Å²	158.3	91%	0.905	83%	0.83	S	S	*	*			trans	-134.1	139.9	146.7	-91	76.7	0	0	0	109.4
6	R	32.5	Very low	31.9	Very low	232 Å²	232	160.5 Å²	160.5	88%	0.875	83%	0.826	S	S	*	*			trans	-131.9	145.9	173.4	-74.7	-175.6	178.8	-126.2	7.1	108.8
7	L	32.8	Very low	31.6	Very low	162 Å²	162	159.8 Å²	159.8	85%	0.848	82%	0.823	S	S	*	*			trans	-175.7	130.8	155	-96	144.7	0	0	0	106.6
8	G	28.3	Very low	31.5	Very low	65 Å²	65	158.4 Å²	158.4	67%	0.67	82%	0.823	S	S	*	*			cis	117.9	80	-14.5	0	0	0	0	0	115.1
9	C	27.8	Very low	31.2	Very low	139 Å²	139	153.8 Å²	153.8	94%	0.939	82%	0.818	S	S	*	*			trans	-174.6	154.5	142	-110.3	0	0	0	0	113.7
10	D	29.9	Very low	31	Very low	145 Å²	145	156 Å²	156	78%	0.775	82%	0.82	S	S	*	*			trans	-161.5	171.4	176.1	-169.4	40.8	0	0	0	104.5
11	P	43.4	Very low	31.4	Very low	85 Å²	85	154.8 Å²	154.8	55%	0.552	82%	0.822	S	S	*	*			cis	-128.1	179.4	-13.8	10.6	16.6	0	0	0	115.5
12	R	31	Very low	30.9	Very low	235 Å²	235	147 Å²	147	89%	0.887	80%	0.802	S	S	*	*			trans	50.3	111.3	146.3	-67.2	164.7	-175.2	-172.7	1.8	120.5
13	L	30.4	Very low	30.6	Very low	168 Å²	168	147.8 Å²	147.8	88%	0.88	80%	0.8	S	S	*	*			trans	-173.9	117.3	134.9	-112.4	166.3	0	0	0	113.6
14	L	31.1	Very low	30.4	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	81%	0.81	S	S	*	*			trans	173.6	165.1	131.6	-116.2	64.6	0	0	0	112.6
15	R	28.4	Very low	30.1	Very low	206 Å²	206	155.6 Å²	155.6	78%	0.777	81%	0.811	S	S	*	*			trans	-147.1	167.9	177.1	-101.5	-169.4	177.7	-172	1.4	109.8
16	Y	29.4	Very low	30.2	Very low	194 Å²	194	152.7 Å²	152.7	76%	0.761	81%	0.812	S	S	*	*			trans	71.8	150	171.3	-65.5	-63.9	0	0	0	115.3
17	L	27.5	Very low	30	Very low	148 Å²	148	145 Å²	145	78%	0.775	81%	0.805	S	S	*	*			cis	-147.6	171.7	3.7	-115.3	158.1	0	0	0	106.1
18	V	30.7	Very low	29.8	Very low	136 Å²	136	144.7 Å²	144.7	82%	0.824	80%	0.803	S	S	*	*			cis	-144.6	170.1	14.2	-164.1	0	0	0	0	108.1
19	G	24.8	Very low	29.8	Very low	70 Å²	70	148.2 Å²	148.2	72%	0.722	81%	0.811	S	S	*	*			trans	155.1	68	152.7	0	0	0	0	0	120.2
20	F	28.2	Very low	29.9	Very low	198 Å²	198	150.8 Å²	150.8	87%	0.868	81%	0.807	S	S	*	*			trans	-135.6	150.9	161.3	-108.2	-78.4	0	0	0	106.9
21	P	39.5	Very low	29.7	Very low	131 Å²	131	147.8 Å²	147.8	85%	0.851	81%	0.809	S	S	*	*				-148.1	171.1	71.7	39.8	-21.1	0	0	0	116.4
22	G	25.4	Very low	29	Very low	75 Å²	75	147.9 Å²	147.9	77%	0.773	82%	0.818	S	S	*	*			trans	180	79.5	172	0	0	0	0	0	112.7
23	C	27.9	Very low	28.9	Very low	122 Å²	122	145.2 Å²	145.2	82%	0.824	82%	0.82	S	S	*	*			trans	-112.8	139.4	-174	-176	0	0	0	0	112.3
24	R	27.4	Very low	28.7	Very low	248 Å²	248	140.4 Å²	140.4	94%	0.936	81%	0.811	S	S	*	*			trans	-153.7	146.7	154.2	-107.3	171.3	-162	-140	1.5	110.8
25	S	27.8	Very low	28.4	Very low	104 Å²	104	145 Å²	145	73%	0.727	82%	0.817	S	S	*	*			trans	-129.7	-172.1	176.6	61.7	0	0	0	0	109.7
26	I	30.7	Very low	28.3	Very low	178 Å²	178	139.9 Å²	139.9	91%	0.913	81%	0.813	S	S	*	*			trans	111.6	131	-172.6	-65.9	157.3	0	0	0	109.8
27	G	26.7	Very low	28.4	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	81%	0.814	S	S	*	*			cis	-175.8	158.3	-4.9	0	0	0	0	0	111.1
28	L	28.5	Very low	28.4	Very low	155 Å²	155	135.6 Å²	135.6	81%	0.812	82%	0.818	S	S	*	*			trans	-115.1	129.3	-173.6	-173.5	150.5	0	0	0	111
29	V	29	Very low	28.5	Very low	139 Å²	139	141.2 Å²	141.2	84%	0.842	82%	0.824	S	S	*	*			trans	-131.8	129.8	175.8	178.5	0	0	0	0	109.8
30	K	29.4	Very low	28.8	Very low	194 Å²	194	141.6 Å²	141.6	84%	0.843	83%	0.828	S	S	*	*			trans	-97.6	144.3	165.7	-76	-179.5	173.4	179.1	0	109.4
31	G	26.7	Very low	29.3	Very low	81 Å²	81	137 Å²	137	84%	0.835	83%	0.827	S	S	*	*			trans	-133.5	140.8	166.1	0	0	0	0	0	110.2
32	A	28.8	Very low	28.9	Very low	88 Å²	88	137.9 Å²	137.9	73%	0.727	82%	0.824	S	S	*	*			trans	-151.2	174.3	179.1	0	0	0	0	0	110
33	L	28.9	Very low	29.2	Very low	178 Å²	178	146 Å²	146	93%	0.932	83%	0.832	S	S	*	*			trans	68.6	135.9	-163	-59.2	78.2	0	0	0	112.6
34	G	25.6	Very low	29.6	Very low	67 Å²	67	150.2 Å²	150.2	69%	0.691	83%	0.831	S	S	*	*			cis	121.9	105.3	-20.4	0	0	0	0	0	115.9
35	W	25.3	Very low	29.7	Very low	261 Å²	261	148.6 Å²	148.6	99%	0.989	83%	0.825	S	S	*	*			trans	-155.5	119	158.4	-102	-14.8	0	0	0	115.1
36	S	26.9	Very low	30	Very low	100 Å²	100	152.9 Å²	152.9	70%	0.699	83%	0.831	S	S	*	*				42.3	107.3	128	-173.5	0	0	0	0	122.8
37	V	30.9	Very low	30.1	Very low	127 Å²	127	152.5 Å²	152.5	77%	0.77	82%	0.824	S	S	*	*				59.1	116.8	129	-174.9	0	0	0	0	120.6
38	S	28.1	Very low	30.5	Very low	124 Å²	124	153.8 Å²	153.8	87%	0.867	82%	0.822	S	S	*	*				-154.2	160.6	126.5	-89.2	0	0	0	0	111.9
39	R	32.7	Very low	30.8	Very low	254 Å²	254	152 Å²	152	96%	0.958	82%	0.818	S	S	*	*			trans	-89.6	140	-169.1	-54.6	179.2	-169.4	-164.7	2.2	111.7
40	G	30.1	Very low	31	Very low	78 Å²	78	154 Å²	154	80%	0.804	82%	0.818	S	S	*	*			trans	-165.4	94	171.2	0	0	0	0	0	111	N42	G40-N42 PolarHBondContact O-N 3.21Å
41	A	38.6	Very low	31	Very low	101 Å²	101	155.2 Å²	155.2	84%	0.835	82%	0.817	S	S	*	*			trans	-81.8	117.6	-179.9	0	0	0	0	0	110.8
42	N	31.4	Very low	31.2	Very low	150 Å²	150	158.1 Å²	158.1	80%	0.802	81%	0.813	S	S	*	*			trans	-162.7	102.1	156.4	-108.5	-32.6	0	0	0	109.9	G40 R44	G40-N42 PolarHBondContact O-N 3.21Å; N42-R44 VanDerWaalsContact C-N 3.34Å; N42-R44 PolarHBondContact O-N 3.27Å
43	W	32.6	Very low	32	Very low	246 Å²	246	163.7 Å²	163.7	93%	0.932	82%	0.815	S	S	*	*			trans	-70.9	90.1	170.5	-102.5	-30.5	0	0	0	109.6
44	R	35.3	Very low	33.1	Very low	211 Å²	211	156.6 Å²	156.6	80%	0.796	79%	0.786	S	S	*	*			trans	-88.8	113.1	159.7	-58.5	-168.3	80	-179.9	4.2	107.3	N42 F46	N42-R44 VanDerWaalsContact C-N 3.34Å; N42-R44 PolarHBondContact O-N 3.27Å; R44-F46 PolarHBondContact O-N 3.2Å
45	W	30.6	Very low	35.1	Very low	214 Å²	214	160.8 Å²	160.8	81%	0.811	79%	0.792	S	S	*	*			trans	-65.8	99	173.8	-74.8	70.1	0	0	0	108.7	H47	W45-H47 PolarHBondContact O-N 3.49Å; W45-H47 VanDerWaalsContact O-N 3.09Å
46	F	33.2	Very low	37.5	Very low	194 Å²	194	150 Å²	150	85%	0.851	76%	0.756	S	S	*	*			trans	-68.3	102.4	159	-78.1	-86	0	0	0	106.7	R44 S48	R44-F46 PolarHBondContact O-N 3.2Å; F46-S48 PolarHBondContact O-N 2.88Å
47	H	33.9	Very low	40.2	Very low	169 Å²	169	147.5 Å²	147.5	78%	0.782	73%	0.734	S	S	*	*			trans	-59.2	108.2	166.3	-74.6	-94.9	0	0	0	107.4	W45 T49	W45-H47 PolarHBondContact O-N 3.49Å; W45-H47 VanDerWaalsContact O-N 3.09Å; H47-T49 PolarHBondContact O-N 3.12Å
48	S	34	Very low	42.8	Very low	98 Å²	98	147.2 Å²	147.2	69%	0.685	72%	0.723	S	S	*	*			trans	-57.2	128.2	173	52.2	0	0	0	0	108.7	F46 Q50	F46-S48 PolarHBondContact O-N 2.88Å; S48-Q50 PolarHBondContact O-N 2.64Å
49	T	35.3	Very low	45.6	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	69%	0.685	S	S	*	*			trans	-0.8	108.6	165.1	46.3	0	0	0	0	114.4	H47 W51	H47-T49 PolarHBondContact O-N 3.12Å; T49-W51 PolarHBondContact O-N 3.38Å
50	Q	31.9	Very low	48.3	Very low	179 Å²	179	134 Å²	134	84%	0.836	66%	0.66	S	S	*	*			trans	-46.1	110.3	168.1	177.2	175.3	-6.1	0	0	109.2	S48 L52	S48-Q50 PolarHBondContact O-N 2.64Å; Q50-L52 PolarHBondContact O-N 3.22Å
51	W	30.7	Very low	51.1	Low	220 Å²	220	130.4 Å²	130.4	83%	0.833	62%	0.623	S	S	*	*			trans	-65.3	103.2	170.2	-77.1	63.7	0	0	0	106.9	T49 R53	T49-W51 PolarHBondContact O-N 3.38Å; W51-R53 PolarHBondContact O-N 3Å
52	L	31.4	Very low	53.3	Low	143 Å²	143	127.6 Å²	127.6	75%	0.749	60%	0.596	S	S	*	*			trans	-58.9	114.5	150.2	-71.3	164.2	0	0	0	105.1	Q50	Q50-L52 PolarHBondContact O-N 3.22Å
53	R	44	Very low	55.9	Low	204 Å²	204	124 Å²	124	77%	0.77	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-87.7	118.7	150.1	-62.6	-173	-170.3	-133.4	8.1	104.6	W51	W51-R53 PolarHBondContact O-N 3Å
54	G	52.2	Low	58.3	Low	30 Å²	30	114.9 Å²	114.9	31%	0.309	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-56.9	135.7	149.1	0	0	0	0	0	108.2	P56 E136	G54-P56 WeakPolarHBondContact O-CD 3.28Å; G54-E136 PolarHBondContact N-OE1 3.34Å
55	D	67.4	Low	60.3	Low	155 Å²	155	105.2 Å²	105.2	83%	0.829	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-73.9	117.2	164	-86	-47.1	0	0	0	106.8	I57	D55-I57 PolarHBondContact O-N 2.88Å
56	P	75.9	Confident	62.3	Low	34 Å²	34	100.9 Å²	100.9	22%	0.221	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-63.8	132.3	-170.8	25	-34.7	0	0	0	111	G54 K58 L130 I131 V132 V141	G54-P56 WeakPolarHBondContact O-CD 3.28Å; P56-K58 PolarHBondContact O-N 2.98Å; P56-L130 HydrophobicContact CB-CB 4.47Å; P56-L130 HydrophobicContact CB-CD2 4.29Å; P56-L130 HydrophobicContact CG-CD2 4.38Å; P56-I131 CarbonylContact C-O 3.57Å; P56-V132 HydrophobicContact CB-CG2 4.05Å; P56-V141 HydrophobicContact CB-CG1 4.42Å; P56-V141 HydrophobicContact CG-CG1 4.38Å
57	I	83.3	Confident	64.2	Low	47 Å²	47	95.1 Å²	95.1	24%	0.241	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	122.4	-175.8	-58.7	176	0	0	0	108.8	D55 I59 D106 L130 I131	D55-I57 PolarHBondContact O-N 2.88Å; I57-I59 PolarHBondContact O-N 2.92Å; I57-D106 HydrophobicContact CD1-CB 4.08Å; I57-D106 HydrophobicContact CG2-CB 4.31Å; I57-L130 WeakPolarHBondContact O-CA 3.17Å; I57-I131 HydrophobicContact CB-CB 4.12Å; I57-I131 PolarHBondContact N-O 3.22Å; I57-I131 PolarHBondContact O-N 2.61Å
58	K	86.4	Confident	66.5	Low	122 Å²	122	87.5 Å²	87.5	53%	0.53	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	107	-171.1	-67.7	175.8	-175	171.2	0	110.9	P56 L60 L127 L130	P56-K58 PolarHBondContact O-N 2.98Å; K58-L60 HydrophobicContact CB-CD2 4.04Å; K58-L60 HydrophobicContact CB-CG 4.45Å; K58-L60 PolarHBondContact O-N 2.79Å; K58-L60 VanDerWaalsContact O-N 3.1Å; K58-L127 HydrophobicContact CB-CD1 3.72Å; K58-L127 HydrophobicContact CG-CD1 3.94Å; K58-L130 HydrophobicContact CG-CD2 3.98Å
59	I	86.2	Confident	68.7	Low	17 Å²	17	89.2 Å²	89.2	9%	0.087	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	106.9	166.7	-51.2	171	0	0	0	107.5	I57 L90 L102 L110 I128 G129 I131	I57-I59 PolarHBondContact O-N 2.92Å; I59-L90 HydrophobicContact CD1-CD1 4.14Å; I59-L102 HydrophobicContact CG2-CD2 4.08Å; I59-L110 HydrophobicContact CD1-CD1 3.74Å; I59-I128 HydrophobicContact CG2-CB 4.28Å; I59-I128 PolarHBondContact O-N 3.17Å; I59-G129 WeakPolarHBondContact CB-O 2.95Å; I59-G129 PolarHBondContact N-O 2.62Å; I59-G129 PolarHBondContact O-N 3Å; I59-I131 HydrophobicContact CD1-CD1 3.91Å; I59-I131 HydrophobicContact CD1-CG1 3.85Å; I59-I131 HydrophobicContact CG1-CD1 3.9Å; I59-I131 HydrophobicContact CG1-CG1 4.01Å
60	L	89.5	Confident	71.1	Confident	82 Å²	82	86.8 Å²	86.8	43%	0.429	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	150.8	173.8	-54.8	-174.5	0	0	0	110.7	K58 P62 S126 L127	K58-L60 HydrophobicContact CB-CD2 4.04Å; K58-L60 HydrophobicContact CB-CG 4.45Å; K58-L60 PolarHBondContact O-N 2.79Å; K58-L60 VanDerWaalsContact O-N 3.1Å; L60-P62 WeakPolarHBondContact O-CD 3.19Å; L60-P62 VanDerWaalsContact O-N 3.14Å; L60-S126 CarbonylContact C-O 3.51Å; L60-S126 WeakPolarHBondContact CA-O 3.3Å; L60-L127 HydrophobicContact CD2-CB 4.25Å; L60-L127 HydrophobicContact CD2-CD1 3.98Å
61	M	89.1	Confident	73.7	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.02	40%	0.399	C	S	.	.			trans	-59.7	111.1	174.3	178.4	55.4	88.9	0	0	111	M68 I93 I122 R123 L124 G125 S126 I128	M61-M68 HydrophobicContact CG-CE 4.36Å; M61-M68 HydrophobicContact SD-CE 3.81Å; M61-I93 HydrophobicContact CE-CD1 4.28Å; M61-I93 HydrophobicContact CE-CG2 4.28Å; M61-I93 HydrophobicContact SD-CD1 4Å; M61-I93 HydrophobicContact SD-CG2 4.37Å; M61-I122 HydrophobicContact CB-CG2 4.26Å; M61-I122 HydrophobicContact CE-CB 3.71Å; M61-I122 HydrophobicContact CE-CD1 3.92Å; M61-I122 HydrophobicContact CE-CG1 4.46Å; M61-I122 HydrophobicContact CE-CG2 3.81Å; M61-I122 HydrophobicContact CG-CG2 4.36Å; M61-R123 VanDerWaalsContact CB-O 3.32Å; M61-R123 WeakPolarHBondContact CB-O 3.5Å; M61-R123 WeakPolarHBondContact CG-O 3.28Å; M61-L124 HydrophobicContact CG-CD2 4.17Å; M61-G125 PolarHBondContact O-N 3.37Å; M61-S126 PolarHBondContact N-O 3.27Å; M61-I128 HydrophobicContact CB-CD1 3.74Å; M61-I128 HydrophobicContact CB-CG1 4.18Å; M61-I128 HydrophobicContact CE-CD1 3.74Å; M61-I128 HydrophobicContact CG-CD1 4.36Å; M61-I128 HydrophobicContact SD-CD1 3.88Å
62	P	84.4	Confident	76.4	Confident	42 Å²	42	68.3 Å²	68.3	27%	0.273	36%	0.362	S	S	.	.			trans	-90.6	160.2	-174.4	31.2	-23.6	0	0	0	112.1	L60 L64 L102 L124	L60-P62 WeakPolarHBondContact O-CD 3.19Å; L60-P62 VanDerWaalsContact O-N 3.14Å; P62-L64 HydrophobicContact CG-CD2 4.25Å; P62-L64 HydrophobicContact CG-CG 4.2Å; P62-L64 PolarHBondContact O-N 3.1Å; P62-L102 HydrophobicContact CG-CD1 3.61Å; P62-L102 HydrophobicContact CG-CD2 4.5Å; P62-L124 WeakPolarHBondContact O-CD2 3.4Å
63	S	86.7	Confident	79.1	Confident	75 Å²	75	61.5 Å²	61.5	52%	0.524	33%	0.327	S	S	.	.			trans	-81.2	85.9	176.8	-166.3	0	0	0	0	111	S65	S63-S65 PolarHBondContact O-N 2.97Å; S63-S65 PolarHBondContact OG-O 3.36Å
64	L	83.3	Confident	81.1	Confident	53 Å²	53	54.8 Å²	54.8	28%	0.277	31%	0.308	S	S	.	.	S	Bend	trans	-79.2	-0.1	177.6	-62.6	177.6	0	0	0	113.7	P62 I93 T95 V100	P62-L64 HydrophobicContact CG-CD2 4.25Å; P62-L64 HydrophobicContact CG-CG 4.2Å; P62-L64 PolarHBondContact O-N 3.1Å; L64-I93 HydrophobicContact CD1-CB 4Å; L64-I93 HydrophobicContact CD1-CD1 4.04Å; L64-I93 HydrophobicContact CD1-CG1 4.45Å; L64-I93 HydrophobicContact CD1-CG2 4.24Å; L64-T95 HydrophobicContact CB-CG2 3.94Å; L64-V100 HydrophobicContact CB-CG1 4.42Å; L64-V100 HydrophobicContact CD1-CB 4.22Å; L64-V100 HydrophobicContact CD1-CG1 4.18Å; L64-V100 HydrophobicContact CD2-CG1 4.48Å
65	S	77.1	Confident	82.8	Confident	8 Å²	8	57.7 Å²	57.7	6%	0.056	31%	0.313	C	S	.	.	S	Bend	trans	-154.3	134	175.6	168.4	0	0	0	0	109.4	S63 T67 M68 D96 K97	S63-S65 PolarHBondContact O-N 2.97Å; S63-S65 PolarHBondContact OG-O 3.36Å; S65-T67 PolarHBondContact O-N 2.95Å; S65-M68 WeakPolarHBondContact O-CB 3.44Å; S65-M68 PolarHBondContact O-N 2.97Å; S65-D96 WeakPolarHBondContact CB-OD1 3.48Å; S65-D96 PolarHBondContact OG-OD1 3.18Å; S65-K97 PolarHBondContact OG-NZ 3.17Å
66	P	72.6	Confident	83.8	Confident	124 Å²	124	51.5 Å²	51.5	81%	0.805	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	2.8	-174.6	28.4	-36.6	0	0	0	114.8
67	T	72.9	Confident	84.3	Confident	72 Å²	72	53 Å²	53	44%	0.442	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	13.9	174.3	52.1	0	0	0	0	113.1	S65 D96 K97	S65-T67 PolarHBondContact O-N 2.95Å; T67-D96 PolarHBondContact OG1-OD2 2.96Å; T67-K97 WeakPolarHBondContact OG1-CE 3.37Å; T67-K97 PolarHBondContact OG1-NZ 3.04Å
68	M	81.6	Confident	84.3	Confident	9 Å²	9	51.9 Å²	51.9	4%	0.044	28%	0.277	C	S	.	.			trans	-90.6	122.6	-178.7	176.7	168.6	140.6	0	0	111.6	M61 S65 E70 T95 L124	M61-M68 HydrophobicContact CG-CE 4.36Å; M61-M68 HydrophobicContact SD-CE 3.81Å; S65-M68 WeakPolarHBondContact O-CB 3.44Å; S65-M68 PolarHBondContact O-N 2.97Å; M68-E70 VanDerWaalsContact CG-O 3.31Å; M68-E70 WeakPolarHBondContact CG-O 3.37Å; M68-T95 HydrophobicContact SD-CG2 3.71Å; M68-L124 HydrophobicContact CE-CD2 3.81Å; M68-L124 HydrophobicContact CG-CD2 4.31Å; M68-L124 VanDerWaalsContact O-CD1 3.25Å; M68-L124 WeakPolarHBondContact O-CD1 3.36Å
69	E	80.3	Confident	84.3	Confident	135 Å²	135	53.4 Å²	53.4	63%	0.631	28%	0.283	S	S	*	.	S	Bend	trans	-99.4	-28.1	171.5	-62.6	169.1	145.3	0	0	111.2	L124 K289	E69-L124 PolarHBondContact O-N 2.89Å; E69-K289 IonicContact OE2-NZ 2.83Å; E69-K289 PolarHBondContact OE2-NZ 3.31Å
70	E	85.7	Confident	84.2	Confident	67 Å²	67	57.2 Å²	57.2	31%	0.313	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	150.9	-177.2	59.3	174.7	-153.6	0	0	111.4	M68 N121 I122 R285	M68-E70 VanDerWaalsContact CG-O 3.31Å; M68-E70 WeakPolarHBondContact CG-O 3.37Å; E70-N121 WeakPolarHBondContact OE2-CB 3.39Å; E70-I122 CarbonylContact C-O 3.58Å; E70-I122 VanDerWaalsContact CA-O 3.23Å; E70-I122 WeakPolarHBondContact CA-O 3.35Å; E70-R285 IonicContact OE1-NH2 2.67Å; E70-R285 PolarHBondContact OE1-NH2 3.45Å
71	G	86.3	Confident	83.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	167.4	176.2	0	0	0	0	0	113	N121 I122	G71-N121 PolarHBondContact O-N 3.08Å; G71-I122 PolarHBondContact N-O 2.74Å; G71-I122 WeakPolarHBondContact O-CB 3.37Å; G71-I122 PolarHBondContact O-N 2.89Å
72	N	87.5	Confident	83.4	Confident	11 Å²	11	58.2 Å²	58.2	6%	0.059	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.8	176.5	-46.6	-38.7	0	0	0	109.8	V74 I93 E94 S119 K120 N121	N72-V74 PolarHBondContact O-N 2.99Å; N72-I93 CarbonylContact O-C 3.55Å; N72-I93 WeakPolarHBondContact O-CA 3.3Å; N72-I93 WeakPolarHBondContact O-CG2 3.4Å; N72-E94 HydrophobicContact CB-CB 4.23Å; N72-E94 PolarHBondContact N-O 3.49Å; N72-E94 PolarHBondContact ND2-OE2 3.3Å; N72-E94 PolarHBondContact O-N 2.85Å; N72-S119 CarbonylContact C-O 3.58Å; N72-S119 VanDerWaalsContact CA-O 3.3Å; N72-S119 WeakPolarHBondContact CA-O 3.09Å; N72-S119 WeakPolarHBondContact CB-O 3.32Å; N72-K120 HydrophobicContact CB-CB 4.5Å; N72-K120 HydrophobicContact CB-CG 4.34Å; N72-K120 WeakPolarHBondContact OD1-CA 3.46Å; N72-K120 WeakPolarHBondContact OD1-CB 3.42Å; N72-N121 PolarHBondContact OD1-N 2.87Å
73	I	88.9	Confident	83.3	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	113.8	170.5	-65	170.6	0	0	0	107.5	W76 C91 V115 G118 S119 I122 I128	I73-W76 HydrophobicContact CD1-CZ2 4.3Å; I73-C91 HydrophobicContact CG2-CB 4.45Å; I73-V115 HydrophobicContact CD1-CB 4.08Å; I73-V115 HydrophobicContact CD1-CG1 3.9Å; I73-G118 VanDerWaalsContact O-CA 3.24Å; I73-G118 WeakPolarHBondContact O-CA 3.25Å; I73-G118 PolarHBondContact O-N 2.85Å; I73-S119 PolarHBondContact N-O 3.12Å; I73-I122 HydrophobicContact CB-CD1 4.38Å; I73-I122 HydrophobicContact CD1-CD1 3.84Å; I73-I122 HydrophobicContact CG1-CD1 3.7Å; I73-I128 HydrophobicContact CD1-CD1 4.29Å; I73-I128 HydrophobicContact CD1-CG1 4.38Å; I73-I128 HydrophobicContact CD1-CG2 3.68Å
74	V	85	Confident	83.3	Confident	62 Å²	62	55.4 Å²	55.4	38%	0.376	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-47	178.8	-176	0	0	0	0	110	N72 E92 E94 V99	N72-V74 PolarHBondContact O-N 2.99Å; V74-E92 HydrophobicContact CB-CB 4.1Å; V74-E92 WeakPolarHBondContact CB-O 3.42Å; V74-E92 PolarHBondContact N-O 2.92Å; V74-E94 HydrophobicContact CG2-CB 3.64Å; V74-V99 HydrophobicContact CG2-CG1 4.1Å; V74-V99 HydrophobicContact CG2-CG2 4.2Å
75	K	88.4	Confident	83.4	Confident	92 Å²	92	56 Å²	56	40%	0.4	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	141	-169.4	178.1	-177.9	160.3	-140.5	0	111	C91 E92	K75-C91 WeakPolarHBondContact O-CA 3.5Å; K75-C91 VanDerWaalsContact O-CB 3.31Å; K75-C91 WeakPolarHBondContact O-CB 3.38Å; K75-E92 IonicContact NZ-OE1 3.96Å; K75-E92 PolarHBondContact NZ-OE1 3.12Å; K75-E92 PolarHBondContact O-N 2.79Å
76	W	88.7	Confident	83.8	Confident	24 Å²	24	58.4 Å²	58.4	9%	0.091	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	137.9	168.1	-78.1	96.8	0	0	0	111.3	I73 L90 C91 L110 I113 V115 I128	I73-W76 HydrophobicContact CD1-CZ2 4.3Å; W76-L90 HydrophobicContact CZ3-CB 4.32Å; W76-C91 HydrophobicContact CD2-CB 3.86Å; W76-C91 HydrophobicContact CE3-CB 3.7Å; W76-C91 HydrophobicContact CG-CB 4.3Å; W76-C91 HydrophobicContact CZ3-CB 4.16Å; W76-L110 HydrophobicContact CE3-CD2 4.34Å; W76-L110 HydrophobicContact CZ3-CD2 4.11Å; W76-I113 HydrophobicContact CB-CD1 4.43Å; W76-I113 HydrophobicContact CD2-CD1 3.72Å; W76-I113 HydrophobicContact CD2-CG1 4.12Å; W76-I113 HydrophobicContact CE3-CD1 4.09Å; W76-I113 HydrophobicContact CE3-CG1 4.32Å; W76-I113 HydrophobicContact CG-CD1 3.87Å; W76-I113 HydrophobicContact CH2-CG1 4.21Å; W76-I113 HydrophobicContact CZ2-CB 4.41Å; W76-I113 HydrophobicContact CZ2-CD1 4.48Å; W76-I113 HydrophobicContact CZ2-CG1 3.99Å; W76-I113 HydrophobicContact CZ2-CG2 3.79Å; W76-I113 HydrophobicContact CZ3-CG1 4.38Å; W76-V115 PolarHBondContact NE1-O 3.34Å; W76-I128 HydrophobicContact CH2-CG2 3.58Å; W76-I128 HydrophobicContact CZ2-CG2 3.39Å
77	L	85.5	Confident	84.3	Confident	65 Å²	65	55 Å²	55	34%	0.34	31%	0.312	S	S	.	.	S	Bend	trans	-98.3	-43.1	177	-62.8	172.9	0	0	0	110.7	A89 L90 E92 T101	L77-A89 HydrophobicContact CD1-CB 3.82Å; L77-L90 WeakPolarHBondContact CB-O 3.4Å; L77-L90 PolarHBondContact N-O 3.44Å; L77-E92 HydrophobicContact CD1-CG 4.31Å; L77-E92 HydrophobicContact CD2-CG 4.48Å; L77-E92 HydrophobicContact CG-CG 4.47Å; L77-T101 HydrophobicContact CD1-CG2 4.24Å
78	K	84.8	Confident	84.9	Confident	24 Å²	24	54.5 Å²	54.5	10%	0.104	31%	0.307	C	S	.	.	S	Bend	trans	-87.3	156.1	171.2	-68.5	-69.4	-169.8	164.6	0	112	E82 A83 V84 D88 L90 L110	K78-E82 WeakPolarHBondContact CA-OE2 3.32Å; K78-E82 HydrophobicContact CD-CG 4.2Å; K78-E82 WeakPolarHBondContact CD-OE1 3.39Å; K78-E82 IonicContact NZ-OE1 3.55Å; K78-E82 PolarHBondContact NZ-OE1 3.14Å; K78-A83 PolarHBondContact NZ-O 2.89Å; K78-V84 HydrophobicContact CB-CG2 4.49Å; K78-V84 HydrophobicContact CD-CG2 4.05Å; K78-V84 HydrophobicContact CG-CG2 4.04Å; K78-D88 WeakPolarHBondContact CE-OD2 3.29Å; K78-D88 IonicContact NZ-OD2 2.84Å; K78-D88 PolarHBondContact NZ-OD2 3.49Å; K78-L90 HydrophobicContact CB-CD2 4.37Å; K78-L90 HydrophobicContact CG-CD2 4.22Å; K78-L90 PolarHBondContact N-O 2.81Å; K78-L90 VanDerWaalsContact N-O 3.16Å; K78-L110 HydrophobicContact CB-CD2 3.75Å
79	K	84.8	Confident	85.3	Confident	155 Å²	155	55.8 Å²	55.8	67%	0.674	32%	0.319	S	S	*	.			trans	-116.4	162	177.9	-66.3	-176.1	-179.3	-179.7	0	113.6	G81 E82	K79-G81 PolarHBondContact O-N 3.01Å; K79-E82 PolarHBondContact N-OE2 3.19Å; K79-E82 WeakPolarHBondContact O-CB 3.22Å; K79-E82 PolarHBondContact O-N 2.87Å
80	E	85.4	Confident	85.6	Confident	96 Å²	96	49.5 Å²	49.5	45%	0.449	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	130	171.7	-57.9	-169.2	141.4	0	0	111.1	E82 L110 K112 I113	E80-E82 VanDerWaalsContact C-N 3.35Å; E80-L110 CarbonylContact C-O 3.57Å; E80-L110 VanDerWaalsContact CA-O 3.32Å; E80-L110 WeakPolarHBondContact CA-O 3.24Å; E80-K112 WeakPolarHBondContact OE1-CA 3.3Å; E80-K112 WeakPolarHBondContact OE1-CG 3.37Å; E80-I113 HydrophobicContact CG-CB 4.38Å; E80-I113 HydrophobicContact CG-CD1 4.12Å; E80-I113 HydrophobicContact CG-CG1 4.07Å; E80-I113 PolarHBondContact OE1-N 3.2Å
81	G	78.7	Confident	85.7	Confident	31 Å²	31	46.3 Å²	46.3	32%	0.32	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	5.7	-174.7	0	0	0	0	0	115.1	K79 L110	K79-G81 PolarHBondContact O-N 3.01Å; G81-L110 PolarHBondContact N-O 3.28Å
82	E	82.7	Confident	85.8	Confident	76 Å²	76	48.9 Å²	48.9	36%	0.355	29%	0.287	S	S	.	.			trans	-87.9	142.6	174.3	-159	-174.7	150.9	0	0	111.6	K78 K79 E80 I109 L110	K78-E82 WeakPolarHBondContact CA-OE2 3.32Å; K78-E82 HydrophobicContact CD-CG 4.2Å; K78-E82 WeakPolarHBondContact CD-OE1 3.39Å; K78-E82 IonicContact NZ-OE1 3.55Å; K78-E82 PolarHBondContact NZ-OE1 3.14Å; K79-E82 PolarHBondContact N-OE2 3.19Å; K79-E82 WeakPolarHBondContact O-CB 3.22Å; K79-E82 PolarHBondContact O-N 2.87Å; E80-E82 VanDerWaalsContact C-N 3.35Å; E82-I109 WeakPolarHBondContact O-CA 3.49Å; E82-L110 PolarHBondContact O-N 2.85Å
83	A	83.1	Confident	85.8	Confident	55 Å²	55	48.4 Å²	48.4	46%	0.455	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	144.9	171	0	0	0	0	0	111.4	K78	K78-A83 PolarHBondContact NZ-O 2.89Å
84	V	85.6	Confident	85.7	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.018	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	133.3	-175.9	179.7	0	0	0	0	107.5	K78 D88 L90 A104 G108 L110	K78-V84 HydrophobicContact CB-CG2 4.49Å; K78-V84 HydrophobicContact CD-CG2 4.05Å; K78-V84 HydrophobicContact CG-CG2 4.04Å; V84-D88 HydrophobicContact CG1-CB 3.92Å; V84-L90 HydrophobicContact CG1-CD2 3.94Å; V84-L90 HydrophobicContact CG2-CD2 4.08Å; V84-A104 HydrophobicContact CG1-CB 3.35Å; V84-G108 PolarHBondContact N-O 3.04Å; V84-G108 PolarHBondContact O-N 3Å; V84-L110 HydrophobicContact CG2-CB 4.09Å
85	S	85.3	Confident	85.8	Confident	67 Å²	67	48.4 Å²	48.4	47%	0.469	28%	0.28	S	S	.	.			trans	-107.5	159.8	171.1	-66.3	0	0	0	0	111.6	G87 D88 D107	S85-G87 PolarHBondContact O-N 3.16Å; S85-G87 VanDerWaalsContact O-N 3.14Å; S85-D88 WeakPolarHBondContact O-CB 3.46Å; S85-D88 PolarHBondContact O-N 3.46Å; S85-D107 WeakPolarHBondContact CA-OD1 3.48Å; S85-D107 WeakPolarHBondContact CB-OD1 3.48Å
86	A	85.8	Confident	85.2	Confident	57 Å²	57	44.9 Å²	44.9	47%	0.471	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	120.4	173.7	0	0	0	0	0	110.5	D107	A86-D107 PolarHBondContact N-OD1 3.02Å
87	G	82.7	Confident	84.4	Confident	53 Å²	53	45.8 Å²	45.8	55%	0.546	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-2.5	-172.1	0	0	0	0	0	116.3	S85 A104	S85-G87 PolarHBondContact O-N 3.16Å; S85-G87 VanDerWaalsContact O-N 3.14Å; G87-A104 PolarHBondContact N-O 3.16Å
88	D	86.9	Confident	84.2	Confident	62 Å²	62	45 Å²	45	33%	0.332	27%	0.274	S	S	.	.			trans	-73.8	136.8	173	-109	4.6	0	0	0	111.6	K78 V84 S85 L90 D103 A104	K78-D88 WeakPolarHBondContact CE-OD2 3.29Å; K78-D88 IonicContact NZ-OD2 2.84Å; K78-D88 PolarHBondContact NZ-OD2 3.49Å; V84-D88 HydrophobicContact CG1-CB 3.92Å; S85-D88 WeakPolarHBondContact O-CB 3.46Å; S85-D88 PolarHBondContact O-N 3.46Å; D88-L90 PolarHBondContact O-N 3.12Å; D88-D103 CarbonylContact O-C 3.56Å; D88-D103 WeakPolarHBondContact O-CA 3.39Å; D88-A104 PolarHBondContact O-N 3.17Å
89	A	88.7	Confident	84.3	Confident	35 Å²	35	47.8 Å²	47.8	29%	0.289	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	110.9	177.5	0	0	0	0	0	112.2	L77 T101	L77-A89 HydrophobicContact CD1-CB 3.82Å; A89-T101 HydrophobicContact CB-CG2 3.52Å
90	L	86.9	Confident	84.5	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-54	-178.5	-73.9	167.2	0	0	0	113	I59 W76 L77 K78 V84 D88 L102 A104	I59-L90 HydrophobicContact CD1-CD1 4.14Å; W76-L90 HydrophobicContact CZ3-CB 4.32Å; L77-L90 WeakPolarHBondContact CB-O 3.4Å; L77-L90 PolarHBondContact N-O 3.44Å; K78-L90 HydrophobicContact CB-CD2 4.37Å; K78-L90 HydrophobicContact CG-CD2 4.22Å; K78-L90 PolarHBondContact N-O 2.81Å; K78-L90 VanDerWaalsContact N-O 3.16Å; V84-L90 HydrophobicContact CG1-CD2 3.94Å; V84-L90 HydrophobicContact CG2-CD2 4.08Å; D88-L90 PolarHBondContact O-N 3.12Å; L90-L102 HydrophobicContact CB-CG 4.47Å; L90-L102 WeakPolarHBondContact CB-O 3.17Å; L90-L102 HydrophobicContact CD1-CD2 4.41Å; L90-L102 HydrophobicContact CD1-CG 4.28Å; L90-L102 PolarHBondContact N-O 3.05Å; L90-A104 HydrophobicContact CD1-CB 3.85Å; L90-A104 HydrophobicContact CD2-CB 4.47Å; L90-A104 HydrophobicContact CG-CB 4.01Å
91	C	87.3	Confident	84.6	Confident	0 Å²	0	41 Å²	41	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	161.6	-175	63.3	0	0	0	0	113.1	I73 K75 W76 L102	I73-C91 HydrophobicContact CG2-CB 4.45Å; K75-C91 WeakPolarHBondContact O-CA 3.5Å; K75-C91 VanDerWaalsContact O-CB 3.31Å; K75-C91 WeakPolarHBondContact O-CB 3.38Å; W76-C91 HydrophobicContact CD2-CB 3.86Å; W76-C91 HydrophobicContact CE3-CB 3.7Å; W76-C91 HydrophobicContact CG-CB 4.3Å; W76-C91 HydrophobicContact CZ3-CB 4.16Å; C91-L102 PolarHBondContact O-N 3.5Å
92	E	88.3	Confident	85.1	Confident	55 Å²	55	40.2 Å²	40.2	26%	0.257	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.5	174.9	-67	171.7	-139.4	0	0	109.5	V74 K75 L77 V99	V74-E92 HydrophobicContact CB-CB 4.1Å; V74-E92 WeakPolarHBondContact CB-O 3.42Å; V74-E92 PolarHBondContact N-O 2.92Å; K75-E92 IonicContact NZ-OE1 3.96Å; K75-E92 PolarHBondContact NZ-OE1 3.12Å; K75-E92 PolarHBondContact O-N 2.79Å; L77-E92 HydrophobicContact CD1-CG 4.31Å; L77-E92 HydrophobicContact CD2-CG 4.48Å; L77-E92 HydrophobicContact CG-CG 4.47Å; E92-V99 HydrophobicContact CB-CG1 3.91Å
93	I	89.2	Confident	85.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.1	-178.7	-60.3	-174.7	0	0	0	110.5	M61 L64 N72 T95 V99 V100 L102	M61-I93 HydrophobicContact CE-CD1 4.28Å; M61-I93 HydrophobicContact CE-CG2 4.28Å; M61-I93 HydrophobicContact SD-CD1 4Å; M61-I93 HydrophobicContact SD-CG2 4.37Å; L64-I93 HydrophobicContact CD1-CB 4Å; L64-I93 HydrophobicContact CD1-CD1 4.04Å; L64-I93 HydrophobicContact CD1-CG1 4.45Å; L64-I93 HydrophobicContact CD1-CG2 4.24Å; N72-I93 CarbonylContact O-C 3.55Å; N72-I93 WeakPolarHBondContact O-CA 3.3Å; N72-I93 WeakPolarHBondContact O-CG2 3.4Å; I93-T95 PolarHBondContact O-N 3.32Å; I93-V99 CarbonylContact O-C 3.52Å; I93-V99 WeakPolarHBondContact O-CA 3.42Å; I93-V100 PolarHBondContact N-O 3.29Å; I93-V100 PolarHBondContact O-N 3.47Å; I93-L102 HydrophobicContact CD1-CB 3.91Å; I93-L102 HydrophobicContact CD1-CD2 4.03Å; I93-L102 HydrophobicContact CG1-CB 4.39Å
94	E	85.6	Confident	85.6	Confident	60 Å²	60	38.5 Å²	38.5	28%	0.28	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	114.1	169.6	-178.2	-170.8	-151.3	0	0	109.1	N72 V74 V99	N72-E94 HydrophobicContact CB-CB 4.23Å; N72-E94 PolarHBondContact N-O 3.49Å; N72-E94 PolarHBondContact ND2-OE2 3.3Å; N72-E94 PolarHBondContact O-N 2.85Å; V74-E94 HydrophobicContact CG2-CB 3.64Å; E94-V99 HydrophobicContact CB-CG2 4.31Å
95	T	86.7	Confident	85.6	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.025	28%	0.278	C	S	.	.			trans	-91.7	-166.6	177.9	67.8	0	0	0	0	111.3	L64 M68 I93 K97 A98 V100 N282	L64-T95 HydrophobicContact CB-CG2 3.94Å; M68-T95 HydrophobicContact SD-CG2 3.71Å; I93-T95 PolarHBondContact O-N 3.32Å; T95-K97 PolarHBondContact O-N 2.8Å; T95-K97 PolarHBondContact OG1-N 2.66Å; T95-A98 WeakPolarHBondContact CB-O 3.3Å; T95-A98 PolarHBondContact N-O 3.41Å; T95-A98 PolarHBondContact OG1-N 3.38Å; T95-A98 PolarHBondContact OG1-O 3.32Å; T95-V100 HydrophobicContact CG2-CB 4.27Å; T95-V100 HydrophobicContact CG2-CG2 3.96Å; T95-N282 PolarHBondContact O-ND2 3.39Å
96	D	75.7	Confident	85.5	Confident	18 Å²	18	43.6 Å²	43.6	10%	0.096	28%	0.275	C	S	.	.	S	Bend	trans	-69.8	-17	171.3	70	-34	0	0	0	113.8	S65 T67 V286	S65-D96 WeakPolarHBondContact CB-OD1 3.48Å; S65-D96 PolarHBondContact OG-OD1 3.18Å; T67-D96 PolarHBondContact OG1-OD2 2.96Å; D96-V286 HydrophobicContact CB-CG2 4.13Å
97	K	73.6	Confident	85.4	Confident	43 Å²	43	45.6 Å²	45.6	19%	0.187	28%	0.278	C	S	.	.	S	Bend	trans	-127.2	-36.7	-169.7	-71.2	162.2	-165.1	161.9	0	115	S65 T67 T95	S65-K97 PolarHBondContact OG-NZ 3.17Å; T67-K97 WeakPolarHBondContact OG1-CE 3.37Å; T67-K97 PolarHBondContact OG1-NZ 3.04Å; T95-K97 PolarHBondContact O-N 2.8Å; T95-K97 PolarHBondContact OG1-N 2.66Å
98	A	80.8	Confident	85.5	Confident	49 Å²	49	43.2 Å²	43.2	41%	0.405	25%	0.254	S	S	.	.			trans	-153.3	163.9	-173.3	0	0	0	0	0	112.1	T95 V100	T95-A98 WeakPolarHBondContact CB-O 3.3Å; T95-A98 PolarHBondContact N-O 3.41Å; T95-A98 PolarHBondContact OG1-N 3.38Å; T95-A98 PolarHBondContact OG1-O 3.32Å; A98-V100 HydrophobicContact CB-CG2 4.13Å
99	V	86	Confident	85.3	Confident	81 Å²	81	41.9 Å²	41.9	49%	0.491	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	126.2	158.2	-176.7	0	0	0	0	107.2	V74 E92 I93 E94	V74-V99 HydrophobicContact CG2-CG1 4.1Å; V74-V99 HydrophobicContact CG2-CG2 4.2Å; E92-V99 HydrophobicContact CB-CG1 3.91Å; I93-V99 CarbonylContact O-C 3.52Å; I93-V99 WeakPolarHBondContact O-CA 3.42Å; E94-V99 HydrophobicContact CB-CG2 4.31Å
100	V	89.2	Confident	85.1	Confident	49 Å²	49	40.2 Å²	40.2	30%	0.297	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.9	-176.6	-176.5	0	0	0	0	107.9	L64 I93 T95 A98	L64-V100 HydrophobicContact CB-CG1 4.42Å; L64-V100 HydrophobicContact CD1-CB 4.22Å; L64-V100 HydrophobicContact CD1-CG1 4.18Å; L64-V100 HydrophobicContact CD2-CG1 4.48Å; I93-V100 PolarHBondContact N-O 3.29Å; I93-V100 PolarHBondContact O-N 3.47Å; T95-V100 HydrophobicContact CG2-CB 4.27Å; T95-V100 HydrophobicContact CG2-CG2 3.96Å; A98-V100 HydrophobicContact CB-CG2 4.13Å
101	T	88.9	Confident	84.7	Confident	60 Å²	60	40.2 Å²	40.2	37%	0.368	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	137.8	175.4	-47.3	0	0	0	0	110.1	L77 A89	L77-T101 HydrophobicContact CD1-CG2 4.24Å; A89-T101 HydrophobicContact CB-CG2 3.52Å
102	L	88.9	Confident	84.3	Confident	15 Å²	15	43.7 Å²	43.7	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.4	163.2	174.4	56.9	0	0	0	108.7	I59 P62 L90 C91 I93	I59-L102 HydrophobicContact CG2-CD2 4.08Å; P62-L102 HydrophobicContact CG-CD1 3.61Å; P62-L102 HydrophobicContact CG-CD2 4.5Å; L90-L102 HydrophobicContact CB-CG 4.47Å; L90-L102 WeakPolarHBondContact CB-O 3.17Å; L90-L102 HydrophobicContact CD1-CD2 4.41Å; L90-L102 HydrophobicContact CD1-CG 4.28Å; L90-L102 PolarHBondContact N-O 3.05Å; C91-L102 PolarHBondContact O-N 3.5Å; I93-L102 HydrophobicContact CD1-CB 3.91Å; I93-L102 HydrophobicContact CD1-CD2 4.03Å; I93-L102 HydrophobicContact CG1-CB 4.39Å
103	D	90.4	Very high	84.2	Confident	87 Å²	87	42.7 Å²	42.7	47%	0.465	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	151.8	172.4	-50.9	-38.2	0	0	0	110.1	D88	D88-D103 CarbonylContact O-C 3.56Å; D88-D103 WeakPolarHBondContact O-CA 3.39Å
104	A	86	Confident	83.8	Confident	7 Å²	7	45 Å²	45	6%	0.058	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-75.4	136.1	-180	0	0	0	0	0	112.6	V84 G87 D88 L90	V84-A104 HydrophobicContact CG1-CB 3.35Å; G87-A104 PolarHBondContact N-O 3.16Å; D88-A104 PolarHBondContact O-N 3.17Å; L90-A104 HydrophobicContact CD1-CB 3.85Å; L90-A104 HydrophobicContact CD2-CB 4.47Å; L90-A104 HydrophobicContact CG-CB 4.01Å
105	S	84.6	Confident	83.6	Confident	101 Å²	101	43.3 Å²	43.3	71%	0.706	25%	0.251	S	S	*	.	S	Bend	trans	-80.4	-30.6	174.6	-59.7	0	0	0	0	113.5
106	D	84.5	Confident	83.4	Confident	76 Å²	76	50.4 Å²	50.4	41%	0.406	28%	0.284	S	S	.	.	S	Bend	trans	-133.3	147.9	-165.1	-50.2	-81.2	0	0	0	110.3	I57	I57-D106 HydrophobicContact CD1-CB 4.08Å; I57-D106 HydrophobicContact CG2-CB 4.31Å
107	D	83.6	Confident	83.7	Confident	99 Å²	99	55.8 Å²	55.8	53%	0.529	31%	0.309	S	S	.	.			trans	-78.3	144.2	175.6	-59.5	-71	0	0	0	111.9	S85 A86	S85-D107 WeakPolarHBondContact CA-OD1 3.48Å; S85-D107 WeakPolarHBondContact CB-OD1 3.48Å; A86-D107 PolarHBondContact N-OD1 3.02Å
108	G	84.6	Confident	83.9	Confident	4 Å²	4	55.7 Å²	55.7	4%	0.041	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.6	-159.5	172.4	0	0	0	0	0	114.6	V84 V132	V84-G108 PolarHBondContact N-O 3.04Å; V84-G108 PolarHBondContact O-N 3Å; G108-V132 CarbonylContact C-O 3.55Å; G108-V132 WeakPolarHBondContact CA-O 3.26Å
109	I	82.5	Confident	84	Confident	34 Å²	34	55.1 Å²	55.1	17%	0.174	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130	176.1	-57.9	176.2	0	0	0	108.7	E82 A111 I131 V132	E82-I109 WeakPolarHBondContact O-CA 3.49Å; I109-A111 VanDerWaalsContact C-N 3.33Å; I109-A111 PolarHBondContact O-N 3.14Å; I109-I131 WeakPolarHBondContact O-CA 3.2Å; I109-V132 PolarHBondContact N-O 3.34Å; I109-V132 PolarHBondContact O-N 2.99Å
110	L	83.7	Confident	83.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	89.1	172.9	179.9	60.3	0	0	0	109	I59 W76 K78 E80 G81 E82 V84 I113 I131	I59-L110 HydrophobicContact CD1-CD1 3.74Å; W76-L110 HydrophobicContact CE3-CD2 4.34Å; W76-L110 HydrophobicContact CZ3-CD2 4.11Å; K78-L110 HydrophobicContact CB-CD2 3.75Å; E80-L110 CarbonylContact C-O 3.57Å; E80-L110 VanDerWaalsContact CA-O 3.32Å; E80-L110 WeakPolarHBondContact CA-O 3.24Å; G81-L110 PolarHBondContact N-O 3.28Å; E82-L110 PolarHBondContact O-N 2.85Å; V84-L110 HydrophobicContact CG2-CB 4.09Å; L110-I113 HydrophobicContact CD2-CG1 4.38Å; L110-I131 HydrophobicContact CD1-CG1 4.39Å
111	A	78.9	Confident	83.4	Confident	3 Å²	3	59.6 Å²	59.6	3%	0.025	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	-36.5	-170.3	0	0	0	0	0	113.1	I109 L130 V132 W138 V141	I109-A111 VanDerWaalsContact C-N 3.33Å; I109-A111 PolarHBondContact O-N 3.14Å; A111-L130 PolarHBondContact N-O 2.87Å; A111-V132 HydrophobicContact CB-CB 4.01Å; A111-V132 HydrophobicContact CB-CG2 3.52Å; A111-W138 HydrophobicContact CB-CB 3.89Å; A111-V141 HydrophobicContact CB-CG2 3.83Å
112	K	79.3	Confident	83.2	Confident	73 Å²	73	57.6 Å²	57.6	32%	0.317	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	138.4	179.9	-164.4	158.7	-167.8	166.5	0	114.5	E80 G129 L130 I143	E80-K112 WeakPolarHBondContact OE1-CA 3.3Å; E80-K112 WeakPolarHBondContact OE1-CG 3.37Å; K112-G129 CarbonylContact O-C 3.54Å; K112-G129 VanDerWaalsContact O-CA 3.26Å; K112-G129 WeakPolarHBondContact O-CA 3.42Å; K112-L130 PolarHBondContact N-O 2.78Å; K112-L130 PolarHBondContact O-N 2.82Å; K112-I143 HydrophobicContact CD-CD1 4.29Å; K112-I143 HydrophobicContact CD-CG1 3.95Å
113	I	85.3	Confident	83.1	Confident	34 Å²	34	65.5 Å²	65.5	17%	0.174	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.9	167.8	-67.8	169.4	0	0	0	108	W76 E80 L110 V115	W76-I113 HydrophobicContact CB-CD1 4.43Å; W76-I113 HydrophobicContact CD2-CD1 3.72Å; W76-I113 HydrophobicContact CD2-CG1 4.12Å; W76-I113 HydrophobicContact CE3-CD1 4.09Å; W76-I113 HydrophobicContact CE3-CG1 4.32Å; W76-I113 HydrophobicContact CG-CD1 3.87Å; W76-I113 HydrophobicContact CH2-CG1 4.21Å; W76-I113 HydrophobicContact CZ2-CB 4.41Å; W76-I113 HydrophobicContact CZ2-CD1 4.48Å; W76-I113 HydrophobicContact CZ2-CG1 3.99Å; W76-I113 HydrophobicContact CZ2-CG2 3.79Å; W76-I113 HydrophobicContact CZ3-CG1 4.38Å; E80-I113 HydrophobicContact CG-CB 4.38Å; E80-I113 HydrophobicContact CG-CD1 4.12Å; E80-I113 HydrophobicContact CG-CG1 4.07Å; E80-I113 PolarHBondContact OE1-N 3.2Å; L110-I113 HydrophobicContact CD2-CG1 4.38Å; I113-V115 WeakPolarHBondContact CG2-O 3.32Å
114	V	80.7	Confident	83	Confident	47 Å²	47	64.5 Å²	64.5	29%	0.285	34%	0.336	S	S	.	.	S	Bend	trans	-93	-23.9	178	-179.9	0	0	0	0	110.9	L127 I128 L130 I143	V114-L127 HydrophobicContact CG1-CD2 4.45Å; V114-L127 HydrophobicContact CG2-CD2 4.12Å; V114-L127 HydrophobicContact CG2-CG 4.27Å; V114-I128 WeakPolarHBondContact CA-O 3.4Å; V114-I128 WeakPolarHBondContact CB-O 3.27Å; V114-I128 PolarHBondContact N-O 2.82Å; V114-L130 HydrophobicContact CG2-CG 4.47Å; V114-I143 HydrophobicContact CG1-CG2 4.31Å; V114-I143 HydrophobicContact CG2-CG2 4.34Å
115	V	81.9	Confident	82.9	Confident	25 Å²	25	66.4 Å²	66.4	15%	0.152	36%	0.356	C	S	.	.	S	Bend	trans	-126.6	110.7	-179.2	-175.9	0	0	0	0	110.5	I73 W76 I113 S119 I122 L127 I128	I73-V115 HydrophobicContact CD1-CB 4.08Å; I73-V115 HydrophobicContact CD1-CG1 3.9Å; W76-V115 PolarHBondContact NE1-O 3.34Å; I113-V115 WeakPolarHBondContact CG2-O 3.32Å; V115-S119 WeakPolarHBondContact CG1-OG 3.23Å; V115-I122 HydrophobicContact CG1-CD1 3.65Å; V115-I122 HydrophobicContact CG1-CG1 4.11Å; V115-L127 WeakPolarHBondContact CG2-O 3.39Å; V115-I128 PolarHBondContact N-O 2.67Å; V115-I128 VanDerWaalsContact N-O 3.13Å
116	E	81.4	Confident	82.9	Confident	153 Å²	153	63.8 Å²	63.8	72%	0.715	34%	0.338	S	S	*	.			trans	-64.8	159.8	-175	-62.6	-179.3	173.6	0	0	113.3	S119	E116-S119 WeakPolarHBondContact O-CB 3.24Å; E116-S119 PolarHBondContact O-N 2.89Å; E116-S119 PolarHBondContact O-OG 2.96Å
117	E	83.2	Confident	83	Confident	131 Å²	131	62 Å²	62	61%	0.612	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	143.7	175.7	56.6	178.9	-164.8	0	0	112.7	S119	E117-S119 VanDerWaalsContact C-N 3.27Å; E117-S119 PolarHBondContact O-N 2.98Å
118	G	78.3	Confident	83.1	Confident	42 Å²	42	57.3 Å²	57.3	43%	0.433	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-1.3	-175.2	0	0	0	0	0	115.2	I73 K120	I73-G118 VanDerWaalsContact O-CA 3.24Å; I73-G118 WeakPolarHBondContact O-CA 3.25Å; I73-G118 PolarHBondContact O-N 2.85Å; G118-K120 WeakPolarHBondContact O-CE 3.2Å; G118-K120 VanDerWaalsContact O-CG 3.3Å; G118-K120 WeakPolarHBondContact O-CG 3.45Å
119	S	81.4	Confident	83.1	Confident	37 Å²	37	57.1 Å²	57.1	26%	0.259	30%	0.301	S	S	.	.			trans	-63.3	142.5	175.2	-66.4	0	0	0	0	112.8	N72 I73 V115 E116 E117	N72-S119 CarbonylContact C-O 3.58Å; N72-S119 VanDerWaalsContact CA-O 3.3Å; N72-S119 WeakPolarHBondContact CA-O 3.09Å; N72-S119 WeakPolarHBondContact CB-O 3.32Å; I73-S119 PolarHBondContact N-O 3.12Å; V115-S119 WeakPolarHBondContact CG1-OG 3.23Å; E116-S119 WeakPolarHBondContact O-CB 3.24Å; E116-S119 PolarHBondContact O-N 2.89Å; E116-S119 PolarHBondContact O-OG 2.96Å; E117-S119 VanDerWaalsContact C-N 3.27Å; E117-S119 PolarHBondContact O-N 2.98Å
120	K	82.8	Confident	83.1	Confident	152 Å²	152	55.5 Å²	55.5	66%	0.661	29%	0.293	S	S	*	.			trans	-130.1	155.6	-167.5	-53.6	-177.7	-175.2	171.7	0	113.1	N72 G118 I122	N72-K120 HydrophobicContact CB-CB 4.5Å; N72-K120 HydrophobicContact CB-CG 4.34Å; N72-K120 WeakPolarHBondContact OD1-CA 3.46Å; N72-K120 WeakPolarHBondContact OD1-CB 3.42Å; G118-K120 WeakPolarHBondContact O-CE 3.2Å; G118-K120 VanDerWaalsContact O-CG 3.3Å; G118-K120 WeakPolarHBondContact O-CG 3.45Å; K120-I122 VanDerWaalsContact C-N 3.3Å; K120-I122 PolarHBondContact O-N 3.24Å
121	N	80.2	Confident	83.2	Confident	72 Å²	72	55.7 Å²	55.7	39%	0.385	29%	0.294	S	S	.	.			trans	56.8	39.2	177.4	-56	-0	0	0	0	112.9	E70 G71 N72 R285	E70-N121 WeakPolarHBondContact OE2-CB 3.39Å; G71-N121 PolarHBondContact O-N 3.08Å; N72-N121 PolarHBondContact OD1-N 2.87Å; N121-R285 PolarHBondContact OD1-NH1 3.4Å; N121-R285 PolarHBondContact OD1-NH2 3.09Å
122	I	85.8	Confident	83.2	Confident	17 Å²	17	55.8 Å²	55.8	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.4	178.1	-53.4	152	0	0	0	107.9	M61 E70 G71 I73 V115 K120	M61-I122 HydrophobicContact CB-CG2 4.26Å; M61-I122 HydrophobicContact CE-CB 3.71Å; M61-I122 HydrophobicContact CE-CD1 3.92Å; M61-I122 HydrophobicContact CE-CG1 4.46Å; M61-I122 HydrophobicContact CE-CG2 3.81Å; M61-I122 HydrophobicContact CG-CG2 4.36Å; E70-I122 CarbonylContact C-O 3.58Å; E70-I122 VanDerWaalsContact CA-O 3.23Å; E70-I122 WeakPolarHBondContact CA-O 3.35Å; G71-I122 PolarHBondContact N-O 2.74Å; G71-I122 WeakPolarHBondContact O-CB 3.37Å; G71-I122 PolarHBondContact O-N 2.89Å; I73-I122 HydrophobicContact CB-CD1 4.38Å; I73-I122 HydrophobicContact CD1-CD1 3.84Å; I73-I122 HydrophobicContact CG1-CD1 3.7Å; V115-I122 HydrophobicContact CG1-CD1 3.65Å; V115-I122 HydrophobicContact CG1-CG1 4.11Å; K120-I122 VanDerWaalsContact C-N 3.3Å; K120-I122 PolarHBondContact O-N 3.24Å
123	R	87	Confident	83	Confident	182 Å²	182	58.6 Å²	58.6	69%	0.687	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	151.3	-177.4	-68.3	-178	176.5	179.5	-1.8	112.1	M61 G125 S126	M61-R123 VanDerWaalsContact CB-O 3.32Å; M61-R123 WeakPolarHBondContact CB-O 3.5Å; M61-R123 WeakPolarHBondContact CG-O 3.28Å; R123-G125 PolarHBondContact O-N 3.42Å; R123-S126 VanDerWaalsContact O-CB 3.23Å; R123-S126 WeakPolarHBondContact O-CB 3.47Å; R123-S126 PolarHBondContact O-N 3.46Å; R123-S126 VanDerWaalsContact O-N 3.16Å; R123-S126 PolarHBondContact O-OG 2.94Å
124	L	87.3	Confident	81.8	Confident	66 Å²	66	65 Å²	65	35%	0.346	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	141.3	167.5	-64.1	-166.6	0	0	0	111.4	M61 P62 M68 E69 S126	M61-L124 HydrophobicContact CG-CD2 4.17Å; P62-L124 WeakPolarHBondContact O-CD2 3.4Å; M68-L124 HydrophobicContact CE-CD2 3.81Å; M68-L124 HydrophobicContact CG-CD2 4.31Å; M68-L124 VanDerWaalsContact O-CD1 3.25Å; M68-L124 WeakPolarHBondContact O-CD1 3.36Å; E69-L124 PolarHBondContact O-N 2.89Å; L124-S126 PolarHBondContact O-N 2.99Å
125	G	83.4	Confident	80.7	Confident	47 Å²	47	66.4 Å²	66.4	49%	0.485	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	-1.8	-179.2	0	0	0	0	0	115.9	M61 R123	M61-G125 PolarHBondContact O-N 3.37Å; R123-G125 PolarHBondContact O-N 3.42Å
126	S	84.6	Confident	79.6	Confident	45 Å²	45	68.5 Å²	68.5	32%	0.315	37%	0.369	S	S	.	.			trans	-70.2	141.6	173.2	-63.6	0	0	0	0	111.4	L60 M61 R123 L124 I128	L60-S126 CarbonylContact C-O 3.51Å; L60-S126 WeakPolarHBondContact CA-O 3.3Å; M61-S126 PolarHBondContact N-O 3.27Å; R123-S126 VanDerWaalsContact O-CB 3.23Å; R123-S126 WeakPolarHBondContact O-CB 3.47Å; R123-S126 PolarHBondContact O-N 3.46Å; R123-S126 VanDerWaalsContact O-N 3.16Å; R123-S126 PolarHBondContact O-OG 2.94Å; L124-S126 PolarHBondContact O-N 2.99Å; S126-I128 PolarHBondContact O-N 3.42Å
127	L	87.1	Confident	78.4	Confident	40 Å²	40	67 Å²	67	21%	0.209	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	121	176.4	-176.2	68.5	0	0	0	110.7	K58 L60 V114 V115 G129 L130	K58-L127 HydrophobicContact CB-CD1 3.72Å; K58-L127 HydrophobicContact CG-CD1 3.94Å; L60-L127 HydrophobicContact CD2-CB 4.25Å; L60-L127 HydrophobicContact CD2-CD1 3.98Å; V114-L127 HydrophobicContact CG1-CD2 4.45Å; V114-L127 HydrophobicContact CG2-CD2 4.12Å; V114-L127 HydrophobicContact CG2-CG 4.27Å; V115-L127 WeakPolarHBondContact CG2-O 3.39Å; L127-G129 WeakPolarHBondContact CD1-O 3.48Å; L127-L130 HydrophobicContact CD1-CD2 3.96Å; L127-L130 HydrophobicContact CD2-CD2 4.32Å
128	I	86.3	Confident	77.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-38.3	178.8	-69.1	-180	0	0	0	111.5	I59 M61 I73 W76 V114 V115 S126	I59-I128 HydrophobicContact CG2-CB 4.28Å; I59-I128 PolarHBondContact O-N 3.17Å; M61-I128 HydrophobicContact CB-CD1 3.74Å; M61-I128 HydrophobicContact CB-CG1 4.18Å; M61-I128 HydrophobicContact CE-CD1 3.74Å; M61-I128 HydrophobicContact CG-CD1 4.36Å; M61-I128 HydrophobicContact SD-CD1 3.88Å; I73-I128 HydrophobicContact CD1-CD1 4.29Å; I73-I128 HydrophobicContact CD1-CG1 4.38Å; I73-I128 HydrophobicContact CD1-CG2 3.68Å; W76-I128 HydrophobicContact CH2-CG2 3.58Å; W76-I128 HydrophobicContact CZ2-CG2 3.39Å; V114-I128 WeakPolarHBondContact CA-O 3.4Å; V114-I128 WeakPolarHBondContact CB-O 3.27Å; V114-I128 PolarHBondContact N-O 2.82Å; V115-I128 PolarHBondContact N-O 2.67Å; V115-I128 VanDerWaalsContact N-O 3.13Å; S126-I128 PolarHBondContact O-N 3.42Å
129	G	84.1	Confident	75.9	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	175	-173.9	0	0	0	0	0	112.7	I59 K112 L127	I59-G129 WeakPolarHBondContact CB-O 2.95Å; I59-G129 PolarHBondContact N-O 2.62Å; I59-G129 PolarHBondContact O-N 3Å; K112-G129 CarbonylContact O-C 3.54Å; K112-G129 VanDerWaalsContact O-CA 3.26Å; K112-G129 WeakPolarHBondContact O-CA 3.42Å; L127-G129 WeakPolarHBondContact CD1-O 3.48Å
130	L	83.5	Confident	74.3	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.9	-177.1	-64.5	169.7	0	0	0	110.2	P56 I57 K58 A111 K112 V114 L127 V141	P56-L130 HydrophobicContact CB-CB 4.47Å; P56-L130 HydrophobicContact CB-CD2 4.29Å; P56-L130 HydrophobicContact CG-CD2 4.38Å; I57-L130 WeakPolarHBondContact O-CA 3.17Å; K58-L130 HydrophobicContact CG-CD2 3.98Å; A111-L130 PolarHBondContact N-O 2.87Å; K112-L130 PolarHBondContact N-O 2.78Å; K112-L130 PolarHBondContact O-N 2.82Å; V114-L130 HydrophobicContact CG2-CG 4.47Å; L127-L130 HydrophobicContact CD1-CD2 3.96Å; L127-L130 HydrophobicContact CD2-CD2 4.32Å; L130-V141 HydrophobicContact CB-CG1 4.45Å; L130-V141 HydrophobicContact CD1-CG1 3.56Å
131	I	84.1	Confident	72.9	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	148.3	170.3	-65.6	169.9	0	0	0	108.5	P56 I57 I59 I109 L110	P56-I131 CarbonylContact C-O 3.57Å; I57-I131 HydrophobicContact CB-CB 4.12Å; I57-I131 PolarHBondContact N-O 3.22Å; I57-I131 PolarHBondContact O-N 2.61Å; I59-I131 HydrophobicContact CD1-CD1 3.91Å; I59-I131 HydrophobicContact CD1-CG1 3.85Å; I59-I131 HydrophobicContact CG1-CD1 3.9Å; I59-I131 HydrophobicContact CG1-CG1 4.01Å; I109-I131 WeakPolarHBondContact O-CA 3.2Å; L110-I131 HydrophobicContact CD1-CG1 4.39Å
132	V	80.7	Confident	71.3	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.024	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.8	-177.5	169.7	0	0	0	0	109.1	P56 G108 I109 A111 E136 V141	P56-V132 HydrophobicContact CB-CG2 4.05Å; G108-V132 CarbonylContact C-O 3.55Å; G108-V132 WeakPolarHBondContact CA-O 3.26Å; I109-V132 PolarHBondContact N-O 3.34Å; I109-V132 PolarHBondContact O-N 2.99Å; A111-V132 HydrophobicContact CB-CB 4.01Å; A111-V132 HydrophobicContact CB-CG2 3.52Å; V132-E136 HydrophobicContact CG1-CB 3.59Å; V132-E136 HydrophobicContact CG1-CG 4.31Å; V132-V141 HydrophobicContact CG2-CG2 3.88Å
133	E	74.8	Confident	69.6	Low	133 Å²	133	77.3 Å²	77.3	62%	0.621	40%	0.395	S	S	*	.			trans	-66.2	159.9	-177.8	-64.2	-173.4	171.3	0	0	112.9	G135	E133-G135 VanDerWaalsContact C-N 3.35Å; E133-G135 PolarHBondContact O-N 3.25Å
134	E	59.1	Low	67.9	Low	169 Å²	169	71.1 Å²	71.1	79%	0.79	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	84.8	180	-68.3	-159.7	141.9	0	0	112.6
135	G	57.3	Low	65.9	Low	76 Å²	76	78 Å²	78	78%	0.784	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	162.5	-16.3	173.6	0	0	0	0	0	115.9	E133	E133-G135 VanDerWaalsContact C-N 3.35Å; E133-G135 PolarHBondContact O-N 3.25Å
136	E	59.4	Low	63.8	Low	69 Å²	69	82.2 Å²	82.2	32%	0.322	42%	0.417	S	S	.	.	S	Bend	trans	-96.4	158.2	-176.8	-56.3	-169.6	134.3	0	0	113.9	G54 V132 W138	G54-E136 PolarHBondContact N-OE1 3.34Å; V132-E136 HydrophobicContact CG1-CB 3.59Å; V132-E136 HydrophobicContact CG1-CG 4.31Å; E136-W138 PolarHBondContact O-N 2.89Å
137	D	57.3	Low	61.9	Low	120 Å²	120	87.3 Å²	87.3	64%	0.642	45%	0.446	S	S	*	.			trans	-77.5	88.4	-175	-110.7	-45.3	0	0	0	112.4	K139 H140	D137-K139 PolarHBondContact O-N 2.94Å; D137-H140 PolarHBondContact O-N 3.44Å
138	W	55.8	Low	59.6	Low	99 Å²	99	87.7 Å²	87.7	38%	0.375	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-47.9	-24.9	176.5	60.7	-92.5	0	0	0	114.8	A111 E136 H140	A111-W138 HydrophobicContact CB-CB 3.89Å; E136-W138 PolarHBondContact O-N 2.89Å; W138-H140 VanDerWaalsContact C-N 3.3Å; W138-H140 PolarHBondContact O-N 3.06Å
139	K	53	Low	57.6	Low	138 Å²	138	93.6 Å²	93.6	60%	0.6	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-73.5	-13	-179.9	-63.8	178.1	-175.3	168.8	0	114.8	D137	D137-K139 PolarHBondContact O-N 2.94Å
140	H	46.1	Very low	56.1	Low	167 Å²	167	99.2 Å²	99.2	77%	0.773	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-124.1	26.2	-175.8	-85.6	18.7	0	0	0	113.7	D137 W138 E142	D137-H140 PolarHBondContact O-N 3.44Å; W138-H140 VanDerWaalsContact C-N 3.3Å; W138-H140 PolarHBondContact O-N 3.06Å; H140-E142 PolarHBondContact O-N 2.99Å
141	V	54.4	Low	54.4	Low	27 Å²	27	104.8 Å²	104.8	16%	0.164	57%	0.571	C	S	.	*			trans	-74.8	104.1	168.3	-174.3	0	0	0	0	110.2	P56 A111 L130 V132	P56-V141 HydrophobicContact CB-CG1 4.42Å; P56-V141 HydrophobicContact CG-CG1 4.38Å; A111-V141 HydrophobicContact CB-CG2 3.83Å; L130-V141 HydrophobicContact CB-CG1 4.45Å; L130-V141 HydrophobicContact CD1-CG1 3.56Å; V132-V141 HydrophobicContact CG2-CG2 3.88Å
142	E	47	Very low	52.6	Low	162 Å²	162	110.6 Å²	110.6	76%	0.757	61%	0.609	S	S	*	*			trans	-68	130.4	168	-65.9	-171.2	146.1	0	0	109.9	H140 P144	H140-E142 PolarHBondContact O-N 2.99Å; E142-P144 VanDerWaalsContact O-CD 3.28Å; E142-P144 WeakPolarHBondContact O-CD 3.16Å
143	I	50.5	Low	50.8	Low	75 Å²	75	116.9 Å²	116.9	39%	0.385	65%	0.647	S	S	.	*			trans	-66.8	121.6	174.3	-56	169.7	0	0	0	107.8	K112 V114 K145	K112-I143 HydrophobicContact CD-CD1 4.29Å; K112-I143 HydrophobicContact CD-CG1 3.95Å; V114-I143 HydrophobicContact CG1-CG2 4.31Å; V114-I143 HydrophobicContact CG2-CG2 4.34Å; I143-K145 PolarHBondContact O-N 3.47Å
144	P	50.8	Low	49	Very low	52 Å²	52	115.4 Å²	115.4	34%	0.338	65%	0.651	S	S	.	*			trans	-61.1	114	174.3	-22.4	34.5	0	0	0	109.8	E142 D146	E142-P144 VanDerWaalsContact O-CD 3.28Å; E142-P144 WeakPolarHBondContact O-CD 3.16Å; P144-D146 PolarHBondContact O-N 3.45Å
145	K	45	Very low	48	Very low	212 Å²	212	116.9 Å²	116.9	92%	0.922	66%	0.655	S	S	*	*			trans	-75.6	69.4	174.7	-78.8	-174.1	174.1	177.4	0	110.8	I143	I143-K145 PolarHBondContact O-N 3.47Å
146	D	40.1	Very low	47.1	Very low	135 Å²	135	119.2 Å²	119.2	72%	0.722	66%	0.656	S	S	*	*			trans	-109.1	96.8	170.8	-161.3	-4.5	0	0	0	110.1	P144	P144-D146 PolarHBondContact O-N 3.45Å
147	V	43.6	Very low	46	Very low	151 Å²	151	121.5 Å²	121.5	92%	0.915	68%	0.68	S	S	*	*			trans	-133.7	73.9	171.6	-174.3	0	0	0	0	107.8
148	G	39	Very low	45.1	Very low	49 Å²	49	125 Å²	125	51%	0.505	69%	0.692	S	S	.	*			trans	-131.4	130.9	168.3	0	0	0	0	0	110.2
149	P	45.2	Very low	44.3	Very low	123 Å²	123	126 Å²	126	80%	0.799	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.4	165.9	-19.1	32	0	0	0	109.9
150	P	51.7	Low	43.5	Very low	119 Å²	119	131 Å²	131	77%	0.773	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-58.8	141.7	176.7	25	-34	0	0	0	110.5
151	P	47.9	Very low	43.6	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-62.7	142.5	-178	26	-34.3	0	0	0	110.8
152	P	46	Very low	42.8	Very low	125 Å²	125	132.9 Å²	132.9	81%	0.812	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-63.5	139.1	179.5	26.9	-34.4	0	0	0	110.8	S154	P152-S154 PolarHBondContact O-N 2.89Å
153	V	42.4	Very low	42.8	Very low	137 Å²	137	130.3 Å²	130.3	83%	0.83	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-53.9	134.5	-178.6	-180	0	0	0	0	110.8	K155	V153-K155 PolarHBondContact O-N 3.15Å
154	S	37.3	Very low	42.4	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-55	124.8	-178.2	51.8	0	0	0	0	112.4	P152 P156	P152-S154 PolarHBondContact O-N 2.89Å; S154-P156 WeakPolarHBondContact O-CD 3.43Å
155	K	37.3	Very low	42.2	Very low	200 Å²	200	137.2 Å²	137.2	87%	0.87	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59.4	127.7	168.1	-72.6	-178.4	174.7	-178.6	0	110.2	V153	V153-K155 PolarHBondContact O-N 3.15Å
156	P	39.3	Very low	41.8	Very low	125 Å²	125	135 Å²	135	81%	0.812	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-62.5	150.1	165.5	-21.9	34.6	0	0	0	111.8	S154	S154-P156 WeakPolarHBondContact O-CD 3.43Å
157	S	35.5	Very low	41.4	Very low	117 Å²	117	134.7 Å²	134.7	82%	0.818	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-73	146.5	-177.9	-50.5	0	0	0	0	113.4	P159	S157-P159 WeakPolarHBondContact O-CD 3.3Å
158	E	38.8	Very low	40.8	Very low	193 Å²	193	133 Å²	133	90%	0.902	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-73.4	135	168.7	-69.1	-178	125	0	0	112.5
159	P	38.4	Very low	40.6	Very low	121 Å²	121	138.1 Å²	138.1	79%	0.786	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.8	146.3	151	-6.2	26.1	0	0	0	111	S157	S157-P159 WeakPolarHBondContact O-CD 3.3Å
160	R	37.3	Very low	40.8	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-72.4	138.2	-176.7	-176.8	-174.7	-64.5	174.4	-0.5	112.7
161	P	48.6	Very low	39.8	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-87	158.3	179	34.8	-36.3	0	0	0	114.7
162	S	36.9	Very low	39	Very low	118 Å²	118	140.7 Å²	140.7	83%	0.825	79%	0.786	S	S	*	*			trans	-154.8	160.2	164.2	-116.5	0	0	0	0	108.3
163	P	46.8	Very low	38.2	Very low	108 Å²	108	144.5 Å²	144.5	70%	0.701	79%	0.79	S	S	*	*				-125.9	144	-114.1	40	-29.3	0	0	0	117.9
164	E	43.4	Very low	37.7	Very low	183 Å²	183	144.7 Å²	144.7	86%	0.855	78%	0.782	S	S	*	*			trans	61.6	175	141.6	-100.3	-159.6	137.3	0	0	120
165	P	45.6	Very low	37.3	Very low	88 Å²	88	147 Å²	147	57%	0.571	78%	0.782	S	S	*	*			cis	-137.6	-173.8	-10.8	26.6	-1.6	0	0	0	116
166	Q	36.2	Very low	36.9	Very low	165 Å²	165	144.8 Å²	144.8	77%	0.771	78%	0.778	S	S	*	*			trans	79.2	149	154.9	-49.4	-157.3	-4.1	0	0	119.4
167	I	32.9	Very low	36.8	Very low	129 Å²	129	144.5 Å²	144.5	66%	0.662	78%	0.776	S	S	*	*			cis	-156.5	152.9	-16.7	-111	169.5	0	0	0	108.7	I169	I167-I169 HydrophobicContact CG2-CG1 4.49Å
168	S	30.5	Very low	36.8	Very low	117 Å²	117	141.9 Å²	141.9	82%	0.818	77%	0.767	S	S	*	*			trans	-153.1	136.8	155.5	63.8	0	0	0	0	112.1
169	I	35.5	Very low	36.5	Very low	155 Å²	155	138.6 Å²	138.6	80%	0.795	76%	0.761	S	S	*	*			trans	-110.5	141.5	-174.3	-64.4	172.9	0	0	0	109.9	I167	I167-I169 HydrophobicContact CG2-CG1 4.49Å
170	P	47.4	Very low	36.8	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	76%	0.763	S	S	*	*			trans	-99.5	167.7	-164.6	38.7	-37.7	0	0	0	115.5
171	V	31.1	Very low	37.7	Very low	152 Å²	152	139.4 Å²	139.4	92%	0.921	76%	0.759	S	S	*	*			trans	-114.7	151.1	169	178.6	0	0	0	0	111.8
172	K	31.5	Very low	38.7	Very low	144 Å²	144	137.6 Å²	137.6	63%	0.626	74%	0.739	S	S	*	*			trans	-86	151	-161.9	-179.3	-159.8	-168.9	-147	0	114.5	E174	K172-E174 WeakPolarHBondContact CE-OE1 2.96Å; K172-E174 WeakPolarHBondContact CE-OE2 3.21Å; K172-E174 IonicContact NZ-OE1 3.31Å; K172-E174 PolarHBondContact NZ-OE1 3.24Å; K172-E174 IonicContact NZ-OE2 2.7Å; K172-E174 PolarHBondContact NZ-OE2 2.83Å
173	K	29.9	Very low	40.6	Very low	206 Å²	206	140.5 Å²	140.5	90%	0.896	73%	0.732	S	S	*	*			trans	-138.2	145.8	143.1	-76.1	-165.7	176.4	-179.3	0	111.2
174	E	30.5	Very low	42.5	Very low	140 Å²	140	137.8 Å²	137.8	65%	0.654	71%	0.711	S	S	*	*			trans	-85.7	165	166.3	-87.6	120.1	159	0	0	110.6	K172	K172-E174 WeakPolarHBondContact CE-OE1 2.96Å; K172-E174 WeakPolarHBondContact CE-OE2 3.21Å; K172-E174 IonicContact NZ-OE1 3.31Å; K172-E174 PolarHBondContact NZ-OE1 3.24Å; K172-E174 IonicContact NZ-OE2 2.7Å; K172-E174 PolarHBondContact NZ-OE2 2.83Å
175	H	29.3	Very low	44.4	Very low	151 Å²	151	130.2 Å²	130.2	70%	0.699	68%	0.679	S	S	*	*			cis	129.5	131.3	4.7	-160.9	88	0	0	0	107.6
176	I	29.3	Very low	46.2	Very low	153 Å²	153	131.3 Å²	131.3	79%	0.785	69%	0.686	S	S	*	*			trans	-133.3	133.9	178.9	-62.8	176.3	0	0	0	107.2
177	P	37.1	Very low	48.5	Very low	119 Å²	119	125.6 Å²	125.6	77%	0.773	67%	0.667	S	S	*	*			trans	-86	143.8	-171.6	33.9	-35.3	0	0	0	113.3
178	G	34.8	Very low	51.1	Low	62 Å²	62	119.5 Å²	119.5	64%	0.639	64%	0.636	S	S	*	*	S	Bend	trans	152.9	114.5	173.4	0	0	0	0	0	111.8
179	T	34	Very low	53.8	Low	124 Å²	124	119.8 Å²	119.8	76%	0.761	62%	0.619	S	S	*	*	S	Bend	trans	64.9	128.5	-171.6	-43.4	0	0	0	0	114	R181	T179-R181 VanDerWaalsContact C-N 3.29Å; T179-R181 HydrophobicContact CG2-CG 4.45Å; T179-R181 PolarHBondContact O-N 3.38Å
180	L	43.4	Very low	56.2	Low	161 Å²	161	116.1 Å²	116.1	84%	0.843	60%	0.601	S	S	*	*			trans	-73.3	77.8	176.6	-72.8	173.5	0	0	0	111.8	F182	L180-F182 PolarHBondContact O-N 2.91Å
181	R	56.5	Low	58.1	Low	218 Å²	218	111.7 Å²	111.7	82%	0.823	57%	0.571	S	S	*	*			trans	-79.6	97.8	172.2	-65.3	-174.7	179.9	-167.8	-0.4	110.1	T179	T179-R181 VanDerWaalsContact C-N 3.29Å; T179-R181 HydrophobicContact CG2-CG 4.45Å; T179-R181 PolarHBondContact O-N 3.38Å
182	F	69.9	Low	60.7	Low	80 Å²	80	104.9 Å²	104.9	35%	0.351	53%	0.529	S	S	.	.			trans	-52.6	139.4	171.9	-61.9	-73.8	0	0	0	111.2	L180 L184 A199 A204 F211	L180-F182 PolarHBondContact O-N 2.91Å; F182-L184 PolarHBondContact O-N 3.11Å; F182-A199 HydrophobicContact CD2-CB 4.49Å; F182-A204 HydrophobicContact CD1-CB 3.71Å; F182-A204 HydrophobicContact CE1-CB 4.1Å; F182-A204 HydrophobicContact CG-CB 4.41Å; F182-F211 HydrophobicContact CB-CB 4.35Å
183	R	76.6	Confident	63.3	Low	179 Å²	179	104.3 Å²	104.3	68%	0.675	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	102.4	172	-66.7	-168.2	-160.7	-156.8	7	108.7	I210 F211	R183-I210 HydrophobicContact CB-CG1 4.07Å; R183-I210 CarbonylContact O-C 3.57Å; R183-I210 VanDerWaalsContact O-CA 3.32Å; R183-I210 WeakPolarHBondContact O-CA 3.27Å; R183-I210 WeakPolarHBondContact O-CG2 3.34Å; R183-F211 PolarHBondContact O-N 3.33Å
184	L	86.6	Confident	66	Low	50 Å²	50	101.6 Å²	101.6	26%	0.262	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.9	175.2	-67	177.3	0	0	0	111.3	F182 R189 L192 A199 F211	F182-L184 PolarHBondContact O-N 3.11Å; L184-R189 HydrophobicContact CB-CB 4.36Å; L184-R189 HydrophobicContact CD1-CB 4.3Å; L184-R189 HydrophobicContact CD1-CG 4.42Å; L184-L192 HydrophobicContact CD1-CD1 4.49Å; L184-L192 HydrophobicContact CD2-CD1 3.73Å; L184-A199 HydrophobicContact CD2-CB 3.71Å; L184-F211 HydrophobicContact CD2-CB 3.77Å; L184-F211 HydrophobicContact CD2-CD1 3.86Å; L184-F211 HydrophobicContact CD2-CG 4Å
185	S	84.2	Confident	68.5	Low	24 Å²	24	99 Å²	99	17%	0.168	50%	0.504	C	S	.	.			trans	-68.5	150.2	163.8	60	0	0	0	0	110.9	A187 A188 R189 F211	S185-A187 VanDerWaalsContact C-N 3.28Å; S185-A187 PolarHBondContact O-N 2.88Å; S185-A188 PolarHBondContact O-N 2.91Å; S185-A188 VanDerWaalsContact O-N 3.07Å; S185-A188 VanDerWaalsContact OG-CB 3.23Å; S185-A188 WeakPolarHBondContact OG-CB 3.37Å; S185-R189 PolarHBondContact O-N 3.38Å; S185-F211 WeakPolarHBondContact CB-O 3.32Å; S185-F211 PolarHBondContact N-O 3.16Å; S185-F211 PolarHBondContact OG-O 3.45Å
186	P	83.5	Confident	70.9	Confident	111 Å²	111	95.8 Å²	95.8	72%	0.721	50%	0.499	S	S	*	.	H	α-helix	trans	-58.1	-38	-176.4	-26.8	35.3	0	0	0	113.8	N190	P186-N190 PolarHBondContact O-N 2.88Å
187	A	83.1	Confident	73.4	Confident	46 Å²	46	89.3 Å²	89.3	38%	0.38	47%	0.466	S	S	.	.	H	α-helix	trans	-68.4	-38.3	176.1	0	0	0	0	0	112.7	S185 I191 K213	S185-A187 VanDerWaalsContact C-N 3.28Å; S185-A187 PolarHBondContact O-N 2.88Å; A187-I191 WeakPolarHBondContact O-CD1 3.11Å; A187-I191 WeakPolarHBondContact O-CG1 3.35Å; A187-I191 PolarHBondContact O-N 2.74Å; A187-K213 HydrophobicContact CB-CB 4.14Å; A187-K213 HydrophobicContact CB-CD 4.35Å; A187-K213 HydrophobicContact CB-CG 4.17Å
188	A	87.6	Confident	75.6	Confident	0 Å²	0	87.6 Å²	87.6	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-66.8	-42.9	176.8	0	0	0	0	0	112	S185 N190 I191 L192 F211 T212 A216	S185-A188 PolarHBondContact O-N 2.91Å; S185-A188 VanDerWaalsContact O-N 3.07Å; S185-A188 VanDerWaalsContact OG-CB 3.23Å; S185-A188 WeakPolarHBondContact OG-CB 3.37Å; A188-N190 PolarHBondContact O-N 2.92Å; A188-I191 PolarHBondContact O-N 2.86Å; A188-L192 WeakPolarHBondContact O-CG 3.33Å; A188-L192 PolarHBondContact O-N 3.49Å; A188-F211 HydrophobicContact CB-CD1 4.02Å; A188-T212 WeakPolarHBondContact CB-O 3.3Å; A188-A216 HydrophobicContact CB-CB 4.05Å
189	R	87	Confident	77.7	Confident	124 Å²	124	85.2 Å²	85.2	47%	0.468	42%	0.424	S	S	.	.	H	α-helix	trans	-55.4	-50.3	177.1	-178.3	179.6	-60.4	152.4	3.6	111.5	L184 S185 I191 L192 E193	L184-R189 HydrophobicContact CB-CB 4.36Å; L184-R189 HydrophobicContact CD1-CB 4.3Å; L184-R189 HydrophobicContact CD1-CG 4.42Å; S185-R189 PolarHBondContact O-N 3.38Å; R189-I191 VanDerWaalsContact C-N 3.26Å; R189-I191 PolarHBondContact O-N 3.43Å; R189-L192 PolarHBondContact O-N 2.83Å; R189-E193 VanDerWaalsContact CD-OE1 3.31Å; R189-E193 WeakPolarHBondContact CD-OE1 3.33Å; R189-E193 VanDerWaalsContact CG-CD 3.48Å; R189-E193 HydrophobicContact CG-CG 4.28Å; R189-E193 WeakPolarHBondContact CG-OE1 2.97Å; R189-E193 WeakPolarHBondContact O-CB 3.34Å; R189-E193 WeakPolarHBondContact O-CG 3.12Å; R189-E193 PolarHBondContact O-N 3.22Å
190	N	87.3	Confident	79.8	Confident	78 Å²	78	83.1 Å²	83.1	42%	0.417	42%	0.415	S	S	.	.	H	α-helix	trans	-58.8	-34.8	179.2	-163.1	-67.1	0	0	0	112.9	P186 A188 K194	P186-N190 PolarHBondContact O-N 2.88Å; A188-N190 PolarHBondContact O-N 2.92Å; N190-K194 WeakPolarHBondContact O-CB 3.24Å; N190-K194 WeakPolarHBondContact O-CD 3.49Å; N190-K194 VanDerWaalsContact O-CG 3.28Å; N190-K194 WeakPolarHBondContact O-CG 3.39Å; N190-K194 PolarHBondContact O-N 3.42Å; N190-K194 WeakPolarHBondContact OD1-CD 3.44Å; N190-K194 VanDerWaalsContact OD1-CE 3.23Å; N190-K194 WeakPolarHBondContact OD1-CE 3.37Å; N190-K194 PolarHBondContact OD1-NZ 2.87Å
191	I	86.4	Confident	81.5	Confident	24 Å²	24	78.6 Å²	78.6	12%	0.123	39%	0.389	C	S	.	.	H	α-helix	trans	-74.6	-45.5	177.5	-66.7	167.6	0	0	0	111	A187 A188 R189 K194 H195 K213 A216 L217 V220	A187-I191 WeakPolarHBondContact O-CD1 3.11Å; A187-I191 WeakPolarHBondContact O-CG1 3.35Å; A187-I191 PolarHBondContact O-N 2.74Å; A188-I191 PolarHBondContact O-N 2.86Å; R189-I191 VanDerWaalsContact C-N 3.26Å; R189-I191 PolarHBondContact O-N 3.43Å; I191-K194 PolarHBondContact O-N 2.9Å; I191-H195 PolarHBondContact O-CD2 2.79Å; I191-H195 VanDerWaalsContact O-CD2 3.24Å; I191-H195 PolarHBondContact O-N 3.17Å; I191-H195 VanDerWaalsContact O-N 3.17Å; I191-K213 HydrophobicContact CD1-CG 3.75Å; I191-A216 HydrophobicContact CB-CB 4.03Å; I191-A216 HydrophobicContact CD1-CB 4.47Å; I191-A216 HydrophobicContact CG2-CB 3.82Å; I191-L217 HydrophobicContact CD1-CD2 4.21Å; I191-L217 HydrophobicContact CD1-CG 4.16Å; I191-V220 HydrophobicContact CG2-CG2 3.91Å
192	L	87.2	Confident	82.5	Confident	8 Å²	8	69 Å²	69	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-43.4	178.9	-70	174.1	0	0	0	111.9	L184 A188 R189 K194 H195 S196 L197 A199 F211 A216 L219	L184-L192 HydrophobicContact CD1-CD1 4.49Å; L184-L192 HydrophobicContact CD2-CD1 3.73Å; A188-L192 WeakPolarHBondContact O-CG 3.33Å; A188-L192 PolarHBondContact O-N 3.49Å; R189-L192 PolarHBondContact O-N 2.83Å; L192-K194 PolarHBondContact O-N 2.79Å; L192-H195 PolarHBondContact O-N 2.73Å; L192-S196 PolarHBondContact O-N 3.49Å; L192-S196 VanDerWaalsContact O-N 3.08Å; L192-L197 HydrophobicContact CD2-CB 3.71Å; L192-L197 PolarHBondContact O-N 2.84Å; L192-L197 VanDerWaalsContact O-N 3.13Å; L192-A199 HydrophobicContact CD1-CB 3.99Å; L192-F211 HydrophobicContact CD1-CD1 4.21Å; L192-F211 HydrophobicContact CD1-CE1 3.96Å; L192-F211 HydrophobicContact CD2-CE1 4.44Å; L192-A216 HydrophobicContact CD2-CB 4.34Å; L192-A216 HydrophobicContact CG-CB 4.23Å; L192-L219 HydrophobicContact CD2-CD1 4.19Å
193	E	85.3	Confident	83	Confident	133 Å²	133	70.7 Å²	70.7	62%	0.621	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-40.9	175.2	-72.9	165.9	174.9	0	0	112.1	R189 H195	R189-E193 VanDerWaalsContact CD-OE1 3.31Å; R189-E193 WeakPolarHBondContact CD-OE1 3.33Å; R189-E193 VanDerWaalsContact CG-CD 3.48Å; R189-E193 HydrophobicContact CG-CG 4.28Å; R189-E193 WeakPolarHBondContact CG-OE1 2.97Å; R189-E193 WeakPolarHBondContact O-CB 3.34Å; R189-E193 WeakPolarHBondContact O-CG 3.12Å; R189-E193 PolarHBondContact O-N 3.22Å; E193-H195 VanDerWaalsContact C-N 3.35Å; E193-H195 PolarHBondContact O-N 2.63Å
194	K	86.4	Confident	83.3	Confident	149 Å²	149	63.1 Å²	63.1	65%	0.648	35%	0.351	S	S	*	.	H	α-helix	trans	-72.3	-21.9	179.2	-81.6	174.1	175.6	162.7	0	115.1	N190 I191 L192	N190-K194 WeakPolarHBondContact O-CB 3.24Å; N190-K194 WeakPolarHBondContact O-CD 3.49Å; N190-K194 VanDerWaalsContact O-CG 3.28Å; N190-K194 WeakPolarHBondContact O-CG 3.39Å; N190-K194 PolarHBondContact O-N 3.42Å; N190-K194 WeakPolarHBondContact OD1-CD 3.44Å; N190-K194 VanDerWaalsContact OD1-CE 3.23Å; N190-K194 WeakPolarHBondContact OD1-CE 3.37Å; N190-K194 PolarHBondContact OD1-NZ 2.87Å; I191-K194 PolarHBondContact O-N 2.9Å; L192-K194 PolarHBondContact O-N 2.79Å
195	H	83.3	Confident	83	Confident	84 Å²	84	65.4 Å²	65.4	39%	0.389	37%	0.367	S	S	.	.	H	α-helix	trans	-112.3	5.9	-177.3	-68	-64.1	0	0	0	113.9	I191 L192 E193 L197 V220 K223	I191-H195 PolarHBondContact O-CD2 2.79Å; I191-H195 VanDerWaalsContact O-CD2 3.24Å; I191-H195 PolarHBondContact O-N 3.17Å; I191-H195 VanDerWaalsContact O-N 3.17Å; L192-H195 PolarHBondContact O-N 2.73Å; E193-H195 VanDerWaalsContact C-N 3.35Å; E193-H195 PolarHBondContact O-N 2.63Å; H195-L197 HydrophobicContact CB-CD1 4.07Å; H195-L197 HydrophobicContact CB-CG 4.45Å; H195-V220 HydrophobicContact CB-CG2 4.03Å; H195-V220 VanDerWaalsContact CD2-CG2 3.43Å; H195-V220 WeakPolarHBondContact CD2-CG2 3.49Å; H195-K223 PolarHBondContact O-NZ 2.98Å
196	S	80.4	Confident	82.9	Confident	84 Å²	84	64.7 Å²	64.7	59%	0.587	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	58.4	-176.4	-58.8	0	0	0	0	111.6	L192 K223	L192-S196 PolarHBondContact O-N 3.49Å; L192-S196 VanDerWaalsContact O-N 3.08Å; S196-K223 PolarHBondContact O-NZ 3.21Å
197	L	81.6	Confident	82.2	Confident	17 Å²	17	64.7 Å²	64.7	9%	0.089	36%	0.364	C	S	.	.			trans	-123.4	139.4	-179.9	-81.5	169.3	0	0	0	110.3	L192 H195 L219 V220 K223	L192-L197 HydrophobicContact CD2-CB 3.71Å; L192-L197 PolarHBondContact O-N 2.84Å; L192-L197 VanDerWaalsContact O-N 3.13Å; H195-L197 HydrophobicContact CB-CD1 4.07Å; H195-L197 HydrophobicContact CB-CG 4.45Å; L197-L219 HydrophobicContact CD1-CB 4.11Å; L197-V220 HydrophobicContact CD1-CG2 3.84Å; L197-K223 HydrophobicContact CD1-CB 4.5Å; L197-K223 HydrophobicContact CD1-CD 4.18Å; L197-K223 HydrophobicContact CD2-CD 3.96Å; L197-K223 HydrophobicContact CG-CD 4.06Å
198	D	83.3	Confident	81.3	Confident	84 Å²	84	74.4 Å²	74.4	45%	0.449	39%	0.391	S	S	.	.			trans	-94.1	141.1	175.7	-174.7	18.6	0	0	0	111.3	S200 Q201	D198-S200 VanDerWaalsContact CG-OG 3.28Å; D198-S200 PolarHBondContact O-N 2.87Å; D198-S200 PolarHBondContact OD1-N 3.37Å; D198-S200 VanDerWaalsContact OD2-CB 3.27Å; D198-S200 WeakPolarHBondContact OD2-CB 3.4Å; D198-S200 PolarHBondContact OD2-OG 2.97Å; D198-Q201 WeakPolarHBondContact O-CB 3.3Å; D198-Q201 PolarHBondContact O-N 2.85Å; D198-Q201 VanDerWaalsContact O-N 3.16Å
199	A	78.1	Confident	80.7	Confident	11 Å²	11	76.3 Å²	76.3	9%	0.091	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-64.1	-21.6	177.1	0	0	0	0	0	112.9	F182 L184 L192 Q201 G202	F182-A199 HydrophobicContact CD2-CB 4.49Å; L184-A199 HydrophobicContact CD2-CB 3.71Å; L192-A199 HydrophobicContact CD1-CB 3.99Å; A199-Q201 PolarHBondContact O-N 2.89Å; A199-G202 PolarHBondContact O-N 3Å
200	S	79.1	Confident	80.6	Confident	81 Å²	81	73.2 Å²	73.2	57%	0.566	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-63.5	-20.7	174.2	70.1	0	0	0	0	113.8	D198 G202	D198-S200 VanDerWaalsContact CG-OG 3.28Å; D198-S200 PolarHBondContact O-N 2.87Å; D198-S200 PolarHBondContact OD1-N 3.37Å; D198-S200 VanDerWaalsContact OD2-CB 3.27Å; D198-S200 WeakPolarHBondContact OD2-CB 3.4Å; D198-S200 PolarHBondContact OD2-OG 2.97Å; S200-G202 VanDerWaalsContact C-N 3.29Å; S200-G202 PolarHBondContact O-N 3.17Å
201	Q	78.5	Confident	80.5	Confident	65 Å²	65	69.5 Å²	69.5	30%	0.304	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-82.3	-0.9	-176.6	-60.2	-175.1	-40.4	0	0	113.7	D198 A199 L219	D198-Q201 WeakPolarHBondContact O-CB 3.3Å; D198-Q201 PolarHBondContact O-N 2.85Å; D198-Q201 VanDerWaalsContact O-N 3.16Å; A199-Q201 PolarHBondContact O-N 2.89Å; Q201-L219 HydrophobicContact CB-CD1 4.39Å; Q201-L219 HydrophobicContact CB-CD2 4.47Å; Q201-L219 WeakPolarHBondContact O-CD2 3.28Å
202	G	77.4	Confident	80.6	Confident	17 Å²	17	69.8 Å²	69.8	18%	0.175	39%	0.385	C	S	.	.	S	Bend	trans	-143.7	160.4	-177.7	0	0	0	0	0	114.7	A199 S200	A199-G202 PolarHBondContact O-N 3Å; S200-G202 VanDerWaalsContact C-N 3.29Å; S200-G202 PolarHBondContact O-N 3.17Å
203	T	80.6	Confident	80.6	Confident	116 Å²	116	75.1 Å²	75.1	71%	0.712	41%	0.408	S	S	*	.			trans	-84.2	131.6	177.5	-48.9	0	0	0	0	110.7	T205	T203-T205 PolarHBondContact O-N 3.16Å
204	A	82.6	Confident	80.7	Confident	20 Å²	20	74.4 Å²	74.4	17%	0.165	40%	0.404	C	S	.	.			trans	-78.2	114.2	173.3	0	0	0	0	0	111	F182 F211	F182-A204 HydrophobicContact CD1-CB 3.71Å; F182-A204 HydrophobicContact CE1-CB 4.1Å; F182-A204 HydrophobicContact CG-CB 4.41Å; A204-F211 HydrophobicContact CB-CB 4.11Å; A204-F211 HydrophobicContact CB-CD2 3.96Å
205	T	80.8	Confident	80.7	Confident	97 Å²	97	67.6 Å²	67.6	60%	0.595	38%	0.375	S	S	*	.			trans	-95.7	-8.9	-175.6	-44.8	0	0	0	0	113	T203 D215	T203-T205 PolarHBondContact O-N 3.16Å; T205-D215 VanDerWaalsContact CB-OD1 3.24Å; T205-D215 WeakPolarHBondContact CB-OD1 3.29Å; T205-D215 PolarHBondContact N-OD2 3.09Å; T205-D215 PolarHBondContact OG1-OD1 3.39Å
206	G	80.6	Confident	80.8	Confident	9 Å²	9	63.6 Å²	63.6	9%	0.093	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-79.7	162.1	-170.1	0	0	0	0	0	115.7	R208 G209 I210	G206-R208 PolarHBondContact O-N 3.12Å; G206-G209 PolarHBondContact O-N 2.84Å; G206-I210 WeakPolarHBondContact CA-O 3.49Å; G206-I210 PolarHBondContact N-O 2.99Å; G206-I210 PolarHBondContact O-N 3.13Å
207	P	69.3	Low	81.1	Confident	111 Å²	111	63.1 Å²	63.1	72%	0.721	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	132.7	177.9	-27.1	34.9	0	0	0	112.6	G209 I210	P207-G209 VanDerWaalsContact C-N 3.27Å; P207-G209 PolarHBondContact O-N 3.38Å; P207-I210 WeakPolarHBondContact O-CD1 3.09Å; P207-I210 WeakPolarHBondContact O-CG1 3.28Å
208	R	65.6	Low	81.3	Confident	251 Å²	251	67.3 Å²	67.3	95%	0.947	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	29.7	-175.1	-57.4	177.7	172.9	158.5	-2.7	114.6	G206	G206-R208 PolarHBondContact O-N 3.12Å
209	G	75	Confident	81.3	Confident	39 Å²	39	63.6 Å²	63.6	40%	0.402	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	30.5	175.7	0	0	0	0	0	113.8	G206 P207	G206-G209 PolarHBondContact O-N 2.84Å; P207-G209 VanDerWaalsContact C-N 3.27Å; P207-G209 PolarHBondContact O-N 3.38Å
210	I	83.7	Confident	81.6	Confident	59 Å²	59	63.6 Å²	63.6	30%	0.303	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133	177.3	-69.1	173.9	0	0	0	109.3	R183 G206 P207 T212	R183-I210 HydrophobicContact CB-CG1 4.07Å; R183-I210 CarbonylContact O-C 3.57Å; R183-I210 VanDerWaalsContact O-CA 3.32Å; R183-I210 WeakPolarHBondContact O-CA 3.27Å; R183-I210 WeakPolarHBondContact O-CG2 3.34Å; G206-I210 WeakPolarHBondContact CA-O 3.49Å; G206-I210 PolarHBondContact N-O 2.99Å; G206-I210 PolarHBondContact O-N 3.13Å; P207-I210 WeakPolarHBondContact O-CD1 3.09Å; P207-I210 WeakPolarHBondContact O-CG1 3.28Å; I210-T212 PolarHBondContact O-N 2.93Å
211	F	85.9	Confident	81.8	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	117.9	175.5	-163.7	-87.3	0	0	0	109.6	F182 R183 L184 S185 A188 L192 A204 D215 A216 L219	F182-F211 HydrophobicContact CB-CB 4.35Å; R183-F211 PolarHBondContact O-N 3.33Å; L184-F211 HydrophobicContact CD2-CB 3.77Å; L184-F211 HydrophobicContact CD2-CD1 3.86Å; L184-F211 HydrophobicContact CD2-CG 4Å; S185-F211 WeakPolarHBondContact CB-O 3.32Å; S185-F211 PolarHBondContact N-O 3.16Å; S185-F211 PolarHBondContact OG-O 3.45Å; A188-F211 HydrophobicContact CB-CD1 4.02Å; L192-F211 HydrophobicContact CD1-CD1 4.21Å; L192-F211 HydrophobicContact CD1-CE1 3.96Å; L192-F211 HydrophobicContact CD2-CE1 4.44Å; A204-F211 HydrophobicContact CB-CB 4.11Å; A204-F211 HydrophobicContact CB-CD2 3.96Å; F211-D215 HydrophobicContact CD1-CB 4.03Å; F211-D215 HydrophobicContact CD2-CB 4.1Å; F211-D215 HydrophobicContact CE1-CB 3.71Å; F211-D215 HydrophobicContact CE2-CB 3.77Å; F211-D215 HydrophobicContact CG-CB 4.22Å; F211-D215 HydrophobicContact CZ-CB 3.55Å; F211-A216 HydrophobicContact CE1-CB 3.97Å; F211-L219 HydrophobicContact CE2-CD1 4.49Å; F211-L219 HydrophobicContact CZ-CD1 3.7Å; F211-L219 HydrophobicContact CZ-CG 4.29Å
212	T	88.7	Confident	81.9	Confident	30 Å²	30	65.5 Å²	65.5	18%	0.184	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-92.9	168.2	-166.7	69.6	0	0	0	0	113.3	A188 I210 E214 D215 A216	A188-T212 WeakPolarHBondContact CB-O 3.3Å; I210-T212 PolarHBondContact O-N 2.93Å; T212-E214 PolarHBondContact O-N 2.67Å; T212-E214 PolarHBondContact OG1-N 2.62Å; T212-D215 WeakPolarHBondContact CB-OD2 3.43Å; T212-D215 PolarHBondContact N-OD2 3.14Å; T212-D215 PolarHBondContact O-N 2.86Å; T212-D215 PolarHBondContact OG1-N 3.28Å; T212-D215 PolarHBondContact OG1-OD2 3.4Å; T212-A216 PolarHBondContact O-N 2.93Å; T212-A216 VanDerWaalsContact O-N 3.15Å
213	K	87.6	Confident	82	Confident	120 Å²	120	67.5 Å²	67.5	52%	0.522	35%	0.347	S	S	.	.	H	α-helix	trans	-55.3	-37.6	170.4	-173.1	-171	174.6	-172.3	0	111.6	A187 I191 L217	A187-K213 HydrophobicContact CB-CB 4.14Å; A187-K213 HydrophobicContact CB-CD 4.35Å; A187-K213 HydrophobicContact CB-CG 4.17Å; I191-K213 HydrophobicContact CD1-CG 3.75Å; K213-L217 HydrophobicContact CG-CD1 4.19Å; K213-L217 VanDerWaalsContact O-CG 3.3Å; K213-L217 WeakPolarHBondContact O-CG 3.49Å; K213-L217 PolarHBondContact O-N 2.92Å; K213-L217 VanDerWaalsContact O-N 3.08Å
214	E	87.1	Confident	81.7	Confident	118 Å²	118	68.9 Å²	68.9	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-69	-42.7	178.8	-65.2	175.8	-154.5	0	0	112	T212 A216 L217 R218	T212-E214 PolarHBondContact O-N 2.67Å; T212-E214 PolarHBondContact OG1-N 2.62Å; E214-A216 VanDerWaalsContact C-N 3.29Å; E214-A216 PolarHBondContact O-N 2.68Å; E214-L217 PolarHBondContact O-N 3.37Å; E214-L217 VanDerWaalsContact O-N 3.14Å; E214-R218 WeakPolarHBondContact O-CG 3.45Å; E214-R218 PolarHBondContact O-N 3.27Å; E214-R218 IonicContact OE2-CZ 3.76Å; E214-R218 IonicContact OE2-NH1 3.26Å; E214-R218 IonicContact OE2-NH2 3.03Å; E214-R218 PolarHBondContact OE2-NH2 2.82Å
215	D	85.8	Confident	81.1	Confident	6 Å²	6	72.7 Å²	72.7	3%	0.032	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-40.3	177.6	-55.7	-43.6	0	0	0	110.9	T205 F211 T212 R218 L219	T205-D215 VanDerWaalsContact CB-OD1 3.24Å; T205-D215 WeakPolarHBondContact CB-OD1 3.29Å; T205-D215 PolarHBondContact N-OD2 3.09Å; T205-D215 PolarHBondContact OG1-OD1 3.39Å; F211-D215 HydrophobicContact CD1-CB 4.03Å; F211-D215 HydrophobicContact CD2-CB 4.1Å; F211-D215 HydrophobicContact CE1-CB 3.71Å; F211-D215 HydrophobicContact CE2-CB 3.77Å; F211-D215 HydrophobicContact CG-CB 4.22Å; F211-D215 HydrophobicContact CZ-CB 3.55Å; T212-D215 WeakPolarHBondContact CB-OD2 3.43Å; T212-D215 PolarHBondContact N-OD2 3.14Å; T212-D215 PolarHBondContact O-N 2.86Å; T212-D215 PolarHBondContact OG1-N 3.28Å; T212-D215 PolarHBondContact OG1-OD2 3.4Å; D215-R218 PolarHBondContact O-N 2.94Å; D215-R218 IonicContact OD1-NH1 3.89Å; D215-R218 PolarHBondContact OD1-NH1 2.85Å; D215-L219 PolarHBondContact O-N 2.98Å; D215-L219 VanDerWaalsContact O-N 3.1Å
216	A	85.4	Confident	80.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-42	173.4	0	0	0	0	0	112.6	A188 I191 L192 F211 T212 E214 L219 V220	A188-A216 HydrophobicContact CB-CB 4.05Å; I191-A216 HydrophobicContact CB-CB 4.03Å; I191-A216 HydrophobicContact CD1-CB 4.47Å; I191-A216 HydrophobicContact CG2-CB 3.82Å; L192-A216 HydrophobicContact CD2-CB 4.34Å; L192-A216 HydrophobicContact CG-CB 4.23Å; F211-A216 HydrophobicContact CE1-CB 3.97Å; T212-A216 PolarHBondContact O-N 2.93Å; T212-A216 VanDerWaalsContact O-N 3.15Å; E214-A216 VanDerWaalsContact C-N 3.29Å; E214-A216 PolarHBondContact O-N 2.68Å; A216-L219 PolarHBondContact O-N 3.29Å; A216-V220 WeakPolarHBondContact O-CG2 3.36Å; A216-V220 PolarHBondContact O-N 2.81Å
217	L	86.1	Confident	79.3	Confident	74 Å²	74	78.9 Å²	78.9	39%	0.387	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-35.8	177.5	-71.3	168.1	0	0	0	112.3	I191 K213 E214 V220 Q221	I191-L217 HydrophobicContact CD1-CD2 4.21Å; I191-L217 HydrophobicContact CD1-CG 4.16Å; K213-L217 HydrophobicContact CG-CD1 4.19Å; K213-L217 VanDerWaalsContact O-CG 3.3Å; K213-L217 WeakPolarHBondContact O-CG 3.49Å; K213-L217 PolarHBondContact O-N 2.92Å; K213-L217 VanDerWaalsContact O-N 3.08Å; E214-L217 PolarHBondContact O-N 3.37Å; E214-L217 VanDerWaalsContact O-N 3.14Å; L217-V220 PolarHBondContact O-N 2.89Å; L217-Q221 WeakPolarHBondContact O-CG 3.42Å; L217-Q221 PolarHBondContact O-N 2.87Å
218	R	85.2	Confident	78.8	Confident	106 Å²	106	75.3 Å²	75.3	40%	0.4	38%	0.375	S	S	.	.	H	α-helix	trans	-61	-42.6	171.5	-70.4	171.1	-170.1	126.7	11.2	111.1	E214 D215 Q221 L222	E214-R218 WeakPolarHBondContact O-CG 3.45Å; E214-R218 PolarHBondContact O-N 3.27Å; E214-R218 IonicContact OE2-CZ 3.76Å; E214-R218 IonicContact OE2-NH1 3.26Å; E214-R218 IonicContact OE2-NH2 3.03Å; E214-R218 PolarHBondContact OE2-NH2 2.82Å; D215-R218 PolarHBondContact O-N 2.94Å; D215-R218 IonicContact OD1-NH1 3.89Å; D215-R218 PolarHBondContact OD1-NH1 2.85Å; R218-Q221 PolarHBondContact O-N 2.89Å; R218-L222 WeakPolarHBondContact O-CB 3.37Å; R218-L222 VanDerWaalsContact O-CG 3.29Å; R218-L222 WeakPolarHBondContact O-CG 3.46Å; R218-L222 PolarHBondContact O-N 3.47Å
219	L	83.8	Confident	78	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.026	37%	0.366	C	S	.	.	H	α-helix	trans	-64.3	-39.4	174.4	-69.5	-173.4	0	0	0	113	L192 L197 Q201 F211 D215 A216 L222 K223 I228	L192-L219 HydrophobicContact CD2-CD1 4.19Å; L197-L219 HydrophobicContact CD1-CB 4.11Å; Q201-L219 HydrophobicContact CB-CD1 4.39Å; Q201-L219 HydrophobicContact CB-CD2 4.47Å; Q201-L219 WeakPolarHBondContact O-CD2 3.28Å; F211-L219 HydrophobicContact CE2-CD1 4.49Å; F211-L219 HydrophobicContact CZ-CD1 3.7Å; F211-L219 HydrophobicContact CZ-CG 4.29Å; D215-L219 PolarHBondContact O-N 2.98Å; D215-L219 VanDerWaalsContact O-N 3.1Å; A216-L219 PolarHBondContact O-N 3.29Å; L219-L222 HydrophobicContact CD2-CD1 4.46Å; L219-L222 PolarHBondContact O-N 2.85Å; L219-K223 PolarHBondContact O-N 3.06Å; L219-I228 HydrophobicContact CD2-CD1 3.71Å
220	V	85.1	Confident	76.8	Confident	12 Å²	12	73.2 Å²	73.2	7%	0.073	37%	0.374	C	S	.	.	H	α-helix	trans	-62.7	-42.5	174.2	174.2	0	0	0	0	111.2	I191 H195 L197 A216 L217 L222 K223 Q224	I191-V220 HydrophobicContact CG2-CG2 3.91Å; H195-V220 HydrophobicContact CB-CG2 4.03Å; H195-V220 VanDerWaalsContact CD2-CG2 3.43Å; H195-V220 WeakPolarHBondContact CD2-CG2 3.49Å; L197-V220 HydrophobicContact CD1-CG2 3.84Å; A216-V220 WeakPolarHBondContact O-CG2 3.36Å; A216-V220 PolarHBondContact O-N 2.81Å; L217-V220 PolarHBondContact O-N 2.89Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 3.45Å; V220-K223 PolarHBondContact O-N 2.99Å; V220-Q224 WeakPolarHBondContact O-CB 3.5Å; V220-Q224 VanDerWaalsContact O-CG 3.28Å; V220-Q224 WeakPolarHBondContact O-CG 3.47Å; V220-Q224 PolarHBondContact O-N 2.92Å
221	Q	83	Confident	74.8	Confident	118 Å²	118	74.3 Å²	74.3	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-65.3	-34.6	174.6	-72.4	174	-20.8	0	0	112.7	L217 R218 Q224 T225	L217-Q221 WeakPolarHBondContact O-CG 3.42Å; L217-Q221 PolarHBondContact O-N 2.87Å; R218-Q221 PolarHBondContact O-N 2.89Å; Q221-Q224 PolarHBondContact O-N 2.61Å; Q221-T225 WeakPolarHBondContact O-CB 3.35Å; Q221-T225 WeakPolarHBondContact O-CG2 3.34Å; Q221-T225 PolarHBondContact O-N 3.28Å; Q221-T225 PolarHBondContact O-OG1 2.91Å
222	L	80.1	Confident	72.3	Confident	68 Å²	68	84.7 Å²	84.7	36%	0.356	43%	0.426	S	S	.	.	H	α-helix	trans	-73.6	-31.5	175.7	-71.9	166.7	0	0	0	113.1	R218 L219 V220 T225 G226 K227 I228	R218-L222 WeakPolarHBondContact O-CB 3.37Å; R218-L222 VanDerWaalsContact O-CG 3.29Å; R218-L222 WeakPolarHBondContact O-CG 3.46Å; R218-L222 PolarHBondContact O-N 3.47Å; L219-L222 HydrophobicContact CD2-CD1 4.46Å; L219-L222 PolarHBondContact O-N 2.85Å; V220-L222 VanDerWaalsContact C-N 3.34Å; V220-L222 PolarHBondContact O-N 3.45Å; L222-T225 WeakPolarHBondContact CA-OG1 3.08Å; L222-T225 PolarHBondContact O-OG1 2.89Å; L222-G226 PolarHBondContact O-N 2.92Å; L222-K227 HydrophobicContact CD2-CB 4.32Å; L222-K227 HydrophobicContact CD2-CD 4.43Å; L222-K227 PolarHBondContact O-N 3.47Å; L222-I228 HydrophobicContact CB-CD1 3.52Å; L222-I228 HydrophobicContact CB-CG1 3.93Å; L222-I228 HydrophobicContact CD1-CD1 4.26Å
223	K	79.3	Confident	69.9	Low	59 Å²	59	89 Å²	89	26%	0.257	46%	0.455	S	S	.	.	H	α-helix	trans	-65.5	-45.5	166.7	-169.9	173.2	-173.7	164.2	0	110.9	H195 S196 L197 L219 V220 T225 G226 E230	H195-K223 PolarHBondContact O-NZ 2.98Å; S196-K223 PolarHBondContact O-NZ 3.21Å; L197-K223 HydrophobicContact CD1-CB 4.5Å; L197-K223 HydrophobicContact CD1-CD 4.18Å; L197-K223 HydrophobicContact CD2-CD 3.96Å; L197-K223 HydrophobicContact CG-CD 4.06Å; L219-K223 PolarHBondContact O-N 3.06Å; V220-K223 PolarHBondContact O-N 2.99Å; K223-T225 VanDerWaalsContact C-N 3.34Å; K223-T225 PolarHBondContact O-N 2.9Å; K223-G226 PolarHBondContact O-N 2.74Å; K223-G226 VanDerWaalsContact O-N 3.16Å; K223-E230 WeakPolarHBondContact CE-OE1 3.39Å; K223-E230 IonicContact NZ-OE1 2.67Å; K223-E230 PolarHBondContact NZ-OE1 3.48Å
224	Q	74.7	Confident	67.2	Low	145 Å²	145	89.1 Å²	89.1	68%	0.678	47%	0.466	S	S	*	.	H	α-helix	trans	-64.9	-31.9	177.9	-73.8	170.3	-13.4	0	0	113.8	V220 Q221 G226	V220-Q224 WeakPolarHBondContact O-CB 3.5Å; V220-Q224 VanDerWaalsContact O-CG 3.28Å; V220-Q224 WeakPolarHBondContact O-CG 3.47Å; V220-Q224 PolarHBondContact O-N 2.92Å; Q221-Q224 PolarHBondContact O-N 2.61Å; Q224-G226 VanDerWaalsContact C-N 3.28Å
225	T	71.1	Confident	64.9	Low	99 Å²	99	89.2 Å²	89.2	61%	0.607	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	12.9	175.4	50.7	0	0	0	0	113.5	Q221 L222 K223 K227	Q221-T225 WeakPolarHBondContact O-CB 3.35Å; Q221-T225 WeakPolarHBondContact O-CG2 3.34Å; Q221-T225 PolarHBondContact O-N 3.28Å; Q221-T225 PolarHBondContact O-OG1 2.91Å; L222-T225 WeakPolarHBondContact CA-OG1 3.08Å; L222-T225 PolarHBondContact O-OG1 2.89Å; K223-T225 VanDerWaalsContact C-N 3.34Å; K223-T225 PolarHBondContact O-N 2.9Å; T225-K227 VanDerWaalsContact C-N 3.25Å; T225-K227 PolarHBondContact O-N 2.83Å
226	G	63.7	Low	62.6	Low	64 Å²	64	93.3 Å²	93.3	66%	0.66	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	14.2	172.2	0	0	0	0	0	115.4	L222 K223 Q224	L222-G226 PolarHBondContact O-N 2.92Å; K223-G226 PolarHBondContact O-N 2.74Å; K223-G226 VanDerWaalsContact O-N 3.16Å; Q224-G226 VanDerWaalsContact C-N 3.28Å
227	K	60.2	Low	60.5	Low	173 Å²	173	99.6 Å²	99.6	75%	0.752	55%	0.552	S	S	*	*			trans	-91.9	-4.1	-177.6	-88.1	-173.5	172.7	-179.2	0	114.8	L222 T225	L222-K227 HydrophobicContact CD2-CB 4.32Å; L222-K227 HydrophobicContact CD2-CD 4.43Å; L222-K227 PolarHBondContact O-N 3.47Å; T225-K227 VanDerWaalsContact C-N 3.25Å; T225-K227 PolarHBondContact O-N 2.83Å
228	I	57.9	Low	57.9	Low	35 Å²	35	101.1 Å²	101.1	18%	0.179	58%	0.575	C	S	.	*	S	Bend	trans	-134.4	123	176.9	-54.4	178.4	0	0	0	109.2	L219 L222	L219-I228 HydrophobicContact CD2-CD1 3.71Å; L222-I228 HydrophobicContact CB-CD1 3.52Å; L222-I228 HydrophobicContact CB-CG1 3.93Å; L222-I228 HydrophobicContact CD1-CD1 4.26Å
229	T	48.3	Very low	55.4	Low	125 Å²	125	100.8 Å²	100.8	77%	0.767	60%	0.595	S	S	*	*			trans	-86.8	145	176.9	-50.3	0	0	0	0	111.2
230	E	50.3	Low	53.1	Low	122 Å²	122	106.9 Å²	106.9	57%	0.57	63%	0.633	S	S	*	*			trans	-70.4	133.5	-179.9	-168.1	158.5	-102.9	0	0	112.4	K223 R232	K223-E230 WeakPolarHBondContact CE-OE1 3.39Å; K223-E230 IonicContact NZ-OE1 2.67Å; K223-E230 PolarHBondContact NZ-OE1 3.48Å; E230-R232 PolarHBondContact O-N 3.01Å
231	S	41.1	Very low	51.5	Low	82 Å²	82	111.6 Å²	111.6	57%	0.573	66%	0.663	S	S	*	*			trans	-80.7	72.9	-172.7	40.6	0	0	0	0	113
232	R	34.1	Very low	49	Very low	217 Å²	217	111.9 Å²	111.9	82%	0.819	67%	0.673	S	S	*	*			trans	-65.3	134.5	168	-171.4	178.4	-175.1	176.7	3.3	110.5	E230 T234	E230-R232 PolarHBondContact O-N 3.01Å; R232-T234 PolarHBondContact O-N 2.94Å
233	P	37.4	Very low	47	Very low	121 Å²	121	112.9 Å²	112.9	79%	0.786	69%	0.691	S	S	*	*			trans	-67.3	126.8	171.3	-18	31.1	0	0	0	111.3
234	T	30.6	Very low	45.4	Very low	123 Å²	123	115.9 Å²	115.9	76%	0.755	72%	0.717	S	S	*	*			trans	-107	136.7	174.4	-57.1	0	0	0	0	109.7	R232	R232-T234 PolarHBondContact O-N 2.94Å
235	P	39.2	Very low	43.8	Very low	120 Å²	120	114.1 Å²	114.1	78%	0.779	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-63.5	157.7	176.5	-22.4	34.2	0	0	0	113.8
236	A	37.3	Very low	42.5	Very low	92 Å²	92	114.7 Å²	114.7	76%	0.76	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-72.1	158.4	173.6	0	0	0	0	0	112.4
237	P	41.8	Very low	41	Very low	131 Å²	131	119.5 Å²	119.5	85%	0.851	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-77.5	160.9	-168.2	-14.8	31.5	0	0	0	115
238	A	32.8	Very low	40.3	Very low	106 Å²	106	120.5 Å²	120.5	88%	0.876	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-84.5	161.4	173.4	0	0	0	0	0	112.9
239	A	32.4	Very low	39.2	Very low	99 Å²	99	125.4 Å²	125.4	82%	0.818	78%	0.775	S	S	*	*			trans	-134.9	151.9	174.8	0	0	0	0	0	111.6
240	T	34.4	Very low	38.6	Very low	134 Å²	134	126.1 Å²	126.1	82%	0.822	78%	0.78	S	S	*	*			trans	-157.9	158.2	-176.4	38.1	0	0	0	0	109.9
241	P	51.2	Low	38.1	Very low	110 Å²	110	125.4 Å²	125.4	71%	0.714	79%	0.794	S	S	*	*			cis	-135	-176.4	-27.4	36	-18.1	0	0	0	113
242	T	30.6	Very low	38.3	Very low	124 Å²	124	124.5 Å²	124.5	76%	0.761	80%	0.798	S	S	*	*			trans	131.8	112.5	138.6	-53.4	0	0	0	0	116.8
243	A	38.3	Very low	39.1	Very low	89 Å²	89	119.2 Å²	119.2	74%	0.736	79%	0.791	S	S	*	*			trans	62.9	159.6	152.5	0	0	0	0	0	120.4
244	P	46.6	Very low	39.5	Very low	123 Å²	123	119 Å²	119	80%	0.799	79%	0.793	S	S	*	*				-127.6	158.8	-58.3	37.1	-24.9	0	0	0	113
245	S	39.8	Very low	40.6	Very low	107 Å²	107	122.7 Å²	122.7	75%	0.748	80%	0.795	S	S	*	*			trans	-84.7	157.3	173.6	167.3	0	0	0	0	111.9
246	P	43.9	Very low	41.6	Very low	111 Å²	111	122.6 Å²	122.6	72%	0.721	79%	0.794	S	S	*	*			trans	-117.3	144	136.9	34.7	-30.3	0	0	0	113.3
247	L	33.1	Very low	42.1	Very low	165 Å²	165	129.5 Å²	129.5	86%	0.864	80%	0.8	S	S	*	*			trans	67.3	115.8	160.9	-61.5	172.7	0	0	0	119.1
248	Q	46.2	Very low	42.6	Very low	194 Å²	194	128.2 Å²	128.2	91%	0.907	79%	0.792	S	S	*	*			trans	-70.2	151.9	168.4	-62.1	159.7	-19.6	0	0	111
249	T	34.5	Very low	43.7	Very low	139 Å²	139	132.3 Å²	132.3	85%	0.853	80%	0.795	S	S	*	*			trans	-129.6	148.2	152.8	-30.2	0	0	0	0	107.9
250	T	36	Very low	44.8	Very low	140 Å²	140	134 Å²	134	86%	0.859	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-68.2	141.6	-164.1	39	0	0	0	0	113.6	G252	T250-G252 PolarHBondContact O-N 3.44Å
251	A	39.8	Very low	46.1	Very low	106 Å²	106	132.7 Å²	132.7	88%	0.876	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-72.1	125.4	177.4	0	0	0	0	0	111.5
252	G	45.6	Very low	46.3	Very low	63 Å²	63	133.2 Å²	133.2	65%	0.649	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-83.7	154.3	159.6	0	0	0	0	0	111.1	T250 S254	T250-G252 PolarHBondContact O-N 3.44Å; G252-S254 PolarHBondContact O-N 3.47Å
253	P	49.2	Very low	47.6	Very low	106 Å²	106	133.6 Å²	133.6	69%	0.688	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66.6	128.7	179	27.2	-34	0	0	0	111.6	Y255	P253-Y255 HydrophobicContact CG-CE2 4.14Å; P253-Y255 PolarHBondContact O-N 2.91Å
254	S	47.3	Very low	48.5	Very low	117 Å²	117	133.4 Å²	133.4	82%	0.818	78%	0.781	S	S	*	*			trans	-82.1	104.9	177.3	43.2	0	0	0	0	111.5	G252	G252-S254 PolarHBondContact O-N 3.47Å
255	Y	52.1	Low	49	Very low	201 Å²	201	131.5 Å²	131.5	79%	0.788	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-77.4	130.5	169.5	-69.4	-86.1	0	0	0	110.6	P253 R257	P253-Y255 HydrophobicContact CG-CE2 4.14Å; P253-Y255 PolarHBondContact O-N 2.91Å; Y255-R257 PolarHBondContact O-N 3.4Å
256	P	60.6	Low	49.9	Very low	117 Å²	117	132.3 Å²	132.3	76%	0.76	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-67.5	119.7	172.1	28.2	-32.8	0	0	0	109.1	P258	P256-P258 VanDerWaalsContact O-CD 3.29Å; P256-P258 WeakPolarHBondContact O-CD 3.47Å
257	R	48.2	Very low	50.6	Low	237 Å²	237	130 Å²	130	89%	0.894	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-65.2	120.3	179.6	-165.2	-176.6	-155.6	-174	7.4	109.6	Y255 M259	Y255-R257 PolarHBondContact O-N 3.4Å; R257-M259 PolarHBondContact O-N 2.75Å
258	P	52	Low	51.6	Low	105 Å²	105	129.3 Å²	129.3	68%	0.682	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-59.7	132.3	174.2	-23.4	35	0	0	0	110.3	P256 I260	P256-P258 VanDerWaalsContact O-CD 3.29Å; P256-P258 WeakPolarHBondContact O-CD 3.47Å; P258-I260 PolarHBondContact O-N 3.27Å
259	M	55.9	Low	52.1	Low	192 Å²	192	123.1 Å²	123.1	95%	0.946	74%	0.736	S	S	*	*	S	Bend	trans	-82.8	12.2	-177.6	-154.8	167.7	71.6	0	0	113.1	R257	R257-M259 PolarHBondContact O-N 2.75Å
260	I	56.8	Low	53.3	Low	133 Å²	133	122.5 Å²	122.5	68%	0.682	74%	0.737	S	S	*	*	S	Bend	trans	-129.5	125.1	177	-52.9	174.7	0	0	0	105.9	P258	P258-I260 PolarHBondContact O-N 3.27Å
261	P	60.5	Low	54.5	Low	107 Å²	107	118.3 Å²	118.3	70%	0.695	72%	0.717	S	S	*	*			trans	-65.2	142.6	173.3	28.7	-33.8	0	0	0	109.8	V263	P261-V263 PolarHBondContact O-N 2.78Å
262	P	56	Low	55.8	Low	121 Å²	121	120.2 Å²	120.2	79%	0.786	72%	0.717	S	S	*	*			trans	-61.5	131.9	175.4	26.8	-33.8	0	0	0	109.9	S264	P262-S264 PolarHBondContact O-N 3.16Å; P262-S264 VanDerWaalsContact O-N 3.15Å
263	V	58	Low	57	Low	132 Å²	132	120.8 Å²	120.8	80%	0.8	72%	0.723	S	S	*	*			trans	-72.3	106.5	175.5	178.9	0	0	0	0	108.1	P261 T265	P261-V263 PolarHBondContact O-N 2.78Å; V263-T265 PolarHBondContact O-N 3.26Å
264	S	56	Low	58.4	Low	85 Å²	85	120.8 Å²	120.8	59%	0.594	72%	0.721	S	S	*	*			trans	-74.7	104.4	177.1	49.4	0	0	0	0	110.7	P262 P266	P262-S264 PolarHBondContact O-N 3.16Å; P262-S264 VanDerWaalsContact O-N 3.15Å; S264-P266 VanDerWaalsContact O-CD 3.31Å; S264-P266 WeakPolarHBondContact O-CD 3.24Å
265	T	58.7	Low	59.8	Low	84 Å²	84	119.8 Å²	119.8	52%	0.515	70%	0.702	S	S	.	*			trans	-68.3	113.3	166.1	37.7	0	0	0	0	109.9	V263 G267 Q268	V263-T265 PolarHBondContact O-N 3.26Å; T265-G267 PolarHBondContact O-N 2.69Å; T265-Q268 PolarHBondContact O-N 3.22Å
266	P	57	Low	61.3	Low	124 Å²	124	116.3 Å²	116.3	81%	0.805	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	126.1	-174.4	-24.2	35	0	0	0	112.3	S264 E277	S264-P266 VanDerWaalsContact O-CD 3.31Å; S264-P266 WeakPolarHBondContact O-CD 3.24Å; P266-E277 WeakPolarHBondContact CA-OE2 3.02Å
267	G	59	Low	62.2	Low	63 Å²	63	114 Å²	114	65%	0.649	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.7	-3.2	178.8	0	0	0	0	0	115.6	T265 E277	T265-G267 PolarHBondContact O-N 2.69Å; G267-E277 PolarHBondContact N-OE2 3.02Å
268	Q	55.3	Low	64	Low	150 Å²	150	109.8 Å²	109.8	70%	0.701	68%	0.675	S	S	*	*			trans	-126.4	94.7	174.1	-84.3	-168	-27.9	0	0	112.4	T265 S270	T265-Q268 PolarHBondContact O-N 3.22Å; Q268-S270 PolarHBondContact O-N 3.27Å
269	P	56.6	Low	65.6	Low	63 Å²	63	110.1 Å²	110.1	41%	0.409	68%	0.677	S	S	.	*			trans	-70	125.8	173.4	29.3	-33.7	0	0	0	110.5	A271 F275	P269-A271 PolarHBondContact O-N 2.98Å; P269-A271 VanDerWaalsContact O-N 3.12Å; P269-F275 HydrophobicContact CB-CE2 3.86Å; P269-F275 HydrophobicContact CB-CZ 3.94Å
270	S	59	Low	67	Low	127 Å²	127	104.2 Å²	104.2	89%	0.888	66%	0.659	S	S	*	*	S	Bend	trans	-64.8	-15.4	-179.6	-42.9	0	0	0	0	114.1	Q268	Q268-S270 PolarHBondContact O-N 3.27Å
271	A	60.9	Low	68.4	Low	51 Å²	51	100.5 Å²	100.5	42%	0.421	64%	0.644	S	S	.	*	S	Bend	trans	-147.4	138.3	170.1	0	0	0	0	0	109.7	P269 G273	P269-A271 PolarHBondContact O-N 2.98Å; P269-A271 VanDerWaalsContact O-N 3.12Å; A271-G273 PolarHBondContact O-N 3.16Å
272	V	66.8	Low	69.7	Low	146 Å²	146	96 Å²	96	89%	0.885	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	127.9	179.9	-177.8	0	0	0	0	109.9
273	G	72.1	Confident	71	Confident	75 Å²	75	93 Å²	93	77%	0.773	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.6	-4.7	170.4	0	0	0	0	0	116.7	A271	A271-G273 PolarHBondContact O-N 3.16Å
274	T	77.8	Confident	72.5	Confident	107 Å²	107	94.2 Å²	94.2	66%	0.656	58%	0.581	S	S	*	*	S	Bend	trans	-74.7	-32.6	177.1	-47.5	0	0	0	0	112.9
275	F	77.8	Confident	74	Confident	96 Å²	96	94.2 Å²	94.2	42%	0.421	57%	0.568	S	S	.	*			trans	-155.5	168.4	176.1	54.9	-96.5	0	0	0	110.3	P269 E277	P269-F275 HydrophobicContact CB-CE2 3.86Å; P269-F275 HydrophobicContact CB-CZ 3.94Å; F275-E277 HydrophobicContact CD2-CG 3.95Å; F275-E277 HydrophobicContact CE2-CG 3.73Å; F275-E277 WeakPolarHBondContact CE2-OE1 3.41Å
276	T	82.6	Confident	75.5	Confident	127 Å²	127	91.9 Å²	91.9	78%	0.779	55%	0.554	S	S	*	*			trans	-118.3	115.4	168	-59.5	0	0	0	0	108.3	I278	T276-I278 HydrophobicContact CG2-CG1 4.46Å
277	E	78.5	Confident	77	Confident	69 Å²	69	88.7 Å²	88.7	32%	0.322	53%	0.53	S	S	.	.			trans	-78.8	124.7	172	-90.2	174.2	-166.2	0	0	110.3	P266 G267 F275	P266-E277 WeakPolarHBondContact CA-OE2 3.02Å; G267-E277 PolarHBondContact N-OE2 3.02Å; F275-E277 HydrophobicContact CD2-CG 3.95Å; F275-E277 HydrophobicContact CE2-CG 3.73Å; F275-E277 WeakPolarHBondContact CE2-OE1 3.41Å
278	I	85.9	Confident	78.6	Confident	149 Å²	149	88.1 Å²	88.1	76%	0.764	52%	0.519	S	S	*	.			trans	-109.2	117.6	172	-58.4	176.3	0	0	0	106.9	T276 A280	T276-I278 HydrophobicContact CG2-CG1 4.46Å; I278-A280 PolarHBondContact O-N 2.88Å
279	P	86.4	Confident	80.4	Confident	112 Å²	112	86.8 Å²	86.8	73%	0.727	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-65.6	135.7	-178.5	26.5	-33.8	0	0	0	111	S281	P279-S281 PolarHBondContact O-N 3.21Å
280	A	85.3	Confident	82	Confident	67 Å²	67	89.2 Å²	89.2	55%	0.554	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-69.6	124.9	178	0	0	0	0	0	111.1	I278 R285	I278-A280 PolarHBondContact O-N 2.88Å; A280-R285 HydrophobicContact CB-CG 4.12Å
281	S	87.5	Confident	83.7	Confident	55 Å²	55	86.7 Å²	86.7	39%	0.385	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-66.7	153.3	173.9	61	0	0	0	0	111.8	P279 I283 R284 R285	P279-S281 PolarHBondContact O-N 3.21Å; S281-I283 VanDerWaalsContact C-N 3.32Å; S281-I283 PolarHBondContact O-N 3.42Å; S281-R284 PolarHBondContact O-N 3.22Å; S281-R284 WeakPolarHBondContact OG-CG 3.28Å; S281-R285 PolarHBondContact O-N 2.85Å; S281-R285 VanDerWaalsContact O-N 3.13Å
282	N	86.5	Confident	85.3	Confident	12 Å²	12	88.9 Å²	88.9	6%	0.064	50%	0.496	C	S	.	.	H	α-helix	trans	-58.1	-44.7	-172.3	-155.1	27.1	0	0	0	112.2	T95 R284 R285 V286	T95-N282 PolarHBondContact O-ND2 3.39Å; N282-R284 VanDerWaalsContact C-N 3.29Å; N282-R284 PolarHBondContact O-N 2.86Å; N282-R285 WeakPolarHBondContact O-CA 3.42Å; N282-R285 WeakPolarHBondContact O-CB 3.34Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 PolarHBondContact OD1-NE 3.3Å; N282-R285 PolarHBondContact OD1-NH2 3.15Å; N282-V286 WeakPolarHBondContact O-CG2 3.24Å; N282-V286 PolarHBondContact O-N 3.06Å
283	I	84.6	Confident	86.6	Confident	58 Å²	58	86.7 Å²	86.7	30%	0.297	48%	0.476	S	S	.	.	H	α-helix	trans	-53.1	-43.1	174.4	-60	173.6	0	0	0	111.8	S281 V286 I287	S281-I283 VanDerWaalsContact C-N 3.32Å; S281-I283 PolarHBondContact O-N 3.42Å; I283-V286 PolarHBondContact O-N 2.85Å; I283-I287 HydrophobicContact CG2-CD1 3.83Å; I283-I287 HydrophobicContact CG2-CG1 4.5Å; I283-I287 VanDerWaalsContact O-CG1 3.31Å; I283-I287 WeakPolarHBondContact O-CG1 3.33Å; I283-I287 PolarHBondContact O-N 3.04Å
284	R	87.6	Confident	87.6	Confident	158 Å²	158	83.1 Å²	83.1	60%	0.596	44%	0.439	S	S	*	.	H	α-helix	trans	-68.9	-33.9	177.6	-73.1	-174.9	-179.9	-159.3	2.1	112.4	S281 N282 A288	S281-R284 PolarHBondContact O-N 3.22Å; S281-R284 WeakPolarHBondContact OG-CG 3.28Å; N282-R284 VanDerWaalsContact C-N 3.29Å; N282-R284 PolarHBondContact O-N 2.86Å; R284-A288 VanDerWaalsContact O-CB 3.31Å; R284-A288 WeakPolarHBondContact O-CB 3.5Å; R284-A288 PolarHBondContact O-N 2.8Å
285	R	89.2	Confident	88.5	Confident	85 Å²	85	82.2 Å²	82.2	32%	0.321	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-44.6	173.2	-55.9	-169.3	-60	-172.6	9	111.1	E70 N121 A280 S281 N282 A288 K289	E70-R285 IonicContact OE1-NH2 2.67Å; E70-R285 PolarHBondContact OE1-NH2 3.45Å; N121-R285 PolarHBondContact OD1-NH1 3.4Å; N121-R285 PolarHBondContact OD1-NH2 3.09Å; A280-R285 HydrophobicContact CB-CG 4.12Å; S281-R285 PolarHBondContact O-N 2.85Å; S281-R285 VanDerWaalsContact O-N 3.13Å; N282-R285 WeakPolarHBondContact O-CA 3.42Å; N282-R285 WeakPolarHBondContact O-CB 3.34Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 PolarHBondContact OD1-NE 3.3Å; N282-R285 PolarHBondContact OD1-NH2 3.15Å; R285-A288 PolarHBondContact O-N 2.92Å; R285-K289 PolarHBondContact O-N 2.84Å
286	V	89	Confident	89.3	Confident	36 Å²	36	81.9 Å²	81.9	22%	0.218	44%	0.436	C	S	.	.	H	α-helix	trans	-64.7	-45.7	177.9	177.4	0	0	0	0	111.8	D96 N282 I283 A288 K289 R290	D96-V286 HydrophobicContact CB-CG2 4.13Å; N282-V286 WeakPolarHBondContact O-CG2 3.24Å; N282-V286 PolarHBondContact O-N 3.06Å; I283-V286 PolarHBondContact O-N 2.85Å; V286-A288 VanDerWaalsContact C-N 3.33Å; V286-A288 PolarHBondContact O-N 3.02Å; V286-K289 PolarHBondContact O-N 2.61Å; V286-R290 PolarHBondContact O-N 2.8Å; V286-R290 VanDerWaalsContact O-N 3.09Å
287	I	89.7	Confident	89.8	Confident	57 Å²	57	79.4 Å²	79.4	29%	0.292	42%	0.421	S	S	.	.	H	α-helix	trans	-60.9	-43.2	175.7	-69.3	169.6	0	0	0	110.6	I283 R290 L291	I283-I287 HydrophobicContact CG2-CD1 3.83Å; I283-I287 HydrophobicContact CG2-CG1 4.5Å; I283-I287 VanDerWaalsContact O-CG1 3.31Å; I283-I287 WeakPolarHBondContact O-CG1 3.33Å; I283-I287 PolarHBondContact O-N 3.04Å; I287-R290 PolarHBondContact O-N 2.85Å; I287-L291 HydrophobicContact CG2-CD1 3.69Å; I287-L291 HydrophobicContact CG2-CG 4.23Å; I287-L291 WeakPolarHBondContact O-CB 3.48Å; I287-L291 WeakPolarHBondContact O-CG 3.4Å; I287-L291 PolarHBondContact O-N 2.94Å
288	A	91.6	Very high	90.6	Very high	50 Å²	50	76.7 Å²	76.7	41%	0.413	41%	0.409	S	S	.	.	H	α-helix	trans	-61.8	-46.1	176.3	0	0	0	0	0	112.4	R284 R285 V286 R290 L291 T292	R284-A288 VanDerWaalsContact O-CB 3.31Å; R284-A288 WeakPolarHBondContact O-CB 3.5Å; R284-A288 PolarHBondContact O-N 2.8Å; R285-A288 PolarHBondContact O-N 2.92Å; V286-A288 VanDerWaalsContact C-N 3.33Å; V286-A288 PolarHBondContact O-N 3.02Å; A288-R290 PolarHBondContact O-N 2.86Å; A288-L291 PolarHBondContact O-N 3Å; A288-T292 WeakPolarHBondContact O-CB 3.39Å; A288-T292 PolarHBondContact O-N 3.12Å; A288-T292 PolarHBondContact O-OG1 2.91Å; A288-T292 VanDerWaalsContact O-OG1 3.04Å
289	K	92.9	Very high	91	Very high	122 Å²	122	72.5 Å²	72.5	53%	0.53	39%	0.391	S	S	.	.	H	α-helix	trans	-52.5	-52.9	175	-171.9	177.9	179.7	-178	0	110.4	E69 R285 V286 T292 E293	E69-K289 IonicContact OE2-NZ 2.83Å; E69-K289 PolarHBondContact OE2-NZ 3.31Å; R285-K289 PolarHBondContact O-N 2.84Å; V286-K289 PolarHBondContact O-N 2.61Å; K289-T292 PolarHBondContact O-N 3.5Å; K289-E293 VanDerWaalsContact O-CB 3.27Å; K289-E293 WeakPolarHBondContact O-CB 3.42Å; K289-E293 PolarHBondContact O-N 3.2Å
290	R	91.3	Very high	91.4	Very high	114 Å²	114	68.4 Å²	68.4	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-65.6	-39.6	-178.9	-70.3	-176.2	177.7	-166.2	-0.9	114.1	V286 I287 A288 S294	V286-R290 PolarHBondContact O-N 2.8Å; V286-R290 VanDerWaalsContact O-N 3.09Å; I287-R290 PolarHBondContact O-N 2.85Å; A288-R290 PolarHBondContact O-N 2.86Å; R290-S294 WeakPolarHBondContact O-CB 3.23Å; R290-S294 PolarHBondContact O-N 2.99Å
291	L	93.1	Very high	91.9	Very high	75 Å²	75	66.4 Å²	66.4	39%	0.393	34%	0.344	S	S	.	.	H	α-helix	trans	-69	-39.3	177.4	-72.5	174.2	0	0	0	111.9	I287 A288 K295 V431	I287-L291 HydrophobicContact CG2-CD1 3.69Å; I287-L291 HydrophobicContact CG2-CG 4.23Å; I287-L291 WeakPolarHBondContact O-CB 3.48Å; I287-L291 WeakPolarHBondContact O-CG 3.4Å; I287-L291 PolarHBondContact O-N 2.94Å; A288-L291 PolarHBondContact O-N 3Å; L291-K295 WeakPolarHBondContact O-CB 3.42Å; L291-K295 PolarHBondContact O-N 2.83Å; L291-V431 HydrophobicContact CD2-CB 3.97Å; L291-V431 HydrophobicContact CD2-CG1 3.86Å
292	T	95.3	Very high	92.3	Very high	97 Å²	97	68.6 Å²	68.6	60%	0.595	35%	0.345	S	S	*	.	H	α-helix	trans	-65.9	-44.1	174.1	-59.9	0	0	0	0	111.4	A288 K289 K295 S296	A288-T292 WeakPolarHBondContact O-CB 3.39Å; A288-T292 PolarHBondContact O-N 3.12Å; A288-T292 PolarHBondContact O-OG1 2.91Å; A288-T292 VanDerWaalsContact O-OG1 3.04Å; K289-T292 PolarHBondContact O-N 3.5Å; T292-K295 PolarHBondContact O-N 2.87Å; T292-S296 VanDerWaalsContact O-CB 3.31Å; T292-S296 WeakPolarHBondContact O-CB 3.15Å; T292-S296 PolarHBondContact O-N 2.91Å; T292-S296 PolarHBondContact O-OG 3.44Å
293	E	93.1	Very high	92.8	Very high	99 Å²	99	69 Å²	69	46%	0.463	35%	0.35	S	S	.	.	H	α-helix	trans	-58.4	-53.2	175.4	178	178.1	-166	0	0	111.3	K289 K295 S296 T297	K289-E293 VanDerWaalsContact O-CB 3.27Å; K289-E293 WeakPolarHBondContact O-CB 3.42Å; K289-E293 PolarHBondContact O-N 3.2Å; E293-K295 PolarHBondContact O-N 2.92Å; E293-S296 PolarHBondContact O-N 3.2Å; E293-S296 PolarHBondContact O-OG 3.01Å; E293-T297 WeakPolarHBondContact O-CB 3.44Å; E293-T297 WeakPolarHBondContact O-CG2 3.2Å; E293-T297 PolarHBondContact O-N 2.73Å; E293-T297 PolarHBondContact O-OG1 3.46Å
294	S	94.6	Very high	93.4	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-54.1	-51	174.5	178.8	0	0	0	0	111.9	R290 S296 T297 V298 V431 I432	R290-S294 WeakPolarHBondContact O-CB 3.23Å; R290-S294 PolarHBondContact O-N 2.99Å; S294-S296 VanDerWaalsContact C-N 3.3Å; S294-S296 PolarHBondContact O-N 2.95Å; S294-T297 PolarHBondContact O-N 2.91Å; S294-V298 VanDerWaalsContact O-CB 3.25Å; S294-V298 WeakPolarHBondContact O-CB 3.44Å; S294-V298 WeakPolarHBondContact O-CG2 3.45Å; S294-V298 PolarHBondContact O-N 2.95Å; S294-V431 WeakPolarHBondContact OG-CG1 3.24Å; S294-I432 WeakPolarHBondContact CB-O 3.47Å; S294-I432 PolarHBondContact OG-O 3.31Å
295	K	95.3	Very high	93.8	Very high	88 Å²	88	62.9 Å²	62.9	38%	0.383	34%	0.335	S	S	.	.	H	α-helix	trans	-77	-13.3	-172.5	-151.8	55.4	164	-174.9	0	115	L291 T292 E293 H300 Y302 V431	L291-K295 WeakPolarHBondContact O-CB 3.42Å; L291-K295 PolarHBondContact O-N 2.83Å; T292-K295 PolarHBondContact O-N 2.87Å; E293-K295 PolarHBondContact O-N 2.92Å; K295-H300 PolarHBondContact NZ-CD2 2.91Å; K295-H300 PolarHBondContact NZ-NE2 2.94Å; K295-Y302 PolarHBondContact NZ-OH 2.63Å; K295-V431 HydrophobicContact CD-CG1 4.46Å; K295-V431 HydrophobicContact CD-CG2 4.43Å
296	S	95.4	Very high	94.1	Very high	89 Å²	89	61.6 Å²	61.6	62%	0.622	34%	0.335	S	S	*	.	H	α-helix	trans	-97.5	-26.4	173.9	57.4	0	0	0	0	113.6	T292 E293 S294	T292-S296 VanDerWaalsContact O-CB 3.31Å; T292-S296 WeakPolarHBondContact O-CB 3.15Å; T292-S296 PolarHBondContact O-N 2.91Å; T292-S296 PolarHBondContact O-OG 3.44Å; E293-S296 PolarHBondContact O-N 3.2Å; E293-S296 PolarHBondContact O-OG 3.01Å; S294-S296 VanDerWaalsContact C-N 3.3Å; S294-S296 PolarHBondContact O-N 2.95Å
297	T	93.3	Very high	94.4	Very high	75 Å²	75	59.9 Å²	59.9	46%	0.46	32%	0.324	S	S	.	.	H	α-helix	trans	-102.4	-28.4	-177	62.2	0	0	0	0	114.5	E293 S294 P299 R476	E293-T297 WeakPolarHBondContact O-CB 3.44Å; E293-T297 WeakPolarHBondContact O-CG2 3.2Å; E293-T297 PolarHBondContact O-N 2.73Å; E293-T297 PolarHBondContact O-OG1 3.46Å; S294-T297 PolarHBondContact O-N 2.91Å; T297-P299 WeakPolarHBondContact O-CD 3.49Å; T297-R476 PolarHBondContact O-NH1 3.26Å
298	V	94.3	Very high	94.6	Very high	12 Å²	12	58 Å²	58	7%	0.073	31%	0.314	C	S	.	.	S	Bend	trans	-98.5	113.7	-176.7	-177.2	0	0	0	0	110.4	S294 H300 I432 D474	S294-V298 VanDerWaalsContact O-CB 3.25Å; S294-V298 WeakPolarHBondContact O-CB 3.44Å; S294-V298 WeakPolarHBondContact O-CG2 3.45Å; S294-V298 PolarHBondContact O-N 2.95Å; V298-H300 PolarHBondContact O-N 3.03Å; V298-H300 PolarHBondContact O-ND1 3Å; V298-I432 HydrophobicContact CG1-CD1 3.74Å; V298-D474 HydrophobicContact CG1-CB 3.69Å
299	P	94.4	Very high	94.6	Very high	62 Å²	62	55.6 Å²	55.6	40%	0.403	30%	0.295	S	S	.	.			trans	-70	100.4	170.1	29.9	-32.1	0	0	0	109.1	T297 S301 S475 R476	T297-P299 WeakPolarHBondContact O-CD 3.49Å; P299-S301 PolarHBondContact O-N 3.04Å; P299-S475 PolarHBondContact O-N 2.83Å; P299-S475 PolarHBondContact O-OG 3.45Å; P299-R476 HydrophobicContact CG-CG 3.73Å
300	H	95.6	Very high	94.6	Very high	25 Å²	25	51.1 Å²	51.1	12%	0.116	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.9	179.3	-70	60.3	0	0	0	110.6	K295 V298 Y302 I432 S473	K295-H300 PolarHBondContact NZ-CD2 2.91Å; K295-H300 PolarHBondContact NZ-NE2 2.94Å; V298-H300 PolarHBondContact O-N 3.03Å; V298-H300 PolarHBondContact O-ND1 3Å; H300-Y302 HydrophobicContact CB-CE1 3.94Å; H300-Y302 HydrophobicContact CB-CE2 4.37Å; H300-I432 PolarHBondContact NE2-N 2.99Å; H300-I432 VanDerWaalsContact NE2-N 3.15Å; H300-S473 WeakPolarHBondContact CA-O 3.39Å
301	S	95.7	Very high	94.6	Very high	25 Å²	25	47.5 Å²	47.5	18%	0.175	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	161.1	153.2	-175.3	0	0	0	0	110.1	P299 S472 S473 S475 D480	P299-S301 PolarHBondContact O-N 3.04Å; S301-S472 WeakPolarHBondContact O-CA 3.42Å; S301-S473 PolarHBondContact N-O 3Å; S301-S473 PolarHBondContact O-N 2.67Å; S301-S475 VanDerWaalsContact CB-OG 3.29Å; S301-S475 WeakPolarHBondContact CB-OG 3.16Å; S301-D480 WeakPolarHBondContact CB-OD1 3.32Å; S301-D480 PolarHBondContact OG-OD1 3.13Å
302	Y	96.4	Very high	94.6	Very high	102 Å²	102	43.9 Å²	43.9	40%	0.4	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.7	178.3	-42.1	-87.8	0	0	0	110	K295 H300 T429 M471 S472	K295-Y302 PolarHBondContact NZ-OH 2.63Å; H300-Y302 HydrophobicContact CB-CE1 3.94Å; H300-Y302 HydrophobicContact CB-CE2 4.37Å; Y302-T429 HydrophobicContact CD1-CG2 3.5Å; Y302-T429 VanDerWaalsContact CD1-CG2 3.5Å; Y302-T429 HydrophobicContact CE1-CG2 3.95Å; Y302-T429 HydrophobicContact CG-CG2 3.97Å; Y302-M471 WeakPolarHBondContact CA-O 3.31Å; Y302-S472 WeakPolarHBondContact CD1-OG 3.32Å
303	A	96.3	Very high	94.5	Very high	20 Å²	20	40.6 Å²	40.6	17%	0.165	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.2	172.2	0	0	0	0	0	110	T470 M471 L487	A303-T470 CarbonylContact O-C 3.56Å; A303-T470 WeakPolarHBondContact O-CA 3.43Å; A303-M471 PolarHBondContact N-O 3.44Å; A303-M471 PolarHBondContact O-N 2.92Å; A303-L487 HydrophobicContact CB-CD1 3.49Å; A303-L487 VanDerWaalsContact CB-CD1 3.49Å; A303-L487 WeakPolarHBondContact O-CD1 3.24Å
304	T	97.2	Very high	94.5	Very high	66 Å²	66	42.5 Å²	42.5	41%	0.405	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.8	-178.8	-65.2	0	0	0	0	110.7	E427 T468 V469 T470	T304-E427 WeakPolarHBondContact CB-OE1 3.43Å; T304-E427 VanDerWaalsContact CG2-OE1 3.26Å; T304-E427 WeakPolarHBondContact CG2-OE1 3.39Å; T304-E427 PolarHBondContact OG1-OE1 2.96Å; T304-T468 HydrophobicContact CG2-CG2 3.33Å; T304-V469 CarbonylContact C-O 3.47Å; T304-V469 WeakPolarHBondContact CA-O 3.39Å; T304-T470 VanDerWaalsContact OG1-CG2 3.32Å; T304-T470 WeakPolarHBondContact OG1-CG2 3.34Å; T304-T470 PolarHBondContact OG1-OG1 3.27Å
305	A	96.2	Very high	94.4	Very high	21 Å²	21	45.1 Å²	45.1	17%	0.174	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	141.2	174.6	0	0	0	0	0	112.2	V469 L487	A305-V469 HydrophobicContact CB-CG2 4.46Å; A305-V469 PolarHBondContact N-O 3.15Å; A305-V469 WeakPolarHBondContact O-CG2 3.3Å; A305-V469 PolarHBondContact O-N 3.08Å; A305-L487 HydrophobicContact CB-CB 4.38Å; A305-L487 HydrophobicContact CB-CD1 4.37Å
306	D	95.7	Very high	94.3	Very high	59 Å²	59	45.4 Å²	45.4	32%	0.316	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	131	168.4	-75.3	-25.1	0	0	0	111	R446 L466 I467 T468 K491	D306-R446 IonicContact OD1-NH2 2.68Å; D306-L466 HydrophobicContact CB-CD1 4.38Å; D306-I467 WeakPolarHBondContact CA-O 3.24Å; D306-T468 WeakPolarHBondContact OD1-CB 3.28Å; D306-T468 PolarHBondContact OD1-OG1 3.17Å; D306-K491 VanDerWaalsContact O-CE 3.24Å; D306-K491 WeakPolarHBondContact O-CE 3.38Å; D306-K491 PolarHBondContact O-NZ 2.99Å
307	C	94.6	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.4	176.5	-57.6	0	0	0	0	111.1	L466 I467 K491 L494	C307-L466 WeakPolarHBondContact O-CA 3.2Å; C307-I467 HydrophobicContact CB-CG1 4.3Å; C307-I467 PolarHBondContact N-O 3.26Å; C307-I467 PolarHBondContact O-N 3.22Å; C307-K491 HydrophobicContact CB-CG 4.42Å; C307-L494 HydrophobicContact CB-CD2 4.19Å
308	D	94.2	Very high	94.1	Very high	16 Å²	16	47.3 Å²	47.3	9%	0.086	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.7	175.8	-162.7	-23.3	0	0	0	111.9	G310 R464 L466 E495	D308-G310 PolarHBondContact OD1-N 3.14Å; D308-R464 WeakPolarHBondContact OD2-CB 3.38Å; D308-R464 WeakPolarHBondContact OD2-CD 3.44Å; D308-R464 VanDerWaalsContact OD2-CG 3.27Å; D308-R464 WeakPolarHBondContact OD2-CG 3.43Å; D308-R464 IonicContact OD2-CZ 2.72Å; D308-R464 IonicContact OD2-NE 2.72Å; D308-R464 IonicContact OD2-NH1 2.99Å; D308-R464 PolarHBondContact OD2-NH1 2.6Å; D308-L466 HydrophobicContact CB-CD2 4Å; D308-E495 HydrophobicContact CB-CG 4.22Å; D308-E495 WeakPolarHBondContact CB-OE1 3.48Å; D308-E495 PolarHBondContact N-OE1 2.95Å; D308-E495 WeakPolarHBondContact O-CG 3.45Å
309	L	92.8	Very high	93.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.			trans	-101.8	4.9	179.6	-60.7	-175.9	0	0	0	113.6	A311 V312 L313 V328 F445 Q465 I467 L494	L309-A311 PolarHBondContact O-N 2.9Å; L309-A311 VanDerWaalsContact O-N 3.11Å; L309-V312 HydrophobicContact CB-CB 4.5Å; L309-V312 HydrophobicContact CD2-CB 4.39Å; L309-V312 HydrophobicContact CD2-CG2 4.03Å; L309-V312 PolarHBondContact O-N 2.82Å; L309-V312 VanDerWaalsContact O-N 3.12Å; L309-L313 HydrophobicContact CB-CD1 4.1Å; L309-L313 HydrophobicContact CB-CG 4.23Å; L309-L313 WeakPolarHBondContact O-CB 3.34Å; L309-L313 WeakPolarHBondContact O-CG 3.39Å; L309-L313 PolarHBondContact O-N 3.23Å; L309-V328 HydrophobicContact CD1-CG1 3.87Å; L309-F445 HydrophobicContact CD1-CD1 3.78Å; L309-F445 HydrophobicContact CD1-CE1 3.39Å; L309-F445 HydrophobicContact CD1-CZ 4.37Å; L309-Q465 PolarHBondContact N-O 2.83Å; L309-I467 HydrophobicContact CD1-CB 4.3Å; L309-I467 HydrophobicContact CD1-CD1 3.98Å; L309-I467 HydrophobicContact CD1-CG1 3.86Å; L309-I467 HydrophobicContact CD1-CG2 3.56Å; L309-I467 HydrophobicContact CD2-CD1 4.14Å; L309-I467 HydrophobicContact CD2-CG1 4.2Å; L309-I467 HydrophobicContact CG-CD1 4.34Å; L309-I467 HydrophobicContact CG-CG1 4Å; L309-I467 HydrophobicContact CG-CG2 4.43Å; L309-L494 HydrophobicContact CD2-CD1 4.3Å; L309-L494 HydrophobicContact CD2-CD2 3.75Å; L309-L494 HydrophobicContact CD2-CG 3.85Å
310	G	91.3	Very high	93.7	Very high	29 Å²	29	49.3 Å²	49.3	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-55.2	-30.4	-178.9	0	0	0	0	0	114.4	D308 K314	D308-G310 PolarHBondContact OD1-N 3.14Å; G310-K314 WeakPolarHBondContact O-CG 3.27Å
311	A	92	Very high	93.6	Very high	37 Å²	37	55.4 Å²	55.4	31%	0.306	29%	0.29	S	S	.	.	H	α-helix	trans	-79.4	-48.1	173.5	0	0	0	0	0	112.5	L309 L313 K314 V315 E495 P497	L309-A311 PolarHBondContact O-N 2.9Å; L309-A311 VanDerWaalsContact O-N 3.11Å; A311-L313 VanDerWaalsContact C-N 3.26Å; A311-L313 PolarHBondContact O-N 2.82Å; A311-K314 PolarHBondContact O-N 3.22Å; A311-V315 PolarHBondContact O-N 3.41Å; A311-V315 VanDerWaalsContact O-N 3.16Å; A311-E495 WeakPolarHBondContact CB-O 3.47Å; A311-P497 HydrophobicContact CB-CG 4Å
312	V	93.4	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-54.9	-42.6	177.8	-179.8	0	0	0	0	111.3	L309 K314 V315 R316 F331 L494 P497	L309-V312 HydrophobicContact CB-CB 4.5Å; L309-V312 HydrophobicContact CD2-CB 4.39Å; L309-V312 HydrophobicContact CD2-CG2 4.03Å; L309-V312 PolarHBondContact O-N 2.82Å; L309-V312 VanDerWaalsContact O-N 3.12Å; V312-K314 PolarHBondContact O-N 3.04Å; V312-V315 PolarHBondContact O-N 2.8Å; V312-R316 VanDerWaalsContact O-CB 3.24Å; V312-R316 WeakPolarHBondContact O-CB 3.24Å; V312-R316 PolarHBondContact O-N 2.98Å; V312-F331 HydrophobicContact CG1-CB 3.91Å; V312-F331 HydrophobicContact CG1-CD1 3.96Å; V312-F331 HydrophobicContact CG1-CD2 3.7Å; V312-F331 HydrophobicContact CG1-CE1 4.37Å; V312-F331 HydrophobicContact CG1-CE2 4.13Å; V312-F331 HydrophobicContact CG1-CG 3.59Å; V312-F331 HydrophobicContact CG1-CZ 4.44Å; V312-L494 HydrophobicContact CG2-CD1 3.94Å; V312-L494 HydrophobicContact CG2-CG 4.25Å; V312-L494 WeakPolarHBondContact CG2-O 3.39Å; V312-P497 HydrophobicContact CG2-CG 4Å
313	L	92.6	Very high	92.8	Very high	27 Å²	27	60 Å²	60	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-69.7	-31.1	-177.4	-68.7	168.7	0	0	0	113.1	L309 A311 Q317 V328 Q465	L309-L313 HydrophobicContact CB-CD1 4.1Å; L309-L313 HydrophobicContact CB-CG 4.23Å; L309-L313 WeakPolarHBondContact O-CB 3.34Å; L309-L313 WeakPolarHBondContact O-CG 3.39Å; L309-L313 PolarHBondContact O-N 3.23Å; A311-L313 VanDerWaalsContact C-N 3.26Å; A311-L313 PolarHBondContact O-N 2.82Å; L313-Q317 VanDerWaalsContact O-CG 3.26Å; L313-Q317 WeakPolarHBondContact O-CG 3.48Å; L313-Q317 PolarHBondContact O-N 3.37Å; L313-V328 HydrophobicContact CD2-CG2 4Å; L313-Q465 HydrophobicContact CD1-CB 4.13Å; L313-Q465 HydrophobicContact CD1-CG 4.42Å
314	K	92.9	Very high	92.4	Very high	140 Å²	140	60.8 Å²	60.8	61%	0.609	32%	0.321	S	S	*	.	H	α-helix	trans	-67.3	-55	171.6	-70.2	172.1	-178.5	-177.7	0	110.5	G310 A311 V312 R316 Q317 D318	G310-K314 WeakPolarHBondContact O-CG 3.27Å; A311-K314 PolarHBondContact O-N 3.22Å; V312-K314 PolarHBondContact O-N 3.04Å; K314-R316 PolarHBondContact O-N 3.37Å; K314-Q317 WeakPolarHBondContact O-CA 3.29Å; K314-Q317 WeakPolarHBondContact O-CB 3.32Å; K314-Q317 PolarHBondContact O-N 2.89Å; K314-D318 PolarHBondContact O-N 3.14Å
315	V	92.9	Very high	92.1	Very high	55 Å²	55	64.3 Å²	64.3	33%	0.333	33%	0.331	S	S	.	.	H	α-helix	trans	-55.8	-39.4	177.8	176.3	0	0	0	0	111.5	A311 V312 D318 L319 F331 P497	A311-V315 PolarHBondContact O-N 3.41Å; A311-V315 VanDerWaalsContact O-N 3.16Å; V312-V315 PolarHBondContact O-N 2.8Å; V315-D318 PolarHBondContact O-N 3.21Å; V315-L319 HydrophobicContact CG1-CD1 4.05Å; V315-L319 HydrophobicContact CG1-CG 4.41Å; V315-L319 WeakPolarHBondContact O-CG 3.4Å; V315-L319 PolarHBondContact O-N 3.02Å; V315-F331 HydrophobicContact CG1-CE1 4.16Å; V315-F331 HydrophobicContact CG1-CZ 4.26Å; V315-P497 HydrophobicContact CG2-CB 4.09Å; V315-P497 HydrophobicContact CG2-CG 4.2Å
316	R	92.8	Very high	91.9	Very high	93 Å²	93	63.5 Å²	63.5	35%	0.351	32%	0.324	S	S	.	.	H	α-helix	trans	-65.3	-38.3	173.8	-176.2	178.9	173.7	-116.2	-10.9	113.3	V312 K314 D318 V320 V326 F331	V312-R316 VanDerWaalsContact O-CB 3.24Å; V312-R316 WeakPolarHBondContact O-CB 3.24Å; V312-R316 PolarHBondContact O-N 2.98Å; K314-R316 PolarHBondContact O-N 3.37Å; R316-D318 VanDerWaalsContact C-N 3.31Å; R316-V320 WeakPolarHBondContact O-CB 3.34Å; R316-V320 WeakPolarHBondContact O-CG2 3.03Å; R316-V320 PolarHBondContact O-N 3.27Å; R316-V320 VanDerWaalsContact O-N 3.17Å; R316-V326 PolarHBondContact NE-O 2.67Å; R316-V326 PolarHBondContact NH2-O 3.03Å; R316-F331 HydrophobicContact CB-CE2 3.93Å; R316-F331 HydrophobicContact CB-CZ 4.22Å; R316-F331 HydrophobicContact CG-CE2 4.25Å
317	Q	92.6	Very high	91.7	Very high	130 Å²	130	62.6 Å²	62.6	61%	0.607	32%	0.322	S	S	*	.	H	α-helix	trans	-67	-33.4	174.2	-76.7	170.7	5.3	0	0	111.9	L313 K314 K321	L313-Q317 VanDerWaalsContact O-CG 3.26Å; L313-Q317 WeakPolarHBondContact O-CG 3.48Å; L313-Q317 PolarHBondContact O-N 3.37Å; K314-Q317 WeakPolarHBondContact O-CA 3.29Å; K314-Q317 WeakPolarHBondContact O-CB 3.32Å; K314-Q317 PolarHBondContact O-N 2.89Å; Q317-K321 WeakPolarHBondContact O-CE 3.48Å; Q317-K321 WeakPolarHBondContact O-CG 3.26Å
318	D	91.9	Very high	91.6	Very high	75 Å²	75	63.2 Å²	63.2	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-71.2	-52.1	176.5	-63	-43	0	0	0	111.2	K314 V315 R316 V320 K321 D322	K314-D318 PolarHBondContact O-N 3.14Å; V315-D318 PolarHBondContact O-N 3.21Å; R316-D318 VanDerWaalsContact C-N 3.31Å; D318-V320 PolarHBondContact O-N 2.91Å; D318-V320 VanDerWaalsContact O-N 3.12Å; D318-K321 VanDerWaalsContact O-CB 3.28Å; D318-K321 WeakPolarHBondContact O-CB 3.46Å; D318-K321 PolarHBondContact O-N 3.06Å; D318-K321 IonicContact OD1-NZ 2.64Å; D318-K321 PolarHBondContact OD1-NZ 2.62Å; D318-D322 PolarHBondContact O-N 2.77Å
319	L	90.5	Very high	91.6	Very high	42 Å²	42	63.6 Å²	63.6	22%	0.22	33%	0.328	C	S	.	.	H	α-helix	trans	-56.6	-30.9	176	-68.7	171.6	0	0	0	113.6	V315 K321 D322 I324 V326 F331	V315-L319 HydrophobicContact CG1-CD1 4.05Å; V315-L319 HydrophobicContact CG1-CG 4.41Å; V315-L319 WeakPolarHBondContact O-CG 3.4Å; V315-L319 PolarHBondContact O-N 3.02Å; L319-K321 VanDerWaalsContact C-N 3.33Å; L319-D322 PolarHBondContact O-N 3.44Å; L319-I324 HydrophobicContact CB-CB 4.32Å; L319-I324 HydrophobicContact CB-CD1 4.42Å; L319-I324 HydrophobicContact CD2-CD1 3.7Å; L319-I324 VanDerWaalsContact O-CB 3.28Å; L319-I324 WeakPolarHBondContact O-CB 3.4Å; L319-I324 PolarHBondContact O-N 2.93Å; L319-V326 HydrophobicContact CD1-CG2 4.22Å; L319-F331 HydrophobicContact CD1-CZ 3.99Å
320	V	91.3	Very high	91.7	Very high	74 Å²	74	63.8 Å²	63.8	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-73.5	-21.4	176.3	166.2	0	0	0	0	112.8	R316 D318 D322 D323	R316-V320 WeakPolarHBondContact O-CB 3.34Å; R316-V320 WeakPolarHBondContact O-CG2 3.03Å; R316-V320 PolarHBondContact O-N 3.27Å; R316-V320 VanDerWaalsContact O-N 3.17Å; D318-V320 PolarHBondContact O-N 2.91Å; D318-V320 VanDerWaalsContact O-N 3.12Å; V320-D322 VanDerWaalsContact C-N 3.32Å; V320-D323 PolarHBondContact O-N 3.31Å
321	K	91.6	Very high	91.9	Very high	152 Å²	152	62.5 Å²	62.5	66%	0.661	32%	0.315	S	S	*	.	H	α-helix	trans	-70.7	-33	169.5	-61.2	161.4	-165.5	168.3	0	111.1	Q317 D318 L319 D323	Q317-K321 WeakPolarHBondContact O-CE 3.48Å; Q317-K321 WeakPolarHBondContact O-CG 3.26Å; D318-K321 VanDerWaalsContact O-CB 3.28Å; D318-K321 WeakPolarHBondContact O-CB 3.46Å; D318-K321 PolarHBondContact O-N 3.06Å; D318-K321 IonicContact OD1-NZ 2.64Å; D318-K321 PolarHBondContact OD1-NZ 2.62Å; L319-K321 VanDerWaalsContact C-N 3.33Å; K321-D323 PolarHBondContact O-N 2.74Å
322	D	88.9	Confident	92.1	Very high	113 Å²	113	60.8 Å²	60.8	60%	0.604	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	14.8	175.2	-52.2	-35.8	0	0	0	112.6	D318 L319 V320 I324	D318-D322 PolarHBondContact O-N 2.77Å; L319-D322 PolarHBondContact O-N 3.44Å; V320-D322 VanDerWaalsContact C-N 3.32Å; D322-I324 HydrophobicContact CB-CD1 3.83Å; D322-I324 HydrophobicContact CB-CG1 4.13Å; D322-I324 PolarHBondContact O-N 2.7Å
323	D	87.6	Confident	92.2	Very high	112 Å²	112	60.8 Å²	60.8	60%	0.599	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	8.8	-174.6	-156.9	46.6	0	0	0	116.6	V320 K321 K325	V320-D323 PolarHBondContact O-N 3.31Å; K321-D323 PolarHBondContact O-N 2.74Å; D323-K325 PolarHBondContact O-N 2.64Å; D323-K325 PolarHBondContact O-NZ 2.61Å; D323-K325 VanDerWaalsContact O-NZ 3.17Å; D323-K325 IonicContact OD1-NZ 2.95Å; D323-K325 PolarHBondContact OD1-NZ 3.15Å; D323-K325 IonicContact OD2-NZ 3.84Å; D323-K325 PolarHBondContact OD2-NZ 2.67Å
324	I	87.6	Confident	92.4	Very high	35 Å²	35	59.9 Å²	59.9	18%	0.179	30%	0.296	C	S	.	.			trans	-80.5	105.3	-178.3	-49	159.4	0	0	0	109.9	L319 D322 V326 Q387	L319-I324 HydrophobicContact CB-CB 4.32Å; L319-I324 HydrophobicContact CB-CD1 4.42Å; L319-I324 HydrophobicContact CD2-CD1 3.7Å; L319-I324 VanDerWaalsContact O-CB 3.28Å; L319-I324 WeakPolarHBondContact O-CB 3.4Å; L319-I324 PolarHBondContact O-N 2.93Å; D322-I324 HydrophobicContact CB-CD1 3.83Å; D322-I324 HydrophobicContact CB-CG1 4.13Å; D322-I324 PolarHBondContact O-N 2.7Å; I324-V326 HydrophobicContact CB-CG2 4.48Å; I324-V326 HydrophobicContact CG2-CG2 3.64Å; I324-V326 PolarHBondContact O-N 3.23Å; I324-Q387 HydrophobicContact CG2-CB 4.45Å; I324-Q387 HydrophobicContact CG2-CG 3.66Å
325	K	90	Very high	92.6	Very high	140 Å²	140	53.2 Å²	53.2	61%	0.609	27%	0.267	S	S	*	.			trans	-85	69.7	-169.8	-67.5	174.2	-170.7	74.9	0	113.4	D323	D323-K325 PolarHBondContact O-N 2.64Å; D323-K325 PolarHBondContact O-NZ 2.61Å; D323-K325 VanDerWaalsContact O-NZ 3.17Å; D323-K325 IonicContact OD1-NZ 2.95Å; D323-K325 PolarHBondContact OD1-NZ 3.15Å; D323-K325 IonicContact OD2-NZ 3.84Å; D323-K325 PolarHBondContact OD2-NZ 2.67Å
326	V	92.1	Very high	92.7	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.024	25%	0.251	C	S	.	.			trans	-85.4	144.4	180	-166.1	0	0	0	0	112.6	R316 L319 I324 D330 F331 I386	R316-V326 PolarHBondContact NE-O 2.67Å; R316-V326 PolarHBondContact NH2-O 3.03Å; L319-V326 HydrophobicContact CD1-CG2 4.22Å; I324-V326 HydrophobicContact CB-CG2 4.48Å; I324-V326 HydrophobicContact CG2-CG2 3.64Å; I324-V326 PolarHBondContact O-N 3.23Å; V326-D330 HydrophobicContact CG1-CB 3.97Å; V326-F331 HydrophobicContact CB-CE2 4.24Å; V326-F331 HydrophobicContact CG1-CD2 3.94Å; V326-F331 HydrophobicContact CG1-CE2 3.48Å; V326-F331 VanDerWaalsContact CG1-CE2 3.48Å; V326-F331 HydrophobicContact CG1-CZ 4.19Å; V326-I386 HydrophobicContact CG1-CG2 3.59Å
327	S	92.5	Very high	92.9	Very high	41 Å²	41	46.1 Å²	46.1	29%	0.287	23%	0.234	S	C	.	.			trans	-103.8	161.3	169.4	84.5	0	0	0	0	111.8	N329 D330 F331	S327-N329 PolarHBondContact O-N 3.37Å; S327-N329 WeakPolarHBondContact OG-CB 3.25Å; S327-N329 PolarHBondContact OG-N 2.93Å; S327-D330 WeakPolarHBondContact CA-OD2 3.32Å; S327-D330 VanDerWaalsContact CB-OD2 3.23Å; S327-D330 WeakPolarHBondContact CB-OD2 3.1Å; S327-D330 PolarHBondContact N-OD2 3.43Å; S327-D330 PolarHBondContact O-N 3.23Å; S327-D330 VanDerWaalsContact OG-CG 3.24Å; S327-D330 PolarHBondContact OG-OD2 3Å; S327-F331 WeakPolarHBondContact O-CD2 3.42Å
328	V	92.9	Very high	93	Very high	13 Å²	13	41 Å²	41	8%	0.079	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-26.5	175	-179.5	0	0	0	0	111.8	L309 L313 D330 F331 I332 F445	L309-V328 HydrophobicContact CD1-CG1 3.87Å; L313-V328 HydrophobicContact CD2-CG2 4Å; V328-D330 PolarHBondContact O-N 2.95Å; V328-F331 PolarHBondContact O-N 3.47Å; V328-I332 HydrophobicContact CG1-CD1 4.15Å; V328-I332 WeakPolarHBondContact O-CG1 3.22Å; V328-I332 PolarHBondContact O-N 2.72Å; V328-I332 VanDerWaalsContact O-N 3.15Å; V328-F445 HydrophobicContact CB-CE1 4.26Å; V328-F445 HydrophobicContact CB-CZ 3.86Å; V328-F445 HydrophobicContact CG1-CE1 3.93Å; V328-F445 HydrophobicContact CG1-CZ 3.82Å; V328-F445 HydrophobicContact CG2-CE1 3.96Å; V328-F445 HydrophobicContact CG2-CZ 3.86Å
329	N	94.1	Very high	93.2	Very high	23 Å²	23	37.4 Å²	37.4	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-31.9	178.9	-159	77.9	0	0	0	112	S327 I332 I333 N419	S327-N329 PolarHBondContact O-N 3.37Å; S327-N329 WeakPolarHBondContact OG-CB 3.25Å; S327-N329 PolarHBondContact OG-N 2.93Å; N329-I332 WeakPolarHBondContact O-CB 3.38Å; N329-I332 PolarHBondContact O-N 2.99Å; N329-I333 WeakPolarHBondContact ND2-CD1 3.45Å; N329-I333 WeakPolarHBondContact O-CD1 3.22Å; N329-I333 VanDerWaalsContact O-CG1 3.28Å; N329-I333 WeakPolarHBondContact O-CG1 3.34Å; N329-I333 PolarHBondContact O-N 2.89Å; N329-N419 PolarHBondContact OD1-ND2 3.04Å
330	D	94.9	Very high	93.5	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-73.6	-36.3	-177.7	-47.1	-50.9	0	0	0	111.3	V326 S327 V328 I333 K334 I386 I389 A390	V326-D330 HydrophobicContact CG1-CB 3.97Å; S327-D330 WeakPolarHBondContact CA-OD2 3.32Å; S327-D330 VanDerWaalsContact CB-OD2 3.23Å; S327-D330 WeakPolarHBondContact CB-OD2 3.1Å; S327-D330 PolarHBondContact N-OD2 3.43Å; S327-D330 PolarHBondContact O-N 3.23Å; S327-D330 VanDerWaalsContact OG-CG 3.24Å; S327-D330 PolarHBondContact OG-OD2 3Å; V328-D330 PolarHBondContact O-N 2.95Å; D330-I333 PolarHBondContact O-N 2.79Å; D330-K334 PolarHBondContact O-N 3.24Å; D330-I386 HydrophobicContact CB-CG2 4.09Å; D330-I389 HydrophobicContact CB-CG2 4.09Å; D330-A390 HydrophobicContact CB-CB 4.22Å; D330-A390 WeakPolarHBondContact OD2-CB 3.27Å
331	F	95.1	Very high	93.6	Very high	2 Å²	2	39 Å²	39	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-39.4	168.4	-68.7	-88	0	0	0	111.9	V312 V315 R316 L319 V326 S327 V328 K334 A335 I386 L494 L500	V312-F331 HydrophobicContact CG1-CB 3.91Å; V312-F331 HydrophobicContact CG1-CD1 3.96Å; V312-F331 HydrophobicContact CG1-CD2 3.7Å; V312-F331 HydrophobicContact CG1-CE1 4.37Å; V312-F331 HydrophobicContact CG1-CE2 4.13Å; V312-F331 HydrophobicContact CG1-CG 3.59Å; V312-F331 HydrophobicContact CG1-CZ 4.44Å; V315-F331 HydrophobicContact CG1-CE1 4.16Å; V315-F331 HydrophobicContact CG1-CZ 4.26Å; R316-F331 HydrophobicContact CB-CE2 3.93Å; R316-F331 HydrophobicContact CB-CZ 4.22Å; R316-F331 HydrophobicContact CG-CE2 4.25Å; L319-F331 HydrophobicContact CD1-CZ 3.99Å; V326-F331 HydrophobicContact CB-CE2 4.24Å; V326-F331 HydrophobicContact CG1-CD2 3.94Å; V326-F331 HydrophobicContact CG1-CE2 3.48Å; V326-F331 VanDerWaalsContact CG1-CE2 3.48Å; V326-F331 HydrophobicContact CG1-CZ 4.19Å; S327-F331 WeakPolarHBondContact O-CD2 3.42Å; V328-F331 PolarHBondContact O-N 3.47Å; F331-K334 PolarHBondContact O-N 2.78Å; F331-A335 WeakPolarHBondContact O-CB 3.36Å; F331-A335 PolarHBondContact O-N 2.82Å; F331-I386 HydrophobicContact CD1-CD1 3.88Å; F331-I386 HydrophobicContact CE1-CD1 3.93Å; F331-L494 HydrophobicContact CB-CD1 4.31Å; F331-L500 HydrophobicContact CD1-CD1 4.15Å
332	I	95.8	Very high	93.7	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-65.9	-42	176.7	-70.7	170	0	0	0	111.1	V328 N329 A335 A336 I417 L440 V442 I467 F490 L494	V328-I332 HydrophobicContact CG1-CD1 4.15Å; V328-I332 WeakPolarHBondContact O-CG1 3.22Å; V328-I332 PolarHBondContact O-N 2.72Å; V328-I332 VanDerWaalsContact O-N 3.15Å; N329-I332 WeakPolarHBondContact O-CB 3.38Å; N329-I332 PolarHBondContact O-N 2.99Å; I332-A335 PolarHBondContact O-N 2.85Å; I332-A336 WeakPolarHBondContact O-CB 3.32Å; I332-A336 PolarHBondContact O-N 2.89Å; I332-I417 HydrophobicContact CG2-CD1 4.31Å; I332-I417 HydrophobicContact CG2-CG2 4.36Å; I332-L440 HydrophobicContact CG2-CD2 4.37Å; I332-V442 HydrophobicContact CD1-CG1 3.87Å; I332-V442 HydrophobicContact CD1-CG2 4.32Å; I332-V442 HydrophobicContact CG2-CG2 4.21Å; I332-I467 HydrophobicContact CD1-CD1 3.89Å; I332-F490 HydrophobicContact CG2-CE2 4.37Å; I332-F490 HydrophobicContact CG2-CZ 4.13Å; I332-L494 HydrophobicContact CG1-CD1 4.23Å; I332-L494 HydrophobicContact CG1-CD2 4.26Å
333	I	96.4	Very high	94	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-50.5	174.2	-69.5	157	0	0	0	110.5	N329 D330 A335 A336 A337 I363 V365 I378 A381 I389 V393 I417	N329-I333 WeakPolarHBondContact ND2-CD1 3.45Å; N329-I333 WeakPolarHBondContact O-CD1 3.22Å; N329-I333 VanDerWaalsContact O-CG1 3.28Å; N329-I333 WeakPolarHBondContact O-CG1 3.34Å; N329-I333 PolarHBondContact O-N 2.89Å; D330-I333 PolarHBondContact O-N 2.79Å; I333-A335 PolarHBondContact O-N 3.45Å; I333-A336 PolarHBondContact O-N 2.67Å; I333-A337 WeakPolarHBondContact O-CB 3.11Å; I333-A337 PolarHBondContact O-N 3.03Å; I333-I363 HydrophobicContact CG1-CG2 4.43Å; I333-I363 HydrophobicContact CG2-CB 4.47Å; I333-I363 HydrophobicContact CG2-CD1 4.03Å; I333-I363 HydrophobicContact CG2-CG2 4.34Å; I333-I363 WeakPolarHBondContact O-CD1 3.39Å; I333-V365 HydrophobicContact CD1-CG2 3.83Å; I333-V365 HydrophobicContact CG1-CG2 4.23Å; I333-I378 HydrophobicContact CD1-CD1 3.69Å; I333-I378 HydrophobicContact CG1-CD1 4.35Å; I333-I378 HydrophobicContact CG2-CD1 3.91Å; I333-A381 HydrophobicContact CG2-CB 4.11Å; I333-I389 HydrophobicContact CB-CG2 4.05Å; I333-I389 HydrophobicContact CD1-CG2 4.08Å; I333-I389 HydrophobicContact CG2-CD1 4.38Å; I333-I389 HydrophobicContact CG2-CG2 3.73Å; I333-V393 HydrophobicContact CD1-CG2 3.62Å; I333-I417 HydrophobicContact CG1-CD1 4.12Å
334	K	96.1	Very high	94.3	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.03	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-41.2	178.2	-174.7	68.4	173.5	-173.9	0	111.7	D330 F331 A337 V338 A382 K384 I386 I389 L500	D330-K334 PolarHBondContact O-N 3.24Å; F331-K334 PolarHBondContact O-N 2.78Å; K334-A337 PolarHBondContact O-N 2.84Å; K334-V338 HydrophobicContact CD-CG2 4.21Å; K334-V338 HydrophobicContact CG-CG2 4.32Å; K334-V338 WeakPolarHBondContact O-CB 3.44Å; K334-V338 VanDerWaalsContact O-CG2 3.29Å; K334-V338 WeakPolarHBondContact O-CG2 3.07Å; K334-V338 PolarHBondContact O-N 3.38Å; K334-A382 PolarHBondContact NZ-O 2.84Å; K334-K384 PolarHBondContact NZ-O 2.77Å; K334-I386 HydrophobicContact CB-CG1 4.1Å; K334-I386 HydrophobicContact CG-CD1 4.39Å; K334-I386 HydrophobicContact CG-CG1 3.96Å; K334-I389 HydrophobicContact CB-CD1 4.02Å; K334-I389 HydrophobicContact CD-CD1 4.01Å; K334-L500 WeakPolarHBondContact CE-O 3.42Å; K334-L500 HydrophobicContact CG-CB 4.15Å
335	A	96.3	Very high	94.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-42.4	176.8	0	0	0	0	0	112.5	F331 I332 I333 T339 F490 L494 L500	F331-A335 WeakPolarHBondContact O-CB 3.36Å; F331-A335 PolarHBondContact O-N 2.82Å; I332-A335 PolarHBondContact O-N 2.85Å; I333-A335 PolarHBondContact O-N 3.45Å; A335-T339 WeakPolarHBondContact O-CB 3.39Å; A335-T339 PolarHBondContact O-N 3.07Å; A335-T339 PolarHBondContact O-OG1 3.42Å; A335-F490 HydrophobicContact CB-CD2 4.08Å; A335-F490 HydrophobicContact CB-CE2 3.84Å; A335-L494 HydrophobicContact CB-CB 4.25Å; A335-L494 HydrophobicContact CB-CD1 4.09Å; A335-L500 HydrophobicContact CB-CD2 3.75Å
336	A	96.6	Very high	94.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.9	-47.2	172.5	0	0	0	0	0	111	I332 I333 V338 T339 L340 I363 F415 I417 F490	I332-A336 WeakPolarHBondContact O-CB 3.32Å; I332-A336 PolarHBondContact O-N 2.89Å; I333-A336 PolarHBondContact O-N 2.67Å; A336-V338 PolarHBondContact O-N 3.01Å; A336-T339 PolarHBondContact O-N 3.24Å; A336-T339 VanDerWaalsContact O-N 3.16Å; A336-L340 WeakPolarHBondContact O-CG 3.38Å; A336-L340 PolarHBondContact O-N 2.64Å; A336-I363 HydrophobicContact CB-CD1 4.11Å; A336-F415 HydrophobicContact CB-CE1 4.47Å; A336-I417 HydrophobicContact CB-CD1 3.84Å; A336-F490 HydrophobicContact CB-CD2 4.37Å; A336-F490 HydrophobicContact CB-CE2 4.19Å
337	A	96	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-42.1	-178.7	0	0	0	0	0	113.5	I333 K334 T339 L340 K341 I361 I363 A381 A382	I333-A337 WeakPolarHBondContact O-CB 3.11Å; I333-A337 PolarHBondContact O-N 3.03Å; K334-A337 PolarHBondContact O-N 2.84Å; A337-T339 VanDerWaalsContact C-N 3.31Å; A337-T339 PolarHBondContact O-N 3.17Å; A337-L340 PolarHBondContact O-N 2.74Å; A337-K341 PolarHBondContact O-N 2.72Å; A337-I361 HydrophobicContact CB-CG2 3.95Å; A337-I363 HydrophobicContact CB-CD1 3.74Å; A337-A381 HydrophobicContact CB-CB 3.91Å; A337-A382 HydrophobicContact CB-CB 3.99Å
338	V	95.4	Very high	95	Very high	21 Å²	21	23.9 Å²	23.9	13%	0.127	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-37.6	173.8	169.6	0	0	0	0	110.7	K334 A336 K341 Q342	K334-V338 HydrophobicContact CD-CG2 4.21Å; K334-V338 HydrophobicContact CG-CG2 4.32Å; K334-V338 WeakPolarHBondContact O-CB 3.44Å; K334-V338 VanDerWaalsContact O-CG2 3.29Å; K334-V338 WeakPolarHBondContact O-CG2 3.07Å; K334-V338 PolarHBondContact O-N 3.38Å; A336-V338 PolarHBondContact O-N 3.01Å; V338-K341 PolarHBondContact O-N 3.1Å; V338-Q342 VanDerWaalsContact O-CG 3.3Å; V338-Q342 WeakPolarHBondContact O-CG 3.45Å; V338-Q342 PolarHBondContact O-N 2.96Å
339	T	96	Very high	95	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-71.4	-40	178.2	-51.2	0	0	0	0	112.2	A335 A336 A337 K341 Q342 M343 F486 F490 N493	A335-T339 WeakPolarHBondContact O-CB 3.39Å; A335-T339 PolarHBondContact O-N 3.07Å; A335-T339 PolarHBondContact O-OG1 3.42Å; A336-T339 PolarHBondContact O-N 3.24Å; A336-T339 VanDerWaalsContact O-N 3.16Å; A337-T339 VanDerWaalsContact C-N 3.31Å; A337-T339 PolarHBondContact O-N 3.17Å; T339-K341 VanDerWaalsContact C-N 3.25Å; T339-K341 PolarHBondContact O-N 3.09Å; T339-Q342 CarbonylContact O-C 3.58Å; T339-Q342 PolarHBondContact O-N 3.41Å; T339-Q342 VanDerWaalsContact O-N 3.12Å; T339-M343 PolarHBondContact O-N 3.41Å; T339-F486 HydrophobicContact CG2-CD2 3.56Å; T339-F486 HydrophobicContact CG2-CE2 3.57Å; T339-F486 HydrophobicContact CG2-CG 4.15Å; T339-F486 HydrophobicContact CG2-CZ 4.18Å; T339-F490 HydrophobicContact CG2-CB 4.17Å; T339-F490 VanDerWaalsContact OG1-CA 3.3Å; T339-F490 WeakPolarHBondContact OG1-CA 3.38Å; T339-N493 PolarHBondContact OG1-ND2 3.42Å
340	L	95.6	Very high	94.7	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-32.7	171.8	-70	166.4	0	0	0	111.8	A336 A337 M343 P344 V346 N347 I361 F415 F486	A336-L340 WeakPolarHBondContact O-CG 3.38Å; A336-L340 PolarHBondContact O-N 2.64Å; A337-L340 PolarHBondContact O-N 2.74Å; L340-M343 CarbonylContact O-C 3.58Å; L340-M343 PolarHBondContact O-N 3.45Å; L340-P344 WeakPolarHBondContact O-CA 3.4Å; L340-V346 HydrophobicContact CD2-CB 4.07Å; L340-V346 HydrophobicContact CD2-CG1 3.91Å; L340-N347 HydrophobicContact CB-CB 4.49Å; L340-N347 HydrophobicContact CD2-CB 4.12Å; L340-I361 HydrophobicContact CB-CD1 4.05Å; L340-I361 HydrophobicContact CB-CG1 4.42Å; L340-I361 HydrophobicContact CB-CG2 4.06Å; L340-I361 HydrophobicContact CD1-CG2 3.85Å; L340-F415 HydrophobicContact CD1-CB 3.76Å; L340-F415 HydrophobicContact CD1-CD1 4.28Å; L340-F415 HydrophobicContact CD1-CD2 3.96Å; L340-F415 HydrophobicContact CD1-CG 3.77Å; L340-F415 HydrophobicContact CD2-CD2 3.93Å; L340-F415 HydrophobicContact CD2-CE2 4.23Å; L340-F415 HydrophobicContact CG-CD2 4.5Å; L340-F486 HydrophobicContact CD2-CE2 3.74Å; L340-F486 HydrophobicContact CD2-CZ 4.35Å; L340-F486 HydrophobicContact CG-CE2 3.94Å; L340-F486 HydrophobicContact CG-CZ 4.4Å
341	K	94.4	Very high	94.1	Very high	148 Å²	148	29.9 Å²	29.9	64%	0.643	15%	0.148	S	C	*	.	H	α-helix	trans	-72.2	-31.4	173.1	-168.8	177.3	179.1	-178.8	0	113	A337 V338 T339 I361 A382	A337-K341 PolarHBondContact O-N 2.72Å; V338-K341 PolarHBondContact O-N 3.1Å; T339-K341 VanDerWaalsContact C-N 3.25Å; T339-K341 PolarHBondContact O-N 3.09Å; K341-I361 HydrophobicContact CB-CD1 3.71Å; K341-I361 HydrophobicContact CG-CD1 4.42Å; K341-A382 HydrophobicContact CD-CB 4.38Å
342	Q	93.7	Very high	93.5	Very high	100 Å²	100	32.4 Å²	32.4	47%	0.467	18%	0.175	S	C	.	.	H	α-helix	trans	-77.3	-27.7	173.8	-71	166.7	-0.9	0	0	112.5	V338 T339 N493	V338-Q342 VanDerWaalsContact O-CG 3.3Å; V338-Q342 WeakPolarHBondContact O-CG 3.45Å; V338-Q342 PolarHBondContact O-N 2.96Å; T339-Q342 CarbonylContact O-C 3.58Å; T339-Q342 PolarHBondContact O-N 3.41Å; T339-Q342 VanDerWaalsContact O-N 3.12Å; Q342-N493 PolarHBondContact OE1-ND2 2.67Å
343	M	94.3	Very high	92.9	Very high	23 Å²	23	40.9 Å²	40.9	11%	0.113	22%	0.215	C	C	.	.			trans	-134.1	73.4	-176.2	-66.2	-177.5	55.1	0	0	110.3	T339 L340 D345 V346 L482 R485 F486	T339-M343 PolarHBondContact O-N 3.41Å; L340-M343 CarbonylContact O-C 3.58Å; L340-M343 PolarHBondContact O-N 3.45Å; M343-D345 PolarHBondContact O-N 3.35Å; M343-D345 VanDerWaalsContact O-N 3.12Å; M343-V346 HydrophobicContact CE-CG2 4.32Å; M343-V346 PolarHBondContact O-N 2.94Å; M343-V346 VanDerWaalsContact O-N 3.16Å; M343-L482 HydrophobicContact CE-CD1 3.5Å; M343-L482 VanDerWaalsContact CE-CD1 3.5Å; M343-L482 HydrophobicContact CE-CG 4.17Å; M343-R485 HydrophobicContact CE-CB 3.65Å; M343-R485 HydrophobicContact SD-CB 4.21Å; M343-F486 HydrophobicContact CE-CB 4.01Å; M343-F486 HydrophobicContact SD-CB 4.3Å
344	P	93.7	Very high	92.3	Very high	55 Å²	55	41.5 Å²	41.5	36%	0.357	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-64.9	-16.7	-176.4	29.2	-36.9	0	0	0	112.8	L340 V346 N347 Q357	L340-P344 WeakPolarHBondContact O-CA 3.4Å; P344-V346 PolarHBondContact O-N 3.33Å; P344-N347 PolarHBondContact O-N 2.97Å; P344-Q357 PolarHBondContact O-NE2 3.46Å
345	D	93.1	Very high	92	Very high	91 Å²	91	45.2 Å²	45.2	49%	0.487	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-67.8	-8.6	176.4	-46.9	-40.3	0	0	0	113.2	M343 V348 Q357 L482	M343-D345 PolarHBondContact O-N 3.35Å; M343-D345 VanDerWaalsContact O-N 3.12Å; D345-V348 WeakPolarHBondContact O-CG2 3.42Å; D345-Q357 PolarHBondContact OD1-NE2 3.37Å; D345-Q357 VanDerWaalsContact OD1-NE2 3.14Å; D345-L482 HydrophobicContact CB-CD1 4.25Å; D345-L482 HydrophobicContact CB-CD2 3.92Å; D345-L482 WeakPolarHBondContact O-CD2 3.46Å
346	V	94.8	Very high	91.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-97.6	-19.1	169.9	-177.5	0	0	0	0	111.7	L340 M343 P344 V348 V478 L482 F486	L340-V346 HydrophobicContact CD2-CB 4.07Å; L340-V346 HydrophobicContact CD2-CG1 3.91Å; M343-V346 HydrophobicContact CE-CG2 4.32Å; M343-V346 PolarHBondContact O-N 2.94Å; M343-V346 VanDerWaalsContact O-N 3.16Å; P344-V346 PolarHBondContact O-N 3.33Å; V346-V348 PolarHBondContact O-N 3.4Å; V346-V478 HydrophobicContact CG1-CG2 4.48Å; V346-L482 HydrophobicContact CG2-CD1 4.39Å; V346-L482 HydrophobicContact CG2-CD2 3.88Å; V346-L482 HydrophobicContact CG2-CG 3.79Å; V346-F486 HydrophobicContact CB-CD2 4.1Å; V346-F486 HydrophobicContact CG1-CD2 3.93Å; V346-F486 HydrophobicContact CG1-CE2 4.16Å; V346-F486 HydrophobicContact CG1-CG 4.38Å; V346-F486 HydrophobicContact CG2-CB 4.2Å; V346-F486 HydrophobicContact CG2-CD2 3.99Å; V346-F486 HydrophobicContact CG2-CG 4.38Å
347	N	95.1	Very high	91.6	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.011	29%	0.293	C	S	.	.	S	Bend	trans	-86.6	61.3	-179.2	-160.3	57.9	0	0	0	110.8	L340 P344 L358 F360 S414	L340-N347 HydrophobicContact CB-CB 4.49Å; L340-N347 HydrophobicContact CD2-CB 4.12Å; P344-N347 PolarHBondContact O-N 2.97Å; N347-L358 PolarHBondContact ND2-O 2.86Å; N347-L358 PolarHBondContact O-N 3.29Å; N347-F360 PolarHBondContact ND2-O 3.01Å; N347-S414 WeakPolarHBondContact OD1-CB 3.39Å; N347-S414 PolarHBondContact OD1-OG 3.38Å
348	V	94.2	Very high	91.4	Very high	8 Å²	8	57.3 Å²	57.3	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	155.7	-170.2	-138.4	0	0	0	0	111.8	D345 V346 P355 K356 A437 M477	D345-V348 WeakPolarHBondContact O-CG2 3.42Å; V346-V348 PolarHBondContact O-N 3.4Å; V348-P355 HydrophobicContact CG1-CB 3.71Å; V348-K356 WeakPolarHBondContact CG1-O 3.48Å; V348-A437 HydrophobicContact CB-CB 4.35Å; V348-A437 VanDerWaalsContact O-CB 3.24Å; V348-A437 WeakPolarHBondContact O-CB 3.32Å; V348-A437 PolarHBondContact O-N 3.09Å; V348-M477 HydrophobicContact CB-SD 3.95Å; V348-M477 HydrophobicContact CG1-SD 3.97Å
349	S	92.8	Very high	91.1	Very high	18 Å²	18	62.2 Å²	62.2	13%	0.126	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	154.4	167.4	60.2	0	0	0	0	111.4	K356 P435	S349-K356 PolarHBondContact N-O 2.98Å; S349-K356 PolarHBondContact O-N 2.93Å; S349-K356 PolarHBondContact OG-O 3.33Å; S349-P435 VanDerWaalsContact CA-O 3.24Å; S349-P435 WeakPolarHBondContact CA-O 3.14Å; S349-P435 VanDerWaalsContact CB-O 3.27Å; S349-P435 WeakPolarHBondContact CB-O 3.32Å
350	W	87.9	Confident	90.9	Very high	74 Å²	74	66.2 Å²	66.2	28%	0.28	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.5	176.8	-175.1	-85.1	0	0	0	110.6	P435 R476 M477	W350-P435 PolarHBondContact N-O 2.99Å; W350-R476 HydrophobicContact CE3-CB 4.28Å; W350-R476 HydrophobicContact CZ3-CB 4.07Å; W350-M477 HydrophobicContact CB-CE 3.66Å; W350-M477 HydrophobicContact CB-SD 3.84Å; W350-M477 HydrophobicContact CE3-CG 3.75Å; W350-M477 HydrophobicContact CE3-SD 3.96Å; W350-M477 HydrophobicContact CZ3-CG 4.32Å
351	D	83.3	Confident	90.9	Very high	74 Å²	74	66.9 Å²	66.9	40%	0.396	36%	0.355	S	S	.	.			trans	-116.4	-3.7	-177.2	72.6	-14.8	0	0	0	114.7	E353 G354 K356	D351-E353 PolarHBondContact OD1-N 2.91Å; D351-G354 PolarHBondContact OD1-N 2.69Å; D351-K356 WeakPolarHBondContact OD2-CD 3.25Å; D351-K356 WeakPolarHBondContact OD2-CE 3.41Å; D351-K356 IonicContact OD2-NZ 3.74Å; D351-K356 PolarHBondContact OD2-NZ 3.2Å
352	G	82.1	Confident	91	Very high	55 Å²	55	60.7 Å²	60.7	57%	0.567	33%	0.329	S	S	*	.	S	Bend	trans	106.1	-28	-176.1	0	0	0	0	0	114.1
353	E	83.4	Confident	91.2	Very high	180 Å²	180	56 Å²	56	84%	0.841	31%	0.307	S	S	*	.	S	Bend	trans	-91.1	-35.8	174.6	-63.7	-170	155.9	0	0	111.3	D351	D351-E353 PolarHBondContact OD1-N 2.91Å
354	G	84.1	Confident	91.2	Very high	13 Å²	13	55 Å²	55	13%	0.134	30%	0.302	C	S	.	.			trans	174.7	-168.6	173	0	0	0	0	0	115.9	D351 K356	D351-G354 PolarHBondContact OD1-N 2.69Å; G354-K356 PolarHBondContact O-N 3.45Å
355	P	90	Very high	91.3	Very high	86 Å²	86	53 Å²	53	56%	0.558	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	120.7	174.2	27.7	-32	0	0	0	111.6	V348 M477	V348-P355 HydrophobicContact CG1-CB 3.71Å; P355-M477 HydrophobicContact CB-CG 4.1Å; P355-M477 HydrophobicContact CB-SD 4.14Å
356	K	91.9	Very high	91.4	Very high	110 Å²	110	49.8 Å²	49.8	48%	0.478	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	105.1	171.8	-77.6	179.7	171.7	167.7	0	110.4	V348 S349 D351 G354	V348-K356 WeakPolarHBondContact CG1-O 3.48Å; S349-K356 PolarHBondContact N-O 2.98Å; S349-K356 PolarHBondContact O-N 2.93Å; S349-K356 PolarHBondContact OG-O 3.33Å; D351-K356 WeakPolarHBondContact OD2-CD 3.25Å; D351-K356 WeakPolarHBondContact OD2-CE 3.41Å; D351-K356 IonicContact OD2-NZ 3.74Å; D351-K356 PolarHBondContact OD2-NZ 3.2Å; G354-K356 PolarHBondContact O-N 3.45Å
357	Q	92.4	Very high	91.2	Very high	109 Å²	109	50.2 Å²	50.2	51%	0.509	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.7	176.6	-172.8	168.8	63.5	0	0	110.6	P344 D345	P344-Q357 PolarHBondContact O-NE2 3.46Å; D345-Q357 PolarHBondContact OD1-NE2 3.37Å; D345-Q357 VanDerWaalsContact OD1-NE2 3.14Å
358	L	92.1	Very high	91	Very high	34 Å²	34	53.2 Å²	53.2	18%	0.178	30%	0.303	C	S	.	.			trans	-104.5	131	-174.8	-60.5	174.9	0	0	0	110.4	N347 F360	N347-L358 PolarHBondContact ND2-O 2.86Å; N347-L358 PolarHBondContact O-N 3.29Å; L358-F360 HydrophobicContact CB-CZ 4.47Å; L358-F360 HydrophobicContact CD1-CE2 4.39Å; L358-F360 HydrophobicContact CD2-CE1 4.4Å; L358-F360 HydrophobicContact CD2-CZ 3.97Å
359	P	88.7	Confident	90.7	Very high	125 Å²	125	54.1 Å²	54.1	81%	0.812	31%	0.309	S	S	*	.	S	Bend	trans	-82.4	-22.6	-179.1	32	-34.7	0	0	0	113.3
360	F	92	Very high	90.2	Very high	84 Å²	84	61.2 Å²	61.2	37%	0.368	35%	0.345	S	S	.	.	S	Bend	trans	-93	152.8	174.3	52.7	-94	0	0	0	110.7	N347 L358 D362	N347-F360 PolarHBondContact ND2-O 3.01Å; L358-F360 HydrophobicContact CB-CZ 4.47Å; L358-F360 HydrophobicContact CD1-CE2 4.39Å; L358-F360 HydrophobicContact CD2-CE1 4.4Å; L358-F360 HydrophobicContact CD2-CZ 3.97Å; F360-D362 HydrophobicContact CD2-CB 4.21Å
361	I	95.8	Very high	89.9	Confident	14 Å²	14	64.9 Å²	64.9	7%	0.072	36%	0.363	C	S	.	.			trans	-122.3	90.3	-175.1	-61.8	173	0	0	0	108.4	A337 L340 K341 D380 A381 A382	A337-I361 HydrophobicContact CB-CG2 3.95Å; L340-I361 HydrophobicContact CB-CD1 4.05Å; L340-I361 HydrophobicContact CB-CG1 4.42Å; L340-I361 HydrophobicContact CB-CG2 4.06Å; L340-I361 HydrophobicContact CD1-CG2 3.85Å; K341-I361 HydrophobicContact CB-CD1 3.71Å; K341-I361 HydrophobicContact CG-CD1 4.42Å; I361-D380 WeakPolarHBondContact O-CA 3.47Å; I361-D380 PolarHBondContact O-N 3.31Å; I361-A381 PolarHBondContact O-N 3.1Å; I361-A382 HydrophobicContact CB-CB 4.18Å; I361-A382 HydrophobicContact CD1-CB 3.88Å; I361-A382 HydrophobicContact CG2-CB 4.39Å
362	D	95.9	Very high	89.9	Confident	19 Å²	19	62.4 Å²	62.4	10%	0.102	36%	0.355	C	S	.	.			trans	-109.2	109.5	-171.1	-82.3	15.6	0	0	0	109.7	F360 I377 I378 K379 D380 G413 S414 F415	F360-D362 HydrophobicContact CD2-CB 4.21Å; D362-I377 HydrophobicContact CB-CG2 3.87Å; D362-I378 WeakPolarHBondContact CA-O 3.46Å; D362-K379 VanDerWaalsContact OD1-CA 3.25Å; D362-K379 WeakPolarHBondContact OD1-CA 3.36Å; D362-D380 PolarHBondContact OD1-N 3.5Å; D362-G413 CarbonylContact O-C 3.52Å; D362-S414 PolarHBondContact N-OG 2.79Å; D362-S414 VanDerWaalsContact N-OG 3.16Å; D362-S414 PolarHBondContact O-N 2.95Å; D362-S414 PolarHBondContact O-OG 3.03Å; D362-F415 PolarHBondContact O-N 2.86Å
363	I	96.8	Very high	90.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.1	-172.1	-66.4	-178.9	0	0	0	110.7	I333 A336 A337 V365 I378 A381 F415 I417	I333-I363 HydrophobicContact CG1-CG2 4.43Å; I333-I363 HydrophobicContact CG2-CB 4.47Å; I333-I363 HydrophobicContact CG2-CD1 4.03Å; I333-I363 HydrophobicContact CG2-CG2 4.34Å; I333-I363 WeakPolarHBondContact O-CD1 3.39Å; A336-I363 HydrophobicContact CB-CD1 4.11Å; A337-I363 HydrophobicContact CB-CD1 3.74Å; I363-V365 HydrophobicContact CG2-CG2 4.24Å; I363-I378 PolarHBondContact N-O 3.36Å; I363-I378 PolarHBondContact O-N 2.8Å; I363-A381 HydrophobicContact CB-CB 4.31Å; I363-A381 HydrophobicContact CD1-CB 3.94Å; I363-A381 HydrophobicContact CG1-CB 4.09Å; I363-F415 WeakPolarHBondContact CA-O 3.38Å; I363-I417 HydrophobicContact CD1-CD1 4.43Å; I363-I417 HydrophobicContact CG2-CB 4.5Å; I363-I417 HydrophobicContact CG2-CD1 3.69Å; I363-I417 HydrophobicContact CG2-CG1 3.86Å
364	S	96.1	Very high	90.4	Very high	3 Å²	3	58 Å²	58	2%	0.021	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	118.6	171.2	-50.7	0	0	0	0	110.1	P376 F415 S416 I417 Q436	S364-P376 WeakPolarHBondContact CA-O 3.29Å; S364-F415 PolarHBondContact N-O 2.81Å; S364-S416 CarbonylContact O-C 3.58Å; S364-S416 WeakPolarHBondContact O-CA 3.31Å; S364-I417 PolarHBondContact O-N 2.8Å; S364-Q436 PolarHBondContact OG-NE2 2.88Å
365	V	95.9	Very high	90.9	Very high	13 Å²	13	58.8 Å²	58.8	8%	0.079	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.8	178.1	-179.2	0	0	0	0	109.7	I333 I363 V367 T375 P376 I378	I333-V365 HydrophobicContact CD1-CG2 3.83Å; I333-V365 HydrophobicContact CG1-CG2 4.23Å; I363-V365 HydrophobicContact CG2-CG2 4.24Å; V365-V367 PolarHBondContact O-N 2.89Å; V365-T375 WeakPolarHBondContact O-CA 3.5Å; V365-P376 PolarHBondContact N-O 2.85Å; V365-P376 WeakPolarHBondContact O-CD 3Å; V365-I378 HydrophobicContact CG2-CD1 3.64Å; V365-I378 HydrophobicContact CG2-CG1 4.34Å
366	A	93.8	Very high	91.1	Very high	24 Å²	24	54.9 Å²	54.9	20%	0.198	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-73.7	118.9	-179.9	0	0	0	0	0	111.5	L373 I417	A366-L373 HydrophobicContact CB-CD1 4.21Å; A366-L373 HydrophobicContact CB-CD2 4.47Å; A366-I417 PolarHBondContact N-O 2.96Å
367	V	91.9	Very high	91.3	Very high	10 Å²	10	50.1 Å²	50.1	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.7	180	-179.8	0	0	0	0	109.7	V365 T369 L374 P376 A400	V365-V367 PolarHBondContact O-N 2.89Å; V367-T369 HydrophobicContact CG1-CG2 4.49Å; V367-L374 PolarHBondContact N-O 2.87Å; V367-L374 PolarHBondContact O-N 2.89Å; V367-P376 HydrophobicContact CB-CG 4.42Å; V367-P376 HydrophobicContact CG2-CG 3.69Å; V367-A400 HydrophobicContact CB-CB 4.47Å; V367-A400 HydrophobicContact CG1-CB 4.12Å
368	A	89.2	Confident	91.5	Very high	65 Å²	65	45 Å²	45	54%	0.537	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	137	173	0	0	0	0	0	111.5
369	T	88	Confident	91.6	Very high	27 Å²	27	48.3 Å²	48.3	17%	0.166	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	162.6	173.8	73.7	0	0	0	0	109.8	V367 K371 G372 L374 A400 R401	V367-T369 HydrophobicContact CG1-CG2 4.49Å; T369-K371 PolarHBondContact O-N 2.84Å; T369-G372 PolarHBondContact N-O 2.92Å; T369-G372 PolarHBondContact O-N 3.16Å; T369-G372 PolarHBondContact OG1-N 2.87Å; T369-G372 PolarHBondContact OG1-O 3.39Å; T369-L374 HydrophobicContact CG2-CD1 4.13Å; T369-A400 HydrophobicContact CG2-CB 4.37Å; T369-R401 HydrophobicContact CG2-CG 4.29Å
370	D	84	Confident	91.9	Very high	167 Å²	167	46.3 Å²	46.3	89%	0.893	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.2	-178.8	-48.6	-60.2	0	0	0	113.1
371	K	80	Confident	92	Very high	151 Å²	151	42.3 Å²	42.3	66%	0.657	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-23	176.3	-64.3	-175.3	-179.9	-178.6	0	113	T369	T369-K371 PolarHBondContact O-N 2.84Å
372	G	83.1	Confident	91.8	Very high	22 Å²	22	42.4 Å²	42.4	23%	0.227	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-166.7	-177.2	0	0	0	0	0	113.4	T369	T369-G372 PolarHBondContact N-O 2.92Å; T369-G372 PolarHBondContact O-N 3.16Å; T369-G372 PolarHBondContact OG1-N 2.87Å; T369-G372 PolarHBondContact OG1-O 3.39Å
373	L	86.3	Confident	91.6	Very high	93 Å²	93	45.5 Å²	45.5	49%	0.487	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.4	173.4	-165.7	70.6	0	0	0	110	A366	A366-L373 HydrophobicContact CB-CD1 4.21Å; A366-L373 HydrophobicContact CB-CD2 4.47Å
374	L	91	Very high	91.4	Very high	49 Å²	49	48.2 Å²	48.2	26%	0.257	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	151.4	170	-67.8	175.4	0	0	0	109.6	V367 T369 P376 A400 L405	V367-L374 PolarHBondContact N-O 2.87Å; V367-L374 PolarHBondContact O-N 2.89Å; T369-L374 HydrophobicContact CG2-CD1 4.13Å; L374-P376 VanDerWaalsContact C-CD 3.47Å; L374-P376 WeakPolarHBondContact O-CD 3.42Å; L374-A400 HydrophobicContact CD1-CB 4.21Å; L374-L405 HydrophobicContact CD1-CD1 4.4Å
375	T	93.4	Very high	91.3	Very high	30 Å²	30	49.6 Å²	49.6	18%	0.184	29%	0.292	C	S	.	.			trans	-126.4	67.6	-173.2	47.8	0	0	0	0	111.8	V365 Y410	V365-T375 WeakPolarHBondContact O-CA 3.5Å; T375-Y410 WeakPolarHBondContact O-CA 3.5Å
376	P	95.4	Very high	91.2	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.019	30%	0.295	C	S	.	.			trans	-54.6	140.8	174.1	20.1	-32.8	0	0	0	113.4	S364 V365 V367 L374 L396 L405 E409	S364-P376 WeakPolarHBondContact CA-O 3.29Å; V365-P376 PolarHBondContact N-O 2.85Å; V365-P376 WeakPolarHBondContact O-CD 3Å; V367-P376 HydrophobicContact CB-CG 4.42Å; V367-P376 HydrophobicContact CG2-CG 3.69Å; L374-P376 VanDerWaalsContact C-CD 3.47Å; L374-P376 WeakPolarHBondContact O-CD 3.42Å; P376-L396 HydrophobicContact CB-CB 3.73Å; P376-L396 HydrophobicContact CB-CD1 4.26Å; P376-L396 HydrophobicContact CB-CG 4.41Å; P376-L396 HydrophobicContact CG-CB 4.39Å; P376-L405 HydrophobicContact CB-CD1 4.17Å; P376-L405 HydrophobicContact CB-CD2 4.37Å; P376-E409 CarbonylContact C-O 3.2Å; P376-E409 VanDerWaalsContact CA-O 3.24Å; P376-E409 WeakPolarHBondContact CA-O 3.32Å
377	I	95.9	Very high	91.1	Very high	10 Å²	10	54.3 Å²	54.3	5%	0.051	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.9	-172.8	-60	162.5	0	0	0	111.1	D362 K379 L396 E409 Q411	D362-I377 HydrophobicContact CB-CG2 3.87Å; I377-K379 HydrophobicContact CG2-CG 4.4Å; I377-L396 WeakPolarHBondContact O-CD1 3.36Å; I377-E409 PolarHBondContact N-O 2.9Å; I377-Q411 VanDerWaalsContact CD1-C 3.47Å; I377-Q411 VanDerWaalsContact CD1-O 3.29Å; I377-Q411 WeakPolarHBondContact CD1-O 3.4Å
378	I	96.3	Very high	91.2	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.015	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	99.1	170.6	-52.8	166.3	0	0	0	107.8	I333 D362 I363 V365 A381 I389 V393	I333-I378 HydrophobicContact CD1-CD1 3.69Å; I333-I378 HydrophobicContact CG1-CD1 4.35Å; I333-I378 HydrophobicContact CG2-CD1 3.91Å; D362-I378 WeakPolarHBondContact CA-O 3.46Å; I363-I378 PolarHBondContact N-O 3.36Å; I363-I378 PolarHBondContact O-N 2.8Å; V365-I378 HydrophobicContact CG2-CD1 3.64Å; V365-I378 HydrophobicContact CG2-CG1 4.34Å; I378-A381 HydrophobicContact CG2-CB 4.07Å; I378-I389 HydrophobicContact CD1-CG2 4.41Å; I378-V393 HydrophobicContact CD1-CG2 3.47Å; I378-V393 VanDerWaalsContact CD1-CG2 3.47Å; I378-V393 HydrophobicContact CG1-CG2 4.37Å
379	K	94.6	Very high	91.5	Very high	103 Å²	103	56 Å²	56	45%	0.448	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	137.8	177.2	-58.6	-172.5	177.9	-178.6	0	111.6	D362 I377 A381 K384	D362-K379 VanDerWaalsContact OD1-CA 3.25Å; D362-K379 WeakPolarHBondContact OD1-CA 3.36Å; I377-K379 HydrophobicContact CG2-CG 4.4Å; K379-A381 PolarHBondContact O-N 2.81Å; K379-K384 VanDerWaalsContact O-CE 3.3Å; K379-K384 WeakPolarHBondContact O-CE 3.17Å; K379-K384 PolarHBondContact O-NZ 2.9Å
380	D	93.7	Very high	91.8	Very high	83 Å²	83	55.2 Å²	55.2	44%	0.444	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	47.4	177.4	-66.9	-58.1	0	0	0	115.2	I361 D362 A382 A383 K384	I361-D380 WeakPolarHBondContact O-CA 3.47Å; I361-D380 PolarHBondContact O-N 3.31Å; D362-D380 PolarHBondContact OD1-N 3.5Å; D380-A382 PolarHBondContact O-N 3.4Å; D380-A383 PolarHBondContact O-N 2.81Å; D380-A383 VanDerWaalsContact O-N 3.12Å; D380-K384 PolarHBondContact O-N 2.93Å
381	A	94.4	Very high	92.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.5	-178	0	0	0	0	0	114	I333 A337 I361 I363 I378 K379	I333-A381 HydrophobicContact CG2-CB 4.11Å; A337-A381 HydrophobicContact CB-CB 3.91Å; I361-A381 PolarHBondContact O-N 3.1Å; I363-A381 HydrophobicContact CB-CB 4.31Å; I363-A381 HydrophobicContact CD1-CB 3.94Å; I363-A381 HydrophobicContact CG1-CB 4.09Å; I378-A381 HydrophobicContact CG2-CB 4.07Å; K379-A381 PolarHBondContact O-N 2.81Å
382	A	91.5	Very high	93.1	Very high	15 Å²	15	46 Å²	46	12%	0.124	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-35.8	177.5	0	0	0	0	0	112.8	K334 A337 K341 I361 D380	K334-A382 PolarHBondContact NZ-O 2.84Å; A337-A382 HydrophobicContact CB-CB 3.99Å; K341-A382 HydrophobicContact CD-CB 4.38Å; I361-A382 HydrophobicContact CB-CB 4.18Å; I361-A382 HydrophobicContact CD1-CB 3.88Å; I361-A382 HydrophobicContact CG2-CB 4.39Å; D380-A382 PolarHBondContact O-N 3.4Å
383	A	91.9	Very high	93.6	Very high	84 Å²	84	46 Å²	46	69%	0.694	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-34.2	-178.4	0	0	0	0	0	112.5	D380	D380-A383 PolarHBondContact O-N 2.81Å; D380-A383 VanDerWaalsContact O-N 3.12Å
384	K	94.1	Very high	94	Very high	57 Å²	57	47.8 Å²	47.8	25%	0.248	26%	0.262	C	S	.	.	S	Bend	trans	-69	151.1	-174.1	-72.4	173.6	176.7	168.6	0	114.2	K334 K379 D380 E388 I389	K334-K384 PolarHBondContact NZ-O 2.77Å; K379-K384 VanDerWaalsContact O-CE 3.3Å; K379-K384 WeakPolarHBondContact O-CE 3.17Å; K379-K384 PolarHBondContact O-NZ 2.9Å; D380-K384 PolarHBondContact O-N 2.93Å; K384-E388 VanDerWaalsContact CA-OE2 3.22Å; K384-E388 WeakPolarHBondContact CA-OE2 3.31Å; K384-E388 HydrophobicContact CB-CB 4.31Å; K384-E388 WeakPolarHBondContact CB-OE2 3.31Å; K384-I389 HydrophobicContact CB-CD1 4.37Å; K384-I389 HydrophobicContact CB-CG1 3.95Å
385	G	93.1	Very high	94.2	Very high	33 Å²	33	48.1 Å²	48.1	34%	0.34	27%	0.272	S	S	.	.			trans	-72.4	154.9	169.2	0	0	0	0	0	112.2	Q387 E388 I389	G385-Q387 PolarHBondContact O-N 2.98Å; G385-E388 PolarHBondContact N-OE2 2.97Å; G385-E388 PolarHBondContact O-N 2.9Å; G385-E388 VanDerWaalsContact O-N 3.14Å; G385-I389 WeakPolarHBondContact O-CG1 3.42Å; G385-I389 PolarHBondContact O-N 3.27Å
386	I	92.8	Very high	94.3	Very high	30 Å²	30	47.7 Å²	47.7	15%	0.154	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-31.3	-179.6	-58.6	177.9	0	0	0	111.6	V326 D330 F331 K334 A390 L500	V326-I386 HydrophobicContact CG1-CG2 3.59Å; D330-I386 HydrophobicContact CB-CG2 4.09Å; F331-I386 HydrophobicContact CD1-CD1 3.88Å; F331-I386 HydrophobicContact CE1-CD1 3.93Å; K334-I386 HydrophobicContact CB-CG1 4.1Å; K334-I386 HydrophobicContact CG-CD1 4.39Å; K334-I386 HydrophobicContact CG-CG1 3.96Å; I386-A390 WeakPolarHBondContact O-CB 3.46Å; I386-A390 PolarHBondContact O-N 2.83Å; I386-L500 HydrophobicContact CD1-CB 4.46Å
387	Q	92.9	Very high	94.1	Very high	105 Å²	105	48.4 Å²	48.4	49%	0.491	27%	0.273	S	S	.	.	H	α-helix	trans	-65.6	-49.7	174.9	-49.2	-172	4.6	0	0	111.7	I324 G385 I389 A390 D391	I324-Q387 HydrophobicContact CG2-CB 4.45Å; I324-Q387 HydrophobicContact CG2-CG 3.66Å; G385-Q387 PolarHBondContact O-N 2.98Å; Q387-I389 VanDerWaalsContact C-N 3.27Å; Q387-I389 PolarHBondContact O-N 2.87Å; Q387-A390 WeakPolarHBondContact O-CB 3.25Å; Q387-A390 PolarHBondContact O-N 2.78Å; Q387-A390 VanDerWaalsContact O-N 3.1Å; Q387-D391 PolarHBondContact O-N 3.18Å
388	E	94.3	Very high	94	Very high	112 Å²	112	54.3 Å²	54.3	52%	0.523	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-36.7	178.6	-55.1	174.3	150.8	0	0	111.6	K384 G385 S392	K384-E388 VanDerWaalsContact CA-OE2 3.22Å; K384-E388 WeakPolarHBondContact CA-OE2 3.31Å; K384-E388 HydrophobicContact CB-CB 4.31Å; K384-E388 WeakPolarHBondContact CB-OE2 3.31Å; G385-E388 PolarHBondContact N-OE2 2.97Å; G385-E388 PolarHBondContact O-N 2.9Å; G385-E388 VanDerWaalsContact O-N 3.14Å; E388-S392 WeakPolarHBondContact O-CB 3.38Å; E388-S392 PolarHBondContact O-N 2.99Å; E388-S392 PolarHBondContact O-OG 3.38Å
389	I	95.7	Very high	93.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-50.5	172	-69.5	167.8	0	0	0	109.9	D330 I333 K334 I378 K384 G385 Q387 D391 S392 V393	D330-I389 HydrophobicContact CB-CG2 4.09Å; I333-I389 HydrophobicContact CB-CG2 4.05Å; I333-I389 HydrophobicContact CD1-CG2 4.08Å; I333-I389 HydrophobicContact CG2-CD1 4.38Å; I333-I389 HydrophobicContact CG2-CG2 3.73Å; K334-I389 HydrophobicContact CB-CD1 4.02Å; K334-I389 HydrophobicContact CD-CD1 4.01Å; I378-I389 HydrophobicContact CD1-CG2 4.41Å; K384-I389 HydrophobicContact CB-CD1 4.37Å; K384-I389 HydrophobicContact CB-CG1 3.95Å; G385-I389 WeakPolarHBondContact O-CG1 3.42Å; G385-I389 PolarHBondContact O-N 3.27Å; Q387-I389 VanDerWaalsContact C-N 3.27Å; Q387-I389 PolarHBondContact O-N 2.87Å; I389-D391 PolarHBondContact O-N 3.16Å; I389-S392 WeakPolarHBondContact O-CB 3.38Å; I389-S392 PolarHBondContact O-N 2.96Å; I389-V393 HydrophobicContact CG2-CG2 4.28Å; I389-V393 WeakPolarHBondContact O-CB 3.34Å; I389-V393 VanDerWaalsContact O-CG2 3.24Å; I389-V393 WeakPolarHBondContact O-CG2 3.33Å; I389-V393 PolarHBondContact O-N 3.28Å
390	A	94.3	Very high	93.8	Very high	10 Å²	10	52.9 Å²	52.9	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-44.4	-178.7	0	0	0	0	0	112.7	D330 I386 Q387 K394	D330-A390 HydrophobicContact CB-CB 4.22Å; D330-A390 WeakPolarHBondContact OD2-CB 3.27Å; I386-A390 WeakPolarHBondContact O-CB 3.46Å; I386-A390 PolarHBondContact O-N 2.83Å; Q387-A390 WeakPolarHBondContact O-CB 3.25Å; Q387-A390 PolarHBondContact O-N 2.78Å; Q387-A390 VanDerWaalsContact O-N 3.1Å; A390-K394 WeakPolarHBondContact O-CB 3.33Å; A390-K394 PolarHBondContact O-N 3.28Å
391	D	94.8	Very high	93.7	Very high	91 Å²	91	57.2 Å²	57.2	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-71.6	-33.8	176.3	-80.5	-43.9	0	0	0	112.6	Q387 I389 K394 A395	Q387-D391 PolarHBondContact O-N 3.18Å; I389-D391 PolarHBondContact O-N 3.16Å; D391-K394 PolarHBondContact O-N 3.49Å; D391-K394 IonicContact OD1-NZ 2.8Å; D391-K394 PolarHBondContact OD1-NZ 2.97Å; D391-A395 VanDerWaalsContact O-CB 3.3Å; D391-A395 WeakPolarHBondContact O-CB 3.33Å; D391-A395 PolarHBondContact O-N 3.26Å
392	S	95.1	Very high	93.6	Very high	34 Å²	34	61.1 Å²	61.1	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-49.7	170.7	-62.4	0	0	0	0	111.7	E388 I389 K394 A395 L396	E388-S392 WeakPolarHBondContact O-CB 3.38Å; E388-S392 PolarHBondContact O-N 2.99Å; E388-S392 PolarHBondContact O-OG 3.38Å; I389-S392 WeakPolarHBondContact O-CB 3.38Å; I389-S392 PolarHBondContact O-N 2.96Å; S392-K394 VanDerWaalsContact C-N 3.31Å; S392-K394 PolarHBondContact O-N 3.37Å; S392-A395 PolarHBondContact O-N 3.01Å; S392-L396 WeakPolarHBondContact O-CB 3.08Å; S392-L396 VanDerWaalsContact O-CG 3.32Å; S392-L396 WeakPolarHBondContact O-CG 3.19Å; S392-L396 PolarHBondContact O-N 2.95Å
393	V	95	Very high	93.4	Very high	21 Å²	21	62.8 Å²	62.8	13%	0.127	34%	0.342	C	S	.	.	H	α-helix	trans	-55.3	-47.8	176.1	166.4	0	0	0	0	110.5	I333 I378 I389 S397	I333-V393 HydrophobicContact CD1-CG2 3.62Å; I378-V393 HydrophobicContact CD1-CG2 3.47Å; I378-V393 VanDerWaalsContact CD1-CG2 3.47Å; I378-V393 HydrophobicContact CG1-CG2 4.37Å; I389-V393 HydrophobicContact CG2-CG2 4.28Å; I389-V393 WeakPolarHBondContact O-CB 3.34Å; I389-V393 VanDerWaalsContact O-CG2 3.24Å; I389-V393 WeakPolarHBondContact O-CG2 3.33Å; I389-V393 PolarHBondContact O-N 3.28Å; V393-S397 WeakPolarHBondContact O-CB 3.46Å; V393-S397 PolarHBondContact O-N 3Å; V393-S397 PolarHBondContact O-OG 2.96Å
394	K	93.8	Very high	93.4	Very high	130 Å²	130	65.8 Å²	65.8	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-67	-42.7	-177.7	178.1	177.7	159.4	-153.4	0	112.5	A390 D391 S392 K398	A390-K394 WeakPolarHBondContact O-CB 3.33Å; A390-K394 PolarHBondContact O-N 3.28Å; D391-K394 PolarHBondContact O-N 3.49Å; D391-K394 IonicContact OD1-NZ 2.8Å; D391-K394 PolarHBondContact OD1-NZ 2.97Å; S392-K394 VanDerWaalsContact C-N 3.31Å; S392-K394 PolarHBondContact O-N 3.37Å; K394-K398 WeakPolarHBondContact O-CB 3.43Å; K394-K398 PolarHBondContact O-N 2.99Å; K394-K398 VanDerWaalsContact O-N 3.09Å
395	A	94.8	Very high	93.2	Very high	57 Å²	57	64.2 Å²	64.2	47%	0.471	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-50	175.7	0	0	0	0	0	111.7	D391 S392 K398 K399	D391-A395 VanDerWaalsContact O-CB 3.3Å; D391-A395 WeakPolarHBondContact O-CB 3.33Å; D391-A395 PolarHBondContact O-N 3.26Å; S392-A395 PolarHBondContact O-N 3.01Å; A395-K398 PolarHBondContact O-N 3.04Å; A395-K399 PolarHBondContact O-N 2.64Å
396	L	95.1	Very high	93.2	Very high	20 Å²	20	67.4 Å²	67.4	11%	0.105	34%	0.343	C	S	.	.	H	α-helix	trans	-66.5	-39.9	179.4	-69	169.9	0	0	0	112.3	P376 I377 S392 K398 K399 A400 L405 E409	P376-L396 HydrophobicContact CB-CB 3.73Å; P376-L396 HydrophobicContact CB-CD1 4.26Å; P376-L396 HydrophobicContact CB-CG 4.41Å; P376-L396 HydrophobicContact CG-CB 4.39Å; I377-L396 WeakPolarHBondContact O-CD1 3.36Å; S392-L396 WeakPolarHBondContact O-CB 3.08Å; S392-L396 VanDerWaalsContact O-CG 3.32Å; S392-L396 WeakPolarHBondContact O-CG 3.19Å; S392-L396 PolarHBondContact O-N 2.95Å; L396-K398 VanDerWaalsContact C-N 3.28Å; L396-K398 PolarHBondContact O-N 2.92Å; L396-K399 PolarHBondContact O-N 3.05Å; L396-A400 WeakPolarHBondContact O-CB 3.39Å; L396-A400 PolarHBondContact O-N 3.03Å; L396-L405 HydrophobicContact CD2-CD2 3.85Å; L396-E409 HydrophobicContact CD2-CB 4.32Å; L396-E409 HydrophobicContact CD2-CG 4.34Å; L396-E409 VanDerWaalsContact CD2-OE1 3.28Å; L396-E409 WeakPolarHBondContact CD2-OE1 3.35Å
397	S	92.4	Very high	93	Very high	19 Å²	19	69.2 Å²	69.2	13%	0.133	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-33.3	175	-63.2	0	0	0	0	112.4	V393 R401	V393-S397 WeakPolarHBondContact O-CB 3.46Å; V393-S397 PolarHBondContact O-N 3Å; V393-S397 PolarHBondContact O-OG 2.96Å; S397-R401 WeakPolarHBondContact O-CG 3.48Å; S397-R401 PolarHBondContact O-N 3.41Å
398	K	94	Very high	92.9	Very high	133 Å²	133	71 Å²	71	58%	0.578	36%	0.364	S	S	*	.	H	α-helix	trans	-69	-50.6	171.7	-172.1	-179.1	175.9	-174.9	0	110.8	K394 A395 L396 A400 R401 D402	K394-K398 WeakPolarHBondContact O-CB 3.43Å; K394-K398 PolarHBondContact O-N 2.99Å; K394-K398 VanDerWaalsContact O-N 3.09Å; A395-K398 PolarHBondContact O-N 3.04Å; L396-K398 VanDerWaalsContact C-N 3.28Å; L396-K398 PolarHBondContact O-N 2.92Å; K398-A400 PolarHBondContact O-N 2.69Å; K398-R401 PolarHBondContact O-N 2.98Å; K398-R401 VanDerWaalsContact O-N 3.16Å; K398-D402 WeakPolarHBondContact CE-OD2 3.31Å; K398-D402 WeakPolarHBondContact O-CB 3.43Å; K398-D402 VanDerWaalsContact O-CG 3.31Å; K398-D402 PolarHBondContact O-N 2.68Å
399	K	94.1	Very high	92.8	Very high	75 Å²	75	67.3 Å²	67.3	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-52.3	-40.2	174.2	-75.6	-172.7	174.4	-170.3	0	112.4	A395 L396 G403 K404 L405 E409	A395-K399 PolarHBondContact O-N 2.64Å; L396-K399 PolarHBondContact O-N 3.05Å; K399-G403 PolarHBondContact O-N 2.92Å; K399-K404 PolarHBondContact O-N 3.34Å; K399-L405 HydrophobicContact CB-CD2 3.59Å; K399-L405 HydrophobicContact CB-CG 3.94Å; K399-L405 HydrophobicContact CD-CD2 4.03Å; K399-E409 WeakPolarHBondContact CD-OE2 3.49Å; K399-E409 IonicContact NZ-OE1 3.01Å; K399-E409 PolarHBondContact NZ-OE1 3Å; K399-E409 IonicContact NZ-OE2 3.39Å; K399-E409 PolarHBondContact NZ-OE2 2.89Å
400	A	92.6	Very high	92.6	Very high	2 Å²	2	69.3 Å²	69.3	2%	0.017	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-50.5	178.9	0	0	0	0	0	111.8	V367 T369 L374 L396 K398 G403 L405	V367-A400 HydrophobicContact CB-CB 4.47Å; V367-A400 HydrophobicContact CG1-CB 4.12Å; T369-A400 HydrophobicContact CG2-CB 4.37Å; L374-A400 HydrophobicContact CD1-CB 4.21Å; L396-A400 WeakPolarHBondContact O-CB 3.39Å; L396-A400 PolarHBondContact O-N 3.03Å; K398-A400 PolarHBondContact O-N 2.69Å; A400-G403 PolarHBondContact O-N 2.82Å; A400-L405 HydrophobicContact CB-CD1 3.69Å; A400-L405 HydrophobicContact CB-CG 4.25Å
401	R	90.4	Very high	92.3	Very high	174 Å²	174	71.9 Å²	71.9	66%	0.657	37%	0.365	S	S	*	.	H	α-helix	trans	-68	-39.8	178.9	-66	171.6	-172.2	169.3	4.6	112.2	T369 S397 K398 G403	T369-R401 HydrophobicContact CG2-CG 4.29Å; S397-R401 WeakPolarHBondContact O-CG 3.48Å; S397-R401 PolarHBondContact O-N 3.41Å; K398-R401 PolarHBondContact O-N 2.98Å; K398-R401 VanDerWaalsContact O-N 3.16Å; R401-G403 PolarHBondContact O-N 3.39Å
402	D	92.1	Very high	91.9	Very high	82 Å²	82	69.8 Å²	69.8	44%	0.439	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-10.9	175.6	-68.2	0.7	0	0	0	112.5	K398 K404	K398-D402 WeakPolarHBondContact CE-OD2 3.31Å; K398-D402 WeakPolarHBondContact O-CB 3.43Å; K398-D402 VanDerWaalsContact O-CG 3.31Å; K398-D402 PolarHBondContact O-N 2.68Å; D402-K404 HydrophobicContact CB-CD 4.2Å; D402-K404 HydrophobicContact CB-CG 4.28Å
403	G	88.4	Confident	91.6	Very high	50 Å²	50	68.8 Å²	68.8	52%	0.515	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	26	-178.2	0	0	0	0	0	114.7	K399 A400 R401	K399-G403 PolarHBondContact O-N 2.92Å; A400-G403 PolarHBondContact O-N 2.82Å; R401-G403 PolarHBondContact O-N 3.39Å
404	K	91.1	Very high	91.6	Very high	147 Å²	147	67.9 Å²	67.9	64%	0.639	36%	0.355	S	S	*	.			trans	-120.8	26.7	-170.3	-62.1	177.2	-176.2	177.3	0	113.9	K399 D402	K399-K404 PolarHBondContact O-N 3.34Å; D402-K404 HydrophobicContact CB-CD 4.2Å; D402-K404 HydrophobicContact CB-CG 4.28Å
405	L	91.2	Very high	91.7	Very high	23 Å²	23	61.7 Å²	61.7	12%	0.12	33%	0.328	C	S	.	.			trans	-76.8	134.8	169.2	-75.5	174.6	0	0	0	110.3	L374 P376 L396 K399 A400 E409 Y410	L374-L405 HydrophobicContact CD1-CD1 4.4Å; P376-L405 HydrophobicContact CB-CD1 4.17Å; P376-L405 HydrophobicContact CB-CD2 4.37Å; L396-L405 HydrophobicContact CD2-CD2 3.85Å; K399-L405 HydrophobicContact CB-CD2 3.59Å; K399-L405 HydrophobicContact CB-CG 3.94Å; K399-L405 HydrophobicContact CD-CD2 4.03Å; A400-L405 HydrophobicContact CB-CD1 3.69Å; A400-L405 HydrophobicContact CB-CG 4.25Å; L405-E409 HydrophobicContact CD2-CB 3.9Å; L405-Y410 HydrophobicContact CB-CD1 3.92Å; L405-Y410 HydrophobicContact CB-CE1 4.32Å; L405-Y410 HydrophobicContact CD1-CD1 4.44Å
406	L	92.3	Very high	91.7	Very high	101 Å²	101	59.1 Å²	59.1	53%	0.529	31%	0.306	S	S	.	.			trans	-73.3	152.8	171.4	-61.1	173.7	0	0	0	110.7	E408 E409 Y410	L406-E408 PolarHBondContact O-N 2.99Å; L406-E408 VanDerWaalsContact O-N 3.15Å; L406-E409 HydrophobicContact CB-CG 4.12Å; L406-E409 PolarHBondContact N-OE2 3.5Å; L406-E409 WeakPolarHBondContact O-CB 3.32Å; L406-E409 PolarHBondContact O-N 2.78Å; L406-Y410 WeakPolarHBondContact O-CD1 3.49Å; L406-Y410 VanDerWaalsContact O-CE1 3.23Å; L406-Y410 WeakPolarHBondContact O-CE1 3.47Å
407	P	89.2	Confident	91.8	Very high	68 Å²	68	58.2 Å²	58.2	44%	0.442	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-46.1	-43.7	175.7	-33	38.6	0	0	0	114.4	E409 Y410 Q411	P407-E409 VanDerWaalsContact C-N 3.27Å; P407-E409 PolarHBondContact O-N 3.32Å; P407-Y410 PolarHBondContact O-N 3.13Å; P407-Q411 VanDerWaalsContact C-NE2 3.34Å; P407-Q411 VanDerWaalsContact CA-NE2 3.31Å; P407-Q411 VanDerWaalsContact CB-NE2 3.35Å; P407-Q411 WeakPolarHBondContact O-CB 3.5Å; P407-Q411 PolarHBondContact O-N 2.96Å; P407-Q411 PolarHBondContact O-NE2 3.19Å
408	E	90.8	Very high	92	Very high	141 Å²	141	58 Å²	58	66%	0.659	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-68.4	-19.4	178.9	-61.8	173.1	-141.2	0	0	114.6	L406 Y410	L406-E408 PolarHBondContact O-N 2.99Å; L406-E408 VanDerWaalsContact O-N 3.15Å; E408-Y410 VanDerWaalsContact C-N 3.31Å
409	E	92.1	Very high	92	Very high	36 Å²	36	53.9 Å²	53.9	17%	0.168	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-81.9	-10.2	-179.3	-65.1	-176.7	117	0	0	112.3	P376 I377 L396 K399 L405 L406 P407	P376-E409 CarbonylContact C-O 3.2Å; P376-E409 VanDerWaalsContact CA-O 3.24Å; P376-E409 WeakPolarHBondContact CA-O 3.32Å; I377-E409 PolarHBondContact N-O 2.9Å; L396-E409 HydrophobicContact CD2-CB 4.32Å; L396-E409 HydrophobicContact CD2-CG 4.34Å; L396-E409 VanDerWaalsContact CD2-OE1 3.28Å; L396-E409 WeakPolarHBondContact CD2-OE1 3.35Å; K399-E409 WeakPolarHBondContact CD-OE2 3.49Å; K399-E409 IonicContact NZ-OE1 3.01Å; K399-E409 PolarHBondContact NZ-OE1 3Å; K399-E409 IonicContact NZ-OE2 3.39Å; K399-E409 PolarHBondContact NZ-OE2 2.89Å; L405-E409 HydrophobicContact CD2-CB 3.9Å; L406-E409 HydrophobicContact CB-CG 4.12Å; L406-E409 PolarHBondContact N-OE2 3.5Å; L406-E409 WeakPolarHBondContact O-CB 3.32Å; L406-E409 PolarHBondContact O-N 2.78Å; P407-E409 VanDerWaalsContact C-N 3.27Å; P407-E409 PolarHBondContact O-N 3.32Å
410	Y	90.4	Very high	92	Very high	42 Å²	42	52.6 Å²	52.6	17%	0.165	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	5.2	-179.4	65.7	-95.7	0	0	0	115.7	T375 L405 L406 P407 E408	T375-Y410 WeakPolarHBondContact O-CA 3.5Å; L405-Y410 HydrophobicContact CB-CD1 3.92Å; L405-Y410 HydrophobicContact CB-CE1 4.32Å; L405-Y410 HydrophobicContact CD1-CD1 4.44Å; L406-Y410 WeakPolarHBondContact O-CD1 3.49Å; L406-Y410 VanDerWaalsContact O-CE1 3.23Å; L406-Y410 WeakPolarHBondContact O-CE1 3.47Å; P407-Y410 PolarHBondContact O-N 3.13Å; E408-Y410 VanDerWaalsContact C-N 3.31Å
411	Q	88.1	Confident	91.7	Very high	63 Å²	63	53 Å²	53	29%	0.294	29%	0.285	S	S	.	.	S	Bend	trans	-110.7	127.7	174.7	-78.5	160.4	95.5	0	0	110.7	I377 P407	I377-Q411 VanDerWaalsContact CD1-C 3.47Å; I377-Q411 VanDerWaalsContact CD1-O 3.29Å; I377-Q411 WeakPolarHBondContact CD1-O 3.4Å; P407-Q411 VanDerWaalsContact C-NE2 3.34Å; P407-Q411 VanDerWaalsContact CA-NE2 3.31Å; P407-Q411 VanDerWaalsContact CB-NE2 3.35Å; P407-Q411 WeakPolarHBondContact O-CB 3.5Å; P407-Q411 PolarHBondContact O-N 2.96Å; P407-Q411 PolarHBondContact O-NE2 3.19Å
412	G	87.2	Confident	91.6	Very high	47 Å²	47	52 Å²	52	49%	0.485	29%	0.29	S	S	.	.			trans	99.7	-136	-172.4	0	0	0	0	0	112	Q436	G412-Q436 PolarHBondContact O-NE2 2.85Å
413	G	89.6	Confident	91.5	Very high	13 Å²	13	54 Å²	54	13%	0.134	30%	0.295	C	S	.	.			trans	77.3	150.2	-166.3	0	0	0	0	0	112.1	D362 Q436	D362-G413 CarbonylContact O-C 3.52Å; G413-Q436 VanDerWaalsContact C-NE2 3.29Å; G413-Q436 WeakPolarHBondContact O-CG 3.47Å; G413-Q436 PolarHBondContact O-NE2 3.36Å
414	S	93.7	Very high	91.6	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.014	29%	0.287	C	S	.	.	S	Bend	trans	-94	-26.4	178.3	67.1	0	0	0	0	113	N347 D362	N347-S414 WeakPolarHBondContact OD1-CB 3.39Å; N347-S414 PolarHBondContact OD1-OG 3.38Å; D362-S414 PolarHBondContact N-OG 2.79Å; D362-S414 VanDerWaalsContact N-OG 3.16Å; D362-S414 PolarHBondContact O-N 2.95Å; D362-S414 PolarHBondContact O-OG 3.03Å
415	F	96.1	Very high	91.8	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.6	-175.1	-167.2	-93.5	0	0	0	111.3	A336 L340 D362 I363 S364 I417 Q436 C438 L440 M471 F486	A336-F415 HydrophobicContact CB-CE1 4.47Å; L340-F415 HydrophobicContact CD1-CB 3.76Å; L340-F415 HydrophobicContact CD1-CD1 4.28Å; L340-F415 HydrophobicContact CD1-CD2 3.96Å; L340-F415 HydrophobicContact CD1-CG 3.77Å; L340-F415 HydrophobicContact CD2-CD2 3.93Å; L340-F415 HydrophobicContact CD2-CE2 4.23Å; L340-F415 HydrophobicContact CG-CD2 4.5Å; D362-F415 PolarHBondContact O-N 2.86Å; I363-F415 WeakPolarHBondContact CA-O 3.38Å; S364-F415 PolarHBondContact N-O 2.81Å; F415-I417 HydrophobicContact CD1-CG1 4.02Å; F415-I417 HydrophobicContact CE1-CG1 3.94Å; F415-Q436 VanDerWaalsContact C-OE1 3.25Å; F415-C438 HydrophobicContact CD2-CB 3.88Å; F415-C438 HydrophobicContact CE2-CB 3.49Å; F415-C438 VanDerWaalsContact CE2-CB 3.49Å; F415-C438 HydrophobicContact CZ-CB 4.41Å; F415-L440 HydrophobicContact CE1-CB 3.79Å; F415-L440 HydrophobicContact CZ-CB 3.98Å; F415-M471 HydrophobicContact CE2-SD 4.34Å; F415-M471 HydrophobicContact CZ-SD 4.3Å; F415-F486 HydrophobicContact CE2-CZ 4.22Å; F415-F486 HydrophobicContact CZ-CE1 4.28Å; F415-F486 HydrophobicContact CZ-CZ 4.04Å
416	S	96.1	Very high	91.8	Very high	2 Å²	2	51 Å²	51	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.6	176.8	-76	0	0	0	0	112.8	S364 N433 Q436 C438 I439 L440	S364-S416 CarbonylContact O-C 3.58Å; S364-S416 WeakPolarHBondContact O-CA 3.31Å; S416-N433 PolarHBondContact OG-ND2 3.47Å; S416-N433 VanDerWaalsContact OG-ND2 3.12Å; S416-Q436 VanDerWaalsContact N-OE1 3.09Å; S416-Q436 PolarHBondContact OG-OE1 2.82Å; S416-C438 PolarHBondContact N-O 3.42Å; S416-I439 WeakPolarHBondContact O-CA 3.31Å; S416-L440 PolarHBondContact O-N 2.87Å
417	I	97	Very high	92	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.1	169.1	-56.9	-178.2	0	0	0	109.6	I332 I333 A336 I363 S364 A366 F415 L440 V442	I332-I417 HydrophobicContact CG2-CD1 4.31Å; I332-I417 HydrophobicContact CG2-CG2 4.36Å; I333-I417 HydrophobicContact CG1-CD1 4.12Å; A336-I417 HydrophobicContact CB-CD1 3.84Å; I363-I417 HydrophobicContact CD1-CD1 4.43Å; I363-I417 HydrophobicContact CG2-CB 4.5Å; I363-I417 HydrophobicContact CG2-CD1 3.69Å; I363-I417 HydrophobicContact CG2-CG1 3.86Å; S364-I417 PolarHBondContact O-N 2.8Å; A366-I417 PolarHBondContact N-O 2.96Å; F415-I417 HydrophobicContact CD1-CG1 4.02Å; F415-I417 HydrophobicContact CE1-CG1 3.94Å; I417-L440 WeakPolarHBondContact CA-O 3.42Å; I417-L440 HydrophobicContact CG1-CB 4.38Å; I417-V442 HydrophobicContact CG2-CG2 4.3Å
418	S	95.9	Very high	92.3	Very high	15 Å²	15	49.3 Å²	49.3	11%	0.105	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.6	174.5	-173.6	0	0	0	0	110.5	L440 A441 V442	S418-L440 PolarHBondContact N-O 3.32Å; S418-A441 CarbonylContact O-C 3.59Å; S418-A441 WeakPolarHBondContact O-CA 3.44Å; S418-V442 PolarHBondContact O-N 2.96Å
419	N	94.6	Very high	92.6	Very high	46 Å²	46	46.5 Å²	46.5	25%	0.246	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	115	-174.5	-174.2	-20.6	0	0	0	109.9	N329 G421 V442	N329-N419 PolarHBondContact OD1-ND2 3.04Å; N419-G421 PolarHBondContact OD1-N 3.4Å; N419-V442 HydrophobicContact CB-CB 4.17Å
420	L	92.6	Very high	92.8	Very high	49 Å²	49	45.2 Å²	45.2	26%	0.257	25%	0.253	S	S	.	.			trans	-114.9	10.6	177.7	-60.4	179.2	0	0	0	112.4	M422 F423 I425 F428 V442	L420-M422 PolarHBondContact O-N 3.13Å; L420-M422 VanDerWaalsContact O-N 3.14Å; L420-F423 HydrophobicContact CB-CD2 4.23Å; L420-F423 HydrophobicContact CD2-CD2 3.73Å; L420-F423 HydrophobicContact CD2-CE2 3.87Å; L420-F423 PolarHBondContact O-N 3.41Å; L420-I425 HydrophobicContact CB-CB 4.44Å; L420-I425 HydrophobicContact CB-CD1 4.13Å; L420-I425 HydrophobicContact CD1-CD1 4.03Å; L420-F428 HydrophobicContact CB-CD1 4.06Å; L420-F428 HydrophobicContact CB-CE1 3.64Å; L420-F428 HydrophobicContact CB-CZ 4.1Å; L420-F428 HydrophobicContact CD1-CD1 3.94Å; L420-F428 HydrophobicContact CD1-CD2 3.8Å; L420-F428 HydrophobicContact CD1-CE1 3.83Å; L420-F428 HydrophobicContact CD1-CE2 3.68Å; L420-F428 HydrophobicContact CD1-CG 3.93Å; L420-F428 HydrophobicContact CD1-CZ 3.7Å; L420-F428 HydrophobicContact CG-CD1 4.22Å; L420-F428 HydrophobicContact CG-CE1 3.67Å; L420-F428 HydrophobicContact CG-CE2 4.07Å; L420-F428 HydrophobicContact CG-CZ 3.58Å; L420-V442 PolarHBondContact N-O 2.87Å; L420-V442 VanDerWaalsContact N-O 3.09Å
421	G	87.3	Confident	93	Very high	10 Å²	10	45.4 Å²	45.4	10%	0.103	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-59.2	-26.4	178	0	0	0	0	0	113.8	N419 F423 G424 V442	N419-G421 PolarHBondContact OD1-N 3.4Å; G421-F423 PolarHBondContact O-N 3.42Å; G421-G424 PolarHBondContact O-N 2.94Å; G421-V442 PolarHBondContact N-O 3.49Å
422	M	87.6	Confident	93.3	Very high	153 Å²	153	42.5 Å²	42.5	75%	0.754	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-68.6	-18	172.8	67.2	174.6	-75.8	0	0	114.4	L420	L420-M422 PolarHBondContact O-N 3.13Å; L420-M422 VanDerWaalsContact O-N 3.14Å
423	F	89.5	Confident	93.5	Very high	123 Å²	123	42.6 Å²	42.6	54%	0.539	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-96.3	4.7	175	-58.8	-77	0	0	0	112.6	L420 G421 I425	L420-F423 HydrophobicContact CB-CD2 4.23Å; L420-F423 HydrophobicContact CD2-CD2 3.73Å; L420-F423 HydrophobicContact CD2-CE2 3.87Å; L420-F423 PolarHBondContact O-N 3.41Å; G421-F423 PolarHBondContact O-N 3.42Å; F423-I425 VanDerWaalsContact C-N 3.33Å; F423-I425 HydrophobicContact CB-CG1 4.43Å; F423-I425 PolarHBondContact O-N 3.33Å
424	G	91.3	Very high	93.6	Very high	34 Å²	34	44.8 Å²	44.8	35%	0.351	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	10.3	177.2	0	0	0	0	0	115.6	G421 R444	G421-G424 PolarHBondContact O-N 2.94Å; G424-R444 VanDerWaalsContact O-CD 3.32Å; G424-R444 WeakPolarHBondContact O-CD 3.49Å; G424-R444 PolarHBondContact O-NE 2.97Å
425	I	94.6	Very high	93.4	Very high	67 Å²	67	48.1 Å²	48.1	34%	0.344	27%	0.268	S	S	.	.			trans	-74.5	125.8	179.9	-63.8	179.6	0	0	0	110.1	L420 F423 E427 F428 G443 R444	L420-I425 HydrophobicContact CB-CB 4.44Å; L420-I425 HydrophobicContact CB-CD1 4.13Å; L420-I425 HydrophobicContact CD1-CD1 4.03Å; F423-I425 VanDerWaalsContact C-N 3.33Å; F423-I425 HydrophobicContact CB-CG1 4.43Å; F423-I425 PolarHBondContact O-N 3.33Å; I425-E427 WeakPolarHBondContact CG2-O 3.31Å; I425-F428 HydrophobicContact CG2-CB 4.15Å; I425-F428 HydrophobicContact CG2-CD1 4.29Å; I425-G443 CarbonylContact O-C 3.54Å; I425-G443 WeakPolarHBondContact O-CA 3.43Å; I425-R444 PolarHBondContact O-N 3.37Å
426	D	92.6	Very high	93.3	Very high	58 Å²	58	48.5 Å²	48.5	31%	0.31	27%	0.269	S	S	.	.	S	Bend	trans	-69.2	-48.3	-178.8	-80.5	-51	0	0	0	113.7	G443 R444 R446	D426-G443 WeakPolarHBondContact O-CA 3.42Å; D426-R444 VanDerWaalsContact CG-NH2 3.28Å; D426-R444 IonicContact OD1-CZ 3.14Å; D426-R444 IonicContact OD1-NE 2.67Å; D426-R444 PolarHBondContact OD1-NE 3.37Å; D426-R444 IonicContact OD1-NH2 3.64Å; D426-R444 PolarHBondContact OD1-NH2 2.94Å; D426-R444 VanDerWaalsContact OD1-NH2 3.1Å; D426-R444 IonicContact OD2-CZ 3.76Å; D426-R444 IonicContact OD2-NE 3.51Å; D426-R444 IonicContact OD2-NH2 3.32Å; D426-R444 PolarHBondContact OD2-NH2 3.27Å; D426-R446 WeakPolarHBondContact OD1-CD 3.3Å; D426-R446 IonicContact OD1-NE 2.86Å; D426-R446 PolarHBondContact OD1-NE 3.25Å
427	E	95.4	Very high	93.2	Very high	98 Å²	98	48.4 Å²	48.4	46%	0.458	27%	0.269	S	S	.	.			trans	-147.8	145.5	-178.6	-174.3	177.4	-178.9	0	0	108.3	T304 I425 T468 T470	T304-E427 WeakPolarHBondContact CB-OE1 3.43Å; T304-E427 VanDerWaalsContact CG2-OE1 3.26Å; T304-E427 WeakPolarHBondContact CG2-OE1 3.39Å; T304-E427 PolarHBondContact OG1-OE1 2.96Å; I425-E427 WeakPolarHBondContact CG2-O 3.31Å; E427-T468 HydrophobicContact CB-CG2 4.28Å; E427-T468 HydrophobicContact CG-CG2 4.11Å; E427-T470 WeakPolarHBondContact CG-OG1 3.41Å; E427-T470 PolarHBondContact OE1-OG1 3.33Å
428	F	96.8	Very high	93.2	Very high	35 Å²	35	48.3 Å²	48.3	15%	0.154	27%	0.268	C	S	.	.			trans	-152.7	151.2	168.2	72.9	-78.6	0	0	0	110.6	L420 I425 A430 A441 V442	L420-F428 HydrophobicContact CB-CD1 4.06Å; L420-F428 HydrophobicContact CB-CE1 3.64Å; L420-F428 HydrophobicContact CB-CZ 4.1Å; L420-F428 HydrophobicContact CD1-CD1 3.94Å; L420-F428 HydrophobicContact CD1-CD2 3.8Å; L420-F428 HydrophobicContact CD1-CE1 3.83Å; L420-F428 HydrophobicContact CD1-CE2 3.68Å; L420-F428 HydrophobicContact CD1-CG 3.93Å; L420-F428 HydrophobicContact CD1-CZ 3.7Å; L420-F428 HydrophobicContact CG-CD1 4.22Å; L420-F428 HydrophobicContact CG-CE1 3.67Å; L420-F428 HydrophobicContact CG-CE2 4.07Å; L420-F428 HydrophobicContact CG-CZ 3.58Å; I425-F428 HydrophobicContact CG2-CB 4.15Å; I425-F428 HydrophobicContact CG2-CD1 4.29Å; F428-A430 HydrophobicContact CE2-CB 4.14Å; F428-A441 HydrophobicContact CD1-CB 4.14Å; F428-A441 HydrophobicContact CD2-CB 3.98Å; F428-A441 HydrophobicContact CE1-CB 3.8Å; F428-A441 HydrophobicContact CE2-CB 3.63Å; F428-A441 HydrophobicContact CG-CB 4.23Å; F428-A441 HydrophobicContact CZ-CB 3.53Å; F428-A441 WeakPolarHBondContact O-CB 3.41Å; F428-V442 WeakPolarHBondContact CE1-O 3.42Å
429	T	96.8	Very high	93.2	Very high	81 Å²	81	48 Å²	48	50%	0.497	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-95.7	131.3	170.3	46	0	0	0	0	109.9	Y302 T470	Y302-T429 HydrophobicContact CD1-CG2 3.5Å; Y302-T429 VanDerWaalsContact CD1-CG2 3.5Å; Y302-T429 HydrophobicContact CE1-CG2 3.95Å; Y302-T429 HydrophobicContact CG-CG2 3.97Å; T429-T470 HydrophobicContact CG2-CG2 3.82Å
430	A	94.8	Very high	93.4	Very high	10 Å²	10	45.8 Å²	45.8	8%	0.083	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-94.8	153.1	174.2	0	0	0	0	0	111.1	F428 I439 A441 S472	F428-A430 HydrophobicContact CE2-CB 4.14Å; A430-I439 HydrophobicContact CB-CD1 3.73Å; A430-I439 HydrophobicContact CB-CG1 3.88Å; A430-I439 HydrophobicContact CB-CG2 3.83Å; A430-A441 HydrophobicContact CB-CB 4.27Å; A430-S472 WeakPolarHBondContact O-CB 3.42Å; A430-S472 PolarHBondContact O-OG 2.84Å
431	V	95.6	Very high	93.6	Very high	46 Å²	46	43.5 Å²	43.5	28%	0.279	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-86.3	134.8	170.2	178.8	0	0	0	0	108.6	L291 S294 K295	L291-V431 HydrophobicContact CD2-CB 3.97Å; L291-V431 HydrophobicContact CD2-CG1 3.86Å; S294-V431 WeakPolarHBondContact OG-CG1 3.24Å; K295-V431 HydrophobicContact CD-CG1 4.46Å; K295-V431 HydrophobicContact CD-CG2 4.43Å
432	I	95	Very high	94.1	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-65.6	142.6	179.8	-63.5	159.6	0	0	0	109.4	S294 V298 H300 P434 Q436 I439	S294-I432 WeakPolarHBondContact CB-O 3.47Å; S294-I432 PolarHBondContact OG-O 3.31Å; V298-I432 HydrophobicContact CG1-CD1 3.74Å; H300-I432 PolarHBondContact NE2-N 2.99Å; H300-I432 VanDerWaalsContact NE2-N 3.15Å; I432-P434 WeakPolarHBondContact O-CD 3.07Å; I432-Q436 WeakPolarHBondContact CG2-O 3.26Å; I432-I439 HydrophobicContact CB-CG2 4.39Å; I432-I439 HydrophobicContact CG1-CG2 3.8Å
433	N	91.5	Very high	94.5	Very high	50 Å²	50	36 Å²	36	27%	0.267	20%	0.202	S	C	.	.			trans	-94.9	107.9	174.8	-68	-47.1	0	0	0	109.8	S416 Q436	S416-N433 PolarHBondContact OG-ND2 3.47Å; S416-N433 VanDerWaalsContact OG-ND2 3.12Å; N433-Q436 VanDerWaalsContact O-CB 3.29Å; N433-Q436 WeakPolarHBondContact O-CB 3.41Å; N433-Q436 PolarHBondContact O-N 3.39Å
434	P	90.1	Very high	94.7	Very high	59 Å²	59	34.6 Å²	34.6	38%	0.383	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	141.8	178	-21.8	34.6	0	0	0	111	I432	I432-P434 WeakPolarHBondContact O-CD 3.07Å
435	P	90.3	Very high	94.7	Very high	71 Å²	71	37.1 Å²	37.1	46%	0.461	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	cis	-93.7	14.7	10.1	38.2	-37.5	0	0	0	115.3	S349 W350	S349-P435 VanDerWaalsContact CA-O 3.24Å; S349-P435 WeakPolarHBondContact CA-O 3.14Å; S349-P435 VanDerWaalsContact CB-O 3.27Å; S349-P435 WeakPolarHBondContact CB-O 3.32Å; W350-P435 PolarHBondContact N-O 2.99Å
436	Q	93.4	Very high	94.6	Very high	9 Å²	9	37.7 Å²	37.7	4%	0.042	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-68.5	150.1	-176.3	-57.2	176.9	-3.2	0	0	112.1	S364 G412 G413 F415 S416 I432 N433	S364-Q436 PolarHBondContact OG-NE2 2.88Å; G412-Q436 PolarHBondContact O-NE2 2.85Å; G413-Q436 VanDerWaalsContact C-NE2 3.29Å; G413-Q436 WeakPolarHBondContact O-CG 3.47Å; G413-Q436 PolarHBondContact O-NE2 3.36Å; F415-Q436 VanDerWaalsContact C-OE1 3.25Å; S416-Q436 VanDerWaalsContact N-OE1 3.09Å; S416-Q436 PolarHBondContact OG-OE1 2.82Å; I432-Q436 WeakPolarHBondContact CG2-O 3.26Å; N433-Q436 VanDerWaalsContact O-CB 3.29Å; N433-Q436 WeakPolarHBondContact O-CB 3.41Å; N433-Q436 PolarHBondContact O-N 3.39Å
437	A	94.5	Very high	94.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-77.8	-32.6	176.9	0	0	0	0	0	114.7	V348 D474 M477	V348-A437 HydrophobicContact CB-CB 4.35Å; V348-A437 VanDerWaalsContact O-CB 3.24Å; V348-A437 WeakPolarHBondContact O-CB 3.32Å; V348-A437 PolarHBondContact O-N 3.09Å; A437-D474 PolarHBondContact O-N 3.18Å; A437-M477 HydrophobicContact CB-CE 3.42Å; A437-M477 VanDerWaalsContact CB-CE 3.42Å; A437-M477 HydrophobicContact CB-SD 4.42Å
438	C	96.1	Very high	94.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	153.3	-165.7	-70.3	0	0	0	0	113.3	F415 S416 M471 S472 S473	F415-C438 HydrophobicContact CD2-CB 3.88Å; F415-C438 HydrophobicContact CE2-CB 3.49Å; F415-C438 VanDerWaalsContact CE2-CB 3.49Å; F415-C438 HydrophobicContact CZ-CB 4.41Å; S416-C438 PolarHBondContact N-O 3.42Å; C438-M471 HydrophobicContact CB-CG 4.48Å; C438-M471 HydrophobicContact CB-SD 4.41Å; C438-S472 WeakPolarHBondContact CA-O 3.18Å; C438-S473 PolarHBondContact SG-OG 3.2Å
439	I	97	Very high	94.3	Very high	8 Å²	8	40.2 Å²	40.2	4%	0.041	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	133.3	168.4	-177.6	161.6	0	0	0	110.7	S416 A430 I432 M471 S472	S416-I439 WeakPolarHBondContact O-CA 3.31Å; A430-I439 HydrophobicContact CB-CD1 3.73Å; A430-I439 HydrophobicContact CB-CG1 3.88Å; A430-I439 HydrophobicContact CB-CG2 3.83Å; I432-I439 HydrophobicContact CB-CG2 4.39Å; I432-I439 HydrophobicContact CG1-CG2 3.8Å; I439-M471 WeakPolarHBondContact O-CA 3.31Å; I439-S472 PolarHBondContact N-O 2.68Å; I439-S472 PolarHBondContact O-N 3.37Å
440	L	97.8	Very high	93.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122	175.9	-169.7	68.8	0	0	0	110.7	I332 F415 S416 I417 S418 V469 M471 L487 F490	I332-L440 HydrophobicContact CG2-CD2 4.37Å; F415-L440 HydrophobicContact CE1-CB 3.79Å; F415-L440 HydrophobicContact CZ-CB 3.98Å; S416-L440 PolarHBondContact O-N 2.87Å; I417-L440 WeakPolarHBondContact CA-O 3.42Å; I417-L440 HydrophobicContact CG1-CB 4.38Å; S418-L440 PolarHBondContact N-O 3.32Å; L440-V469 HydrophobicContact CD1-CB 4.14Å; L440-M471 HydrophobicContact CD1-CB 4.03Å; L440-L487 HydrophobicContact CD1-CD2 4.33Å; L440-F490 HydrophobicContact CD2-CE1 4.37Å; L440-F490 HydrophobicContact CD2-CE2 3.94Å; L440-F490 HydrophobicContact CD2-CZ 3.82Å
441	A	97.4	Very high	93.6	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.4	171.4	0	0	0	0	0	110.6	S418 F428 A430 V469 T470	S418-A441 CarbonylContact O-C 3.59Å; S418-A441 WeakPolarHBondContact O-CA 3.44Å; F428-A441 HydrophobicContact CD1-CB 4.14Å; F428-A441 HydrophobicContact CD2-CB 3.98Å; F428-A441 HydrophobicContact CE1-CB 3.8Å; F428-A441 HydrophobicContact CE2-CB 3.63Å; F428-A441 HydrophobicContact CG-CB 4.23Å; F428-A441 HydrophobicContact CZ-CB 3.53Å; F428-A441 WeakPolarHBondContact O-CB 3.41Å; A430-A441 HydrophobicContact CB-CB 4.27Å; A441-V469 WeakPolarHBondContact O-CA 3.44Å; A441-T470 WeakPolarHBondContact CB-O 3.43Å; A441-T470 PolarHBondContact N-O 3.43Å; A441-T470 PolarHBondContact O-N 3.05Å
442	V	97.3	Very high	93.1	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	113.9	-177.5	-177.6	0	0	0	0	110.4	I332 I417 S418 N419 L420 G421 F428 I467 V469	I332-V442 HydrophobicContact CD1-CG1 3.87Å; I332-V442 HydrophobicContact CD1-CG2 4.32Å; I332-V442 HydrophobicContact CG2-CG2 4.21Å; I417-V442 HydrophobicContact CG2-CG2 4.3Å; S418-V442 PolarHBondContact O-N 2.96Å; N419-V442 HydrophobicContact CB-CB 4.17Å; L420-V442 PolarHBondContact N-O 2.87Å; L420-V442 VanDerWaalsContact N-O 3.09Å; G421-V442 PolarHBondContact N-O 3.49Å; F428-V442 WeakPolarHBondContact CE1-O 3.42Å; V442-I467 HydrophobicContact CG1-CD1 4.15Å; V442-V469 HydrophobicContact CG2-CG1 4.3Å
443	G	96.1	Very high	92.7	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-174.8	176.2	0	0	0	0	0	114.2	I425 D426 T468	I425-G443 CarbonylContact O-C 3.54Å; I425-G443 WeakPolarHBondContact O-CA 3.43Å; D426-G443 WeakPolarHBondContact O-CA 3.42Å; G443-T468 PolarHBondContact N-O 3.34Å
444	R	94.8	Very high	92.2	Very high	94 Å²	94	52.3 Å²	52.3	36%	0.355	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	158.3	178.9	68.6	156.7	171.9	-164.4	-9.5	112.8	G424 I425 D426 R446	G424-R444 VanDerWaalsContact O-CD 3.32Å; G424-R444 WeakPolarHBondContact O-CD 3.49Å; G424-R444 PolarHBondContact O-NE 2.97Å; I425-R444 PolarHBondContact O-N 3.37Å; D426-R444 VanDerWaalsContact CG-NH2 3.28Å; D426-R444 IonicContact OD1-CZ 3.14Å; D426-R444 IonicContact OD1-NE 2.67Å; D426-R444 PolarHBondContact OD1-NE 3.37Å; D426-R444 IonicContact OD1-NH2 3.64Å; D426-R444 PolarHBondContact OD1-NH2 2.94Å; D426-R444 VanDerWaalsContact OD1-NH2 3.1Å; D426-R444 IonicContact OD2-CZ 3.76Å; D426-R444 IonicContact OD2-NE 3.51Å; D426-R444 IonicContact OD2-NH2 3.32Å; D426-R444 PolarHBondContact OD2-NH2 3.27Å; R444-R446 HydrophobicContact CG-CG 4.35Å
445	F	91.1	Very high	91.7	Very high	87 Å²	87	59.5 Å²	59.5	38%	0.382	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	130.1	167.1	-57.6	-99.3	0	0	0	109.8	L309 V328 I467	L309-F445 HydrophobicContact CD1-CD1 3.78Å; L309-F445 HydrophobicContact CD1-CE1 3.39Å; L309-F445 HydrophobicContact CD1-CZ 4.37Å; V328-F445 HydrophobicContact CB-CE1 4.26Å; V328-F445 HydrophobicContact CB-CZ 3.86Å; V328-F445 HydrophobicContact CG1-CE1 3.93Å; V328-F445 HydrophobicContact CG1-CZ 3.82Å; V328-F445 HydrophobicContact CG2-CE1 3.96Å; V328-F445 HydrophobicContact CG2-CZ 3.86Å; F445-I467 HydrophobicContact CD1-CG2 3.95Å; F445-I467 HydrophobicContact CE1-CG2 4.23Å; F445-I467 HydrophobicContact CG-CG2 4.18Å
446	R	92.4	Very high	91.2	Very high	79 Å²	79	63.7 Å²	63.7	30%	0.298	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.5	173.5	-75.7	-170.2	-81.9	161.5	2.6	111.3	D306 D426 R444 V448 L466 T468	D306-R446 IonicContact OD1-NH2 2.68Å; D426-R446 WeakPolarHBondContact OD1-CD 3.3Å; D426-R446 IonicContact OD1-NE 2.86Å; D426-R446 PolarHBondContact OD1-NE 3.25Å; R444-R446 HydrophobicContact CG-CG 4.35Å; R446-V448 HydrophobicContact CB-CG2 4.08Å; R446-V448 PolarHBondContact O-N 3.02Å; R446-L466 PolarHBondContact N-O 2.76Å; R446-L466 PolarHBondContact O-N 2.92Å; R446-T468 PolarHBondContact NH2-OG1 2.94Å
447	P	92.4	Very high	90.7	Very high	92 Å²	92	65.8 Å²	65.8	60%	0.597	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	122.7	162.8	30.5	-31.1	0	0	0	109	Q463 R464	P447-Q463 HydrophobicContact CB-CG 4.21Å; P447-Q463 VanDerWaalsContact CB-NE2 3.33Å; P447-R464 WeakPolarHBondContact CA-O 3.23Å
448	V	93.4	Very high	90.3	Very high	42 Å²	42	70.1 Å²	70.1	26%	0.255	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.3	179	-179.6	0	0	0	0	108.9	R446 R464 L466	R446-V448 HydrophobicContact CB-CG2 4.08Å; R446-V448 PolarHBondContact O-N 3.02Å; V448-R464 PolarHBondContact N-O 3.43Å; V448-R464 PolarHBondContact O-N 2.77Å; V448-L466 HydrophobicContact CB-CD1 3.89Å; V448-L466 HydrophobicContact CB-CG 4.22Å; V448-L466 HydrophobicContact CG1-CD1 4.19Å; V448-L466 HydrophobicContact CG2-CD1 3.92Å; V448-L466 HydrophobicContact CG2-CG 4.25Å
449	L	92.4	Very high	89.8	Confident	110 Å²	110	73.9 Å²	73.9	58%	0.576	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.8	171.2	-61.4	177.4	0	0	0	108.9	L461 Q463	L449-L461 HydrophobicContact CB-CD2 4.38Å; L449-Q463 HydrophobicContact CD2-CB 3.97Å
450	K	87.9	Confident	89.4	Confident	85 Å²	85	78.1 Å²	78.1	37%	0.37	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	146	166.8	-72.3	-169.6	173	173.3	0	109.6	Q462	K450-Q462 PolarHBondContact N-O 3.15Å; K450-Q462 PolarHBondContact O-N 3.32Å
451	L	90	Very high	89	Confident	125 Å²	125	83.4 Å²	83.4	65%	0.654	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.7	164.8	-68.8	166.8	0	0	0	108.8	K460 L461	L451-K460 CarbonylContact C-O 3.49Å; L451-K460 WeakPolarHBondContact CA-O 3.42Å; L451-L461 HydrophobicContact CD2-CD2 3.61Å; L451-L461 HydrophobicContact CD2-CG 4.12Å; L451-L461 HydrophobicContact CG-CD2 4.09Å
452	T	84.6	Confident	88.6	Confident	21 Å²	21	87 Å²	87	13%	0.129	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	137.6	175.3	50.3	0	0	0	0	107.7	K460 Q462	T452-K460 PolarHBondContact N-O 2.95Å; T452-K460 PolarHBondContact O-N 2.9Å; T452-K460 PolarHBondContact OG1-O 3.07Å; T452-Q462 HydrophobicContact CG2-CB 4.13Å; T452-Q462 HydrophobicContact CG2-CG 4.32Å; T452-Q462 WeakPolarHBondContact OG1-CG 3.43Å; T452-Q462 PolarHBondContact OG1-NE2 3.35Å
453	E	86.4	Confident	88.2	Confident	162 Å²	162	93.2 Å²	93.2	76%	0.757	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.8	130.3	171.4	-70.3	151.1	-158.3	0	0	109.2	N458	E453-N458 WeakPolarHBondContact CA-O 3.23Å
454	D	80.9	Confident	88	Confident	50 Å²	50	97.6 Å²	97.6	27%	0.267	49%	0.494	S	S	.	.			trans	-72.9	170.6	162.3	-85.9	-20.9	0	0	0	109.9	E456 G457 N458 K460	D454-E456 PolarHBondContact O-N 3.24Å; D454-G457 PolarHBondContact O-N 3.05Å; D454-N458 PolarHBondContact N-O 3.04Å; D454-K460 VanDerWaalsContact CG-CD 3.43Å; D454-K460 VanDerWaalsContact OD1-CD 3.3Å; D454-K460 WeakPolarHBondContact OD1-CD 3.21Å; D454-K460 IonicContact OD1-NZ 2.79Å; D454-K460 PolarHBondContact OD1-NZ 3.5Å; D454-K460 WeakPolarHBondContact OD2-CD 3.44Å; D454-K460 WeakPolarHBondContact OD2-CE 3.4Å; D454-K460 IonicContact OD2-NZ 2.62Å; D454-K460 PolarHBondContact OD2-NZ 3.4Å
455	E	78.7	Confident	87.8	Confident	209 Å²	209	97.2 Å²	97.2	98%	0.977	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-18.3	-179.5	-59.8	-177.5	167.1	0	0	114.1
456	E	81.8	Confident	88	Confident	159 Å²	159	93.2 Å²	93.2	74%	0.743	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	1.2	176.4	-59.6	172.5	169.6	0	0	113.6	D454 N458	D454-E456 PolarHBondContact O-N 3.24Å; E456-N458 PolarHBondContact O-N 2.84Å; E456-N458 PolarHBondContact OE2-ND2 2.79Å
457	G	82.3	Confident	88.1	Confident	53 Å²	53	89.5 Å²	89.5	55%	0.546	47%	0.465	S	S	.	.	S	Bend	trans	77.5	2.6	-173.2	0	0	0	0	0	114.6	D454	D454-G457 PolarHBondContact O-N 3.05Å
458	N	86.3	Confident	88.3	Confident	92 Å²	92	85.3 Å²	85.3	49%	0.492	44%	0.438	S	S	.	.			trans	-73.8	127.6	179.4	-75.7	-48.1	0	0	0	111.4	E453 D454 E456 K460	E453-N458 WeakPolarHBondContact CA-O 3.23Å; D454-N458 PolarHBondContact N-O 3.04Å; E456-N458 PolarHBondContact O-N 2.84Å; E456-N458 PolarHBondContact OE2-ND2 2.79Å; N458-K460 PolarHBondContact O-N 3.35Å
459	A	85.6	Confident	88.5	Confident	79 Å²	79	83.3 Å²	83.3	65%	0.653	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	112.9	-178.6	0	0	0	0	0	112
460	K	88.8	Confident	88.8	Confident	96 Å²	96	78.1 Å²	78.1	42%	0.417	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146.5	-174.5	-178.5	168.5	170.6	-173	0	111.8	L451 T452 D454 N458 Q462	L451-K460 CarbonylContact C-O 3.49Å; L451-K460 WeakPolarHBondContact CA-O 3.42Å; T452-K460 PolarHBondContact N-O 2.95Å; T452-K460 PolarHBondContact O-N 2.9Å; T452-K460 PolarHBondContact OG1-O 3.07Å; D454-K460 VanDerWaalsContact CG-CD 3.43Å; D454-K460 VanDerWaalsContact OD1-CD 3.3Å; D454-K460 WeakPolarHBondContact OD1-CD 3.21Å; D454-K460 IonicContact OD1-NZ 2.79Å; D454-K460 PolarHBondContact OD1-NZ 3.5Å; D454-K460 WeakPolarHBondContact OD2-CD 3.44Å; D454-K460 WeakPolarHBondContact OD2-CE 3.4Å; D454-K460 IonicContact OD2-NZ 2.62Å; D454-K460 PolarHBondContact OD2-NZ 3.4Å; N458-K460 PolarHBondContact O-N 3.35Å; K460-Q462 PolarHBondContact O-N 3.2Å
461	L	89.6	Confident	89.2	Confident	111 Å²	111	74 Å²	74	58%	0.581	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	111.2	174.3	-68.6	168.3	0	0	0	109.9	L449 L451	L449-L461 HydrophobicContact CB-CD2 4.38Å; L451-L461 HydrophobicContact CD2-CD2 3.61Å; L451-L461 HydrophobicContact CD2-CG 4.12Å; L451-L461 HydrophobicContact CG-CD2 4.09Å
462	Q	87.1	Confident	89.6	Confident	76 Å²	76	68.1 Å²	68.1	36%	0.355	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.8	170	-74.5	-178.2	19	0	0	110.6	K450 T452 K460 R464	K450-Q462 PolarHBondContact N-O 3.15Å; K450-Q462 PolarHBondContact O-N 3.32Å; T452-Q462 HydrophobicContact CG2-CB 4.13Å; T452-Q462 HydrophobicContact CG2-CG 4.32Å; T452-Q462 WeakPolarHBondContact OG1-CG 3.43Å; T452-Q462 PolarHBondContact OG1-NE2 3.35Å; K460-Q462 PolarHBondContact O-N 3.2Å; Q462-R464 PolarHBondContact O-N 3.31Å
463	Q	90.5	Very high	90.1	Very high	134 Å²	134	67.2 Å²	67.2	63%	0.626	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	116	172.6	-176.3	-179.2	-9.9	0	0	109.9	P447 L449	P447-Q463 HydrophobicContact CB-CG 4.21Å; P447-Q463 VanDerWaalsContact CB-NE2 3.33Å; L449-Q463 HydrophobicContact CD2-CB 3.97Å
464	R	90.4	Very high	90.5	Very high	93 Å²	93	59.6 Å²	59.6	35%	0.351	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	155.6	174	-72.4	169.8	174.8	-108.2	7.6	110.3	D308 P447 V448 Q462 L466	D308-R464 WeakPolarHBondContact OD2-CB 3.38Å; D308-R464 WeakPolarHBondContact OD2-CD 3.44Å; D308-R464 VanDerWaalsContact OD2-CG 3.27Å; D308-R464 WeakPolarHBondContact OD2-CG 3.43Å; D308-R464 IonicContact OD2-CZ 2.72Å; D308-R464 IonicContact OD2-NE 2.72Å; D308-R464 IonicContact OD2-NH1 2.99Å; D308-R464 PolarHBondContact OD2-NH1 2.6Å; P447-R464 WeakPolarHBondContact CA-O 3.23Å; V448-R464 PolarHBondContact N-O 3.43Å; V448-R464 PolarHBondContact O-N 2.77Å; Q462-R464 PolarHBondContact O-N 3.31Å; R464-L466 HydrophobicContact CB-CD2 4.35Å
465	Q	91.9	Very high	91.1	Very high	86 Å²	86	60 Å²	60	40%	0.402	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	100.7	178.6	-63.6	-164.3	31.4	0	0	108.7	L309 L313	L309-Q465 PolarHBondContact N-O 2.83Å; L313-Q465 HydrophobicContact CD1-CB 4.13Å; L313-Q465 HydrophobicContact CD1-CG 4.42Å
466	L	94.3	Very high	91.8	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146.7	-178.1	-53.9	-176.1	0	0	0	110.6	D306 C307 D308 R446 V448 R464	D306-L466 HydrophobicContact CB-CD1 4.38Å; C307-L466 WeakPolarHBondContact O-CA 3.2Å; D308-L466 HydrophobicContact CB-CD2 4Å; R446-L466 PolarHBondContact N-O 2.76Å; R446-L466 PolarHBondContact O-N 2.92Å; V448-L466 HydrophobicContact CB-CD1 3.89Å; V448-L466 HydrophobicContact CB-CG 4.22Å; V448-L466 HydrophobicContact CG1-CD1 4.19Å; V448-L466 HydrophobicContact CG2-CD1 3.92Å; V448-L466 HydrophobicContact CG2-CG 4.25Å; R464-L466 HydrophobicContact CB-CD2 4.35Å
467	I	95.6	Very high	92.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	147.3	153.6	54.5	165.2	0	0	0	109	D306 C307 L309 I332 V442 F445 V469 L494	D306-I467 WeakPolarHBondContact CA-O 3.24Å; C307-I467 HydrophobicContact CB-CG1 4.3Å; C307-I467 PolarHBondContact N-O 3.26Å; C307-I467 PolarHBondContact O-N 3.22Å; L309-I467 HydrophobicContact CD1-CB 4.3Å; L309-I467 HydrophobicContact CD1-CD1 3.98Å; L309-I467 HydrophobicContact CD1-CG1 3.86Å; L309-I467 HydrophobicContact CD1-CG2 3.56Å; L309-I467 HydrophobicContact CD2-CD1 4.14Å; L309-I467 HydrophobicContact CD2-CG1 4.2Å; L309-I467 HydrophobicContact CG-CD1 4.34Å; L309-I467 HydrophobicContact CG-CG1 4Å; L309-I467 HydrophobicContact CG-CG2 4.43Å; I332-I467 HydrophobicContact CD1-CD1 3.89Å; V442-I467 HydrophobicContact CG1-CD1 4.15Å; F445-I467 HydrophobicContact CD1-CG2 3.95Å; F445-I467 HydrophobicContact CE1-CG2 4.23Å; F445-I467 HydrophobicContact CG-CG2 4.18Å; I467-V469 HydrophobicContact CD1-CG1 3.78Å; I467-V469 HydrophobicContact CG1-CG1 4.31Å; I467-L494 HydrophobicContact CD1-CD2 4.25Å
468	T	96.6	Very high	92.8	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.2	168.7	-55.6	0	0	0	0	107.9	T304 D306 E427 G443 R446	T304-T468 HydrophobicContact CG2-CG2 3.33Å; D306-T468 WeakPolarHBondContact OD1-CB 3.28Å; D306-T468 PolarHBondContact OD1-OG1 3.17Å; E427-T468 HydrophobicContact CB-CG2 4.28Å; E427-T468 HydrophobicContact CG-CG2 4.11Å; G443-T468 PolarHBondContact N-O 3.34Å; R446-T468 PolarHBondContact NH2-OG1 2.94Å
469	V	97.4	Very high	93.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	135	175.3	-62.7	0	0	0	0	110	T304 A305 L440 A441 V442 I467 L487 F490	T304-V469 CarbonylContact C-O 3.47Å; T304-V469 WeakPolarHBondContact CA-O 3.39Å; A305-V469 HydrophobicContact CB-CG2 4.46Å; A305-V469 PolarHBondContact N-O 3.15Å; A305-V469 WeakPolarHBondContact O-CG2 3.3Å; A305-V469 PolarHBondContact O-N 3.08Å; L440-V469 HydrophobicContact CD1-CB 4.14Å; A441-V469 WeakPolarHBondContact O-CA 3.44Å; V442-V469 HydrophobicContact CG2-CG1 4.3Å; I467-V469 HydrophobicContact CD1-CG1 3.78Å; I467-V469 HydrophobicContact CG1-CG1 4.31Å; V469-L487 HydrophobicContact CG2-CD2 4.29Å; V469-F490 HydrophobicContact CG1-CE1 4.28Å; V469-F490 HydrophobicContact CG2-CD1 4.37Å; V469-F490 HydrophobicContact CG2-CE1 4.01Å
470	T	97.7	Very high	93.5	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	118	-176.4	-56.7	0	0	0	0	108.7	A303 T304 E427 T429 A441	A303-T470 CarbonylContact O-C 3.56Å; A303-T470 WeakPolarHBondContact O-CA 3.43Å; T304-T470 VanDerWaalsContact OG1-CG2 3.32Å; T304-T470 WeakPolarHBondContact OG1-CG2 3.34Å; T304-T470 PolarHBondContact OG1-OG1 3.27Å; E427-T470 WeakPolarHBondContact CG-OG1 3.41Å; E427-T470 PolarHBondContact OE1-OG1 3.33Å; T429-T470 HydrophobicContact CG2-CG2 3.82Å; A441-T470 WeakPolarHBondContact CB-O 3.43Å; A441-T470 PolarHBondContact N-O 3.43Å; A441-T470 PolarHBondContact O-N 3.05Å
471	M	97.1	Very high	93.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.4	176.8	-171.8	168.4	72.8	0	0	110	Y302 A303 F415 C438 I439 L440 A483 F486 L487	Y302-M471 WeakPolarHBondContact CA-O 3.31Å; A303-M471 PolarHBondContact N-O 3.44Å; A303-M471 PolarHBondContact O-N 2.92Å; F415-M471 HydrophobicContact CE2-SD 4.34Å; F415-M471 HydrophobicContact CZ-SD 4.3Å; C438-M471 HydrophobicContact CB-CG 4.48Å; C438-M471 HydrophobicContact CB-SD 4.41Å; I439-M471 WeakPolarHBondContact O-CA 3.31Å; L440-M471 HydrophobicContact CD1-CB 4.03Å; M471-A483 HydrophobicContact CE-CB 3.74Å; M471-F486 HydrophobicContact CE-CB 4.18Å; M471-F486 HydrophobicContact CE-CD1 3.65Å; M471-F486 HydrophobicContact CE-CE1 4.39Å; M471-F486 HydrophobicContact CE-CG 4.12Å; M471-F486 HydrophobicContact SD-CD1 3.41Å; M471-F486 WeakPolarHBondContact SD-CD1 3.3Å; M471-F486 HydrophobicContact SD-CE1 3.53Å; M471-F486 VanDerWaalsContact SD-CE1 3.53Å; M471-F486 HydrophobicContact SD-CG 4.25Å; M471-F486 HydrophobicContact SD-CZ 4.44Å; M471-L487 HydrophobicContact CB-CD2 4.15Å
472	S	97.2	Very high	94	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	131.8	165.2	-54.8	0	0	0	0	108.8	S301 Y302 A430 C438 I439	S301-S472 WeakPolarHBondContact O-CA 3.42Å; Y302-S472 WeakPolarHBondContact CD1-OG 3.32Å; A430-S472 WeakPolarHBondContact O-CB 3.42Å; A430-S472 PolarHBondContact O-OG 2.84Å; C438-S472 WeakPolarHBondContact CA-O 3.18Å; I439-S472 PolarHBondContact N-O 2.68Å; I439-S472 PolarHBondContact O-N 3.37Å
473	S	96	Very high	94.3	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.1	-176.1	-49	0	0	0	0	112.3	H300 S301 C438 S475	H300-S473 WeakPolarHBondContact CA-O 3.39Å; S301-S473 PolarHBondContact N-O 3Å; S301-S473 PolarHBondContact O-N 2.67Å; C438-S473 PolarHBondContact SG-OG 3.2Å; S473-S475 PolarHBondContact O-N 2.64Å
474	D	95.7	Very high	94.6	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.011	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	108	170.7	-174.4	-12.9	0	0	0	111.1	V298 A437 R476 M477 V478	V298-D474 HydrophobicContact CG1-CB 3.69Å; A437-D474 PolarHBondContact O-N 3.18Å; D474-R476 PolarHBondContact O-N 3.12Å; D474-R476 VanDerWaalsContact OD1-CB 3.25Å; D474-R476 WeakPolarHBondContact OD1-CB 3.45Å; D474-R476 VanDerWaalsContact OD1-CG 3.31Å; D474-R476 WeakPolarHBondContact OD1-CG 3.23Å; D474-R476 IonicContact OD1-CZ 2.61Å; D474-R476 PolarHBondContact OD1-N 3.23Å; D474-R476 IonicContact OD1-NE 3.94Å; D474-R476 PolarHBondContact OD1-NE 3.36Å; D474-R476 IonicContact OD1-NH2 2.62Å; D474-R476 IonicContact OD2-CZ 2.64Å; D474-R476 VanDerWaalsContact OD2-CZ 3.26Å; D474-R476 IonicContact OD2-NE 3.4Å; D474-R476 PolarHBondContact OD2-NE 3.45Å; D474-R476 IonicContact OD2-NH2 2.93Å; D474-R476 PolarHBondContact OD2-NH2 3.33Å; D474-M477 HydrophobicContact CB-CE 3.87Å; D474-M477 PolarHBondContact O-N 3.49Å; D474-M477 WeakPolarHBondContact OD2-CE 3.49Å; D474-V478 PolarHBondContact O-N 3.47Å
475	S	93.6	Very high	94.9	Very high	59 Å²	59	39.5 Å²	39.5	41%	0.413	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-2.5	-179.7	-56.9	0	0	0	0	115.1	P299 S301 S473	P299-S475 PolarHBondContact O-N 2.83Å; P299-S475 PolarHBondContact O-OG 3.45Å; S301-S475 VanDerWaalsContact CB-OG 3.29Å; S301-S475 WeakPolarHBondContact CB-OG 3.16Å; S473-S475 PolarHBondContact O-N 2.64Å
476	R	93	Very high	95.1	Very high	93 Å²	93	35.4 Å²	35.4	35%	0.351	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-19.8	169.9	-60.5	174	-66.9	-175.3	6.6	113.2	T297 P299 W350 D474	T297-R476 PolarHBondContact O-NH1 3.26Å; P299-R476 HydrophobicContact CG-CG 3.73Å; W350-R476 HydrophobicContact CE3-CB 4.28Å; W350-R476 HydrophobicContact CZ3-CB 4.07Å; D474-R476 PolarHBondContact O-N 3.12Å; D474-R476 VanDerWaalsContact OD1-CB 3.25Å; D474-R476 WeakPolarHBondContact OD1-CB 3.45Å; D474-R476 VanDerWaalsContact OD1-CG 3.31Å; D474-R476 WeakPolarHBondContact OD1-CG 3.23Å; D474-R476 IonicContact OD1-CZ 2.61Å; D474-R476 PolarHBondContact OD1-N 3.23Å; D474-R476 IonicContact OD1-NE 3.94Å; D474-R476 PolarHBondContact OD1-NE 3.36Å; D474-R476 IonicContact OD1-NH2 2.62Å; D474-R476 IonicContact OD2-CZ 2.64Å; D474-R476 VanDerWaalsContact OD2-CZ 3.26Å; D474-R476 IonicContact OD2-NE 3.4Å; D474-R476 PolarHBondContact OD2-NE 3.45Å; D474-R476 IonicContact OD2-NH2 2.93Å; D474-R476 PolarHBondContact OD2-NH2 3.33Å
477	M	91.1	Very high	95.3	Very high	29 Å²	29	35.7 Å²	35.7	14%	0.143	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-39.3	-174.5	-61.2	-175.2	-76.7	0	0	112.7	V348 W350 P355 A437 D474	V348-M477 HydrophobicContact CB-SD 3.95Å; V348-M477 HydrophobicContact CG1-SD 3.97Å; W350-M477 HydrophobicContact CB-CE 3.66Å; W350-M477 HydrophobicContact CB-SD 3.84Å; W350-M477 HydrophobicContact CE3-CG 3.75Å; W350-M477 HydrophobicContact CE3-SD 3.96Å; W350-M477 HydrophobicContact CZ3-CG 4.32Å; P355-M477 HydrophobicContact CB-CG 4.1Å; P355-M477 HydrophobicContact CB-SD 4.14Å; A437-M477 HydrophobicContact CB-CE 3.42Å; A437-M477 VanDerWaalsContact CB-CE 3.42Å; A437-M477 HydrophobicContact CB-SD 4.42Å; D474-M477 HydrophobicContact CB-CE 3.87Å; D474-M477 PolarHBondContact O-N 3.49Å; D474-M477 WeakPolarHBondContact OD2-CE 3.49Å
478	V	94.3	Very high	95.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.21	C	C	.	.			trans	-116.6	108.5	-177.8	178.4	0	0	0	0	108	V346 D474 L482 A483	V346-V478 HydrophobicContact CG1-CG2 4.48Å; D474-V478 PolarHBondContact O-N 3.47Å; V478-L482 HydrophobicContact CG1-CB 4.27Å; V478-L482 HydrophobicContact CG1-CD2 4.22Å; V478-L482 HydrophobicContact CG1-CG 4.4Å; V478-L482 HydrophobicContact CG2-CD2 4.33Å; V478-A483 HydrophobicContact CG1-CB 4.02Å
479	D	92.6	Very high	95.3	Very high	94 Å²	94	44.7 Å²	44.7	50%	0.503	22%	0.221	S	C	.	.			trans	-76.5	167.5	172.9	68.3	24.2	0	0	0	111.9	E481 L482 A483	D479-E481 PolarHBondContact O-N 3.08Å; D479-E481 PolarHBondContact OD1-N 3.36Å; D479-L482 PolarHBondContact O-N 3.16Å; D479-L482 VanDerWaalsContact OD1-CB 3.28Å; D479-L482 WeakPolarHBondContact OD1-CB 3.41Å; D479-L482 PolarHBondContact OD1-N 3.25Å; D479-A483 WeakPolarHBondContact O-CB 3.06Å; D479-A483 PolarHBondContact O-N 3.14Å
480	D	92.1	Very high	95.2	Very high	95 Å²	95	44.7 Å²	44.7	51%	0.508	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-22.9	-176.6	-61.2	-39.3	0	0	0	112.4	S301 T484	S301-D480 WeakPolarHBondContact CB-OD1 3.32Å; S301-D480 PolarHBondContact OG-OD1 3.13Å; D480-T484 VanDerWaalsContact O-CB 3.24Å; D480-T484 WeakPolarHBondContact O-CB 3.32Å; D480-T484 PolarHBondContact O-N 3.1Å; D480-T484 PolarHBondContact O-OG1 3.05Å
481	E	93.9	Very high	95.2	Very high	113 Å²	113	47.6 Å²	47.6	53%	0.528	23%	0.234	S	C	.	.	H	α-helix	trans	-74	-47.3	173.8	-164.7	-173.3	169.1	0	0	111	D479 A483 T484 R485	D479-E481 PolarHBondContact O-N 3.08Å; D479-E481 PolarHBondContact OD1-N 3.36Å; E481-A483 VanDerWaalsContact C-N 3.33Å; E481-A483 PolarHBondContact O-N 3.3Å; E481-T484 PolarHBondContact O-N 3.24Å; E481-T484 VanDerWaalsContact O-N 3.16Å; E481-R485 VanDerWaalsContact CD-NH2 3.28Å; E481-R485 HydrophobicContact CG-CG 4.38Å; E481-R485 WeakPolarHBondContact O-CB 3.38Å; E481-R485 VanDerWaalsContact O-CG 3.27Å; E481-R485 WeakPolarHBondContact O-CG 3.37Å; E481-R485 PolarHBondContact O-N 3.45Å; E481-R485 IonicContact OE1-CZ 2.66Å; E481-R485 IonicContact OE1-NE 2.74Å; E481-R485 PolarHBondContact OE1-NE 3.4Å; E481-R485 IonicContact OE1-NH2 3.61Å; E481-R485 PolarHBondContact OE1-NH2 3.42Å; E481-R485 IonicContact OE2-NH2 2.89Å
482	L	95.1	Very high	95.1	Very high	26 Å²	26	48.9 Å²	48.9	14%	0.136	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-40.6	176.8	-170.1	69.6	0	0	0	110.9	M343 D345 V346 V478 D479 R485 F486	M343-L482 HydrophobicContact CE-CD1 3.5Å; M343-L482 VanDerWaalsContact CE-CD1 3.5Å; M343-L482 HydrophobicContact CE-CG 4.17Å; D345-L482 HydrophobicContact CB-CD1 4.25Å; D345-L482 HydrophobicContact CB-CD2 3.92Å; D345-L482 WeakPolarHBondContact O-CD2 3.46Å; V346-L482 HydrophobicContact CG2-CD1 4.39Å; V346-L482 HydrophobicContact CG2-CD2 3.88Å; V346-L482 HydrophobicContact CG2-CG 3.79Å; V478-L482 HydrophobicContact CG1-CB 4.27Å; V478-L482 HydrophobicContact CG1-CD2 4.22Å; V478-L482 HydrophobicContact CG1-CG 4.4Å; V478-L482 HydrophobicContact CG2-CD2 4.33Å; D479-L482 PolarHBondContact O-N 3.16Å; D479-L482 VanDerWaalsContact OD1-CB 3.28Å; D479-L482 WeakPolarHBondContact OD1-CB 3.41Å; D479-L482 PolarHBondContact OD1-N 3.25Å; L482-R485 PolarHBondContact O-N 2.55Å; L482-F486 WeakPolarHBondContact O-CB 3.23Å; L482-F486 PolarHBondContact O-N 3.46Å
483	A	95.1	Very high	95	Very high	2 Å²	2	49 Å²	49	2%	0.017	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-43.1	171.9	0	0	0	0	0	112.3	M471 V478 D479 E481 F486 L487	M471-A483 HydrophobicContact CE-CB 3.74Å; V478-A483 HydrophobicContact CG1-CB 4.02Å; D479-A483 WeakPolarHBondContact O-CB 3.06Å; D479-A483 PolarHBondContact O-N 3.14Å; E481-A483 VanDerWaalsContact C-N 3.33Å; E481-A483 PolarHBondContact O-N 3.3Å; A483-F486 PolarHBondContact O-N 3.41Å; A483-L487 PolarHBondContact O-N 3.28Å
484	T	95.4	Very high	94.8	Very high	86 Å²	86	48.9 Å²	48.9	53%	0.528	24%	0.244	S	C	.	.	H	α-helix	trans	-67	-42.5	177	-62.7	0	0	0	0	111.9	D480 E481 F486 L487 K488	D480-T484 VanDerWaalsContact O-CB 3.24Å; D480-T484 WeakPolarHBondContact O-CB 3.32Å; D480-T484 PolarHBondContact O-N 3.1Å; D480-T484 PolarHBondContact O-OG1 3.05Å; E481-T484 PolarHBondContact O-N 3.24Å; E481-T484 VanDerWaalsContact O-N 3.16Å; T484-F486 VanDerWaalsContact C-N 3.34Å; T484-L487 PolarHBondContact O-N 2.85Å; T484-K488 VanDerWaalsContact O-CB 3.3Å; T484-K488 WeakPolarHBondContact O-CB 3.45Å; T484-K488 PolarHBondContact O-N 3.17Å
485	R	96.9	Very high	94.7	Very high	134 Å²	134	51.6 Å²	51.6	51%	0.506	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-41.8	174.1	-72.6	170.4	179.4	-164.8	7.9	110.8	M343 E481 L482 K488 S489	M343-R485 HydrophobicContact CE-CB 3.65Å; M343-R485 HydrophobicContact SD-CB 4.21Å; E481-R485 VanDerWaalsContact CD-NH2 3.28Å; E481-R485 HydrophobicContact CG-CG 4.38Å; E481-R485 WeakPolarHBondContact O-CB 3.38Å; E481-R485 VanDerWaalsContact O-CG 3.27Å; E481-R485 WeakPolarHBondContact O-CG 3.37Å; E481-R485 PolarHBondContact O-N 3.45Å; E481-R485 IonicContact OE1-CZ 2.66Å; E481-R485 IonicContact OE1-NE 2.74Å; E481-R485 PolarHBondContact OE1-NE 3.4Å; E481-R485 IonicContact OE1-NH2 3.61Å; E481-R485 PolarHBondContact OE1-NH2 3.42Å; E481-R485 IonicContact OE2-NH2 2.89Å; L482-R485 PolarHBondContact O-N 2.55Å; R485-K488 PolarHBondContact O-N 3.49Å; R485-S489 WeakPolarHBondContact O-CB 3.28Å; R485-S489 PolarHBondContact O-N 2.94Å; R485-S489 PolarHBondContact O-OG 3.35Å; R485-S489 VanDerWaalsContact O-OG 3.08Å
486	F	97.2	Very high	94.7	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-52.3	175.4	178.7	-88.5	0	0	0	111.4	T339 L340 M343 V346 F415 M471 L482 A483 T484 K488 S489 F490	T339-F486 HydrophobicContact CG2-CD2 3.56Å; T339-F486 HydrophobicContact CG2-CE2 3.57Å; T339-F486 HydrophobicContact CG2-CG 4.15Å; T339-F486 HydrophobicContact CG2-CZ 4.18Å; L340-F486 HydrophobicContact CD2-CE2 3.74Å; L340-F486 HydrophobicContact CD2-CZ 4.35Å; L340-F486 HydrophobicContact CG-CE2 3.94Å; L340-F486 HydrophobicContact CG-CZ 4.4Å; M343-F486 HydrophobicContact CE-CB 4.01Å; M343-F486 HydrophobicContact SD-CB 4.3Å; V346-F486 HydrophobicContact CB-CD2 4.1Å; V346-F486 HydrophobicContact CG1-CD2 3.93Å; V346-F486 HydrophobicContact CG1-CE2 4.16Å; V346-F486 HydrophobicContact CG1-CG 4.38Å; V346-F486 HydrophobicContact CG2-CB 4.2Å; V346-F486 HydrophobicContact CG2-CD2 3.99Å; V346-F486 HydrophobicContact CG2-CG 4.38Å; F415-F486 HydrophobicContact CE2-CZ 4.22Å; F415-F486 HydrophobicContact CZ-CE1 4.28Å; F415-F486 HydrophobicContact CZ-CZ 4.04Å; M471-F486 HydrophobicContact CE-CB 4.18Å; M471-F486 HydrophobicContact CE-CD1 3.65Å; M471-F486 HydrophobicContact CE-CE1 4.39Å; M471-F486 HydrophobicContact CE-CG 4.12Å; M471-F486 HydrophobicContact SD-CD1 3.41Å; M471-F486 WeakPolarHBondContact SD-CD1 3.3Å; M471-F486 HydrophobicContact SD-CE1 3.53Å; M471-F486 VanDerWaalsContact SD-CE1 3.53Å; M471-F486 HydrophobicContact SD-CG 4.25Å; M471-F486 HydrophobicContact SD-CZ 4.44Å; L482-F486 WeakPolarHBondContact O-CB 3.23Å; L482-F486 PolarHBondContact O-N 3.46Å; A483-F486 PolarHBondContact O-N 3.41Å; T484-F486 VanDerWaalsContact C-N 3.34Å; F486-K488 VanDerWaalsContact C-N 3.28Å; F486-K488 PolarHBondContact O-N 2.8Å; F486-S489 PolarHBondContact O-N 3.32Å; F486-S489 VanDerWaalsContact O-N 3.13Å; F486-F490 HydrophobicContact CE1-CB 4.34Å; F486-F490 WeakPolarHBondContact O-CB 3.38Å; F486-F490 PolarHBondContact O-N 3.48Å
487	L	96.9	Very high	94.4	Very high	9 Å²	9	49 Å²	49	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-36.2	179	-74.1	175.7	0	0	0	112.4	A303 A305 L440 V469 M471 A483 T484 K491	A303-L487 HydrophobicContact CB-CD1 3.49Å; A303-L487 VanDerWaalsContact CB-CD1 3.49Å; A303-L487 WeakPolarHBondContact O-CD1 3.24Å; A305-L487 HydrophobicContact CB-CB 4.38Å; A305-L487 HydrophobicContact CB-CD1 4.37Å; L440-L487 HydrophobicContact CD1-CD2 4.33Å; V469-L487 HydrophobicContact CG2-CD2 4.29Å; M471-L487 HydrophobicContact CB-CD2 4.15Å; A483-L487 PolarHBondContact O-N 3.28Å; T484-L487 PolarHBondContact O-N 2.85Å; L487-K491 WeakPolarHBondContact O-CB 3.47Å; L487-K491 PolarHBondContact O-N 3.28Å
488	K	96.6	Very high	94.3	Very high	158 Å²	158	55.3 Å²	55.3	69%	0.687	28%	0.279	S	S	*	.	H	α-helix	trans	-63	-44.1	173.4	-176.6	178.8	179.1	-179.4	0	112.1	T484 R485 F486 A492	T484-K488 VanDerWaalsContact O-CB 3.3Å; T484-K488 WeakPolarHBondContact O-CB 3.45Å; T484-K488 PolarHBondContact O-N 3.17Å; R485-K488 PolarHBondContact O-N 3.49Å; F486-K488 VanDerWaalsContact C-N 3.28Å; F486-K488 PolarHBondContact O-N 2.8Å; K488-A492 WeakPolarHBondContact O-CB 3.34Å; K488-A492 PolarHBondContact O-N 3.25Å
489	S	96.1	Very high	94	Very high	35 Å²	35	62.2 Å²	62.2	25%	0.245	31%	0.305	C	S	.	.	H	α-helix	trans	-70.4	-45.7	178.2	-63.1	0	0	0	0	111.9	R485 F486 K491 A492 N493	R485-S489 WeakPolarHBondContact O-CB 3.28Å; R485-S489 PolarHBondContact O-N 2.94Å; R485-S489 PolarHBondContact O-OG 3.35Å; R485-S489 VanDerWaalsContact O-OG 3.08Å; F486-S489 PolarHBondContact O-N 3.32Å; F486-S489 VanDerWaalsContact O-N 3.13Å; S489-K491 VanDerWaalsContact C-N 3.35Å; S489-K491 PolarHBondContact O-N 2.89Å; S489-A492 PolarHBondContact O-N 2.93Å; S489-A492 VanDerWaalsContact O-N 3.17Å; S489-N493 WeakPolarHBondContact O-CB 3.29Å; S489-N493 PolarHBondContact O-N 2.9Å; S489-N493 PolarHBondContact O-ND2 2.96Å; S489-N493 VanDerWaalsContact O-ND2 3.14Å
490	F	96.6	Very high	93.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-49.5	172.6	172.3	-94.9	0	0	0	111.6	I332 A335 A336 T339 L440 V469 F486 N493 L494	I332-F490 HydrophobicContact CG2-CE2 4.37Å; I332-F490 HydrophobicContact CG2-CZ 4.13Å; A335-F490 HydrophobicContact CB-CD2 4.08Å; A335-F490 HydrophobicContact CB-CE2 3.84Å; A336-F490 HydrophobicContact CB-CD2 4.37Å; A336-F490 HydrophobicContact CB-CE2 4.19Å; T339-F490 HydrophobicContact CG2-CB 4.17Å; T339-F490 VanDerWaalsContact OG1-CA 3.3Å; T339-F490 WeakPolarHBondContact OG1-CA 3.38Å; L440-F490 HydrophobicContact CD2-CE1 4.37Å; L440-F490 HydrophobicContact CD2-CE2 3.94Å; L440-F490 HydrophobicContact CD2-CZ 3.82Å; V469-F490 HydrophobicContact CG1-CE1 4.28Å; V469-F490 HydrophobicContact CG2-CD1 4.37Å; V469-F490 HydrophobicContact CG2-CE1 4.01Å; F486-F490 HydrophobicContact CE1-CB 4.34Å; F486-F490 WeakPolarHBondContact O-CB 3.38Å; F486-F490 PolarHBondContact O-N 3.48Å; F490-N493 PolarHBondContact O-N 3.26Å; F490-L494 HydrophobicContact CE1-CD2 3.85Å; F490-L494 HydrophobicContact CZ-CD2 3.86Å; F490-L494 WeakPolarHBondContact O-CB 3.43Å; F490-L494 PolarHBondContact O-N 3.41Å
491	K	96	Very high	92.1	Very high	62 Å²	62	60.1 Å²	60.1	27%	0.27	31%	0.313	S	S	.	.	H	α-helix	trans	-58.3	-49.1	175.1	177.1	171	-179.7	166.4	0	111.7	D306 C307 L487 S489 N493 L494 E495	D306-K491 VanDerWaalsContact O-CE 3.24Å; D306-K491 WeakPolarHBondContact O-CE 3.38Å; D306-K491 PolarHBondContact O-NZ 2.99Å; C307-K491 HydrophobicContact CB-CG 4.42Å; L487-K491 WeakPolarHBondContact O-CB 3.47Å; L487-K491 PolarHBondContact O-N 3.28Å; S489-K491 VanDerWaalsContact C-N 3.35Å; S489-K491 PolarHBondContact O-N 2.89Å; K491-N493 VanDerWaalsContact C-N 3.28Å; K491-N493 PolarHBondContact O-N 3.36Å; K491-L494 PolarHBondContact O-N 3.16Å; K491-E495 WeakPolarHBondContact CE-OE1 3.4Å; K491-E495 WeakPolarHBondContact CE-OE2 3.29Å; K491-E495 HydrophobicContact CG-CG 4.1Å; K491-E495 WeakPolarHBondContact CG-OE2 3.43Å; K491-E495 IonicContact NZ-OE1 3.1Å; K491-E495 WeakPolarHBondContact O-CB 3.28Å; K491-E495 WeakPolarHBondContact O-CG 3.27Å; K491-E495 PolarHBondContact O-N 3.43Å
492	A	95.4	Very high	92.1	Very high	27 Å²	27	57.5 Å²	57.5	22%	0.223	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-33.1	179.7	0	0	0	0	0	113.1	K488 S489 N496	K488-A492 WeakPolarHBondContact O-CB 3.34Å; K488-A492 PolarHBondContact O-N 3.25Å; S489-A492 PolarHBondContact O-N 2.93Å; S489-A492 VanDerWaalsContact O-N 3.17Å; A492-N496 WeakPolarHBondContact O-CB 3.45Å; A492-N496 PolarHBondContact O-N 3.42Å; A492-N496 PolarHBondContact O-ND2 2.99Å
493	N	94.4	Very high	91.9	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-74.3	-37.6	175.5	-67	-28.6	0	0	0	111.9	T339 Q342 S489 F490 K491 N496 L500	T339-N493 PolarHBondContact OG1-ND2 3.42Å; Q342-N493 PolarHBondContact OE1-ND2 2.67Å; S489-N493 WeakPolarHBondContact O-CB 3.29Å; S489-N493 PolarHBondContact O-N 2.9Å; S489-N493 PolarHBondContact O-ND2 2.96Å; S489-N493 VanDerWaalsContact O-ND2 3.14Å; F490-N493 PolarHBondContact O-N 3.26Å; K491-N493 VanDerWaalsContact C-N 3.28Å; K491-N493 PolarHBondContact O-N 3.36Å; N493-N496 CarbonylContact O-C 3.44Å; N493-L500 HydrophobicContact CB-CD2 3.96Å; N493-L500 WeakPolarHBondContact O-CD2 3.48Å
494	L	93.7	Very high	91.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-76.7	-41.6	179.3	-169.2	63.5	0	0	0	112.6	C307 L309 V312 F331 I332 A335 I467 F490 K491 N496	C307-L494 HydrophobicContact CB-CD2 4.19Å; L309-L494 HydrophobicContact CD2-CD1 4.3Å; L309-L494 HydrophobicContact CD2-CD2 3.75Å; L309-L494 HydrophobicContact CD2-CG 3.85Å; V312-L494 HydrophobicContact CG2-CD1 3.94Å; V312-L494 HydrophobicContact CG2-CG 4.25Å; V312-L494 WeakPolarHBondContact CG2-O 3.39Å; F331-L494 HydrophobicContact CB-CD1 4.31Å; I332-L494 HydrophobicContact CG1-CD1 4.23Å; I332-L494 HydrophobicContact CG1-CD2 4.26Å; A335-L494 HydrophobicContact CB-CB 4.25Å; A335-L494 HydrophobicContact CB-CD1 4.09Å; I467-L494 HydrophobicContact CD1-CD2 4.25Å; F490-L494 HydrophobicContact CE1-CD2 3.85Å; F490-L494 HydrophobicContact CZ-CD2 3.86Å; F490-L494 WeakPolarHBondContact O-CB 3.43Å; F490-L494 PolarHBondContact O-N 3.41Å; K491-L494 PolarHBondContact O-N 3.16Å; L494-N496 PolarHBondContact O-N 3.49Å
495	E	93.6	Very high	91.5	Very high	59 Å²	59	60.9 Å²	60.9	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-68.7	-18.7	176.7	-69.7	-175.4	152.6	0	0	112.5	D308 A311 K491	D308-E495 HydrophobicContact CB-CG 4.22Å; D308-E495 WeakPolarHBondContact CB-OE1 3.48Å; D308-E495 PolarHBondContact N-OE1 2.95Å; D308-E495 WeakPolarHBondContact O-CG 3.45Å; A311-E495 WeakPolarHBondContact CB-O 3.47Å; K491-E495 WeakPolarHBondContact CE-OE1 3.4Å; K491-E495 WeakPolarHBondContact CE-OE2 3.29Å; K491-E495 HydrophobicContact CG-CG 4.1Å; K491-E495 WeakPolarHBondContact CG-OE2 3.43Å; K491-E495 IonicContact NZ-OE1 3.1Å; K491-E495 WeakPolarHBondContact O-CB 3.28Å; K491-E495 WeakPolarHBondContact O-CG 3.27Å; K491-E495 PolarHBondContact O-N 3.43Å
496	N	92.6	Very high	91.2	Very high	78 Å²	78	56.3 Å²	56.3	42%	0.417	30%	0.304	S	S	.	.			trans	-125.5	80.1	177.9	-58.8	-90.7	0	0	0	111.1	A492 N493 L494 I498 R499	A492-N496 WeakPolarHBondContact O-CB 3.45Å; A492-N496 PolarHBondContact O-N 3.42Å; A492-N496 PolarHBondContact O-ND2 2.99Å; N493-N496 CarbonylContact O-C 3.44Å; L494-N496 PolarHBondContact O-N 3.49Å; N496-I498 PolarHBondContact O-N 2.77Å; N496-R499 HydrophobicContact CB-CG 4.13Å; N496-R499 WeakPolarHBondContact O-CB 3.44Å; N496-R499 PolarHBondContact O-N 2.92Å
497	P	87.4	Confident	90.8	Very high	19 Å²	19	60.1 Å²	60.1	12%	0.123	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-55.3	-22.4	-172.9	-28.1	34.9	0	0	0	115.9	A311 V312 V315 R499 L500	A311-P497 HydrophobicContact CB-CG 4Å; V312-P497 HydrophobicContact CG2-CG 4Å; V315-P497 HydrophobicContact CG2-CB 4.09Å; V315-P497 HydrophobicContact CG2-CG 4.2Å; P497-R499 PolarHBondContact O-N 3.24Å; P497-L500 VanDerWaalsContact O-CB 3.3Å; P497-L500 WeakPolarHBondContact O-CB 3.46Å; P497-L500 PolarHBondContact O-N 3.42Å
498	I	89.3	Confident	90.3	Very high	161 Å²	161	63.7 Å²	63.7	83%	0.826	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-59.9	-25.6	174.4	-58	170	0	0	0	111.5	N496 L500	N496-I498 PolarHBondContact O-N 2.77Å; I498-L500 PolarHBondContact O-N 3.47Å
499	R	87.3	Confident	89.8	Confident	145 Å²	145	56.5 Å²	56.5	55%	0.547	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-77.8	-1.4	175.1	-61.1	-175.1	176.4	-159.8	-1.5	114.2	N496 P497	N496-R499 HydrophobicContact CB-CG 4.13Å; N496-R499 WeakPolarHBondContact O-CB 3.44Å; N496-R499 PolarHBondContact O-N 2.92Å; P497-R499 PolarHBondContact O-N 3.24Å
500	L	82.2	Confident	89.3	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.016	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-99.8	-0	-179.1	-55.1	179	0	0	0	113.5	F331 K334 A335 I386 N493 P497 I498	F331-L500 HydrophobicContact CD1-CD1 4.15Å; K334-L500 WeakPolarHBondContact CE-O 3.42Å; K334-L500 HydrophobicContact CG-CB 4.15Å; A335-L500 HydrophobicContact CB-CD2 3.75Å; I386-L500 HydrophobicContact CD1-CB 4.46Å; N493-L500 HydrophobicContact CB-CD2 3.96Å; N493-L500 WeakPolarHBondContact O-CD2 3.48Å; P497-L500 VanDerWaalsContact O-CB 3.3Å; P497-L500 WeakPolarHBondContact O-CB 3.46Å; P497-L500 PolarHBondContact O-N 3.42Å; I498-L500 PolarHBondContact O-N 3.47Å
501	A	63.6	Low	88.7	Confident	142 Å²	142	63.5 Å²	63.5	100%	1.174	35%	0.353	S	S	*	.			trans	-69.8	0	175.5	0	0	0	0	0	111.2

Retrieved 501 of 501 residues in 75.7 ms (Link to these results)

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