A0A096N2E1_PAPAN Loading...

Myoneurin

AlphaFold DB (F6UBH1), UniProt , Accession A0A096N2E1, Species PAPAN (Papio anubis, Olive baboon), Gene MYNN, Length 662 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	30.5	Very low	36.2	Very low	231 Å²	231	147.1 Å²	147.1	100%	1.138	77%	0.771	S	S	*	*				0	147.7	0	-72.4	163.2	87.5	0	0	107.5
2	T	32.4	Very low	35.4	Very low	136 Å²	136	144.8 Å²	144.8	83%	0.834	75%	0.753	S	S	*	*			trans	59.1	103	160.4	52.2	0	0	0	0	119.3
3	E	30.6	Very low	34.6	Very low	178 Å²	178	138.7 Å²	138.7	83%	0.832	75%	0.747	S	S	*	*			trans	-61.1	-173	132.1	-50.9	-165.9	139.4	0	0	110.6
4	P	56.1	Low	34.1	Very low	105 Å²	105	145 Å²	145	68%	0.682	76%	0.755	S	S	*	*			cis	-128.8	-143.1	3.2	30.6	-2.6	0	0	0	111.7
5	D	29.5	Very low	33.6	Very low	122 Å²	122	141.1 Å²	141.1	65%	0.652	76%	0.764	S	S	*	*			cis	-167.6	174	13.3	-149	-11.9	0	0	0	114.9
6	M	26.7	Very low	33.1	Very low	154 Å²	154	137.4 Å²	137.4	76%	0.759	77%	0.769	S	S	*	*			trans	81.7	135.1	151.6	-68.7	-70.7	147.2	0	0	121.6
7	T	27.1	Very low	32.7	Very low	134 Å²	134	134 Å²	134	82%	0.822	76%	0.762	S	S	*	*			trans	-124.7	-151.4	-178.7	55.6	0	0	0	0	111.3
8	P	59.3	Low	32.2	Very low	104 Å²	104	138.4 Å²	138.4	68%	0.675	77%	0.765	S	S	*	*			trans	-95.2	-168.6	-138.1	40.6	-23.4	0	0	0	113.9
9	P	50.9	Low	31.9	Very low	105 Å²	105	140.9 Å²	140.9	68%	0.682	76%	0.762	S	S	*	*				-161.2	144.6	100.4	36.1	-13.9	0	0	0	122.2
10	W	25.9	Very low	31.7	Very low	208 Å²	208	136.9 Å²	136.9	79%	0.788	75%	0.754	S	S	*	*			trans	68.2	173.7	133.7	-55.5	33.7	0	0	0	119.2
11	K	28.8	Very low	31.4	Very low	141 Å²	141	137.1 Å²	137.1	61%	0.613	75%	0.754	S	S	*	*			cis	-162.5	148	18.2	-155.6	142.8	-171	-68.4	0	114.7
12	E	26.6	Very low	31.2	Very low	120 Å²	120	133.1 Å²	133.1	56%	0.561	74%	0.743	S	S	*	*			trans	30.4	157	147.1	-64.5	156.2	-154	0	0	123.6
13	G	26	Very low	30.9	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	74%	0.74	S	S	*	*			cis	147.7	153.8	-7.2	0	0	0	0	0	116.1
14	R	27.6	Very low	31.4	Very low	227 Å²	227	130.6 Å²	130.6	86%	0.857	74%	0.735	S	S	*	*			trans	91.7	137.6	154.9	-63.9	-173.3	-76.1	-111.1	-6.1	124.7
15	G	25.6	Very low	29.9	Very low	87 Å²	87	133.7 Å²	133.7	90%	0.897	73%	0.733	S	S	*	*			trans	95.1	141.4	148.6	0	0	0	0	0	117.9
16	G	26.3	Very low	29.6	Very low	81 Å²	81	137.5 Å²	137.5	84%	0.835	74%	0.739	S	S	*	*			cis	141.3	151.5	-10.9	0	0	0	0	0	113.5
17	A	25.6	Very low	29.5	Very low	80 Å²	80	138.5 Å²	138.5	66%	0.661	73%	0.734	S	S	*	*			cis	-174.9	150.2	-20.5	0	0	0	0	0	112.2
18	W	24.5	Very low	29.5	Very low	213 Å²	213	142 Å²	142	81%	0.807	73%	0.732	S	S	*	*			trans	67.4	162.8	162.1	-54.6	114.9	0	0	0	119.5
19	R	26.9	Very low	27.9	Very low	187 Å²	187	144 Å²	144	71%	0.706	73%	0.732	S	S	*	*			cis	-159.1	168.9	-16.6	-112.7	-164.1	-72.7	-100.2	11.1	106.3
20	G	26.2	Very low	26.7	Very low	60 Å²	60	142.9 Å²	142.9	62%	0.619	73%	0.728	S	S	*	*			cis	-168.2	148.8	-0.3	0	0	0	0	0	108.1
21	D	25.8	Very low	26.7	Very low	141 Å²	141	140.4 Å²	140.4	75%	0.754	73%	0.725	S	S	*	*				78.1	106	93.1	-67.6	-47.2	0	0	0	116
22	V	26.6	Very low	26.5	Very low	148 Å²	148	141.8 Å²	141.8	90%	0.897	73%	0.733	S	S	*	*				-151.8	126.8	119	176.6	0	0	0	0	109.3
23	L	26.5	Very low	26.3	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	74%	0.742	S	S	*	*			trans	-109.9	159.8	171.7	-102.8	169.9	0	0	0	108.4
24	P	40.1	Very low	26.1	Very low	114 Å²	114	145.2 Å²	145.2	74%	0.74	75%	0.749	S	S	*	*				-136	145.1	68.8	11.2	14.9	0	0	0	115.2
25	R	26.3	Very low	26.2	Very low	169 Å²	169	143.8 Å²	143.8	64%	0.638	75%	0.75	S	S	*	*				77.5	131.2	73.8	-152.6	-176.4	179.2	150.5	-0.1	110.7
26	W	23.1	Very low	26.7	Very low	202 Å²	202	145.1 Å²	145.1	77%	0.765	74%	0.743	S	S	*	*			cis	-140.7	135.3	37.2	-64.4	72.1	0	0	0	110.2
27	R	22.9	Very low	26.6	Very low	176 Å²	176	148.9 Å²	148.9	66%	0.664	74%	0.738	S	S	*	*				58.8	98.8	60.1	-164	-176.2	-95.4	-120.2	6.7	111.9
28	R	27.8	Very low	26.6	Very low	206 Å²	206	152.8 Å²	152.8	78%	0.777	75%	0.747	S	S	*	*				79.9	118.8	61.2	-174	-138.5	-74.9	-167.3	-4.1	113.3
29	Q	26.3	Very low	26.5	Very low	146 Å²	146	145.8 Å²	145.8	68%	0.682	74%	0.741	S	S	*	*			trans	161	130	144.2	-89.8	163.8	-72.2	0	0	108.5
30	S	25.8	Very low	26.5	Very low	83 Å²	83	142.4 Å²	142.4	58%	0.58	75%	0.745	S	S	*	*				64.9	141.6	79.6	93.7	0	0	0	0	112
31	E	24.8	Very low	26.4	Very low	156 Å²	156	150.5 Å²	150.5	73%	0.729	76%	0.758	S	S	*	*			cis	-161.4	168.3	14.3	-120.1	136.2	171.3	0	0	109.2
32	E	24.4	Very low	26.7	Very low	169 Å²	169	154.7 Å²	154.7	79%	0.79	76%	0.764	S	S	*	*			trans	48.5	141.7	153	-54.5	178.5	157.2	0	0	121
33	T	22.3	Very low	26.4	Very low	121 Å²	121	153.4 Å²	153.4	74%	0.742	76%	0.761	S	S	*	*				-177.9	153.9	57.2	18.8	0	0	0	0	111.6
34	V	22.9	Very low	26.4	Very low	136 Å²	136	156.5 Å²	156.5	82%	0.824	76%	0.762	S	S	*	*			trans	60.9	128.1	140.5	-179.5	0	0	0	0	122.7
35	F	30.3	Very low	26	Very low	197 Å²	197	157.2 Å²	157.2	86%	0.864	77%	0.765	S	S	*	*			trans	-74.9	155.1	167.9	-85.8	-90.2	0	0	0	113.3
36	P	34.6	Very low	25.9	Very low	116 Å²	116	154.4 Å²	154.4	75%	0.753	76%	0.759	S	S	*	*				-154.6	152.9	94.8	38.5	-18.8	0	0	0	119.4
37	H	25.6	Very low	26.3	Very low	160 Å²	160	153 Å²	153	74%	0.741	76%	0.758	S	S	*	*			trans	31.3	129.3	141.5	-83.1	-104.9	0	0	0	125.4
38	L	24.6	Very low	26.8	Very low	162 Å²	162	150.8 Å²	150.8	85%	0.848	76%	0.755	S	S	*	*			trans	70.5	141.6	130.6	-70.3	170	0	0	0	123.1
39	G	22.9	Very low	27.7	Very low	66 Å²	66	144.3 Å²	144.3	68%	0.68	74%	0.741	S	S	*	*			trans	130.2	58.8	158.1	0	0	0	0	0	115.2
40	C	27.3	Very low	28.9	Very low	116 Å²	116	140.6 Å²	140.6	78%	0.784	73%	0.726	S	S	*	*				45.9	101.8	89.8	-166.1	0	0	0	0	115.5
41	Y	23	Very low	30.5	Very low	229 Å²	229	137.1 Å²	137.1	90%	0.898	70%	0.701	S	S	*	*			trans	-137.3	126	147.7	-106.8	-85.1	0	0	0	111.7
42	R	32.3	Very low	32	Very low	230 Å²	230	136.4 Å²	136.4	87%	0.868	70%	0.695	S	S	*	*			trans	-71.7	138.7	162.1	-87.8	171.7	156.4	175.2	-8.7	108.6
43	S	21.8	Very low	33.7	Very low	120 Å²	120	130.1 Å²	130.1	84%	0.839	67%	0.666	S	S	*	*			trans	-162.2	149.2	137	-89.6	0	0	0	0	112.6
44	R	24.7	Very low	34.9	Very low	212 Å²	212	133.6 Å²	133.6	80%	0.8	67%	0.674	S	S	*	*			trans	52.9	107.8	165.7	-123	167.2	-178.5	130.2	4.7	118.4	E46	R44-E46 HydrophobicContact CB-CG 4.45Å; R44-E46 VanDerWaalsContact CD-OE1 3.29Å; R44-E46 WeakPolarHBondContact CD-OE1 3.09Å; R44-E46 HydrophobicContact CG-CG 4.04Å; R44-E46 IonicContact NE-OE1 2.75Å; R44-E46 PolarHBondContact NE-OE1 2.87Å; R44-E46 PolarHBondContact O-N 3.34Å
45	V	32.8	Very low	36.5	Very low	130 Å²	130	129.9 Å²	129.9	79%	0.788	65%	0.646	S	S	*	*			trans	-74.1	113.3	151.6	174.6	0	0	0	0	106.7	F47	V45-F47 HydrophobicContact CG1-CD2 4.09Å; V45-F47 HydrophobicContact CG1-CE2 4.19Å
46	E	23.6	Very low	37.3	Very low	110 Å²	110	123.7 Å²	123.7	51%	0.514	63%	0.627	S	S	.	*			trans	-111.2	129.2	160	-64.3	-162.3	171.5	0	0	108.5	R44 H48	R44-E46 HydrophobicContact CB-CG 4.45Å; R44-E46 VanDerWaalsContact CD-OE1 3.29Å; R44-E46 WeakPolarHBondContact CD-OE1 3.09Å; R44-E46 HydrophobicContact CG-CG 4.04Å; R44-E46 IonicContact NE-OE1 2.75Å; R44-E46 PolarHBondContact NE-OE1 2.87Å; R44-E46 PolarHBondContact O-N 3.34Å; E46-H48 PolarHBondContact O-N 3.42Å; E46-H48 VanDerWaalsContact O-N 3.07Å; E46-H48 IonicContact OE2-CE1 3.84Å; E46-H48 IonicContact OE2-ND1 3.61Å; E46-H48 PolarHBondContact OE2-ND1 3.1Å
47	F	31.1	Very low	37.9	Very low	171 Å²	171	125.6 Å²	125.6	75%	0.75	63%	0.626	S	S	*	*			trans	-82.1	65.1	169.1	-92.2	-90.1	0	0	0	108.8	V45	V45-F47 HydrophobicContact CG1-CD2 4.09Å; V45-F47 HydrophobicContact CG1-CE2 4.19Å
48	H	33.4	Very low	38.9	Very low	130 Å²	130	124.9 Å²	124.9	60%	0.602	62%	0.623	S	S	*	*			trans	-95.4	135.8	155.9	-69.8	103.8	0	0	0	107.7	E46 D50	E46-H48 PolarHBondContact O-N 3.42Å; E46-H48 VanDerWaalsContact O-N 3.07Å; E46-H48 IonicContact OE2-CE1 3.84Å; E46-H48 IonicContact OE2-ND1 3.61Å; E46-H48 PolarHBondContact OE2-ND1 3.1Å; H48-D50 VanDerWaalsContact C-N 3.3Å; H48-D50 WeakPolarHBondContact CB-OD2 3.21Å; H48-D50 PolarHBondContact O-N 3.49Å
49	S	46.7	Very low	40.5	Very low	70 Å²	70	119.7 Å²	119.7	49%	0.49	60%	0.599	S	S	.	*			trans	-104.6	53.7	-159.7	57.4	0	0	0	0	109.7	K166	S49-K166 WeakPolarHBondContact O-CE 3.28Å; S49-K166 PolarHBondContact O-NZ 2.79Å; S49-K166 PolarHBondContact OG-NZ 2.84Å
50	D	52.9	Low	42.2	Very low	68 Å²	68	121.5 Å²	121.5	36%	0.364	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.5	142	-162.6	-43.3	-28.9	0	0	0	109.7	H48 K52 L137 N138	H48-D50 VanDerWaalsContact C-N 3.3Å; H48-D50 WeakPolarHBondContact CB-OD2 3.21Å; H48-D50 PolarHBondContact O-N 3.49Å; D50-K52 PolarHBondContact O-N 3.39Å; D50-L137 CarbonylContact C-O 3.57Å; D50-L137 VanDerWaalsContact CA-O 3.32Å; D50-L137 WeakPolarHBondContact CA-O 3.4Å; D50-N138 VanDerWaalsContact CG-OD1 3.3Å; D50-N138 PolarHBondContact OD1-OD1 3.43Å
51	I	57.8	Low	43.9	Very low	10 Å²	10	122 Å²	122	5%	0.051	58%	0.58	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.7	110.3	167.7	-53.1	-178.8	0	0	0	106.8	F131 T136 L137 L139 V159 K162	I51-F131 HydrophobicContact CB-CE2 4.09Å; I51-F131 HydrophobicContact CG2-CE2 3.61Å; I51-F131 HydrophobicContact CG2-CZ 3.81Å; I51-T136 CarbonylContact O-C 3.19Å; I51-T136 VanDerWaalsContact O-CA 3.26Å; I51-T136 WeakPolarHBondContact O-CA 3.32Å; I51-L137 HydrophobicContact CB-CB 4.01Å; I51-L137 HydrophobicContact CD1-CB 4.4Å; I51-L137 HydrophobicContact CD1-CD2 3.94Å; I51-L137 HydrophobicContact CG1-CB 4.35Å; I51-L137 PolarHBondContact N-O 3.49Å; I51-L137 PolarHBondContact O-N 3.23Å; I51-L139 HydrophobicContact CD1-CD1 3.82Å; I51-L139 HydrophobicContact CD1-CG 4.5Å; I51-L139 HydrophobicContact CG1-CD1 4.05Å; I51-V159 HydrophobicContact CD1-CG1 4.35Å; I51-K162 HydrophobicContact CB-CD 4.26Å; I51-K162 HydrophobicContact CD1-CB 3.56Å; I51-K162 HydrophobicContact CD1-CD 3.78Å; I51-K162 HydrophobicContact CD1-CG 4.31Å; I51-K162 HydrophobicContact CG1-CB 4.06Å; I51-K162 HydrophobicContact CG1-CD 3.82Å; I51-K162 HydrophobicContact CG2-CD 3.56Å
52	K	58.1	Low	46.1	Very low	141 Å²	141	115.3 Å²	115.3	61%	0.613	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.4	116.8	169.6	-170.5	159.5	-175.1	163	0	111.2	D50 G135 T136	D50-K52 PolarHBondContact O-N 3.39Å; K52-G135 CarbonylContact C-O 3.59Å; K52-G135 VanDerWaalsContact CA-O 3.3Å; K52-G135 WeakPolarHBondContact CA-O 3.37Å; K52-T136 HydrophobicContact CD-CG2 4.13Å; K52-T136 HydrophobicContact CG-CG2 4.14Å
53	M	59.3	Low	48.1	Very low	37 Å²	37	105.1 Å²	105.1	18%	0.182	52%	0.522	C	S	.	.			trans	-81.2	146.9	169	-73.1	-178	74.2	0	0	110.4	Y55 F97 F131 G135 E158	M53-Y55 HydrophobicContact CB-CE1 4.32Å; M53-Y55 HydrophobicContact CB-CE2 4.07Å; M53-Y55 HydrophobicContact CE-CE1 4.07Å; M53-Y55 PolarHBondContact SD-OH 2.9Å; M53-Y55 VanDerWaalsContact SD-OH 3.37Å; M53-F97 HydrophobicContact CE-CE1 3.98Å; M53-F97 HydrophobicContact SD-CE1 3.85Å; M53-F131 HydrophobicContact CG-CE2 3.94Å; M53-F131 HydrophobicContact CG-CZ 3.69Å; M53-F131 HydrophobicContact SD-CE1 3.97Å; M53-F131 HydrophobicContact SD-CE2 4.07Å; M53-F131 HydrophobicContact SD-CZ 3.36Å; M53-F131 WeakPolarHBondContact SD-CZ 3.4Å; M53-G135 PolarHBondContact N-O 3.08Å; M53-E158 WeakPolarHBondContact CE-OE2 3.44Å
54	Q	47.3	Very low	50.5	Low	194 Å²	194	103.1 Å²	103.1	91%	0.907	50%	0.5	S	S	*	.			trans	-107.2	106.8	176.8	-71.5	-172	-23.7	0	0	109.8
55	Y	55.8	Low	52.8	Low	58 Å²	58	100.7 Å²	100.7	23%	0.227	49%	0.491	C	S	.	.			trans	-92.2	165.9	170.9	-54.8	-65.2	0	0	0	110.7	M53 L63 F97	M53-Y55 HydrophobicContact CB-CE1 4.32Å; M53-Y55 HydrophobicContact CB-CE2 4.07Å; M53-Y55 HydrophobicContact CE-CE1 4.07Å; M53-Y55 PolarHBondContact SD-OH 2.9Å; M53-Y55 VanDerWaalsContact SD-OH 3.37Å; Y55-L63 HydrophobicContact CD1-CD1 4.06Å; Y55-L63 HydrophobicContact CD2-CD1 3.64Å; Y55-L63 HydrophobicContact CE1-CD1 4Å; Y55-L63 HydrophobicContact CE2-CD1 3.55Å; Y55-L63 HydrophobicContact CG-CD1 3.91Å; Y55-F97 HydrophobicContact CE1-CZ 4.04Å; Y55-F97 AromaticContact CZ-CZ 3.92Å; Y55-F97 VanDerWaalsContact OH-CE1 3.24Å; Y55-F97 WeakPolarHBondContact OH-CE1 3.45Å; Y55-F97 WeakPolarHBondContact OH-CZ 3.21Å
56	S	48.6	Very low	54.7	Low	68 Å²	68	96.1 Å²	96.1	48%	0.476	46%	0.461	S	S	.	.			trans	-68.2	151.3	162.7	70.9	0	0	0	0	109.3	H58 C59 E60	S56-H58 PolarHBondContact O-N 3.3Å; S56-C59 CarbonylContact O-C 3.52Å; S56-C59 WeakPolarHBondContact O-CA 3.35Å; S56-C59 PolarHBondContact O-N 3.21Å; S56-C59 PolarHBondContact OG-N 2.84Å; S56-C59 PolarHBondContact OG-SG 3.35Å; S56-C59 VanDerWaalsContact OG-SG 3.32Å; S56-E60 PolarHBondContact O-N 3.22Å
57	H	46.6	Very low	57.3	Low	155 Å²	155	91.3 Å²	91.3	72%	0.718	44%	0.439	S	S	*	.	H	α-helix	trans	-55.8	-27.8	179.2	-172.2	-61.7	0	0	0	112.8	H61	H57-H61 PolarHBondContact O-N 2.92Å
58	H	45.9	Very low	59.5	Low	146 Å²	146	89 Å²	89	68%	0.676	43%	0.429	S	S	*	.	H	α-helix	trans	-70.2	-42.9	173.7	-172.4	71.7	0	0	0	112	S56 L62	S56-H58 PolarHBondContact O-N 3.3Å; H58-L62 WeakPolarHBondContact O-CB 3.47Å; H58-L62 PolarHBondContact O-N 3Å; H58-L62 VanDerWaalsContact O-N 3.09Å
59	C	57.8	Low	61.5	Low	52 Å²	52	85.3 Å²	85.3	35%	0.351	41%	0.412	S	S	.	.	H	α-helix	trans	-72.5	-34.2	177	-67.5	0	0	0	0	112.8	S56 L62 L63	S56-C59 CarbonylContact O-C 3.52Å; S56-C59 WeakPolarHBondContact O-CA 3.35Å; S56-C59 PolarHBondContact O-N 3.21Å; S56-C59 PolarHBondContact OG-N 2.84Å; S56-C59 PolarHBondContact OG-SG 3.35Å; S56-C59 VanDerWaalsContact OG-SG 3.32Å; C59-L62 PolarHBondContact O-N 2.88Å; C59-L63 WeakPolarHBondContact O-CB 3.47Å; C59-L63 WeakPolarHBondContact O-CG 3.41Å; C59-L63 PolarHBondContact O-N 3.12Å
60	E	59.9	Low	63	Low	105 Å²	105	83.6 Å²	83.6	49%	0.491	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-48.2	175.4	-170.9	170.8	-160.2	0	0	110.9	S56 L62 L63 E64	S56-E60 PolarHBondContact O-N 3.22Å; E60-L62 VanDerWaalsContact C-N 3.3Å; E60-L62 PolarHBondContact O-N 3.26Å; E60-L63 PolarHBondContact O-N 3.48Å; E60-E64 VanDerWaalsContact O-CB 3.29Å; E60-E64 WeakPolarHBondContact O-CB 3.34Å; E60-E64 PolarHBondContact O-N 2.94Å
61	H	63.5	Low	64	Low	125 Å²	125	86.5 Å²	86.5	58%	0.579	41%	0.406	S	S	*	.	H	α-helix	trans	-66.2	-29.4	174.8	-171.7	-78.3	0	0	0	113.1	H57 R65	H57-H61 PolarHBondContact O-N 2.92Å; H61-R65 WeakPolarHBondContact O-CB 3.4Å; H61-R65 PolarHBondContact O-N 3.28Å; H61-R65 VanDerWaalsContact O-N 3.15Å
62	L	69	Low	64.7	Low	90 Å²	90	89 Å²	89	47%	0.471	43%	0.428	S	S	.	.	H	α-helix	trans	-70.6	-48.1	173.9	-172.1	104.4	0	0	0	111.4	H58 C59 E60 R65 L66	H58-L62 WeakPolarHBondContact O-CB 3.47Å; H58-L62 PolarHBondContact O-N 3Å; H58-L62 VanDerWaalsContact O-N 3.09Å; C59-L62 PolarHBondContact O-N 2.88Å; E60-L62 VanDerWaalsContact C-N 3.3Å; E60-L62 PolarHBondContact O-N 3.26Å; L62-R65 PolarHBondContact O-N 3.2Å; L62-L66 HydrophobicContact CD2-CD1 3.83Å; L62-L66 HydrophobicContact CG-CD1 4.01Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 VanDerWaalsContact O-CG 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.46Å; L62-L66 PolarHBondContact O-N 3.23Å
63	L	72.5	Confident	65	Low	16 Å²	16	83.7 Å²	83.7	8%	0.084	41%	0.414	C	S	.	.	H	α-helix	trans	-63.2	-41.3	178.1	-76.4	167.2	0	0	0	111.6	Y55 C59 E60 R65 L66 N67 V93	Y55-L63 HydrophobicContact CD1-CD1 4.06Å; Y55-L63 HydrophobicContact CD2-CD1 3.64Å; Y55-L63 HydrophobicContact CE1-CD1 4Å; Y55-L63 HydrophobicContact CE2-CD1 3.55Å; Y55-L63 HydrophobicContact CG-CD1 3.91Å; C59-L63 WeakPolarHBondContact O-CB 3.47Å; C59-L63 WeakPolarHBondContact O-CG 3.41Å; C59-L63 PolarHBondContact O-N 3.12Å; E60-L63 PolarHBondContact O-N 3.48Å; L63-R65 PolarHBondContact O-N 3.37Å; L63-L66 CarbonylContact O-C 3.6Å; L63-L66 PolarHBondContact O-N 2.82Å; L63-N67 WeakPolarHBondContact O-CB 3.26Å; L63-N67 PolarHBondContact O-N 3.48Å; L63-V93 HydrophobicContact CD2-CG1 4.37Å
64	E	74.3	Confident	65	Low	77 Å²	77	88.8 Å²	88.8	36%	0.36	44%	0.435	S	S	.	.	H	α-helix	trans	-61.9	-40	173.9	175.6	59	-166.2	0	0	112.3	E60 N67 K68	E60-E64 VanDerWaalsContact O-CB 3.29Å; E60-E64 WeakPolarHBondContact O-CB 3.34Å; E60-E64 PolarHBondContact O-N 2.94Å; E64-N67 PolarHBondContact O-N 3.08Å; E64-K68 PolarHBondContact O-N 2.92Å; E64-K68 VanDerWaalsContact O-N 3.08Å; E64-K68 WeakPolarHBondContact OE1-CE 3.38Å; E64-K68 IonicContact OE1-NZ 2.63Å; E64-K68 PolarHBondContact OE1-NZ 3.17Å
65	R	71.6	Confident	65.7	Low	162 Å²	162	85.3 Å²	85.3	61%	0.611	42%	0.422	S	S	*	.	H	α-helix	trans	-67.1	-43	174.3	-176.8	176.5	-179.8	166.6	2.1	111.9	H61 L62 L63 N67 K68 Q69	H61-R65 WeakPolarHBondContact O-CB 3.4Å; H61-R65 PolarHBondContact O-N 3.28Å; H61-R65 VanDerWaalsContact O-N 3.15Å; L62-R65 PolarHBondContact O-N 3.2Å; L63-R65 PolarHBondContact O-N 3.37Å; R65-N67 VanDerWaalsContact C-N 3.28Å; R65-N67 PolarHBondContact O-N 3.07Å; R65-K68 PolarHBondContact O-N 3.46Å; R65-Q69 WeakPolarHBondContact O-CG 3.48Å; R65-Q69 PolarHBondContact O-N 3.18Å
66	L	73.4	Confident	66.5	Low	33 Å²	33	83.9 Å²	83.9	17%	0.173	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-31.3	175.2	-70.6	165.6	0	0	0	111.7	L62 L63 Q69 R70 H90 V93 Y133	L62-L66 HydrophobicContact CD2-CD1 3.83Å; L62-L66 HydrophobicContact CG-CD1 4.01Å; L62-L66 WeakPolarHBondContact O-CB 3.48Å; L62-L66 VanDerWaalsContact O-CG 3.29Å; L62-L66 WeakPolarHBondContact O-CG 3.46Å; L62-L66 PolarHBondContact O-N 3.23Å; L63-L66 CarbonylContact O-C 3.6Å; L63-L66 PolarHBondContact O-N 2.82Å; L66-Q69 PolarHBondContact O-N 2.87Å; L66-R70 WeakPolarHBondContact O-CB 3.34Å; L66-R70 PolarHBondContact O-N 3.11Å; L66-H90 PolarHBondContact O-CE1 3.22Å; L66-H90 VanDerWaalsContact O-CE1 3.27Å; L66-V93 HydrophobicContact CD1-CG2 4.08Å; L66-Y133 HydrophobicContact CB-CD1 4.39Å; L66-Y133 HydrophobicContact CB-CE1 4.08Å
67	N	78.2	Confident	67.6	Low	10 Å²	10	84.9 Å²	84.9	5%	0.053	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-47.9	174.6	-170.1	46.1	0	0	0	111.2	L63 E64 R65 Q69 R70 E71 Y133	L63-N67 WeakPolarHBondContact O-CB 3.26Å; L63-N67 PolarHBondContact O-N 3.48Å; E64-N67 PolarHBondContact O-N 3.08Å; R65-N67 VanDerWaalsContact C-N 3.28Å; R65-N67 PolarHBondContact O-N 3.07Å; N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 3.05Å; N67-R70 WeakPolarHBondContact O-CB 3.36Å; N67-R70 PolarHBondContact O-N 2.6Å; N67-R70 VanDerWaalsContact O-N 3.12Å; N67-R70 PolarHBondContact OD1-NE 3.03Å; N67-R70 PolarHBondContact OD1-NH2 2.79Å; N67-E71 PolarHBondContact ND2-OE1 3.41Å; N67-E71 WeakPolarHBondContact O-CG 3.43Å; N67-E71 PolarHBondContact O-N 3.12Å; N67-E71 PolarHBondContact OD1-OE1 3.07Å; N67-Y133 HydrophobicContact CB-CD1 4.06Å
68	K	76.6	Confident	69.2	Low	122 Å²	122	77.5 Å²	77.5	53%	0.53	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-36.5	174.2	-77.8	164.8	169	151.2	0	112.8	E64 R65 A72	E64-K68 PolarHBondContact O-N 2.92Å; E64-K68 VanDerWaalsContact O-N 3.08Å; E64-K68 WeakPolarHBondContact OE1-CE 3.38Å; E64-K68 IonicContact OE1-NZ 2.63Å; E64-K68 PolarHBondContact OE1-NZ 3.17Å; R65-K68 PolarHBondContact O-N 3.46Å; K68-A72 VanDerWaalsContact O-CB 3.28Å; K68-A72 WeakPolarHBondContact O-CB 3.45Å; K68-A72 PolarHBondContact O-N 3.22Å
69	Q	75.2	Confident	70.9	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.243	36%	0.362	C	S	.	.	H	α-helix	trans	-66.6	-40.2	173.1	-73.3	173.5	-45.2	0	0	112.1	R65 L66 N67 A72 G73 F74	R65-Q69 WeakPolarHBondContact O-CG 3.48Å; R65-Q69 PolarHBondContact O-N 3.18Å; L66-Q69 PolarHBondContact O-N 2.87Å; N67-Q69 VanDerWaalsContact C-N 3.3Å; N67-Q69 PolarHBondContact O-N 3.05Å; Q69-A72 CarbonylContact O-C 3.38Å; Q69-A72 PolarHBondContact O-N 3.17Å; Q69-G73 PolarHBondContact O-N 3.12Å; Q69-F74 PolarHBondContact O-N 2.85Å
70	R	79.3	Confident	72	Confident	34 Å²	34	69.4 Å²	69.4	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-49.5	174.7	-177.6	-167.1	70.6	171.9	8.8	112.3	L66 N67 A72 G73 K88 L129 Y133	L66-R70 WeakPolarHBondContact O-CB 3.34Å; L66-R70 PolarHBondContact O-N 3.11Å; N67-R70 WeakPolarHBondContact O-CB 3.36Å; N67-R70 PolarHBondContact O-N 2.6Å; N67-R70 VanDerWaalsContact O-N 3.12Å; N67-R70 PolarHBondContact OD1-NE 3.03Å; N67-R70 PolarHBondContact OD1-NH2 2.79Å; R70-A72 VanDerWaalsContact C-N 3.35Å; R70-G73 WeakPolarHBondContact O-CA 3.46Å; R70-G73 PolarHBondContact O-N 3.47Å; R70-K88 WeakPolarHBondContact CD-O 3.43Å; R70-K88 VanDerWaalsContact CG-O 3.27Å; R70-K88 WeakPolarHBondContact CG-O 3.35Å; R70-L129 PolarHBondContact NH1-O 3.33Å; R70-Y133 HydrophobicContact CB-CE1 4.49Å
71	E	74.3	Confident	72.9	Confident	130 Å²	130	65.4 Å²	65.4	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-65.7	-36.9	179.9	-72.7	167.7	-168.2	0	0	112.1	N67 G73	N67-E71 PolarHBondContact ND2-OE1 3.41Å; N67-E71 WeakPolarHBondContact O-CG 3.43Å; N67-E71 PolarHBondContact O-N 3.12Å; N67-E71 PolarHBondContact OD1-OE1 3.07Å; E71-G73 PolarHBondContact O-N 3.34Å
72	A	72.2	Confident	73.9	Confident	61 Å²	61	59.4 Å²	59.4	50%	0.504	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.7	171.4	0	0	0	0	0	113.7	K68 Q69 R70 F74	K68-A72 VanDerWaalsContact O-CB 3.28Å; K68-A72 WeakPolarHBondContact O-CB 3.45Å; K68-A72 PolarHBondContact O-N 3.22Å; Q69-A72 CarbonylContact O-C 3.38Å; Q69-A72 PolarHBondContact O-N 3.17Å; R70-A72 VanDerWaalsContact C-N 3.35Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 HydrophobicContact CB-CD2 3.71Å; A72-F74 HydrophobicContact CB-CE2 4.16Å; A72-F74 WeakPolarHBondContact O-CD2 3.23Å; A72-F74 WeakPolarHBondContact O-CE2 3.39Å; A72-F74 PolarHBondContact O-N 3.15Å
73	G	63.9	Low	74.5	Confident	31 Å²	31	57.1 Å²	57.1	32%	0.32	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.4	11.9	176.5	0	0	0	0	0	116	Q69 R70 E71	Q69-G73 PolarHBondContact O-N 3.12Å; R70-G73 WeakPolarHBondContact O-CA 3.46Å; R70-G73 PolarHBondContact O-N 3.47Å; E71-G73 PolarHBondContact O-N 3.34Å
74	F	60	Low	74.8	Confident	144 Å²	144	65.1 Å²	65.1	63%	0.632	34%	0.335	S	S	*	.			trans	-93.2	144.8	-179.4	-69.4	-85	0	0	0	111.7	Q69 A72 C76	Q69-F74 PolarHBondContact O-N 2.85Å; A72-F74 VanDerWaalsContact C-N 3.31Å; A72-F74 HydrophobicContact CB-CD2 3.71Å; A72-F74 HydrophobicContact CB-CE2 4.16Å; A72-F74 WeakPolarHBondContact O-CD2 3.23Å; A72-F74 WeakPolarHBondContact O-CE2 3.39Å; A72-F74 PolarHBondContact O-N 3.15Å; F74-C76 PolarHBondContact O-N 3.25Å; F74-C76 VanDerWaalsContact O-N 3.08Å
75	L	60.8	Low	75.1	Confident	121 Å²	121	66.6 Å²	66.6	63%	0.634	34%	0.341	S	S	*	.	S	Bend	trans	57.2	20.5	173.7	-55.5	173	0	0	0	115.8	D77 H90	L75-D77 PolarHBondContact O-N 3.49Å; L75-H90 PolarHBondContact O-CD2 3.31Å; L75-H90 VanDerWaalsContact O-CD2 3.23Å; L75-H90 PolarHBondContact O-NE2 2.72Å
76	C	72.5	Confident	75.5	Confident	27 Å²	27	65.7 Å²	65.7	18%	0.182	34%	0.343	C	S	.	.			trans	-83.1	98.7	173.3	-70.6	0	0	0	0	111.1	F74 C78 K88	F74-C76 PolarHBondContact O-N 3.25Å; F74-C76 VanDerWaalsContact O-N 3.08Å; C76-C78 PolarHBondContact O-N 3.43Å; C76-K88 HydrophobicContact CB-CB 3.86Å
77	D	71.4	Confident	76	Confident	90 Å²	90	65.3 Å²	65.3	48%	0.481	34%	0.34	S	S	.	.			trans	-75.8	2.9	-178.4	-52.7	-40.1	0	0	0	114.6	L75 R91	L75-D77 PolarHBondContact O-N 3.49Å; D77-R91 HydrophobicContact CB-CG 4.22Å
78	C	80.3	Confident	76.1	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	140.1	175	-165.1	0	0	0	0	112.4	C76 A89 R91 Y105 N111	C76-C78 PolarHBondContact O-N 3.43Å; C78-A89 PolarHBondContact N-O 2.92Å; C78-A89 PolarHBondContact O-N 3.05Å; C78-R91 HydrophobicContact CB-CG 3.82Å; C78-Y105 PolarHBondContact SG-OH 2.73Å; C78-N111 CarbonylContact C-O 3.52Å; C78-N111 VanDerWaalsContact CA-O 3.3Å; C78-N111 WeakPolarHBondContact CA-O 3.2Å
79	T	81.1	Confident	76.3	Confident	28 Å²	28	64.2 Å²	64.2	17%	0.172	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.7	162.5	-47.8	0	0	0	0	108.9	V81 Q86 F87 N111 N112 V113	T79-V81 HydrophobicContact CG2-CG2 4.37Å; T79-Q86 HydrophobicContact CG2-CB 4.14Å; T79-F87 CarbonylContact C-O 3.59Å; T79-F87 WeakPolarHBondContact CA-O 3.44Å; T79-N111 PolarHBondContact N-O 3.32Å; T79-N112 WeakPolarHBondContact CB-OD1 3.45Å; T79-N112 CarbonylContact O-C 3.56Å; T79-N112 VanDerWaalsContact O-CA 3.3Å; T79-N112 WeakPolarHBondContact O-CA 3.48Å; T79-V113 PolarHBondContact O-N 3.49Å
80	I	82.3	Confident	76.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.7	173.7	-64.9	169.8	0	0	0	107.7	I82 Q86 F87 L94 F101 V113 L115 F125	I80-I82 HydrophobicContact CG2-CD1 4.31Å; I80-I82 HydrophobicContact CG2-CG1 4.04Å; I80-Q86 CarbonylContact O-C 3.57Å; I80-Q86 WeakPolarHBondContact O-CA 3.28Å; I80-F87 HydrophobicContact CB-CB 4.39Å; I80-F87 PolarHBondContact N-O 3.01Å; I80-F87 PolarHBondContact O-N 3.18Å; I80-L94 HydrophobicContact CD1-CD1 3.57Å; I80-L94 HydrophobicContact CD1-CD2 4.37Å; I80-L94 HydrophobicContact CG1-CD1 4.49Å; I80-F101 HydrophobicContact CD1-CE1 3.7Å; I80-F101 HydrophobicContact CD1-CE2 4.29Å; I80-F101 HydrophobicContact CD1-CZ 3.46Å; I80-F101 VanDerWaalsContact CD1-CZ 3.46Å; I80-F101 HydrophobicContact CG1-CE1 4.23Å; I80-F101 HydrophobicContact CG1-CZ 4.35Å; I80-V113 CarbonylContact C-O 3.55Å; I80-V113 WeakPolarHBondContact CA-O 3.38Å; I80-V113 HydrophobicContact CG1-CB 4.38Å; I80-L115 HydrophobicContact CG2-CD1 3.65Å; I80-L115 HydrophobicContact CG2-CG 3.95Å; I80-F125 HydrophobicContact CB-CE1 4.33Å; I80-F125 HydrophobicContact CD1-CE1 4.08Å; I80-F125 HydrophobicContact CD1-CE2 4.41Å; I80-F125 HydrophobicContact CD1-CZ 3.49Å; I80-F125 VanDerWaalsContact CD1-CZ 3.49Å; I80-F125 HydrophobicContact CG2-CE1 4.01Å; I80-F125 HydrophobicContact CG2-CZ 4.17Å
81	V	79.3	Confident	76.5	Confident	20 Å²	20	63.2 Å²	63.2	12%	0.121	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.7	-177.5	-173.6	0	0	0	0	109.1	T79 F85 Q86 V113 F114 L115	T79-V81 HydrophobicContact CG2-CG2 4.37Å; V81-F85 WeakPolarHBondContact CA-O 3.49Å; V81-Q86 HydrophobicContact CG1-CG 4.49Å; V81-Q86 HydrophobicContact CG2-CG 4.32Å; V81-V113 PolarHBondContact N-O 2.97Å; V81-F114 HydrophobicContact CB-CD1 3.68Å; V81-F114 HydrophobicContact CB-CE1 3.92Å; V81-F114 HydrophobicContact CG1-CD1 3.99Å; V81-F114 HydrophobicContact CG1-CE1 4.08Å; V81-F114 HydrophobicContact CG2-CD1 4.17Å; V81-F114 HydrophobicContact CG2-CE1 3.95Å; V81-L115 PolarHBondContact O-N 3.13Å
82	I	83.5	Confident	76.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	95.5	179.7	-44.4	-170.6	0	0	0	108.2	I80 E84 F85 F87 L115 Q117 V120 A122 F125	I80-I82 HydrophobicContact CG2-CD1 4.31Å; I80-I82 HydrophobicContact CG2-CG1 4.04Å; I82-E84 PolarHBondContact O-N 3.28Å; I82-F85 PolarHBondContact N-O 2.95Å; I82-F85 PolarHBondContact O-N 2.89Å; I82-F87 HydrophobicContact CB-CE2 4.41Å; I82-F87 HydrophobicContact CD1-CD2 4.19Å; I82-F87 HydrophobicContact CD1-CE2 3.92Å; I82-F87 HydrophobicContact CG1-CD2 4.21Å; I82-F87 HydrophobicContact CG1-CE2 4.08Å; I82-L115 HydrophobicContact CD1-CB 4.49Å; I82-L115 HydrophobicContact CD1-CD1 3.94Å; I82-L115 HydrophobicContact CG1-CB 4.17Å; I82-L115 HydrophobicContact CG1-CD1 4.27Å; I82-Q117 HydrophobicContact CG2-CB 4.48Å; I82-V120 HydrophobicContact CD1-CG1 4.06Å; I82-V120 WeakPolarHBondContact CG2-O 3.28Å; I82-A122 HydrophobicContact CG2-CB 4.49Å; I82-F125 HydrophobicContact CD1-CB 3.63Å; I82-F125 HydrophobicContact CD1-CD1 3.5Å; I82-F125 VanDerWaalsContact CD1-CD1 3.5Å; I82-F125 HydrophobicContact CD1-CD2 4.37Å; I82-F125 HydrophobicContact CD1-CE1 4.31Å; I82-F125 HydrophobicContact CD1-CG 3.54Å
83	G	80.9	Confident	76.5	Confident	41 Å²	41	61.2 Å²	61.2	42%	0.423	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	-122.5	-168.1	0	0	0	0	0	110.8
84	E	79.3	Confident	77.2	Confident	185 Å²	185	59.8 Å²	59.8	86%	0.864	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-13.5	177.2	-60.4	-177.4	163.5	0	0	113.7	I82	I82-E84 PolarHBondContact O-N 3.28Å
85	F	80.4	Confident	77.9	Confident	108 Å²	108	54.8 Å²	54.8	47%	0.474	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.9	-174.9	-61.9	-85.4	0	0	0	112.1	V81 I82 F87 A122	V81-F85 WeakPolarHBondContact CA-O 3.49Å; I82-F85 PolarHBondContact N-O 2.95Å; I82-F85 PolarHBondContact O-N 2.89Å; F85-F87 HydrophobicContact CB-CE2 3.72Å; F85-F87 HydrophobicContact CB-CZ 3.98Å; F85-A122 HydrophobicContact CB-CB 4.07Å; F85-A122 HydrophobicContact CD2-CB 3.48Å; F85-A122 VanDerWaalsContact CD2-CB 3.48Å; F85-A122 HydrophobicContact CE2-CB 4.04Å; F85-A122 HydrophobicContact CG-CB 3.76Å
86	Q	81.3	Confident	78.5	Confident	143 Å²	143	53.2 Å²	53.2	67%	0.668	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	124	177.6	-58.9	-172.9	4.2	0	0	110.8	T79 I80 V81	T79-Q86 HydrophobicContact CG2-CB 4.14Å; I80-Q86 CarbonylContact O-C 3.57Å; I80-Q86 WeakPolarHBondContact O-CA 3.28Å; V81-Q86 HydrophobicContact CG1-CG 4.49Å; V81-Q86 HydrophobicContact CG2-CG 4.32Å
87	F	82.8	Confident	78.4	Confident	24 Å²	24	53.7 Å²	53.7	11%	0.105	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.3	-178.7	-58.8	-82.2	0	0	0	110.5	T79 I80 I82 F85 A122 F125 Q126 L129	T79-F87 CarbonylContact C-O 3.59Å; T79-F87 WeakPolarHBondContact CA-O 3.44Å; I80-F87 HydrophobicContact CB-CB 4.39Å; I80-F87 PolarHBondContact N-O 3.01Å; I80-F87 PolarHBondContact O-N 3.18Å; I82-F87 HydrophobicContact CB-CE2 4.41Å; I82-F87 HydrophobicContact CD1-CD2 4.19Å; I82-F87 HydrophobicContact CD1-CE2 3.92Å; I82-F87 HydrophobicContact CG1-CD2 4.21Å; I82-F87 HydrophobicContact CG1-CE2 4.08Å; F85-F87 HydrophobicContact CB-CE2 3.72Å; F85-F87 HydrophobicContact CB-CZ 3.98Å; F87-A122 HydrophobicContact CE2-CB 4.28Å; F87-A122 HydrophobicContact CZ-CB 4.14Å; F87-F125 HydrophobicContact CB-CE1 3.99Å; F87-F125 AromaticContact CD2-CD1 3.69Å; F87-F125 HydrophobicContact CD2-CD1 3.69Å; F87-F125 AromaticContact CD2-CE1 3.9Å; F87-F125 HydrophobicContact CD2-CE1 3.9Å; F87-F125 AromaticContact CE2-CD1 3.91Å; F87-F125 HydrophobicContact CE2-CD1 3.91Å; F87-F125 HydrophobicContact CG-CD1 4.01Å; F87-F125 AromaticContact CG-CE1 3.93Å; F87-F125 HydrophobicContact CG-CE1 3.93Å; F87-F125 HydrophobicContact CZ-CD1 4.41Å; F87-Q126 HydrophobicContact CE1-CB 3.78Å; F87-Q126 HydrophobicContact CE1-CG 4.09Å; F87-Q126 HydrophobicContact CZ-CB 4.19Å; F87-L129 HydrophobicContact CB-CD2 3.86Å; F87-L129 HydrophobicContact CD1-CD2 4.26Å; F87-L129 HydrophobicContact CG-CD2 4.34Å
88	K	81.4	Confident	78.7	Confident	110 Å²	110	49.7 Å²	49.7	48%	0.478	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	138.1	175.2	-69	-177.1	178.6	-179.7	0	110.8	R70 C76	R70-K88 WeakPolarHBondContact CD-O 3.43Å; R70-K88 VanDerWaalsContact CG-O 3.27Å; R70-K88 WeakPolarHBondContact CG-O 3.35Å; C76-K88 HydrophobicContact CB-CB 3.86Å
89	A	81.3	Confident	78.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	165.2	-179.1	0	0	0	0	0	112.5	C78 L94 L129	C78-A89 PolarHBondContact N-O 2.92Å; C78-A89 PolarHBondContact O-N 3.05Å; A89-L94 HydrophobicContact CB-CD1 3.55Å; A89-L94 HydrophobicContact CB-CD2 4.37Å; A89-L94 HydrophobicContact CB-CG 4.01Å; A89-L129 HydrophobicContact CB-CD1 4.2Å
90	H	81.2	Confident	78.3	Confident	14 Å²	14	57 Å²	57	7%	0.065	29%	0.293	C	S	.	.			trans	-93.7	123.3	176.7	-58.3	80	0	0	0	109.5	L66 L75 N92 V93 L94 Y133	L66-H90 PolarHBondContact O-CE1 3.22Å; L66-H90 VanDerWaalsContact O-CE1 3.27Å; L75-H90 PolarHBondContact O-CD2 3.31Å; L75-H90 VanDerWaalsContact O-CD2 3.23Å; L75-H90 PolarHBondContact O-NE2 2.72Å; H90-N92 VanDerWaalsContact C-N 3.32Å; H90-N92 PolarHBondContact O-N 3.26Å; H90-V93 HydrophobicContact CB-CB 4.25Å; H90-V93 HydrophobicContact CB-CG2 3.88Å; H90-V93 PolarHBondContact O-N 2.84Å; H90-L94 PolarHBondContact O-N 3.08Å; H90-L94 VanDerWaalsContact O-N 3.1Å; H90-Y133 WeakPolarHBondContact CB-OH 3.48Å; H90-Y133 PolarHBondContact N-OH 3.33Å; H90-Y133 AromaticContact ND1-CE1 3.73Å; H90-Y133 AromaticContact ND1-CZ 3.8Å; H90-Y133 PolarHBondContact ND1-OH 3.17Å
91	R	75.8	Confident	78.1	Confident	50 Å²	50	57 Å²	57	19%	0.189	29%	0.293	C	S	.	.	H	α-helix	trans	-51.3	-47.4	-177.5	-74.5	-178.9	150.8	154.7	-10.8	113.3	D77 C78 V93 L94 A95 Y105 S109 E110 N111	D77-R91 HydrophobicContact CB-CG 4.22Å; C78-R91 HydrophobicContact CB-CG 3.82Å; R91-V93 VanDerWaalsContact C-N 3.27Å; R91-V93 PolarHBondContact O-N 2.96Å; R91-L94 PolarHBondContact O-N 3.38Å; R91-A95 WeakPolarHBondContact O-CB 3.42Å; R91-A95 PolarHBondContact O-N 3.49Å; R91-Y105 HydrophobicContact CB-CD2 4.09Å; R91-Y105 HydrophobicContact CB-CE2 3.92Å; R91-Y105 HydrophobicContact CG-CD1 4.2Å; R91-Y105 HydrophobicContact CG-CD2 4.33Å; R91-Y105 HydrophobicContact CG-CE1 3.9Å; R91-Y105 HydrophobicContact CG-CE2 4.03Å; R91-Y105 HydrophobicContact CG-CG 4.42Å; R91-S109 PolarHBondContact NH2-O 3.22Å; R91-E110 PolarHBondContact NH2-O 2.96Å; R91-N111 PolarHBondContact NH1-OD1 3.18Å; R91-N111 PolarHBondContact NH2-OD1 2.94Å
92	N	71.8	Confident	77.7	Confident	137 Å²	137	56.5 Å²	56.5	73%	0.733	29%	0.292	S	S	*	.	H	α-helix	trans	-64.9	-30.6	-177.5	-65.6	-18.1	0	0	0	113	H90 S96	H90-N92 VanDerWaalsContact C-N 3.32Å; H90-N92 PolarHBondContact O-N 3.26Å; N92-S96 PolarHBondContact O-N 3.32Å; N92-S96 PolarHBondContact O-OG 2.78Å
93	V	76.5	Confident	77.2	Confident	13 Å²	13	59 Å²	59	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-74.8	-44.7	175.4	-178.5	0	0	0	0	109.6	L63 L66 H90 R91 A95 S96 F97 I132 Y133	L63-V93 HydrophobicContact CD2-CG1 4.37Å; L66-V93 HydrophobicContact CD1-CG2 4.08Å; H90-V93 HydrophobicContact CB-CB 4.25Å; H90-V93 HydrophobicContact CB-CG2 3.88Å; H90-V93 PolarHBondContact O-N 2.84Å; R91-V93 VanDerWaalsContact C-N 3.27Å; R91-V93 PolarHBondContact O-N 2.96Å; V93-A95 VanDerWaalsContact C-N 3.34Å; V93-A95 PolarHBondContact O-N 2.81Å; V93-S96 PolarHBondContact O-N 3.29Å; V93-S96 PolarHBondContact O-OG 3.2Å; V93-F97 HydrophobicContact CG1-CD2 4.34Å; V93-F97 HydrophobicContact CG1-CE2 4.29Å; V93-F97 VanDerWaalsContact O-CD2 3.28Å; V93-F97 WeakPolarHBondContact O-CD2 3.3Å; V93-F97 PolarHBondContact O-N 2.8Å; V93-I132 HydrophobicContact CG1-CG2 3.54Å; V93-Y133 HydrophobicContact CG1-CE1 4.31Å; V93-Y133 HydrophobicContact CG1-CE2 4.01Å
94	L	77.4	Confident	76.9	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-41	176.5	-69.2	171.5	0	0	0	112.6	I80 A89 H90 R91 S96 F97 S98 F101 Y105 L129 I132	I80-L94 HydrophobicContact CD1-CD1 3.57Å; I80-L94 HydrophobicContact CD1-CD2 4.37Å; I80-L94 HydrophobicContact CG1-CD1 4.49Å; A89-L94 HydrophobicContact CB-CD1 3.55Å; A89-L94 HydrophobicContact CB-CD2 4.37Å; A89-L94 HydrophobicContact CB-CG 4.01Å; H90-L94 PolarHBondContact O-N 3.08Å; H90-L94 VanDerWaalsContact O-N 3.1Å; R91-L94 PolarHBondContact O-N 3.38Å; L94-S96 VanDerWaalsContact C-N 3.29Å; L94-S96 PolarHBondContact O-N 2.97Å; L94-F97 PolarHBondContact O-N 3.48Å; L94-S98 PolarHBondContact O-N 3.11Å; L94-S98 VanDerWaalsContact O-N 3.09Å; L94-F101 HydrophobicContact CB-CB 3.98Å; L94-F101 HydrophobicContact CB-CD2 3.92Å; L94-F101 HydrophobicContact CB-CG 3.92Å; L94-F101 HydrophobicContact CD2-CD2 4.16Å; L94-F101 HydrophobicContact CD2-CE2 4.09Å; L94-F101 HydrophobicContact CG-CD2 4.47Å; L94-Y105 HydrophobicContact CB-CE2 4.19Å; L94-Y105 VanDerWaalsContact CD1-OH 3.31Å; L94-Y105 WeakPolarHBondContact CD1-OH 3.46Å; L94-L129 HydrophobicContact CD2-CD1 4.02Å; L94-I132 HydrophobicContact CD2-CD1 4.33Å
95	A	75.8	Confident	76.6	Confident	38 Å²	38	52.2 Å²	52.2	31%	0.314	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-24.6	179.1	0	0	0	0	0	114.2	R91 V93 Y105	R91-A95 WeakPolarHBondContact O-CB 3.42Å; R91-A95 PolarHBondContact O-N 3.49Å; V93-A95 VanDerWaalsContact C-N 3.34Å; V93-A95 PolarHBondContact O-N 2.81Å; A95-Y105 HydrophobicContact CB-CD2 4.2Å
96	S	72.4	Confident	75.8	Confident	88 Å²	88	57.6 Å²	57.6	62%	0.615	29%	0.286	S	S	*	.	H	α-helix	trans	-84.7	-19.5	177.4	63	0	0	0	0	113.7	N92 V93 L94	N92-S96 PolarHBondContact O-N 3.32Å; N92-S96 PolarHBondContact O-OG 2.78Å; V93-S96 PolarHBondContact O-N 3.29Å; V93-S96 PolarHBondContact O-OG 3.2Å; L94-S96 VanDerWaalsContact C-N 3.29Å; L94-S96 PolarHBondContact O-N 2.97Å
97	F	71.1	Confident	74.7	Confident	38 Å²	38	55.1 Å²	55.1	17%	0.167	29%	0.285	C	S	.	.	H	α-helix	trans	-102.6	-15.4	179.1	-77.6	-98.3	0	0	0	114.3	M53 Y55 V93 L94 I132	M53-F97 HydrophobicContact CE-CE1 3.98Å; M53-F97 HydrophobicContact SD-CE1 3.85Å; Y55-F97 HydrophobicContact CE1-CZ 4.04Å; Y55-F97 AromaticContact CZ-CZ 3.92Å; Y55-F97 VanDerWaalsContact OH-CE1 3.24Å; Y55-F97 WeakPolarHBondContact OH-CE1 3.45Å; Y55-F97 WeakPolarHBondContact OH-CZ 3.21Å; V93-F97 HydrophobicContact CG1-CD2 4.34Å; V93-F97 HydrophobicContact CG1-CE2 4.29Å; V93-F97 VanDerWaalsContact O-CD2 3.28Å; V93-F97 WeakPolarHBondContact O-CD2 3.3Å; V93-F97 PolarHBondContact O-N 2.8Å; L94-F97 PolarHBondContact O-N 3.48Å; F97-I132 HydrophobicContact CB-CD1 4.27Å; F97-I132 HydrophobicContact CB-CG1 4.12Å; F97-I132 HydrophobicContact CB-CG2 4.49Å; F97-I132 HydrophobicContact CD1-CG1 4.07Å; F97-I132 HydrophobicContact CD1-CG2 4.47Å; F97-I132 HydrophobicContact CD2-CG2 3.84Å; F97-I132 HydrophobicContact CE2-CG2 4.1Å; F97-I132 HydrophobicContact CG-CG1 4.06Å; F97-I132 HydrophobicContact CG-CG2 4.02Å
98	S	77.1	Confident	73.5	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.042	30%	0.296	C	S	.	.			trans	-141.3	122.8	-173.2	168.3	0	0	0	0	111.3	L94 Y100 F101 G102 L154	L94-S98 PolarHBondContact O-N 3.11Å; L94-S98 VanDerWaalsContact O-N 3.09Å; S98-Y100 PolarHBondContact O-N 2.78Å; S98-Y100 WeakPolarHBondContact OG-CB 3.34Å; S98-Y100 PolarHBondContact OG-N 3.16Å; S98-F101 PolarHBondContact O-N 2.93Å; S98-F101 PolarHBondContact OG-N 2.8Å; S98-G102 PolarHBondContact O-N 2.79Å; S98-L154 WeakPolarHBondContact CB-O 3.33Å; S98-L154 PolarHBondContact OG-O 3.16Å
99	E	74	Confident	72.4	Confident	128 Å²	128	56.5 Å²	56.5	60%	0.598	31%	0.309	S	S	*	.	H	α-helix	trans	-62.8	-32.1	172.6	-167.1	-170.7	-138.5	0	0	111.5	G102 A103 K155	E99-G102 CarbonylContact O-C 3.57Å; E99-G102 PolarHBondContact O-N 3.45Å; E99-A103 WeakPolarHBondContact O-CB 3.44Å; E99-A103 PolarHBondContact O-N 3.11Å; E99-K155 HydrophobicContact CB-CB 4.39Å; E99-K155 HydrophobicContact CB-CD 4.24Å; E99-K155 WeakPolarHBondContact OE2-CD 3.45Å; E99-K155 IonicContact OE2-NZ 2.96Å; E99-K155 PolarHBondContact OE2-NZ 3.48Å
100	Y	79.1	Confident	71.6	Confident	52 Å²	52	62.5 Å²	62.5	20%	0.204	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-51.8	177.1	177.6	-92	0	0	0	111.8	S98 G102 A103 I104 L115 Y153 L154	S98-Y100 PolarHBondContact O-N 2.78Å; S98-Y100 WeakPolarHBondContact OG-CB 3.34Å; S98-Y100 PolarHBondContact OG-N 3.16Å; Y100-G102 VanDerWaalsContact C-N 3.34Å; Y100-G102 PolarHBondContact O-N 2.89Å; Y100-A103 PolarHBondContact O-N 3.09Å; Y100-I104 HydrophobicContact CD1-CD1 3.78Å; Y100-I104 HydrophobicContact CE1-CD1 3.27Å; Y100-I104 HydrophobicContact CE2-CD1 4.19Å; Y100-I104 HydrophobicContact CG-CD1 4.42Å; Y100-I104 WeakPolarHBondContact O-CG1 3.4Å; Y100-I104 PolarHBondContact O-N 3.13Å; Y100-I104 VanDerWaalsContact O-N 3.09Å; Y100-L115 HydrophobicContact CE1-CD2 3.75Å; Y100-Y153 HydrophobicContact CE1-CE1 4.25Å; Y100-Y153 AromaticContact CE2-CE1 3.84Å; Y100-Y153 HydrophobicContact CE2-CE1 3.84Å; Y100-Y153 AromaticContact CZ-CE1 3.64Å; Y100-Y153 PolarHBondContact OH-OH 3.29Å; Y100-L154 HydrophobicContact CD1-CD2 3.51Å; Y100-L154 HydrophobicContact CE1-CD2 3.79Å; Y100-L154 HydrophobicContact CG-CD2 4.2Å
101	F	77.1	Confident	70.8	Confident	2 Å²	2	66 Å²	66	1%	0.009	36%	0.356	C	S	.	.	H	α-helix	trans	-66.8	-36.3	174.7	-71.4	-61.4	0	0	0	112	I80 L94 S98 A103 I104 Y105 V113 L115 F125 L154	I80-F101 HydrophobicContact CD1-CE1 3.7Å; I80-F101 HydrophobicContact CD1-CE2 4.29Å; I80-F101 HydrophobicContact CD1-CZ 3.46Å; I80-F101 VanDerWaalsContact CD1-CZ 3.46Å; I80-F101 HydrophobicContact CG1-CE1 4.23Å; I80-F101 HydrophobicContact CG1-CZ 4.35Å; L94-F101 HydrophobicContact CB-CB 3.98Å; L94-F101 HydrophobicContact CB-CD2 3.92Å; L94-F101 HydrophobicContact CB-CG 3.92Å; L94-F101 HydrophobicContact CD2-CD2 4.16Å; L94-F101 HydrophobicContact CD2-CE2 4.09Å; L94-F101 HydrophobicContact CG-CD2 4.47Å; S98-F101 PolarHBondContact O-N 2.93Å; S98-F101 PolarHBondContact OG-N 2.8Å; F101-A103 PolarHBondContact O-N 3.41Å; F101-I104 PolarHBondContact O-N 3.34Å; F101-Y105 HydrophobicContact CB-CD2 4.38Å; F101-Y105 HydrophobicContact CB-CE2 3.83Å; F101-Y105 HydrophobicContact CD1-CE2 4.32Å; F101-Y105 HydrophobicContact CG-CE2 4.42Å; F101-Y105 WeakPolarHBondContact O-CD2 3.43Å; F101-Y105 PolarHBondContact O-N 3.44Å; F101-Y105 VanDerWaalsContact O-N 3.11Å; F101-V113 HydrophobicContact CE1-CG1 4.09Å; F101-L115 HydrophobicContact CZ-CD1 4.49Å; F101-F125 HydrophobicContact CE2-CE2 4.42Å; F101-F125 HydrophobicContact CZ-CE2 4.4Å; F101-L154 HydrophobicContact CD2-CD2 4.47Å; F101-L154 HydrophobicContact CE2-CD1 4.11Å; F101-L154 HydrophobicContact CE2-CD2 3.69Å; F101-L154 HydrophobicContact CE2-CG 4.41Å; F101-L154 HydrophobicContact CZ-CD2 3.78Å
102	G	71.9	Confident	70.7	Confident	9 Å²	9	67.3 Å²	67.3	9%	0.093	37%	0.367	C	S	.	.	H	α-helix	trans	-61.8	-27.4	173.4	0	0	0	0	0	114.3	S98 E99 Y100 R106	S98-G102 PolarHBondContact O-N 2.79Å; E99-G102 CarbonylContact O-C 3.57Å; E99-G102 PolarHBondContact O-N 3.45Å; Y100-G102 VanDerWaalsContact C-N 3.34Å; Y100-G102 PolarHBondContact O-N 2.89Å; G102-R106 VanDerWaalsContact O-CD 3.29Å; G102-R106 WeakPolarHBondContact O-CD 3.42Å; G102-R106 VanDerWaalsContact O-CG 3.3Å; G102-R106 WeakPolarHBondContact O-CG 3.21Å; G102-R106 PolarHBondContact O-NE 3.21Å
103	A	72.9	Confident	71.1	Confident	53 Å²	53	61.3 Å²	61.3	44%	0.438	34%	0.335	S	S	.	.	H	α-helix	trans	-79.7	-47.3	172.9	0	0	0	0	0	111.9	E99 Y100 F101 Y105 R106 S107	E99-A103 WeakPolarHBondContact O-CB 3.44Å; E99-A103 PolarHBondContact O-N 3.11Å; Y100-A103 PolarHBondContact O-N 3.09Å; F101-A103 PolarHBondContact O-N 3.41Å; A103-Y105 PolarHBondContact O-N 2.98Å; A103-R106 WeakPolarHBondContact O-CB 3.39Å; A103-R106 PolarHBondContact O-N 3.45Å; A103-R106 VanDerWaalsContact O-N 3.1Å; A103-S107 PolarHBondContact O-N 3.49Å
104	I	75.1	Confident	71.2	Confident	38 Å²	38	67.4 Å²	67.4	20%	0.195	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-45.5	-177.1	-70.7	173.4	0	0	0	112.1	Y100 F101 R106 S107 T108 V113	Y100-I104 HydrophobicContact CD1-CD1 3.78Å; Y100-I104 HydrophobicContact CE1-CD1 3.27Å; Y100-I104 HydrophobicContact CE2-CD1 4.19Å; Y100-I104 HydrophobicContact CG-CD1 4.42Å; Y100-I104 WeakPolarHBondContact O-CG1 3.4Å; Y100-I104 PolarHBondContact O-N 3.13Å; Y100-I104 VanDerWaalsContact O-N 3.09Å; F101-I104 PolarHBondContact O-N 3.34Å; I104-R106 PolarHBondContact O-N 3.1Å; I104-R106 VanDerWaalsContact O-N 3.15Å; I104-S107 PolarHBondContact O-N 3.23Å; I104-S107 PolarHBondContact O-OG 2.77Å; I104-T108 PolarHBondContact O-N 3.39Å; I104-V113 HydrophobicContact CD1-CG1 4.17Å; I104-V113 HydrophobicContact CG2-CG2 4.23Å
105	Y	73.3	Confident	71.3	Confident	45 Å²	45	67.7 Å²	67.7	18%	0.176	36%	0.362	C	S	.	.	H	α-helix	trans	-73.1	-3.9	180	-54.3	-43.7	0	0	0	114	C78 R91 L94 A95 F101 A103 V113	C78-Y105 PolarHBondContact SG-OH 2.73Å; R91-Y105 HydrophobicContact CB-CD2 4.09Å; R91-Y105 HydrophobicContact CB-CE2 3.92Å; R91-Y105 HydrophobicContact CG-CD1 4.2Å; R91-Y105 HydrophobicContact CG-CD2 4.33Å; R91-Y105 HydrophobicContact CG-CE1 3.9Å; R91-Y105 HydrophobicContact CG-CE2 4.03Å; R91-Y105 HydrophobicContact CG-CG 4.42Å; L94-Y105 HydrophobicContact CB-CE2 4.19Å; L94-Y105 VanDerWaalsContact CD1-OH 3.31Å; L94-Y105 WeakPolarHBondContact CD1-OH 3.46Å; A95-Y105 HydrophobicContact CB-CD2 4.2Å; F101-Y105 HydrophobicContact CB-CD2 4.38Å; F101-Y105 HydrophobicContact CB-CE2 3.83Å; F101-Y105 HydrophobicContact CD1-CE2 4.32Å; F101-Y105 HydrophobicContact CG-CE2 4.42Å; F101-Y105 WeakPolarHBondContact O-CD2 3.43Å; F101-Y105 PolarHBondContact O-N 3.44Å; F101-Y105 VanDerWaalsContact O-N 3.11Å; A103-Y105 PolarHBondContact O-N 2.98Å; Y105-V113 HydrophobicContact CE1-CG2 3.93Å
106	R	63.2	Low	71.4	Confident	220 Å²	220	70 Å²	70	83%	0.83	37%	0.369	S	S	*	.	H	α-helix	trans	-91.7	-23.2	168	-67.7	173.4	-171.5	158.4	6.1	112.7	G102 A103 I104	G102-R106 VanDerWaalsContact O-CD 3.29Å; G102-R106 WeakPolarHBondContact O-CD 3.42Å; G102-R106 VanDerWaalsContact O-CG 3.3Å; G102-R106 WeakPolarHBondContact O-CG 3.21Å; G102-R106 PolarHBondContact O-NE 3.21Å; A103-R106 WeakPolarHBondContact O-CB 3.39Å; A103-R106 PolarHBondContact O-N 3.45Å; A103-R106 VanDerWaalsContact O-N 3.1Å; I104-R106 PolarHBondContact O-N 3.1Å; I104-R106 VanDerWaalsContact O-N 3.15Å
107	S	57.9	Low	71.5	Confident	92 Å²	92	71 Å²	71	64%	0.643	36%	0.364	S	S	*	.	H	α-helix	trans	-99.3	-29.2	-178.1	60.7	0	0	0	0	114	A103 I104	A103-S107 PolarHBondContact O-N 3.49Å; I104-S107 PolarHBondContact O-N 3.23Å; I104-S107 PolarHBondContact O-OG 2.77Å
108	T	58	Low	71.5	Confident	57 Å²	57	72.6 Å²	72.6	35%	0.35	38%	0.38	S	S	.	.			trans	-135.1	129.1	-165	-42.2	0	0	0	0	111.1	I104 E110	I104-T108 PolarHBondContact O-N 3.39Å; T108-E110 HydrophobicContact CG2-CB 3.95Å; T108-E110 HydrophobicContact CG2-CG 3.91Å
109	S	57.9	Low	71.3	Confident	106 Å²	106	76.4 Å²	76.4	74%	0.741	40%	0.397	S	S	*	.			trans	-82.1	-10.8	178.9	53.1	0	0	0	0	114	R91 N111	R91-S109 PolarHBondContact NH2-O 3.22Å; S109-N111 PolarHBondContact O-OD1 2.87Å
110	E	65.1	Low	71.6	Confident	125 Å²	125	70.3 Å²	70.3	58%	0.584	37%	0.369	S	S	*	.			trans	-64.8	131.5	-175.9	-64.3	179.3	-175	0	0	112.9	R91 T108 N112	R91-E110 PolarHBondContact NH2-O 2.96Å; T108-E110 HydrophobicContact CG2-CB 3.95Å; T108-E110 HydrophobicContact CG2-CG 3.91Å; E110-N112 PolarHBondContact O-N 3.49Å
111	N	64.1	Low	71.7	Confident	89 Å²	89	72.2 Å²	72.2	48%	0.476	38%	0.378	S	S	.	.	S	Bend	trans	-78.6	-7.2	-176.5	-63.1	-9.3	0	0	0	113.2	C78 T79 R91 S109	C78-N111 CarbonylContact C-O 3.52Å; C78-N111 VanDerWaalsContact CA-O 3.3Å; C78-N111 WeakPolarHBondContact CA-O 3.2Å; T79-N111 PolarHBondContact N-O 3.32Å; R91-N111 PolarHBondContact NH1-OD1 3.18Å; R91-N111 PolarHBondContact NH2-OD1 2.94Å; S109-N111 PolarHBondContact O-OD1 2.87Å
112	N	73.9	Confident	71.8	Confident	77 Å²	77	72.6 Å²	72.6	41%	0.412	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	126.1	-178.7	-64.7	-15.5	0	0	0	109.6	T79 E110 F114	T79-N112 WeakPolarHBondContact CB-OD1 3.45Å; T79-N112 CarbonylContact O-C 3.56Å; T79-N112 VanDerWaalsContact O-CA 3.3Å; T79-N112 WeakPolarHBondContact O-CA 3.48Å; E110-N112 PolarHBondContact O-N 3.49Å; N112-F114 HydrophobicContact CB-CE2 4.13Å; N112-F114 HydrophobicContact CB-CZ 4.37Å
113	V	78.9	Confident	72.2	Confident	10 Å²	10	74.9 Å²	74.9	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.1	175.6	-177.5	0	0	0	0	108.2	T79 I80 V81 F101 I104 Y105 L115	T79-V113 PolarHBondContact O-N 3.49Å; I80-V113 CarbonylContact C-O 3.55Å; I80-V113 WeakPolarHBondContact CA-O 3.38Å; I80-V113 HydrophobicContact CG1-CB 4.38Å; V81-V113 PolarHBondContact N-O 2.97Å; F101-V113 HydrophobicContact CE1-CG1 4.09Å; I104-V113 HydrophobicContact CD1-CG1 4.17Å; I104-V113 HydrophobicContact CG2-CG2 4.23Å; Y105-V113 HydrophobicContact CE1-CG2 3.93Å; V113-L115 HydrophobicContact CG1-CD2 4.09Å
114	F	78.1	Confident	72.5	Confident	141 Å²	141	72.3 Å²	72.3	62%	0.618	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	128.4	176.1	-60.6	-88.4	0	0	0	109.4	V81 N112	V81-F114 HydrophobicContact CB-CD1 3.68Å; V81-F114 HydrophobicContact CB-CE1 3.92Å; V81-F114 HydrophobicContact CG1-CD1 3.99Å; V81-F114 HydrophobicContact CG1-CE1 4.08Å; V81-F114 HydrophobicContact CG2-CD1 4.17Å; V81-F114 HydrophobicContact CG2-CE1 3.95Å; N112-F114 HydrophobicContact CB-CE2 4.13Å; N112-F114 HydrophobicContact CB-CZ 4.37Å
115	L	80.8	Confident	73	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.037	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.3	171.7	-53.3	178.3	0	0	0	109.1	I80 V81 I82 Y100 F101 V113 Q117 V120 Y153 L154	I80-L115 HydrophobicContact CG2-CD1 3.65Å; I80-L115 HydrophobicContact CG2-CG 3.95Å; V81-L115 PolarHBondContact O-N 3.13Å; I82-L115 HydrophobicContact CD1-CB 4.49Å; I82-L115 HydrophobicContact CD1-CD1 3.94Å; I82-L115 HydrophobicContact CG1-CB 4.17Å; I82-L115 HydrophobicContact CG1-CD1 4.27Å; Y100-L115 HydrophobicContact CE1-CD2 3.75Å; F101-L115 HydrophobicContact CZ-CD1 4.49Å; V113-L115 HydrophobicContact CG1-CD2 4.09Å; L115-Q117 PolarHBondContact O-N 2.98Å; L115-V120 HydrophobicContact CD1-CG1 4.46Å; L115-Y153 HydrophobicContact CD2-CE1 4.23Å; L115-L154 HydrophobicContact CD1-CD2 4.26Å; L115-L154 HydrophobicContact CD2-CD2 4.42Å
116	D	76.9	Confident	73.5	Confident	86 Å²	86	73 Å²	73	46%	0.46	38%	0.375	S	S	.	.			trans	-70.7	125.3	177.7	178.8	12.3	0	0	0	110.9	S118 Q119 V120	D116-S118 VanDerWaalsContact CG-OG 3.28Å; D116-S118 PolarHBondContact O-N 3.42Å; D116-S118 PolarHBondContact OD1-N 3.48Å; D116-S118 WeakPolarHBondContact OD2-CB 3.47Å; D116-S118 PolarHBondContact OD2-OG 3.41Å; D116-Q119 HydrophobicContact CB-CG 4.32Å; D116-Q119 PolarHBondContact O-N 2.83Å; D116-V120 PolarHBondContact O-N 3.17Å
117	Q	75.3	Confident	74.4	Confident	109 Å²	109	65.3 Å²	65.3	51%	0.509	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.3	177.4	-167.5	175.4	5.4	0	0	112.6	I82 L115 Q119	I82-Q117 HydrophobicContact CG2-CB 4.48Å; L115-Q117 PolarHBondContact O-N 2.98Å; Q117-Q119 VanDerWaalsContact C-N 3.29Å
118	S	70	Confident	75.5	Confident	73 Å²	73	61 Å²	61	51%	0.51	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-29.2	171.5	92.4	0	0	0	0	112.7	D116 Q149	D116-S118 VanDerWaalsContact CG-OG 3.28Å; D116-S118 PolarHBondContact O-N 3.42Å; D116-S118 PolarHBondContact OD1-N 3.48Å; D116-S118 WeakPolarHBondContact OD2-CB 3.47Å; D116-S118 PolarHBondContact OD2-OG 3.41Å; S118-Q149 PolarHBondContact O-NE2 3.15Å
119	Q	73.4	Confident	76.6	Confident	86 Å²	86	58.6 Å²	58.6	40%	0.402	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-36.5	-176	-58.5	-55	-47.1	0	0	112.9	D116 Q117 Q149 Y153	D116-Q119 HydrophobicContact CB-CG 4.32Å; D116-Q119 PolarHBondContact O-N 2.83Å; Q117-Q119 VanDerWaalsContact C-N 3.29Å; Q119-Q149 WeakPolarHBondContact O-CG 3.45Å; Q119-Q149 PolarHBondContact O-NE2 3.12Å; Q119-Y153 HydrophobicContact CB-CD2 3.71Å; Q119-Y153 HydrophobicContact CB-CE2 3.79Å; Q119-Y153 HydrophobicContact CB-CG 4.38Å; Q119-Y153 HydrophobicContact CG-CD2 4.25Å; Q119-Y153 HydrophobicContact CG-CE2 3.99Å
120	V	79.6	Confident	77.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	-129.4	115.1	-177.2	-178.2	0	0	0	0	109.9	I82 L115 D116 F125 A150 Y153	I82-V120 HydrophobicContact CD1-CG1 4.06Å; I82-V120 WeakPolarHBondContact CG2-O 3.28Å; L115-V120 HydrophobicContact CD1-CG1 4.46Å; D116-V120 PolarHBondContact O-N 3.17Å; V120-F125 HydrophobicContact CG1-CB 3.8Å; V120-F125 HydrophobicContact CG1-CD2 4.4Å; V120-F125 HydrophobicContact CG1-CG 4.38Å; V120-A150 HydrophobicContact CG1-CB 3.94Å; V120-Y153 HydrophobicContact CG2-CD1 3.47Å; V120-Y153 VanDerWaalsContact CG2-CD1 3.47Å; V120-Y153 HydrophobicContact CG2-CE1 4.17Å; V120-Y153 HydrophobicContact CG2-CG 3.7Å
121	K	82.7	Confident	78.5	Confident	91 Å²	91	51.2 Å²	51.2	40%	0.396	26%	0.256	S	S	.	.			trans	-76.3	140.1	172.3	-72.9	-178.4	170	-179.6	0	111.2	D123 G124 F125 E146	K121-D123 PolarHBondContact O-N 3.07Å; K121-G124 PolarHBondContact O-N 3.15Å; K121-F125 PolarHBondContact O-N 3.37Å; K121-E146 HydrophobicContact CD-CB 4.28Å; K121-E146 HydrophobicContact CD-CG 3.96Å; K121-E146 WeakPolarHBondContact CD-OE1 3.4Å; K121-E146 WeakPolarHBondContact CD-OE2 3.33Å; K121-E146 IonicContact NZ-OE1 3.86Å; K121-E146 PolarHBondContact NZ-OE1 3.4Å
122	A	79.4	Confident	79.2	Confident	11 Å²	11	47.2 Å²	47.2	9%	0.091	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-40.9	-177.6	0	0	0	0	0	113.4	I82 F85 F87 F125 Q126	I82-A122 HydrophobicContact CG2-CB 4.49Å; F85-A122 HydrophobicContact CB-CB 4.07Å; F85-A122 HydrophobicContact CD2-CB 3.48Å; F85-A122 VanDerWaalsContact CD2-CB 3.48Å; F85-A122 HydrophobicContact CE2-CB 4.04Å; F85-A122 HydrophobicContact CG-CB 3.76Å; F87-A122 HydrophobicContact CE2-CB 4.28Å; F87-A122 HydrophobicContact CZ-CB 4.14Å; A122-F125 PolarHBondContact O-N 3.29Å; A122-Q126 WeakPolarHBondContact O-CB 3.47Å; A122-Q126 PolarHBondContact O-N 3.38Å
123	D	79.3	Confident	79.3	Confident	56 Å²	56	43.7 Å²	43.7	30%	0.299	22%	0.215	S	C	.	.	H	α-helix	trans	-66.5	-48	178.3	-175.1	64.2	0	0	0	112.3	K121 F125 Q126 K127 W142	K121-D123 PolarHBondContact O-N 3.07Å; D123-F125 VanDerWaalsContact C-N 3.29Å; D123-F125 PolarHBondContact O-N 3.33Å; D123-Q126 WeakPolarHBondContact O-CB 3.39Å; D123-Q126 PolarHBondContact O-N 2.96Å; D123-Q126 VanDerWaalsContact O-N 3.15Å; D123-K127 PolarHBondContact O-N 2.86Å; D123-W142 WeakPolarHBondContact OD2-CZ3 3.35Å
124	G	79.9	Confident	79.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.3	-39.4	173.8	0	0	0	0	0	113	K121 L128	K121-G124 PolarHBondContact O-N 3.15Å; G124-L128 WeakPolarHBondContact O-CB 3.34Å; G124-L128 PolarHBondContact O-N 3.05Å; G124-L128 VanDerWaalsContact O-N 3.1Å
125	F	85.4	Confident	78.6	Confident	1 Å²	1	39.1 Å²	39.1	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-69.5	-41.2	173.5	-177.3	-103.9	0	0	0	112.9	I80 I82 F87 F101 V120 K121 A122 D123 K127 L128 L129 L154	I80-F125 HydrophobicContact CB-CE1 4.33Å; I80-F125 HydrophobicContact CD1-CE1 4.08Å; I80-F125 HydrophobicContact CD1-CE2 4.41Å; I80-F125 HydrophobicContact CD1-CZ 3.49Å; I80-F125 VanDerWaalsContact CD1-CZ 3.49Å; I80-F125 HydrophobicContact CG2-CE1 4.01Å; I80-F125 HydrophobicContact CG2-CZ 4.17Å; I82-F125 HydrophobicContact CD1-CB 3.63Å; I82-F125 HydrophobicContact CD1-CD1 3.5Å; I82-F125 VanDerWaalsContact CD1-CD1 3.5Å; I82-F125 HydrophobicContact CD1-CD2 4.37Å; I82-F125 HydrophobicContact CD1-CE1 4.31Å; I82-F125 HydrophobicContact CD1-CG 3.54Å; F87-F125 HydrophobicContact CB-CE1 3.99Å; F87-F125 AromaticContact CD2-CD1 3.69Å; F87-F125 HydrophobicContact CD2-CD1 3.69Å; F87-F125 AromaticContact CD2-CE1 3.9Å; F87-F125 HydrophobicContact CD2-CE1 3.9Å; F87-F125 AromaticContact CE2-CD1 3.91Å; F87-F125 HydrophobicContact CE2-CD1 3.91Å; F87-F125 HydrophobicContact CG-CD1 4.01Å; F87-F125 AromaticContact CG-CE1 3.93Å; F87-F125 HydrophobicContact CG-CE1 3.93Å; F87-F125 HydrophobicContact CZ-CD1 4.41Å; F101-F125 HydrophobicContact CE2-CE2 4.42Å; F101-F125 HydrophobicContact CZ-CE2 4.4Å; V120-F125 HydrophobicContact CG1-CB 3.8Å; V120-F125 HydrophobicContact CG1-CD2 4.4Å; V120-F125 HydrophobicContact CG1-CG 4.38Å; K121-F125 PolarHBondContact O-N 3.37Å; A122-F125 PolarHBondContact O-N 3.29Å; D123-F125 VanDerWaalsContact C-N 3.29Å; D123-F125 PolarHBondContact O-N 3.33Å; F125-K127 VanDerWaalsContact C-N 3.32Å; F125-K127 PolarHBondContact O-N 3.45Å; F125-L128 PolarHBondContact O-N 2.96Å; F125-L129 HydrophobicContact CE1-CB 4.26Å; F125-L129 HydrophobicContact CE1-CD2 3.93Å; F125-L129 HydrophobicContact CZ-CB 4.34Å; F125-L129 HydrophobicContact CZ-CD1 4.48Å; F125-L129 HydrophobicContact CZ-CD2 4.39Å; F125-L129 VanDerWaalsContact O-CB 3.31Å; F125-L129 WeakPolarHBondContact O-CB 3.46Å; F125-L129 PolarHBondContact O-N 3.49Å; F125-L154 HydrophobicContact CD2-CD1 3.55Å; F125-L154 HydrophobicContact CE2-CD1 3.53Å
126	Q	83.2	Confident	78.1	Confident	97 Å²	97	41.2 Å²	41.2	45%	0.453	21%	0.213	S	C	.	.	H	α-helix	trans	-58.8	-44.4	176.8	-178.3	174.3	-16	0	0	111	F87 A122 D123 L129 E130	F87-Q126 HydrophobicContact CE1-CB 3.78Å; F87-Q126 HydrophobicContact CE1-CG 4.09Å; F87-Q126 HydrophobicContact CZ-CB 4.19Å; A122-Q126 WeakPolarHBondContact O-CB 3.47Å; A122-Q126 PolarHBondContact O-N 3.38Å; D123-Q126 WeakPolarHBondContact O-CB 3.39Å; D123-Q126 PolarHBondContact O-N 2.96Å; D123-Q126 VanDerWaalsContact O-N 3.15Å; Q126-L129 PolarHBondContact O-N 2.9Å; Q126-E130 WeakPolarHBondContact O-CB 3.34Å; Q126-E130 PolarHBondContact O-N 3.37Å
127	K	81.9	Confident	78.1	Confident	58 Å²	58	37.2 Å²	37.2	25%	0.252	19%	0.191	S	C	.	.	H	α-helix	trans	-65.5	-40.1	175.9	-70.8	-72.6	153.1	-158.2	0	112.4	D123 F125 E130 F131 L137 I147	D123-K127 PolarHBondContact O-N 2.86Å; F125-K127 VanDerWaalsContact C-N 3.32Å; F125-K127 PolarHBondContact O-N 3.45Å; K127-E130 WeakPolarHBondContact CD-OE2 3.3Å; K127-E130 WeakPolarHBondContact CE-OE2 3.4Å; K127-E130 IonicContact NZ-OE1 3.76Å; K127-E130 IonicContact NZ-OE2 3.86Å; K127-E130 PolarHBondContact NZ-OE2 3.42Å; K127-E130 PolarHBondContact O-N 3.12Å; K127-F131 PolarHBondContact O-N 3.38Å; K127-L137 HydrophobicContact CB-CD1 4.03Å; K127-L137 VanDerWaalsContact O-CD1 3.26Å; K127-L137 WeakPolarHBondContact O-CD1 3.4Å; K127-I147 HydrophobicContact CB-CD1 3.89Å; K127-I147 HydrophobicContact CB-CG1 4.06Å; K127-I147 HydrophobicContact CG-CD1 4.4Å
128	L	81.3	Confident	78	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-39.9	173.6	-174.4	65.2	0	0	0	112.1	G124 F125 F131 I132 A150 A151 L154 V156 V159	G124-L128 WeakPolarHBondContact O-CB 3.34Å; G124-L128 PolarHBondContact O-N 3.05Å; G124-L128 VanDerWaalsContact O-N 3.1Å; F125-L128 PolarHBondContact O-N 2.96Å; L128-F131 HydrophobicContact CD1-CD1 4.32Å; L128-F131 WeakPolarHBondContact O-CB 3.35Å; L128-F131 PolarHBondContact O-N 3.13Å; L128-I132 HydrophobicContact CG-CD1 4.48Å; L128-I132 WeakPolarHBondContact O-CG1 3.5Å; L128-I132 PolarHBondContact O-N 3.32Å; L128-A150 HydrophobicContact CD2-CB 4.32Å; L128-A151 HydrophobicContact CD1-CB 4.35Å; L128-A151 HydrophobicContact CD2-CB 4.38Å; L128-L154 HydrophobicContact CD2-CD1 3.83Å; L128-V156 HydrophobicContact CD2-CG2 4.38Å; L128-V159 HydrophobicContact CD1-CB 4.22Å; L128-V159 HydrophobicContact CD1-CG1 3.98Å; L128-V159 HydrophobicContact CD1-CG2 3.92Å
129	L	82.3	Confident	78.3	Confident	8 Å²	8	32.8 Å²	32.8	4%	0.042	17%	0.165	C	C	.	.	H	α-helix	trans	-71.8	-32.6	177.4	-175	63.5	0	0	0	112.3	R70 F87 A89 L94 F125 Q126 Y133	R70-L129 PolarHBondContact NH1-O 3.33Å; F87-L129 HydrophobicContact CB-CD2 3.86Å; F87-L129 HydrophobicContact CD1-CD2 4.26Å; F87-L129 HydrophobicContact CG-CD2 4.34Å; A89-L129 HydrophobicContact CB-CD1 4.2Å; L94-L129 HydrophobicContact CD2-CD1 4.02Å; F125-L129 HydrophobicContact CE1-CB 4.26Å; F125-L129 HydrophobicContact CE1-CD2 3.93Å; F125-L129 HydrophobicContact CZ-CB 4.34Å; F125-L129 HydrophobicContact CZ-CD1 4.48Å; F125-L129 HydrophobicContact CZ-CD2 4.39Å; F125-L129 VanDerWaalsContact O-CB 3.31Å; F125-L129 WeakPolarHBondContact O-CB 3.46Å; F125-L129 PolarHBondContact O-N 3.49Å; Q126-L129 PolarHBondContact O-N 2.9Å; L129-Y133 HydrophobicContact CD1-CD2 4.21Å; L129-Y133 HydrophobicContact CD1-CE2 3.84Å; L129-Y133 WeakPolarHBondContact O-CD2 3.41Å
130	E	81.3	Confident	78.1	Confident	75 Å²	75	32.2 Å²	32.2	35%	0.35	17%	0.165	S	C	.	.	H	α-helix	trans	-62.6	-45.2	168.9	-171.1	177.8	-177.2	0	0	110.6	Q126 K127 Y133 T134	Q126-E130 WeakPolarHBondContact O-CB 3.34Å; Q126-E130 PolarHBondContact O-N 3.37Å; K127-E130 WeakPolarHBondContact CD-OE2 3.3Å; K127-E130 WeakPolarHBondContact CE-OE2 3.4Å; K127-E130 IonicContact NZ-OE1 3.76Å; K127-E130 IonicContact NZ-OE2 3.86Å; K127-E130 PolarHBondContact NZ-OE2 3.42Å; K127-E130 PolarHBondContact O-N 3.12Å; E130-Y133 PolarHBondContact O-N 3.22Å; E130-T134 HydrophobicContact CG-CG2 4.28Å; E130-T134 WeakPolarHBondContact O-CB 3.42Å; E130-T134 WeakPolarHBondContact O-CG2 3.23Å; E130-T134 PolarHBondContact O-N 3.25Å; E130-T134 PolarHBondContact O-OG1 2.8Å
131	F	81.1	Confident	77.6	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-41.1	176.5	165.4	-107.4	0	0	0	114.2	I51 M53 K127 L128 Y133 G135 L137 V159	I51-F131 HydrophobicContact CB-CE2 4.09Å; I51-F131 HydrophobicContact CG2-CE2 3.61Å; I51-F131 HydrophobicContact CG2-CZ 3.81Å; M53-F131 HydrophobicContact CG-CE2 3.94Å; M53-F131 HydrophobicContact CG-CZ 3.69Å; M53-F131 HydrophobicContact SD-CE1 3.97Å; M53-F131 HydrophobicContact SD-CE2 4.07Å; M53-F131 HydrophobicContact SD-CZ 3.36Å; M53-F131 WeakPolarHBondContact SD-CZ 3.4Å; K127-F131 PolarHBondContact O-N 3.38Å; L128-F131 HydrophobicContact CD1-CD1 4.32Å; L128-F131 WeakPolarHBondContact O-CB 3.35Å; L128-F131 PolarHBondContact O-N 3.13Å; F131-Y133 PolarHBondContact O-N 3.37Å; F131-G135 VanDerWaalsContact O-CA 3.23Å; F131-G135 WeakPolarHBondContact O-CA 3.46Å; F131-G135 PolarHBondContact O-N 3.14Å; F131-L137 HydrophobicContact CB-CB 3.81Å; F131-L137 HydrophobicContact CB-CD1 3.85Å; F131-L137 HydrophobicContact CB-CD2 4.38Å; F131-L137 HydrophobicContact CB-CG 4.22Å; F131-L137 HydrophobicContact CD2-CB 3.58Å; F131-L137 HydrophobicContact CE2-CB 4.3Å; F131-L137 HydrophobicContact CG-CB 3.8Å; F131-L137 HydrophobicContact CG-CD2 4.31Å; F131-L137 HydrophobicContact CG-CG 4.46Å; F131-V159 HydrophobicContact CD1-CG2 3.77Å; F131-V159 HydrophobicContact CE1-CG2 3.24Å; F131-V159 HydrophobicContact CZ-CG2 3.94Å
132	I	79.1	Confident	76.9	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-57.7	-33.2	178.6	-74.6	166.6	0	0	0	111.8	V93 L94 F97 L128	V93-I132 HydrophobicContact CG1-CG2 3.54Å; L94-I132 HydrophobicContact CD2-CD1 4.33Å; F97-I132 HydrophobicContact CB-CD1 4.27Å; F97-I132 HydrophobicContact CB-CG1 4.12Å; F97-I132 HydrophobicContact CB-CG2 4.49Å; F97-I132 HydrophobicContact CD1-CG1 4.07Å; F97-I132 HydrophobicContact CD1-CG2 4.47Å; F97-I132 HydrophobicContact CD2-CG2 3.84Å; F97-I132 HydrophobicContact CE2-CG2 4.1Å; F97-I132 HydrophobicContact CG-CG1 4.06Å; F97-I132 HydrophobicContact CG-CG2 4.02Å; L128-I132 HydrophobicContact CG-CD1 4.48Å; L128-I132 WeakPolarHBondContact O-CG1 3.5Å; L128-I132 PolarHBondContact O-N 3.32Å
133	Y	75.1	Confident	76.7	Confident	3 Å²	3	39 Å²	39	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-97	-34.9	-177.4	-77.8	-99	0	0	0	113.8	L66 N67 R70 H90 V93 L129 E130 F131	L66-Y133 HydrophobicContact CB-CD1 4.39Å; L66-Y133 HydrophobicContact CB-CE1 4.08Å; N67-Y133 HydrophobicContact CB-CD1 4.06Å; R70-Y133 HydrophobicContact CB-CE1 4.49Å; H90-Y133 WeakPolarHBondContact CB-OH 3.48Å; H90-Y133 PolarHBondContact N-OH 3.33Å; H90-Y133 AromaticContact ND1-CE1 3.73Å; H90-Y133 AromaticContact ND1-CZ 3.8Å; H90-Y133 PolarHBondContact ND1-OH 3.17Å; V93-Y133 HydrophobicContact CG1-CE1 4.31Å; V93-Y133 HydrophobicContact CG1-CE2 4.01Å; L129-Y133 HydrophobicContact CD1-CD2 4.21Å; L129-Y133 HydrophobicContact CD1-CE2 3.84Å; L129-Y133 WeakPolarHBondContact O-CD2 3.41Å; E130-Y133 PolarHBondContact O-N 3.22Å; F131-Y133 PolarHBondContact O-N 3.37Å
134	T	74.4	Confident	76.7	Confident	53 Å²	53	36.5 Å²	36.5	33%	0.325	19%	0.186	S	C	.	.	H	α-helix	trans	-91.4	-18.3	-179.3	61.3	0	0	0	0	113.5	E130 T136	E130-T134 HydrophobicContact CG-CG2 4.28Å; E130-T134 WeakPolarHBondContact O-CB 3.42Å; E130-T134 WeakPolarHBondContact O-CG2 3.23Å; E130-T134 PolarHBondContact O-N 3.25Å; E130-T134 PolarHBondContact O-OG1 2.8Å; T134-T136 WeakPolarHBondContact CB-OG1 3.43Å; T134-T136 PolarHBondContact O-N 3.35Å; T134-T136 PolarHBondContact OG1-N 3.35Å; T134-T136 PolarHBondContact OG1-O 2.98Å; T134-T136 PolarHBondContact OG1-OG1 3.4Å; T134-T136 VanDerWaalsContact OG1-OG1 3.06Å
135	G	67.4	Low	76.6	Confident	2 Å²	2	43.2 Å²	43.2	2%	0.021	22%	0.215	C	C	.	.	S	Bend	trans	70.2	5.8	-170.3	0	0	0	0	0	114.7	K52 M53 F131	K52-G135 CarbonylContact C-O 3.59Å; K52-G135 VanDerWaalsContact CA-O 3.3Å; K52-G135 WeakPolarHBondContact CA-O 3.37Å; M53-G135 PolarHBondContact N-O 3.08Å; F131-G135 VanDerWaalsContact O-CA 3.23Å; F131-G135 WeakPolarHBondContact O-CA 3.46Å; F131-G135 PolarHBondContact O-N 3.14Å
136	T	70.4	Confident	76.5	Confident	51 Å²	51	45.3 Å²	45.3	31%	0.313	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.2	-175.8	46.9	0	0	0	0	112.5	I51 K52 T134	I51-T136 CarbonylContact O-C 3.19Å; I51-T136 VanDerWaalsContact O-CA 3.26Å; I51-T136 WeakPolarHBondContact O-CA 3.32Å; K52-T136 HydrophobicContact CD-CG2 4.13Å; K52-T136 HydrophobicContact CG-CG2 4.14Å; T134-T136 WeakPolarHBondContact CB-OG1 3.43Å; T134-T136 PolarHBondContact O-N 3.35Å; T134-T136 PolarHBondContact OG1-N 3.35Å; T134-T136 PolarHBondContact OG1-O 2.98Å; T134-T136 PolarHBondContact OG1-OG1 3.4Å; T134-T136 VanDerWaalsContact OG1-OG1 3.06Å
137	L	77.3	Confident	76.4	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	119	176.3	-167.8	59.4	0	0	0	111.2	D50 I51 K127 F131 L139 I147 V159	D50-L137 CarbonylContact C-O 3.57Å; D50-L137 VanDerWaalsContact CA-O 3.32Å; D50-L137 WeakPolarHBondContact CA-O 3.4Å; I51-L137 HydrophobicContact CB-CB 4.01Å; I51-L137 HydrophobicContact CD1-CB 4.4Å; I51-L137 HydrophobicContact CD1-CD2 3.94Å; I51-L137 HydrophobicContact CG1-CB 4.35Å; I51-L137 PolarHBondContact N-O 3.49Å; I51-L137 PolarHBondContact O-N 3.23Å; K127-L137 HydrophobicContact CB-CD1 4.03Å; K127-L137 VanDerWaalsContact O-CD1 3.26Å; K127-L137 WeakPolarHBondContact O-CD1 3.4Å; F131-L137 HydrophobicContact CB-CB 3.81Å; F131-L137 HydrophobicContact CB-CD1 3.85Å; F131-L137 HydrophobicContact CB-CD2 4.38Å; F131-L137 HydrophobicContact CB-CG 4.22Å; F131-L137 HydrophobicContact CD2-CB 3.58Å; F131-L137 HydrophobicContact CE2-CB 4.3Å; F131-L137 HydrophobicContact CG-CB 3.8Å; F131-L137 HydrophobicContact CG-CD2 4.31Å; F131-L137 HydrophobicContact CG-CG 4.46Å; L137-L139 HydrophobicContact CD2-CD2 4.02Å; L137-L139 HydrophobicContact CG-CD2 4.06Å; L137-L139 HydrophobicContact CG-CG 4.39Å; L137-I147 HydrophobicContact CD1-CD1 4.23Å; L137-I147 HydrophobicContact CD2-CG2 3.67Å; L137-I147 HydrophobicContact CG-CG2 4.5Å; L137-V159 HydrophobicContact CD2-CG1 3.72Å; L137-V159 HydrophobicContact CD2-CG2 4.49Å
138	N	74.6	Confident	76.5	Confident	86 Å²	86	39.4 Å²	39.4	46%	0.46	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	112.9	179.2	-62	3.7	0	0	0	109.1	D50 N143	D50-N138 VanDerWaalsContact CG-OD1 3.3Å; D50-N138 PolarHBondContact OD1-OD1 3.43Å; N138-N143 PolarHBondContact O-ND2 3.24Å; N138-N143 VanDerWaalsContact O-ND2 3.14Å
139	L	75.4	Confident	76.6	Confident	2 Å²	2	43 Å²	43	1%	0.01	22%	0.215	C	C	.	.			trans	-103.9	111.8	-177.1	-68.2	-179.3	0	0	0	111.5	I51 L137 V144 I147 K166	I51-L139 HydrophobicContact CD1-CD1 3.82Å; I51-L139 HydrophobicContact CD1-CG 4.5Å; I51-L139 HydrophobicContact CG1-CD1 4.05Å; L137-L139 HydrophobicContact CD2-CD2 4.02Å; L137-L139 HydrophobicContact CG-CD2 4.06Å; L137-L139 HydrophobicContact CG-CG 4.39Å; L139-V144 HydrophobicContact CD1-CG2 4.47Å; L139-V144 HydrophobicContact CD2-CG2 4.36Å; L139-I147 HydrophobicContact CD2-CB 4.22Å; L139-I147 HydrophobicContact CD2-CD1 3.72Å; L139-I147 HydrophobicContact CD2-CG2 3.88Å; L139-K166 HydrophobicContact CB-CD 4.18Å; L139-K166 HydrophobicContact CB-CG 4.4Å; L139-K166 HydrophobicContact CD1-CG 3.95Å; L139-K166 PolarHBondContact O-NZ 3.11Å
140	D	70.1	Confident	76.7	Confident	74 Å²	74	42.6 Å²	42.6	40%	0.396	21%	0.213	S	C	.	.			trans	-108.7	166.1	177.4	-66.7	-30.3	0	0	0	111.5	W142 N143 V144	D140-W142 HydrophobicContact CB-CG 4.31Å; D140-W142 PolarHBondContact O-N 3Å; D140-W142 VanDerWaalsContact O-N 3.12Å; D140-W142 PolarHBondContact OD2-NE1 3.15Å; D140-N143 PolarHBondContact N-OD1 3.1Å; D140-N143 PolarHBondContact O-N 3.49Å; D140-N143 PolarHBondContact O-OD1 2.87Å; D140-V144 VanDerWaalsContact O-CB 3.28Å; D140-V144 WeakPolarHBondContact O-CB 3.49Å; D140-V144 WeakPolarHBondContact O-CG1 3.21Å; D140-V144 PolarHBondContact O-N 3.3Å; D140-V144 VanDerWaalsContact O-N 3.08Å
141	S	67.6	Low	76.7	Confident	83 Å²	83	39 Å²	39	58%	0.58	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-27.9	177.5	-169.3	0	0	0	0	113.5
142	W	67.5	Low	76.9	Confident	157 Å²	157	42.9 Å²	42.9	60%	0.595	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-41.8	-178.1	69.6	-86.9	0	0	0	113.3	D123 D140	D123-W142 WeakPolarHBondContact OD2-CZ3 3.35Å; D140-W142 HydrophobicContact CB-CG 4.31Å; D140-W142 PolarHBondContact O-N 3Å; D140-W142 VanDerWaalsContact O-N 3.12Å; D140-W142 PolarHBondContact OD2-NE1 3.15Å
143	N	76.6	Confident	77	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.021	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-20.8	-173.5	69.4	14	0	0	0	114.3	N138 D140 K145 E146 I147	N138-N143 PolarHBondContact O-ND2 3.24Å; N138-N143 VanDerWaalsContact O-ND2 3.14Å; D140-N143 PolarHBondContact N-OD1 3.1Å; D140-N143 PolarHBondContact O-N 3.49Å; D140-N143 PolarHBondContact O-OD1 2.87Å; N143-K145 PolarHBondContact O-N 3.16Å; N143-K145 VanDerWaalsContact O-N 3.13Å; N143-E146 PolarHBondContact O-N 3.22Å; N143-I147 HydrophobicContact CB-CD1 3.87Å; N143-I147 WeakPolarHBondContact O-CG1 3.43Å; N143-I147 PolarHBondContact O-N 3.06Å
144	V	78.1	Confident	77.2	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-59.1	-32.9	-171.2	66.3	0	0	0	0	113.4	L139 D140 H148 C163 K166 M167 F170	L139-V144 HydrophobicContact CD1-CG2 4.47Å; L139-V144 HydrophobicContact CD2-CG2 4.36Å; D140-V144 VanDerWaalsContact O-CB 3.28Å; D140-V144 WeakPolarHBondContact O-CB 3.49Å; D140-V144 WeakPolarHBondContact O-CG1 3.21Å; D140-V144 PolarHBondContact O-N 3.3Å; D140-V144 VanDerWaalsContact O-N 3.08Å; V144-H148 WeakPolarHBondContact O-CB 3.47Å; V144-H148 PolarHBondContact O-N 2.77Å; V144-C163 HydrophobicContact CG2-CB 4.03Å; V144-K166 HydrophobicContact CG2-CB 4Å; V144-M167 HydrophobicContact CB-CG 4.44Å; V144-M167 HydrophobicContact CG1-CG 3.83Å; V144-M167 HydrophobicContact CG2-CG 3.74Å; V144-M167 HydrophobicContact CG2-SD 4.29Å; V144-F170 HydrophobicContact CG1-CD2 4.29Å; V144-F170 HydrophobicContact CG1-CE2 4.3Å
145	K	79.4	Confident	77.4	Confident	141 Å²	141	49.3 Å²	49.3	61%	0.613	24%	0.239	S	C	*	.	H	α-helix	trans	-67.7	-41.1	177.3	-70.7	-178.5	177.8	179.1	0	112.3	N143 Q149 M167	N143-K145 PolarHBondContact O-N 3.16Å; N143-K145 VanDerWaalsContact O-N 3.13Å; K145-Q149 WeakPolarHBondContact O-CB 3.45Å; K145-Q149 PolarHBondContact O-N 2.89Å; K145-M167 HydrophobicContact CG-CE 3.95Å; K145-M167 HydrophobicContact CG-SD 4.48Å
146	E	82.1	Confident	77.9	Confident	46 Å²	46	49.7 Å²	49.7	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-77.1	-39.2	-176	-47.1	-157.5	159.7	0	0	111	K121 N143 Q149 A150	K121-E146 HydrophobicContact CD-CB 4.28Å; K121-E146 HydrophobicContact CD-CG 3.96Å; K121-E146 WeakPolarHBondContact CD-OE1 3.4Å; K121-E146 WeakPolarHBondContact CD-OE2 3.33Å; K121-E146 IonicContact NZ-OE1 3.86Å; K121-E146 PolarHBondContact NZ-OE1 3.4Å; N143-E146 PolarHBondContact O-N 3.22Å; E146-Q149 PolarHBondContact O-N 3.23Å; E146-A150 WeakPolarHBondContact O-CB 3.26Å; E146-A150 PolarHBondContact O-N 2.89Å
147	I	81.5	Confident	77.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-42	172.4	-65.1	168.2	0	0	0	110.7	K127 L137 L139 N143 A150 A151 V159	K127-I147 HydrophobicContact CB-CD1 3.89Å; K127-I147 HydrophobicContact CB-CG1 4.06Å; K127-I147 HydrophobicContact CG-CD1 4.4Å; L137-I147 HydrophobicContact CD1-CD1 4.23Å; L137-I147 HydrophobicContact CD2-CG2 3.67Å; L137-I147 HydrophobicContact CG-CG2 4.5Å; L139-I147 HydrophobicContact CD2-CB 4.22Å; L139-I147 HydrophobicContact CD2-CD1 3.72Å; L139-I147 HydrophobicContact CD2-CG2 3.88Å; N143-I147 HydrophobicContact CB-CD1 3.87Å; N143-I147 WeakPolarHBondContact O-CG1 3.43Å; N143-I147 PolarHBondContact O-N 3.06Å; I147-A150 PolarHBondContact O-N 2.94Å; I147-A151 VanDerWaalsContact O-CB 3.25Å; I147-A151 WeakPolarHBondContact O-CB 3.24Å; I147-A151 PolarHBondContact O-N 3.17Å; I147-V159 HydrophobicContact CG2-CG1 4.03Å
148	H	84.2	Confident	77.7	Confident	31 Å²	31	58.4 Å²	58.4	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-50.5	172.8	177	-74	0	0	0	111.1	V144 A150 A151 D152 C163 K164 M167	V144-H148 WeakPolarHBondContact O-CB 3.47Å; V144-H148 PolarHBondContact O-N 2.77Å; H148-A150 PolarHBondContact O-N 2.78Å; H148-A151 PolarHBondContact O-N 3.17Å; H148-D152 VanDerWaalsContact O-CB 3.31Å; H148-D152 WeakPolarHBondContact O-CB 3.44Å; H148-D152 PolarHBondContact O-N 3.08Å; H148-C163 HydrophobicContact CB-CB 3.82Å; H148-K164 WeakPolarHBondContact NE2-CE 3.36Å; H148-K164 VanDerWaalsContact NE2-CG 3.29Å; H148-K164 WeakPolarHBondContact NE2-CG 3.29Å; H148-M167 HydrophobicContact CB-SD 4.02Å
149	Q	83.8	Confident	77.7	Confident	74 Å²	74	54.3 Å²	54.3	35%	0.346	26%	0.256	S	S	.	.	H	α-helix	trans	-59.5	-45.6	-179	-168.1	-175.6	-7.7	0	0	111.6	S118 Q119 K145 E146 D152 Y153	S118-Q149 PolarHBondContact O-NE2 3.15Å; Q119-Q149 WeakPolarHBondContact O-CG 3.45Å; Q119-Q149 PolarHBondContact O-NE2 3.12Å; K145-Q149 WeakPolarHBondContact O-CB 3.45Å; K145-Q149 PolarHBondContact O-N 2.89Å; E146-Q149 PolarHBondContact O-N 3.23Å; Q149-D152 PolarHBondContact O-N 3.24Å; Q149-Y153 PolarHBondContact O-N 3.32Å; Q149-Y153 VanDerWaalsContact O-N 3.12Å
150	A	83.3	Confident	77.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-43.6	175.5	0	0	0	0	0	112.5	V120 L128 E146 I147 H148 L154	V120-A150 HydrophobicContact CG1-CB 3.94Å; L128-A150 HydrophobicContact CD2-CB 4.32Å; E146-A150 WeakPolarHBondContact O-CB 3.26Å; E146-A150 PolarHBondContact O-N 2.89Å; I147-A150 PolarHBondContact O-N 2.94Å; H148-A150 PolarHBondContact O-N 2.78Å; A150-L154 VanDerWaalsContact O-CB 3.3Å; A150-L154 WeakPolarHBondContact O-CB 3.5Å; A150-L154 VanDerWaalsContact O-CG 3.26Å; A150-L154 WeakPolarHBondContact O-CG 3.46Å; A150-L154 PolarHBondContact O-N 3.49Å
151	A	82.5	Confident	77.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-69.7	-34.7	-179.9	0	0	0	0	0	113.2	L128 I147 H148 K155 V156 V159 V160	L128-A151 HydrophobicContact CD1-CB 4.35Å; L128-A151 HydrophobicContact CD2-CB 4.38Å; I147-A151 VanDerWaalsContact O-CB 3.25Å; I147-A151 WeakPolarHBondContact O-CB 3.24Å; I147-A151 PolarHBondContact O-N 3.17Å; H148-A151 PolarHBondContact O-N 3.17Å; A151-K155 PolarHBondContact O-N 3.04Å; A151-V156 HydrophobicContact CB-CB 4.3Å; A151-V156 PolarHBondContact O-N 3.21Å; A151-V159 HydrophobicContact CB-CB 3.88Å; A151-V159 HydrophobicContact CB-CG1 3.69Å; A151-V160 HydrophobicContact CB-CG2 3.73Å; A151-V160 WeakPolarHBondContact O-CG2 3.43Å
152	D	83.6	Confident	78	Confident	82 Å²	82	53.5 Å²	53.5	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-70.9	-45.8	179.6	-155.9	63.5	0	0	0	110	H148 Q149 L154 K155 V160 K164	H148-D152 VanDerWaalsContact O-CB 3.31Å; H148-D152 WeakPolarHBondContact O-CB 3.44Å; H148-D152 PolarHBondContact O-N 3.08Å; Q149-D152 PolarHBondContact O-N 3.24Å; D152-L154 PolarHBondContact O-N 3.34Å; D152-K155 PolarHBondContact O-N 2.86Å; D152-V160 HydrophobicContact CB-CG2 4.04Å; D152-V160 WeakPolarHBondContact OD1-CG1 3.43Å; D152-K164 IonicContact OD1-NZ 3.7Å
153	Y	82.1	Confident	78.5	Confident	80 Å²	80	46 Å²	46	31%	0.314	22%	0.216	S	C	.	.	H	α-helix	trans	-60.4	-43.4	173.6	-174.9	-89	0	0	0	112.5	Y100 L115 Q119 V120 Q149 K155	Y100-Y153 HydrophobicContact CE1-CE1 4.25Å; Y100-Y153 AromaticContact CE2-CE1 3.84Å; Y100-Y153 HydrophobicContact CE2-CE1 3.84Å; Y100-Y153 AromaticContact CZ-CE1 3.64Å; Y100-Y153 PolarHBondContact OH-OH 3.29Å; L115-Y153 HydrophobicContact CD2-CE1 4.23Å; Q119-Y153 HydrophobicContact CB-CD2 3.71Å; Q119-Y153 HydrophobicContact CB-CE2 3.79Å; Q119-Y153 HydrophobicContact CB-CG 4.38Å; Q119-Y153 HydrophobicContact CG-CD2 4.25Å; Q119-Y153 HydrophobicContact CG-CE2 3.99Å; V120-Y153 HydrophobicContact CG2-CD1 3.47Å; V120-Y153 VanDerWaalsContact CG2-CD1 3.47Å; V120-Y153 HydrophobicContact CG2-CE1 4.17Å; V120-Y153 HydrophobicContact CG2-CG 3.7Å; Q149-Y153 PolarHBondContact O-N 3.32Å; Q149-Y153 VanDerWaalsContact O-N 3.12Å; Y153-K155 VanDerWaalsContact C-N 3.26Å; Y153-K155 PolarHBondContact O-N 3.14Å
154	L	79.3	Confident	78.4	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.016	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	5.4	-179.8	-63.5	172.4	0	0	0	113.9	S98 Y100 F101 L115 F125 L128 A150 D152 V156	S98-L154 WeakPolarHBondContact CB-O 3.33Å; S98-L154 PolarHBondContact OG-O 3.16Å; Y100-L154 HydrophobicContact CD1-CD2 3.51Å; Y100-L154 HydrophobicContact CE1-CD2 3.79Å; Y100-L154 HydrophobicContact CG-CD2 4.2Å; F101-L154 HydrophobicContact CD2-CD2 4.47Å; F101-L154 HydrophobicContact CE2-CD1 4.11Å; F101-L154 HydrophobicContact CE2-CD2 3.69Å; F101-L154 HydrophobicContact CE2-CG 4.41Å; F101-L154 HydrophobicContact CZ-CD2 3.78Å; L115-L154 HydrophobicContact CD1-CD2 4.26Å; L115-L154 HydrophobicContact CD2-CD2 4.42Å; F125-L154 HydrophobicContact CD2-CD1 3.55Å; F125-L154 HydrophobicContact CE2-CD1 3.53Å; L128-L154 HydrophobicContact CD2-CD1 3.83Å; A150-L154 VanDerWaalsContact O-CB 3.3Å; A150-L154 WeakPolarHBondContact O-CB 3.5Å; A150-L154 VanDerWaalsContact O-CG 3.26Å; A150-L154 WeakPolarHBondContact O-CG 3.46Å; A150-L154 PolarHBondContact O-N 3.49Å; D152-L154 PolarHBondContact O-N 3.34Å; L154-V156 HydrophobicContact CB-CG2 4.1Å; L154-V156 PolarHBondContact O-N 3.14Å
155	K	79.2	Confident	78.1	Confident	113 Å²	113	54.7 Å²	54.7	49%	0.491	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	45.1	179.5	-60.7	179.2	159.9	-166.5	0	114.5	E99 A151 D152 Y153 E157	E99-K155 HydrophobicContact CB-CB 4.39Å; E99-K155 HydrophobicContact CB-CD 4.24Å; E99-K155 WeakPolarHBondContact OE2-CD 3.45Å; E99-K155 IonicContact OE2-NZ 2.96Å; E99-K155 PolarHBondContact OE2-NZ 3.48Å; A151-K155 PolarHBondContact O-N 3.04Å; D152-K155 PolarHBondContact O-N 2.86Å; Y153-K155 VanDerWaalsContact C-N 3.26Å; Y153-K155 PolarHBondContact O-N 3.14Å; K155-E157 PolarHBondContact O-N 2.75Å
156	V	78.4	Confident	77.8	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.055	23%	0.234	C	C	.	.			trans	-95.6	74.3	176.5	-170.1	0	0	0	0	109.2	L128 A151 L154 E158 V159 V160	L128-V156 HydrophobicContact CD2-CG2 4.38Å; A151-V156 HydrophobicContact CB-CB 4.3Å; A151-V156 PolarHBondContact O-N 3.21Å; L154-V156 HydrophobicContact CB-CG2 4.1Å; L154-V156 PolarHBondContact O-N 3.14Å; V156-E158 VanDerWaalsContact C-N 3.26Å; V156-E158 PolarHBondContact O-N 3.19Å; V156-E158 VanDerWaalsContact O-N 3.1Å; V156-V159 HydrophobicContact CB-CB 4.49Å; V156-V159 HydrophobicContact CG1-CB 4.07Å; V156-V159 HydrophobicContact CG1-CG2 3.73Å; V156-V159 PolarHBondContact O-N 3.21Å; V156-V160 WeakPolarHBondContact O-CG2 3.48Å; V156-V160 PolarHBondContact O-N 3.38Å
157	E	70.7	Confident	77.3	Confident	157 Å²	157	50 Å²	50	73%	0.734	24%	0.237	S	C	*	.	H	α-helix	trans	-53.3	-36.4	-167.9	-62.1	-168.8	154.9	0	0	114.5	K155 V159 V160 T161	K155-E157 PolarHBondContact O-N 2.75Å; E157-V159 VanDerWaalsContact C-N 3.32Å; E157-V159 PolarHBondContact O-N 2.84Å; E157-V160 PolarHBondContact O-N 3.46Å; E157-T161 WeakPolarHBondContact O-CB 3.49Å; E157-T161 WeakPolarHBondContact O-CG2 3.46Å; E157-T161 PolarHBondContact O-N 2.84Å; E157-T161 PolarHBondContact O-OG1 3.1Å
158	E	71.3	Confident	76.6	Confident	80 Å²	80	56.4 Å²	56.4	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-65.5	-33.9	178.7	-173.6	175.3	174.1	0	0	112.5	M53 V156 T161 K162	M53-E158 WeakPolarHBondContact CE-OE2 3.44Å; V156-E158 VanDerWaalsContact C-N 3.26Å; V156-E158 PolarHBondContact O-N 3.19Å; V156-E158 VanDerWaalsContact O-N 3.1Å; E158-T161 PolarHBondContact O-OG1 3.4Å; E158-K162 HydrophobicContact CG-CD 4.34Å; E158-K162 WeakPolarHBondContact O-CD 3.47Å; E158-K162 VanDerWaalsContact O-CG 3.26Å; E158-K162 WeakPolarHBondContact O-CG 3.5Å; E158-K162 IonicContact OE1-NZ 3.96Å; E158-K162 PolarHBondContact OE1-NZ 2.82Å
159	V	74.4	Confident	75.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-80.5	-42.2	176.8	178.7	0	0	0	0	110.3	I51 L128 F131 L137 I147 A151 V156 E157 T161 K162 C163	I51-V159 HydrophobicContact CD1-CG1 4.35Å; L128-V159 HydrophobicContact CD1-CB 4.22Å; L128-V159 HydrophobicContact CD1-CG1 3.98Å; L128-V159 HydrophobicContact CD1-CG2 3.92Å; F131-V159 HydrophobicContact CD1-CG2 3.77Å; F131-V159 HydrophobicContact CE1-CG2 3.24Å; F131-V159 HydrophobicContact CZ-CG2 3.94Å; L137-V159 HydrophobicContact CD2-CG1 3.72Å; L137-V159 HydrophobicContact CD2-CG2 4.49Å; I147-V159 HydrophobicContact CG2-CG1 4.03Å; A151-V159 HydrophobicContact CB-CB 3.88Å; A151-V159 HydrophobicContact CB-CG1 3.69Å; V156-V159 HydrophobicContact CB-CB 4.49Å; V156-V159 HydrophobicContact CG1-CB 4.07Å; V156-V159 HydrophobicContact CG1-CG2 3.73Å; V156-V159 PolarHBondContact O-N 3.21Å; E157-V159 VanDerWaalsContact C-N 3.32Å; E157-V159 PolarHBondContact O-N 2.84Å; V159-T161 PolarHBondContact O-N 3.13Å; V159-K162 PolarHBondContact O-N 2.98Å; V159-C163 WeakPolarHBondContact O-CB 3.06Å; V159-C163 PolarHBondContact O-N 2.83Å; V159-C163 PolarHBondContact O-SG 3.18Å
160	V	77.5	Confident	74.8	Confident	10 Å²	10	59.5 Å²	59.5	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-55.4	-52.1	176.9	174.6	0	0	0	0	111.1	A151 D152 V156 E157 K162 C163 K164	A151-V160 HydrophobicContact CB-CG2 3.73Å; A151-V160 WeakPolarHBondContact O-CG2 3.43Å; D152-V160 HydrophobicContact CB-CG2 4.04Å; D152-V160 WeakPolarHBondContact OD1-CG1 3.43Å; V156-V160 WeakPolarHBondContact O-CG2 3.48Å; V156-V160 PolarHBondContact O-N 3.38Å; E157-V160 PolarHBondContact O-N 3.46Å; V160-K162 PolarHBondContact O-N 3.22Å; V160-C163 PolarHBondContact O-N 2.9Å; V160-K164 HydrophobicContact CG1-CD 4.04Å; V160-K164 VanDerWaalsContact CG1-NZ 3.34Å; V160-K164 WeakPolarHBondContact O-CG 3.18Å; V160-K164 PolarHBondContact O-N 3.05Å
161	T	70.2	Confident	73.4	Confident	68 Å²	68	62.4 Å²	62.4	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-61.2	-42.8	-179	48.4	0	0	0	0	112.4	E157 E158 V159 K164 I165	E157-T161 WeakPolarHBondContact O-CB 3.49Å; E157-T161 WeakPolarHBondContact O-CG2 3.46Å; E157-T161 PolarHBondContact O-N 2.84Å; E157-T161 PolarHBondContact O-OG1 3.1Å; E158-T161 PolarHBondContact O-OG1 3.4Å; V159-T161 PolarHBondContact O-N 3.13Å; T161-K164 PolarHBondContact O-N 3.16Å; T161-I165 WeakPolarHBondContact O-CD1 3.34Å; T161-I165 WeakPolarHBondContact O-CG1 3.41Å; T161-I165 PolarHBondContact O-N 2.86Å
162	K	72.3	Confident	71.6	Confident	65 Å²	65	70.5 Å²	70.5	28%	0.283	34%	0.344	S	S	.	.	H	α-helix	trans	-70	-34.1	177.7	-68.8	175.5	-170.7	173.7	0	112.8	I51 E158 V159 V160 K166	I51-K162 HydrophobicContact CB-CD 4.26Å; I51-K162 HydrophobicContact CD1-CB 3.56Å; I51-K162 HydrophobicContact CD1-CD 3.78Å; I51-K162 HydrophobicContact CD1-CG 4.31Å; I51-K162 HydrophobicContact CG1-CB 4.06Å; I51-K162 HydrophobicContact CG1-CD 3.82Å; I51-K162 HydrophobicContact CG2-CD 3.56Å; E158-K162 HydrophobicContact CG-CD 4.34Å; E158-K162 WeakPolarHBondContact O-CD 3.47Å; E158-K162 VanDerWaalsContact O-CG 3.26Å; E158-K162 WeakPolarHBondContact O-CG 3.5Å; E158-K162 IonicContact OE1-NZ 3.96Å; E158-K162 PolarHBondContact OE1-NZ 2.82Å; V159-K162 PolarHBondContact O-N 2.98Å; V160-K162 PolarHBondContact O-N 3.22Å; K162-K166 WeakPolarHBondContact O-CG 3.3Å; K162-K166 PolarHBondContact O-N 3.27Å
163	C	77.5	Confident	70	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-68.6	-40.5	172.8	-65.8	0	0	0	0	112.2	V144 H148 V159 V160 I165 K166 M167	V144-C163 HydrophobicContact CG2-CB 4.03Å; H148-C163 HydrophobicContact CB-CB 3.82Å; V159-C163 WeakPolarHBondContact O-CB 3.06Å; V159-C163 PolarHBondContact O-N 2.83Å; V159-C163 PolarHBondContact O-SG 3.18Å; V160-C163 PolarHBondContact O-N 2.9Å; C163-I165 PolarHBondContact O-N 3.46Å; C163-K166 WeakPolarHBondContact O-CB 3.47Å; C163-K166 PolarHBondContact O-N 3.38Å; C163-M167 VanDerWaalsContact O-CG 3.3Å; C163-M167 WeakPolarHBondContact O-CG 3.5Å; C163-M167 PolarHBondContact O-N 3.34Å
164	K	75.6	Confident	68.1	Low	91 Å²	91	72.5 Å²	72.5	40%	0.396	37%	0.369	S	S	.	.	H	α-helix	trans	-58	-48.9	175.3	-72.6	175.4	-175.3	170.6	0	111.4	H148 D152 V160 T161 K166 M167 E168	H148-K164 WeakPolarHBondContact NE2-CE 3.36Å; H148-K164 VanDerWaalsContact NE2-CG 3.29Å; H148-K164 WeakPolarHBondContact NE2-CG 3.29Å; D152-K164 IonicContact OD1-NZ 3.7Å; V160-K164 HydrophobicContact CG1-CD 4.04Å; V160-K164 VanDerWaalsContact CG1-NZ 3.34Å; V160-K164 WeakPolarHBondContact O-CG 3.18Å; V160-K164 PolarHBondContact O-N 3.05Å; T161-K164 PolarHBondContact O-N 3.16Å; K164-K166 VanDerWaalsContact C-N 3.34Å; K164-K166 PolarHBondContact O-N 3.14Å; K164-M167 PolarHBondContact O-N 3.35Å; K164-M167 VanDerWaalsContact O-N 3.14Å; K164-E168 WeakPolarHBondContact O-CG 3.45Å; K164-E168 PolarHBondContact O-N 3.05Å
165	I	71	Confident	66.1	Low	99 Å²	99	77.6 Å²	77.6	51%	0.508	40%	0.397	S	S	.	.	H	α-helix	trans	-57.1	-45.6	176.2	-65.2	163.1	0	0	0	111.5	T161 C163 E168 D169	T161-I165 WeakPolarHBondContact O-CD1 3.34Å; T161-I165 WeakPolarHBondContact O-CG1 3.41Å; T161-I165 PolarHBondContact O-N 2.86Å; C163-I165 PolarHBondContact O-N 3.46Å; I165-E168 PolarHBondContact O-N 3.12Å; I165-D169 PolarHBondContact O-N 3.36Å
166	K	72.9	Confident	64.4	Low	27 Å²	27	78 Å²	78	12%	0.117	41%	0.411	C	S	.	.	H	α-helix	trans	-61.5	-42	176	-84.9	-92.2	-163.5	148.4	0	113	S49 L139 V144 K162 C163 K164 E168 D169 F170	S49-K166 WeakPolarHBondContact O-CE 3.28Å; S49-K166 PolarHBondContact O-NZ 2.79Å; S49-K166 PolarHBondContact OG-NZ 2.84Å; L139-K166 HydrophobicContact CB-CD 4.18Å; L139-K166 HydrophobicContact CB-CG 4.4Å; L139-K166 HydrophobicContact CD1-CG 3.95Å; L139-K166 PolarHBondContact O-NZ 3.11Å; V144-K166 HydrophobicContact CG2-CB 4Å; K162-K166 WeakPolarHBondContact O-CG 3.3Å; K162-K166 PolarHBondContact O-N 3.27Å; C163-K166 WeakPolarHBondContact O-CB 3.47Å; C163-K166 PolarHBondContact O-N 3.38Å; K164-K166 VanDerWaalsContact C-N 3.34Å; K164-K166 PolarHBondContact O-N 3.14Å; K166-E168 VanDerWaalsContact C-N 3.35Å; K166-D169 PolarHBondContact O-N 3.3Å; K166-F170 HydrophobicContact CB-CE2 4.47Å; K166-F170 HydrophobicContact CD-CE2 4.19Å; K166-F170 WeakPolarHBondContact O-CD2 3.4Å; K166-F170 WeakPolarHBondContact O-CG 3.43Å; K166-F170 PolarHBondContact O-N 2.96Å
167	M	73	Confident	62.2	Low	60 Å²	60	82.7 Å²	82.7	30%	0.296	44%	0.444	S	S	.	.	H	α-helix	trans	-67.3	-36.2	179.3	-72	172.6	62.1	0	0	111.7	V144 K145 H148 C163 K164 F170 A171	V144-M167 HydrophobicContact CB-CG 4.44Å; V144-M167 HydrophobicContact CG1-CG 3.83Å; V144-M167 HydrophobicContact CG2-CG 3.74Å; V144-M167 HydrophobicContact CG2-SD 4.29Å; K145-M167 HydrophobicContact CG-CE 3.95Å; K145-M167 HydrophobicContact CG-SD 4.48Å; H148-M167 HydrophobicContact CB-SD 4.02Å; C163-M167 VanDerWaalsContact O-CG 3.3Å; C163-M167 WeakPolarHBondContact O-CG 3.5Å; C163-M167 PolarHBondContact O-N 3.34Å; K164-M167 PolarHBondContact O-N 3.35Å; K164-M167 VanDerWaalsContact O-N 3.14Å; M167-F170 PolarHBondContact O-N 3.27Å; M167-A171 WeakPolarHBondContact O-CB 3.13Å; M167-A171 PolarHBondContact O-N 3.01Å
168	E	66.3	Low	60.4	Low	136 Å²	136	79.6 Å²	79.6	64%	0.636	44%	0.44	S	S	*	.	H	α-helix	trans	-66.1	-43.4	171.5	-70.2	172.4	-169	0	0	112	K164 I165 K166 F170 A171 F172	K164-E168 WeakPolarHBondContact O-CG 3.45Å; K164-E168 PolarHBondContact O-N 3.05Å; I165-E168 PolarHBondContact O-N 3.12Å; K166-E168 VanDerWaalsContact C-N 3.35Å; E168-F170 VanDerWaalsContact C-N 3.31Å; E168-F170 PolarHBondContact O-N 3.44Å; E168-A171 PolarHBondContact O-N 3.47Å; E168-F172 WeakPolarHBondContact O-CB 3.26Å; E168-F172 PolarHBondContact O-N 3.49Å
169	D	62.9	Low	59.1	Low	104 Å²	104	82.6 Å²	82.6	56%	0.556	46%	0.464	S	S	*	.	H	α-helix	trans	-58.1	-40.2	173.9	-87.1	-28.7	0	0	0	111.9	I165 K166 I173	I165-D169 PolarHBondContact O-N 3.36Å; K166-D169 PolarHBondContact O-N 3.3Å; D169-I173 WeakPolarHBondContact O-CG1 3.39Å
170	F	65.9	Low	57	Low	65 Å²	65	91.6 Å²	91.6	29%	0.285	51%	0.506	S	S	.	.	H	α-helix	trans	-73.9	-39.5	175.7	-68.3	-54.8	0	0	0	113	V144 K166 M167 E168 F172 I173 A174	V144-F170 HydrophobicContact CG1-CD2 4.29Å; V144-F170 HydrophobicContact CG1-CE2 4.3Å; K166-F170 HydrophobicContact CB-CE2 4.47Å; K166-F170 HydrophobicContact CD-CE2 4.19Å; K166-F170 WeakPolarHBondContact O-CD2 3.4Å; K166-F170 WeakPolarHBondContact O-CG 3.43Å; K166-F170 PolarHBondContact O-N 2.96Å; M167-F170 PolarHBondContact O-N 3.27Å; E168-F170 VanDerWaalsContact C-N 3.31Å; E168-F170 PolarHBondContact O-N 3.44Å; F170-F172 VanDerWaalsContact C-N 3.31Å; F170-F172 PolarHBondContact O-N 2.92Å; F170-I173 WeakPolarHBondContact O-CB 3.49Å; F170-I173 PolarHBondContact O-N 2.95Å; F170-I173 VanDerWaalsContact O-N 3.12Å; F170-A174 PolarHBondContact O-N 3.23Å
171	A	54.2	Low	55.5	Low	62 Å²	62	99.4 Å²	99.4	51%	0.512	55%	0.545	S	S	.	.	H	α-helix	trans	-62.6	-37.4	177.7	0	0	0	0	0	112.2	M167 E168 I173 A174 N175	M167-A171 WeakPolarHBondContact O-CB 3.13Å; M167-A171 PolarHBondContact O-N 3.01Å; E168-A171 PolarHBondContact O-N 3.47Å; A171-I173 PolarHBondContact O-N 3.08Å; A171-A174 PolarHBondContact O-N 3.37Å; A171-N175 PolarHBondContact O-N 3.45Å
172	F	45	Very low	53.5	Low	169 Å²	169	101.5 Å²	101.5	74%	0.741	56%	0.561	S	S	*	*	H	α-helix	trans	-65.7	-22.7	175.7	-172.9	-97.2	0	0	0	113.7	E168 F170	E168-F172 WeakPolarHBondContact O-CB 3.26Å; E168-F172 PolarHBondContact O-N 3.49Å; F170-F172 VanDerWaalsContact C-N 3.31Å; F170-F172 PolarHBondContact O-N 2.92Å
173	I	50.4	Low	51.8	Low	131 Å²	131	103.1 Å²	103.1	67%	0.672	58%	0.581	S	S	*	*	H	α-helix	trans	-79.1	-31.1	175.2	-64.8	166.5	0	0	0	111	D169 F170 A171	D169-I173 WeakPolarHBondContact O-CG1 3.39Å; F170-I173 WeakPolarHBondContact O-CB 3.49Å; F170-I173 PolarHBondContact O-N 2.95Å; F170-I173 VanDerWaalsContact O-N 3.12Å; A171-I173 PolarHBondContact O-N 3.08Å
174	A	42	Very low	50	Low	73 Å²	73	109.9 Å²	109.9	60%	0.603	62%	0.616	S	S	*	*	H	α-helix	trans	-81.2	-32.3	-173.1	0	0	0	0	0	114.5	F170 A171	F170-A174 PolarHBondContact O-N 3.23Å; A171-A174 PolarHBondContact O-N 3.37Å
175	N	37.1	Very low	47.9	Very low	111 Å²	111	111.3 Å²	111.3	59%	0.594	63%	0.632	S	S	*	*			trans	-135.9	98.2	-178	-89.1	-34.6	0	0	0	112.5	A171 S177	A171-N175 PolarHBondContact O-N 3.45Å; N175-S177 VanDerWaalsContact C-N 3.25Å; N175-S177 PolarHBondContact O-N 3.08Å
176	P	43.3	Very low	46	Very low	121 Å²	121	109 Å²	109	79%	0.786	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-3.5	179	-18.4	33	0	0	0	115.7
177	S	32.2	Very low	44.3	Very low	107 Å²	107	114.3 Å²	114.3	75%	0.748	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.3	29.6	-159.6	62.6	0	0	0	0	116.1	N175	N175-S177 VanDerWaalsContact C-N 3.25Å; N175-S177 PolarHBondContact O-N 3.08Å
178	S	32.9	Very low	42.6	Very low	93 Å²	93	115 Å²	115	65%	0.65	67%	0.67	S	S	*	*			trans	-108.5	97.1	167.3	57.7	0	0	0	0	110.6	E180	S178-E180 PolarHBondContact O-N 2.79Å
179	T	45	Very low	41	Very low	143 Å²	143	115.4 Å²	115.4	88%	0.877	67%	0.672	S	S	*	*			trans	-73.6	101.3	168.5	44.2	0	0	0	0	110.2
180	E	30.1	Very low	39.7	Very low	189 Å²	189	116.5 Å²	116.5	88%	0.883	68%	0.677	S	S	*	*			trans	-141.3	123.5	160.2	-119	167	-143.9	0	0	110.7	S178 C182	S178-E180 PolarHBondContact O-N 2.79Å; E180-C182 PolarHBondContact O-N 2.84Å
181	I	44.7	Very low	38.3	Very low	174 Å²	174	119.1 Å²	119.1	89%	0.892	69%	0.694	S	S	*	*			trans	-90	104.6	-175.8	-63.2	169.5	0	0	0	107.2
182	C	29.8	Very low	37.4	Very low	111 Å²	111	119.9 Å²	119.9	75%	0.75	69%	0.687	S	S	*	*			trans	-111.9	90.5	175	-138.9	0	0	0	0	111.3	E180 I184	E180-C182 PolarHBondContact O-N 2.84Å; C182-I184 PolarHBondContact O-N 3.33Å; C182-I184 VanDerWaalsContact O-N 3.08Å
183	S	37.1	Very low	37	Very low	99 Å²	99	117.4 Å²	117.4	69%	0.692	68%	0.677	S	S	*	*			trans	38.3	56	144.5	-54.2	0	0	0	0	119.4	T185	S183-T185 PolarHBondContact O-N 3.19Å
184	I	38.1	Very low	36.3	Very low	143 Å²	143	115.4 Å²	115.4	73%	0.733	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	72.4	169.5	-48.2	-179.8	0	0	0	110.7	C182	C182-I184 PolarHBondContact O-N 3.33Å; C182-I184 VanDerWaalsContact O-N 3.08Å
185	T	32.8	Very low	35.9	Very low	121 Å²	121	113.8 Å²	113.8	74%	0.742	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	-20.7	166.5	39.7	0	0	0	0	113.2	S183	S183-T185 PolarHBondContact O-N 3.19Å
186	G	30.3	Very low	35.9	Very low	51 Å²	51	113.3 Å²	113.3	53%	0.526	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-30.1	-179.2	0	0	0	0	0	115.7	V188	G186-V188 VanDerWaalsContact C-N 3.28Å; G186-V188 PolarHBondContact O-N 2.8Å
187	N	37.4	Very low	35.6	Very low	137 Å²	137	111.9 Å²	111.9	73%	0.733	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	9	-171.9	-69.2	-14.5	0	0	0	114.6
188	V	37.7	Very low	35.9	Very low	75 Å²	75	111.2 Å²	111.2	46%	0.455	63%	0.629	S	S	.	*	H	α-helix	trans	-80.3	-30.5	177.7	-168.2	0	0	0	0	111.2	G186 Q192	G186-V188 VanDerWaalsContact C-N 3.28Å; G186-V188 PolarHBondContact O-N 2.8Å; V188-Q192 HydrophobicContact CG1-CG 4.27Å; V188-Q192 VanDerWaalsContact O-CG 3.26Å; V188-Q192 WeakPolarHBondContact O-CG 3.49Å; V188-Q192 PolarHBondContact O-N 3.27Å
189	E	32.1	Very low	36	Very low	145 Å²	145	109.8 Å²	109.8	68%	0.678	61%	0.614	S	S	*	*	H	α-helix	trans	-68.7	-42.8	-173.8	-106.8	168.4	157.4	0	0	114	N191 Q192 Q193	E189-N191 VanDerWaalsContact C-N 3.28Å; E189-N191 PolarHBondContact O-N 3.14Å; E189-Q192 WeakPolarHBondContact O-CB 3.49Å; E189-Q192 PolarHBondContact O-N 3.28Å; E189-Q192 VanDerWaalsContact O-N 3.11Å; E189-Q193 PolarHBondContact O-N 2.97Å
190	L	36.1	Very low	35.6	Very low	127 Å²	127	110.9 Å²	110.9	67%	0.665	60%	0.602	S	S	*	*	H	α-helix	trans	-66.8	-30.6	-178.4	-163.8	66.3	0	0	0	112.5	T194	L190-T194 PolarHBondContact O-OG1 3.48Å
191	N	35.8	Very low	36	Very low	120 Å²	120	106.6 Å²	106.6	64%	0.642	59%	0.585	S	S	*	*	H	α-helix	trans	-85.6	-20.3	175.5	-144.2	-1.6	0	0	0	112.4	E189	E189-N191 VanDerWaalsContact C-N 3.28Å; E189-N191 PolarHBondContact O-N 3.14Å
192	Q	35.1	Very low	35.7	Very low	78 Å²	78	105.6 Å²	105.6	36%	0.364	57%	0.571	S	S	.	*	H	α-helix	trans	-67.9	-39.5	165.8	-76.5	168.1	-3.4	0	0	111.1	V188 E189 T194 C195 L196	V188-Q192 HydrophobicContact CG1-CG 4.27Å; V188-Q192 VanDerWaalsContact O-CG 3.26Å; V188-Q192 WeakPolarHBondContact O-CG 3.49Å; V188-Q192 PolarHBondContact O-N 3.27Å; E189-Q192 WeakPolarHBondContact O-CB 3.49Å; E189-Q192 PolarHBondContact O-N 3.28Å; E189-Q192 VanDerWaalsContact O-N 3.11Å; Q192-T194 PolarHBondContact O-N 3.16Å; Q192-C195 CarbonylContact O-C 3.23Å; Q192-C195 PolarHBondContact O-N 3.29Å; Q192-C195 VanDerWaalsContact O-N 3.15Å; Q192-L196 WeakPolarHBondContact O-CB 3.35Å; Q192-L196 WeakPolarHBondContact O-CG 3.46Å; Q192-L196 PolarHBondContact O-N 2.98Å
193	Q	36.7	Very low	36	Very low	116 Å²	116	105.1 Å²	105.1	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-59.5	-43.1	-179.4	-112.8	166.4	-10.3	0	0	112.9	E189 C195 L196 L197	E189-Q193 PolarHBondContact O-N 2.97Å; Q193-C195 VanDerWaalsContact C-N 3.28Å; Q193-C195 PolarHBondContact O-N 3.35Å; Q193-L196 PolarHBondContact O-N 3.24Å; Q193-L196 VanDerWaalsContact O-N 3.14Å; Q193-L197 WeakPolarHBondContact O-CG 3.26Å; Q193-L197 PolarHBondContact O-N 3.28Å
194	T	36.8	Very low	36.1	Very low	89 Å²	89	104.9 Å²	104.9	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-64.5	-29.8	177.2	-40.1	0	0	0	0	113.1	L190 Q192	L190-T194 PolarHBondContact O-OG1 3.48Å; Q192-T194 PolarHBondContact O-N 3.16Å
195	C	33.1	Very low	36.2	Very low	40 Å²	40	108.2 Å²	108.2	27%	0.27	56%	0.556	S	S	.	*	H	α-helix	trans	-86.2	-21.5	174	-68.3	0	0	0	0	113.7	Q192 Q193 T198 H385	Q192-C195 CarbonylContact O-C 3.23Å; Q192-C195 PolarHBondContact O-N 3.29Å; Q192-C195 VanDerWaalsContact O-N 3.15Å; Q193-C195 VanDerWaalsContact C-N 3.28Å; Q193-C195 PolarHBondContact O-N 3.35Å; C195-T198 PolarHBondContact O-OG1 3.18Å; C195-H385 WeakPolarHBondContact CB-NE2 3.45Å
196	L	36.7	Very low	36.3	Very low	101 Å²	101	110.2 Å²	110.2	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-79.5	-31	173.1	-74.2	170.3	0	0	0	112	Q192 Q193 L199 R200	Q192-L196 WeakPolarHBondContact O-CB 3.35Å; Q192-L196 WeakPolarHBondContact O-CG 3.46Å; Q192-L196 PolarHBondContact O-N 2.98Å; Q193-L196 PolarHBondContact O-N 3.24Å; Q193-L196 VanDerWaalsContact O-N 3.14Å; L196-L199 PolarHBondContact O-N 2.87Å; L196-R200 VanDerWaalsContact O-CB 3.23Å; L196-R200 WeakPolarHBondContact O-CB 3.3Å; L196-R200 PolarHBondContact O-N 3.16Å
197	L	38	Very low	36.6	Very low	91 Å²	91	116.2 Å²	116.2	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-62.3	-48	173.4	-73.2	168.4	0	0	0	111.3	Q193 L199 R200 D201	Q193-L197 WeakPolarHBondContact O-CG 3.26Å; Q193-L197 PolarHBondContact O-N 3.28Å; L197-L199 VanDerWaalsContact C-N 3.26Å; L197-L199 PolarHBondContact O-N 3.34Å; L197-R200 PolarHBondContact O-N 3.02Å; L197-R200 VanDerWaalsContact O-N 3.14Å; L197-D201 WeakPolarHBondContact O-CB 3.42Å; L197-D201 VanDerWaalsContact O-CG 3.24Å; L197-D201 PolarHBondContact O-N 3.43Å
198	T	38.9	Very low	36.4	Very low	93 Å²	93	114.1 Å²	114.1	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-64.7	-26.2	178.2	54.6	0	0	0	0	114	C195 Y202	C195-T198 PolarHBondContact O-OG1 3.18Å; T198-Y202 PolarHBondContact O-N 2.9Å
199	L	33.8	Very low	36.2	Very low	62 Å²	62	119.5 Å²	119.5	33%	0.325	58%	0.584	S	S	.	*	H	α-helix	trans	-83.9	-32.7	172.5	-82	163.6	0	0	0	113.3	L196 L197 Y202 N203 L386	L196-L199 PolarHBondContact O-N 2.87Å; L197-L199 VanDerWaalsContact C-N 3.26Å; L197-L199 PolarHBondContact O-N 3.34Å; L199-Y202 PolarHBondContact O-N 2.29Å; L199-N203 PolarHBondContact O-N 2.57Å; L199-L386 HydrophobicContact CD1-CD2 4.33Å
200	R	36.8	Very low	36.1	Very low	166 Å²	166	119.3 Å²	119.3	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-66.1	-41.7	173.2	178.1	176.6	-99.5	177.6	-6	110.5	L196 L197 Y202 N203 N204	L196-R200 VanDerWaalsContact O-CB 3.23Å; L196-R200 WeakPolarHBondContact O-CB 3.3Å; L196-R200 PolarHBondContact O-N 3.16Å; L197-R200 PolarHBondContact O-N 3.02Å; L197-R200 VanDerWaalsContact O-N 3.14Å; R200-Y202 VanDerWaalsContact C-N 3.29Å; R200-Y202 PolarHBondContact O-N 3.24Å; R200-N203 PolarHBondContact O-N 3.14Å; R200-N204 VanDerWaalsContact O-CB 3.3Å; R200-N204 WeakPolarHBondContact O-CB 3.47Å; R200-N204 PolarHBondContact O-N 3.3Å; R200-N204 PolarHBondContact O-ND2 2.89Å
201	D	39.2	Very low	35.7	Very low	99 Å²	99	118.5 Å²	118.5	53%	0.529	60%	0.598	S	S	.	*	H	α-helix	trans	-67.6	-29.5	176.7	-64.4	-21.6	0	0	0	112.4	L197 R205	L197-D201 WeakPolarHBondContact O-CB 3.42Å; L197-D201 VanDerWaalsContact O-CG 3.24Å; L197-D201 PolarHBondContact O-N 3.43Å; D201-R205 PolarHBondContact O-N 2.98Å
202	Y	36.6	Very low	35.3	Very low	153 Å²	153	118.7 Å²	118.7	60%	0.6	60%	0.603	S	S	*	*	H	α-helix	trans	-72.6	-48.9	173.5	-149.4	-86.7	0	0	0	111.8	T198 L199 R200 N204 R205	T198-Y202 PolarHBondContact O-N 2.9Å; L199-Y202 PolarHBondContact O-N 2.29Å; R200-Y202 VanDerWaalsContact C-N 3.29Å; R200-Y202 PolarHBondContact O-N 3.24Å; Y202-N204 VanDerWaalsContact C-N 3.27Å; Y202-N204 PolarHBondContact O-N 3.38Å; Y202-R205 PolarHBondContact O-N 2.83Å
203	N	38.1	Very low	34.8	Very low	102 Å²	102	123.3 Å²	123.3	55%	0.545	63%	0.63	S	S	.	*	H	α-helix	trans	-67.1	-24.7	177.8	-82.2	-31.7	0	0	0	113.9	L199 R200 R205	L199-N203 PolarHBondContact O-N 2.57Å; R200-N203 PolarHBondContact O-N 3.14Å; N203-R205 VanDerWaalsContact C-N 3.34Å
204	N	37.4	Very low	34.3	Very low	94 Å²	94	122.4 Å²	122.4	50%	0.503	64%	0.637	S	S	.	*	H	α-helix	trans	-77.1	-21.9	173.1	-73.5	-14.9	0	0	0	112.3	R200 Y202 K207	R200-N204 VanDerWaalsContact O-CB 3.3Å; R200-N204 WeakPolarHBondContact O-CB 3.47Å; R200-N204 PolarHBondContact O-N 3.3Å; R200-N204 PolarHBondContact O-ND2 2.89Å; Y202-N204 VanDerWaalsContact C-N 3.27Å; Y202-N204 PolarHBondContact O-N 3.38Å; N204-K207 PolarHBondContact O-N 3.15Å
205	R	40.1	Very low	34	Very low	212 Å²	212	124.2 Å²	124.2	80%	0.8	65%	0.648	S	S	*	*	H	α-helix	trans	-83.5	-15.8	-178.5	-151.3	172.6	-172.9	-175.2	2	114.2	D201 Y202 N203	D201-R205 PolarHBondContact O-N 2.98Å; Y202-R205 PolarHBondContact O-N 2.83Å; N203-R205 VanDerWaalsContact C-N 3.34Å
206	E	36.8	Very low	33.7	Very low	163 Å²	163	131.4 Å²	131.4	76%	0.762	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	2.2	168.7	-66.9	-163.2	153.2	0	0	113.4
207	K	36.5	Very low	33.2	Very low	178 Å²	178	130.8 Å²	130.8	77%	0.774	69%	0.687	S	S	*	*	S	Bend	trans	-107.8	4.4	179.5	-78	-172.9	175.2	-177.3	0	115	N204	N204-K207 PolarHBondContact O-N 3.15Å
208	S	33	Very low	32.7	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	71%	0.706	S	S	*	*	S	Bend	trans	-109.8	29.3	-174.9	68.8	0	0	0	0	114.8
209	E	33.6	Very low	32.7	Very low	188 Å²	188	134.9 Å²	134.9	88%	0.879	71%	0.711	S	S	*	*	S	Bend	trans	-141.6	87.2	161.4	-74.1	-166.2	-170.7	0	0	110.5
210	V	29.9	Very low	32.4	Very low	141 Å²	141	142.2 Å²	142.2	86%	0.855	74%	0.741	S	S	*	*	S	Bend	trans	-171.4	139.9	134.5	158	0	0	0	0	106.8
211	S	27.6	Very low	32	Very low	110 Å²	110	144 Å²	144	77%	0.769	76%	0.756	S	S	*	*			trans	-61.6	143.9	-171.2	51.4	0	0	0	0	116.3
212	T	26.3	Very low	31.3	Very low	124 Å²	124	143 Å²	143	76%	0.761	77%	0.769	S	S	*	*			trans	-82.4	133.2	157.5	49.3	0	0	0	0	111.5
213	D	24.8	Very low	30.9	Very low	175 Å²	175	140.1 Å²	140.1	94%	0.936	78%	0.778	S	S	*	*			trans	-130.9	147.7	142.9	-112.5	-32	0	0	0	108
214	S	27.3	Very low	30.3	Very low	97 Å²	97	143.6 Å²	143.6	68%	0.678	80%	0.795	S	S	*	*			trans	-118	-173.3	-159.3	-65.7	0	0	0	0	113.8
215	V	28.7	Very low	29.8	Very low	128 Å²	128	143.7 Å²	143.7	78%	0.776	81%	0.809	S	S	*	*			trans	87.9	126.2	167.9	-174.2	0	0	0	0	113.4
216	Q	28.7	Very low	29.2	Very low	190 Å²	190	142.7 Å²	142.7	89%	0.888	81%	0.81	S	S	*	*			cis	-150.7	171.1	3.8	-134.7	157.7	7.2	0	0	112
217	A	24.7	Very low	28.7	Very low	88 Å²	88	144.4 Å²	144.4	73%	0.727	82%	0.815	S	S	*	*			trans	-108.4	155.9	-174.7	0	0	0	0	0	114.5
218	N	28.1	Very low	28.1	Very low	164 Å²	164	140.4 Å²	140.4	88%	0.877	81%	0.81	S	S	*	*				-166	154.6	125.6	-121.2	-8.6	0	0	0	112.8
219	P	38.2	Very low	27.7	Very low	106 Å²	106	140.9 Å²	140.9	69%	0.688	81%	0.813	S	S	*	*			trans	-103.5	162.3	-173.2	39.3	-33.9	0	0	0	114.2
220	K	28.5	Very low	27.4	Very low	216 Å²	216	140 Å²	140	94%	0.939	81%	0.809	S	S	*	*			trans	-160.6	155.2	149.7	-110.3	160.6	-171.8	-179.8	0	112
221	Q	27.8	Very low	27.2	Very low	203 Å²	203	138.3 Å²	138.3	95%	0.949	80%	0.799	S	S	*	*			trans	-86.8	161.1	-167.3	-59.6	159.4	-31	0	0	113
222	G	25.8	Very low	27.2	Very low	78 Å²	78	141.6 Å²	141.6	80%	0.804	80%	0.799	S	S	*	*			trans	158.5	100.7	158.8	0	0	0	0	0	119.1
223	A	26.9	Very low	27.1	Very low	94 Å²	94	144.5 Å²	144.5	78%	0.777	80%	0.802	S	S	*	*			trans	44.7	125.8	141.7	0	0	0	0	0	124.3
224	L	26.1	Very low	27.1	Very low	175 Å²	175	144.4 Å²	144.4	92%	0.916	79%	0.793	S	S	*	*				30	119.2	129.6	-70.7	149.6	0	0	0	121
225	A	26.3	Very low	27.1	Very low	96 Å²	96	148.6 Å²	148.6	79%	0.793	80%	0.799	S	S	*	*				162	133.7	107.7	0	0	0	0	0	117.1
226	K	27.7	Very low	27.1	Very low	190 Å²	190	150.7 Å²	150.7	83%	0.826	80%	0.797	S	S	*	*			trans	11	143.2	146.3	-70.9	175.7	177.4	172.1	0	123.5
227	K	26.3	Very low	27.1	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.865	80%	0.796	S	S	*	*			trans	70.3	163.6	156.4	-65.4	171.4	179.1	-175.9	0	116.9
228	S	23.2	Very low	27.1	Very low	95 Å²	95	151.5 Å²	151.5	66%	0.664	80%	0.795	S	S	*	*			cis	-163.4	153.9	-44.3	62.3	0	0	0	0	109.6
229	S	25.2	Very low	26.8	Very low	101 Å²	101	150.9 Å²	150.9	71%	0.706	79%	0.792	S	S	*	*			trans	55.6	135	144.8	63.9	0	0	0	0	123.5
230	Q	27.8	Very low	26.3	Very low	171 Å²	171	150.3 Å²	150.3	80%	0.799	79%	0.791	S	S	*	*			trans	95.2	100.7	146.3	-75.5	-170.4	16.2	0	0	123
231	T	25	Very low	26.4	Very low	104 Å²	104	146.4 Å²	146.4	64%	0.638	79%	0.787	S	S	*	*				47.1	126.1	122.7	69.1	0	0	0	0	122
232	K	27.2	Very low	26.4	Very low	179 Å²	179	145.5 Å²	145.5	78%	0.778	78%	0.78	S	S	*	*				170.5	140.1	102.6	-93.1	161.4	-170.7	166.3	0	113
233	K	25.8	Very low	26.3	Very low	186 Å²	186	148.7 Å²	148.7	81%	0.809	78%	0.784	S	S	*	*			trans	33.5	136.6	134.6	-66.7	176.5	179.2	177.9	0	118
234	K	24.7	Very low	26.1	Very low	172 Å²	172	147.4 Å²	147.4	75%	0.748	78%	0.78	S	S	*	*			cis	178.4	163.5	48.5	-134.5	172	-178.8	174.8	0	111.9
235	K	27.2	Very low	26.1	Very low	185 Å²	185	148.2 Å²	148.2	80%	0.804	78%	0.779	S	S	*	*			trans	74.3	119	150.3	-74.3	-177.1	174.7	-170.7	0	121.9
236	K	28.1	Very low	26	Very low	172 Å²	172	150.7 Å²	150.7	75%	0.748	78%	0.779	S	S	*	*			trans	-68.7	173.2	145.5	-62.3	-177.8	174.1	-176	0	110.7
237	P	28	Very low	25.8	Very low	132 Å²	132	151.3 Å²	151.3	86%	0.857	78%	0.782	S	S	*	*				-131.3	172.9	102.3	38.1	-30.6	0	0	0	115.7
238	F	24.6	Very low	25.6	Very low	163 Å²	163	147.3 Å²	147.3	72%	0.715	78%	0.775	S	S	*	*			trans	-84.5	150.9	178.5	-115.7	-112.7	0	0	0	111.4
239	N	23.6	Very low	25.5	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	78%	0.781	S	S	*	*				177	151.6	105.6	-100.9	-17.2	0	0	0	114.1
240	S	26.2	Very low	25.3	Very low	94 Å²	94	153.2 Å²	153.2	66%	0.657	79%	0.789	S	S	*	*			trans	-97.7	171.5	162.5	54.1	0	0	0	0	110.8
241	P	31.7	Very low	25	Very low	133 Å²	133	155.3 Å²	155.3	86%	0.864	79%	0.791	S	S	*	*				-139.2	-178.6	119.2	32.2	-15.8	0	0	0	114.7
242	K	27.3	Very low	25.4	Very low	184 Å²	184	155.6 Å²	155.6	80%	0.8	80%	0.795	S	S	*	*			trans	-107.2	179.6	-166.7	-57.2	174.3	173.5	176.6	0	113.6
243	T	24.1	Very low	25.4	Very low	145 Å²	145	151 Å²	151	89%	0.89	79%	0.786	S	S	*	*			trans	70.4	145.2	151.5	42.7	0	0	0	0	118
244	G	23.1	Very low	25.4	Very low	67 Å²	67	148.4 Å²	148.4	69%	0.691	78%	0.78	S	S	*	*			cis	160.6	170.1	-5.5	0	0	0	0	0	112.5
245	Q	25.9	Very low	25.6	Very low	192 Å²	192	147 Å²	147	90%	0.897	78%	0.779	S	S	*	*			trans	92.1	109.9	165.9	-54.2	-173	-8.8	0	0	121.9
246	N	22.7	Very low	25.6	Very low	149 Å²	149	144.8 Å²	144.8	80%	0.797	78%	0.776	S	S	*	*				30.8	128.1	123.3	-60.1	-12.1	0	0	0	122.9
247	K	25	Very low	25.6	Very low	202 Å²	202	143.5 Å²	143.5	88%	0.878	77%	0.773	S	S	*	*				171.7	179.6	107.4	-92	173.4	-178.1	178.8	0	110.9
248	T	20.4	Very low	25.6	Very low	116 Å²	116	143.5 Å²	143.5	71%	0.712	77%	0.765	S	S	*	*				-160.2	153.7	-85.8	-44.7	0	0	0	0	106.7
249	V	22.4	Very low	25.7	Very low	133 Å²	133	139.4 Å²	139.4	81%	0.806	76%	0.761	S	S	*	*			trans	64.7	133.1	165.9	-123.5	0	0	0	0	117.1
250	Q	21.1	Very low	25.7	Very low	186 Å²	186	137.4 Å²	137.4	87%	0.869	76%	0.759	S	S	*	*				-165.2	164	55.3	-105.2	-174.1	-39.9	0	0	114.9
251	Y	21.5	Very low	25.6	Very low	215 Å²	215	139.4 Å²	139.4	84%	0.843	77%	0.767	S	S	*	*			trans	-97.1	162.1	170.8	-103.7	-85.6	0	0	0	111.4
252	P	32.2	Very low	25.3	Very low	110 Å²	110	140.2 Å²	140.2	71%	0.714	76%	0.759	S	S	*	*				-130.6	149.1	86.2	9.1	14.9	0	0	0	112.9
253	S	26.9	Very low	25.3	Very low	84 Å²	84	137.5 Å²	137.5	59%	0.587	75%	0.753	S	S	*	*				64.6	134.5	70.7	94.3	0	0	0	0	112.7
254	D	26.9	Very low	25.2	Very low	130 Å²	130	139.4 Å²	139.4	70%	0.695	75%	0.749	S	S	*	*			cis	-168.6	166.1	39	-105.2	-48.2	0	0	0	116.2
255	I	28.2	Very low	25.4	Very low	142 Å²	142	142.8 Å²	142.8	73%	0.728	75%	0.751	S	S	*	*			trans	66.3	125.3	146	-67.2	161.5	0	0	0	119
256	L	28.1	Very low	25.4	Very low	139 Å²	139	140.6 Å²	140.6	73%	0.728	75%	0.745	S	S	*	*				-161.6	122.6	50.8	-165.7	67.4	0	0	0	108.5
257	E	28.6	Very low	25.6	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.682	74%	0.741	S	S	*	*				53.6	137.9	90.8	-76.5	-165.9	-161	0	0	115.3
258	N	27.3	Very low	25.8	Very low	132 Å²	132	135.5 Å²	135.5	71%	0.706	74%	0.739	S	S	*	*			cis	-155.7	171	6.1	-91.6	-37	0	0	0	107.8
259	A	26.3	Very low	26.1	Very low	76 Å²	76	139.8 Å²	139.8	63%	0.628	75%	0.748	S	S	*	*			cis	153.7	158.5	-19.4	0	0	0	0	0	107
260	S	24.1	Very low	26.3	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	75%	0.751	S	S	*	*			trans	86.8	114.5	169.2	-50.4	0	0	0	0	117.5
261	V	24.4	Very low	26.5	Very low	136 Å²	136	138.1 Å²	138.1	82%	0.824	75%	0.749	S	S	*	*			cis	88.4	139.6	45.3	167.4	0	0	0	0	111.8
262	E	25.5	Very low	26.7	Very low	150 Å²	150	134.3 Å²	134.3	70%	0.701	75%	0.748	S	S	*	*			cis	-176.2	179.1	-23.3	-163.3	-166.8	-156.5	0	0	107.6
263	L	25.7	Very low	26.7	Very low	128 Å²	128	135 Å²	135	67%	0.67	75%	0.753	S	S	*	*			trans	82.2	129.4	159.8	-53.7	170.6	0	0	0	117.7
264	F	22.8	Very low	26.6	Very low	185 Å²	185	137 Å²	137	81%	0.811	76%	0.762	S	S	*	*				66.1	128.3	61.4	-84.7	-73.1	0	0	0	112
265	L	26.9	Very low	26.5	Very low	137 Å²	137	137.6 Å²	137.6	72%	0.717	77%	0.77	S	S	*	*			cis	-159.9	154.1	34.7	-101.8	157.1	0	0	0	114.1
266	D	26.3	Very low	26.5	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	77%	0.772	S	S	*	*			trans	36.3	148.2	137.5	-75.8	-12.1	0	0	0	128.6
267	A	27.3	Very low	26.4	Very low	85 Å²	85	140.9 Å²	140.9	70%	0.702	78%	0.778	S	S	*	*			trans	101.2	107.3	135	0	0	0	0	0	123.5
268	N	28.4	Very low	26.2	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	78%	0.78	S	S	*	*				40	124.1	128.8	-69.9	-31.4	0	0	0	122.4
269	K	28.1	Very low	26.1	Very low	206 Å²	206	137.1 Å²	137.1	90%	0.896	78%	0.778	S	S	*	*				-171.4	159.4	108.6	-106.1	170.7	-177.5	177.6	0	114.4
270	L	25.7	Very low	26	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	78%	0.784	S	S	*	*			trans	-77.5	149.3	175.8	-59.9	82.5	0	0	0	112
271	S	25.1	Very low	26	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	78%	0.777	S	S	*	*				-175	139.7	123.3	44.7	0	0	0	0	113.3
272	T	25.6	Very low	26.1	Very low	134 Å²	134	142.5 Å²	142.5	82%	0.822	78%	0.776	S	S	*	*			trans	-91.1	154.1	158.3	53.2	0	0	0	0	108.5
273	P	33	Very low	26.2	Very low	126 Å²	126	142.2 Å²	142.2	82%	0.818	78%	0.78	S	S	*	*				-146.9	166.1	90.2	37.6	-20.3	0	0	0	117
274	V	24.3	Very low	26.2	Very low	126 Å²	126	143.6 Å²	143.6	76%	0.764	79%	0.788	S	S	*	*			trans	-44.3	146.3	162.1	171.2	0	0	0	0	114.1
275	V	25.4	Very low	26.6	Very low	142 Å²	142	139.6 Å²	139.6	86%	0.861	78%	0.783	S	S	*	*				-162.7	152.4	123.3	144.2	0	0	0	0	110.3
276	E	27.1	Very low	26.7	Very low	164 Å²	164	140.7 Å²	140.7	77%	0.766	78%	0.784	S	S	*	*			trans	-119.4	141	-164	167.5	-178.8	-141.9	0	0	110
277	Q	26.7	Very low	26.8	Very low	185 Å²	185	140 Å²	140	86%	0.864	78%	0.779	S	S	*	*			trans	-179.7	148.1	159.2	-101.8	159.5	34.4	0	0	108
278	V	24.3	Very low	26.7	Very low	121 Å²	121	143 Å²	143	73%	0.733	78%	0.779	S	S	*	*			cis	165.3	147.2	-20.9	134.5	0	0	0	0	104.3
279	A	24.7	Very low	26.5	Very low	78 Å²	78	141.7 Å²	141.7	65%	0.645	77%	0.771	S	S	*	*			trans	68.5	153.8	164.8	0	0	0	0	0	118
280	Q	25.2	Very low	26.4	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	76%	0.762	S	S	*	*			cis	-166.5	158.6	-19	-112	175.8	-18.8	0	0	108.7
281	I	24.2	Very low	26.4	Very low	121 Å²	121	134.8 Å²	134.8	62%	0.621	76%	0.758	S	S	*	*			trans	53.7	113	139.4	-61.7	164.8	0	0	0	118.5
282	N	25.1	Very low	26.5	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	76%	0.755	S	S	*	*				-174.2	148.7	94	-120	-22.2	0	0	0	113
283	D	27.9	Very low	26.6	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	75%	0.748	S	S	*	*			trans	-85.2	170.8	177.3	-62.4	-64.7	0	0	0	113
284	N	26.4	Very low	26.4	Very low	157 Å²	157	135.6 Å²	135.6	84%	0.84	74%	0.744	S	S	*	*			trans	-166.5	146.5	133.4	-104.5	-22.4	0	0	0	115.1
285	S	31.1	Very low	26.5	Very low	101 Å²	101	134.6 Å²	134.6	71%	0.706	73%	0.734	S	S	*	*			trans	60.8	139.1	157.7	57	0	0	0	0	121
286	E	27.8	Very low	26.6	Very low	160 Å²	160	134.9 Å²	134.9	75%	0.748	74%	0.737	S	S	*	*			cis	-176.8	157.5	-22.6	-126.3	-172.7	131.8	0	0	109.2
287	L	28.9	Very low	26.6	Very low	131 Å²	131	134.9 Å²	134.9	69%	0.686	73%	0.734	S	S	*	*			trans	61.5	138.7	149	-61.3	174.6	0	0	0	119.9
288	E	25.8	Very low	27	Very low	149 Å²	149	131.5 Å²	131.5	70%	0.696	73%	0.728	S	S	*	*			cis	-154.5	151.2	-4.6	-100	-153.8	154	0	0	112.3
289	L	24.9	Very low	27.2	Very low	130 Å²	130	129.2 Å²	129.2	68%	0.681	72%	0.722	S	S	*	*			trans	38.8	148.6	132.2	-50.4	-179.4	0	0	0	121.9
290	T	25.4	Very low	27.4	Very low	115 Å²	115	133.6 Å²	133.6	71%	0.706	73%	0.729	S	S	*	*			cis	-167.2	179.1	0.2	16.1	0	0	0	0	113.1
291	S	25.9	Very low	27.5	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	72%	0.724	S	S	*	*			trans	80.9	105.3	172.4	71	0	0	0	0	115.5
292	V	26	Very low	27.7	Very low	129 Å²	129	132.2 Å²	132.2	78%	0.782	73%	0.727	S	S	*	*			cis	89.1	137.3	21.6	-164.4	0	0	0	0	115.1
293	V	28.4	Very low	27.8	Very low	112 Å²	112	131.4 Å²	131.4	68%	0.679	73%	0.727	S	S	*	*			trans	81.6	92.8	178.3	-161.1	0	0	0	0	113.7
294	E	28.5	Very low	27.7	Very low	158 Å²	158	132.5 Å²	132.5	74%	0.738	73%	0.728	S	S	*	*				66.5	153.1	71.6	-63.8	-169.5	133.2	0	0	113.7
295	N	27.5	Very low	27.6	Very low	104 Å²	104	130.6 Å²	130.6	56%	0.556	72%	0.722	S	S	*	*			cis	-169.9	146.9	-22.7	-100.5	-27.8	0	0	0	105.3
296	T	26.3	Very low	27.4	Very low	148 Å²	148	131.8 Å²	131.8	91%	0.908	73%	0.725	S	S	*	*			trans	-165.2	121.1	135.1	5.7	0	0	0	0	113.1
297	F	26.5	Very low	27.2	Very low	164 Å²	164	130.7 Å²	130.7	72%	0.719	73%	0.729	S	S	*	*			trans	-75.4	-173.9	166	-73.7	-91.7	0	0	0	110.7	A299	F297-A299 HydrophobicContact CD1-CB 4.17Å
298	P	36	Very low	26.9	Very low	114 Å²	114	129.9 Å²	129.9	74%	0.74	73%	0.729	S	S	*	*			cis	-123.3	164.4	-2	28.3	-6	0	0	0	113.7
299	A	28.5	Very low	26.8	Very low	73 Å²	73	131.4 Å²	131.4	60%	0.603	73%	0.734	S	S	*	*			cis	80.8	157	28.5	0	0	0	0	0	115.5	F297	F297-A299 HydrophobicContact CD1-CB 4.17Å
300	Q	29.9	Very low	26.8	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.794	75%	0.745	S	S	*	*			trans	82.5	129.9	-175	-60.6	179.8	-25.9	0	0	113.7
301	D	26.4	Very low	26.7	Very low	123 Å²	123	141.7 Å²	141.7	66%	0.658	76%	0.756	S	S	*	*			cis	-164.4	165.7	12.5	-104.3	-9.2	0	0	0	109.1
302	I	29.3	Very low	26.8	Very low	134 Å²	134	148.5 Å²	148.5	69%	0.687	77%	0.765	S	S	*	*			cis	-158.4	150.8	0.9	-127.8	160.8	0	0	0	111.7
303	V	25.7	Very low	26.7	Very low	132 Å²	132	145.9 Å²	145.9	80%	0.8	77%	0.765	S	S	*	*			trans	68.8	120.7	155.2	173.9	0	0	0	0	122.4
304	Q	25.9	Very low	26.5	Very low	168 Å²	168	150.9 Å²	150.9	79%	0.785	78%	0.777	S	S	*	*			trans	-89.3	170.8	168.8	-53.9	149.7	-40.2	0	0	110.1
305	T	25.8	Very low	26.4	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.724	78%	0.782	S	S	*	*				-174.9	130.8	60.2	37.9	0	0	0	0	107
306	V	25.7	Very low	26.3	Very low	126 Å²	126	152.3 Å²	152.3	76%	0.764	79%	0.794	S	S	*	*				66	107.3	78.9	-178.4	0	0	0	0	116.2
307	T	22.9	Very low	26.5	Very low	137 Å²	137	151.5 Å²	151.5	84%	0.84	79%	0.791	S	S	*	*			trans	175.3	165.1	144.7	27.3	0	0	0	0	109.8
308	V	24.4	Very low	26.5	Very low	113 Å²	113	150.8 Å²	150.8	69%	0.685	80%	0.795	S	S	*	*				-164	164.4	-50.2	111.2	0	0	0	0	111.7
309	K	22.6	Very low	25.9	Very low	182 Å²	182	151.5 Å²	151.5	79%	0.791	80%	0.801	S	S	*	*			trans	77.6	106	164.7	-85	155.4	-166.9	172.6	0	122.4
310	R	25.9	Very low	25.8	Very low	242 Å²	242	152.6 Å²	152.6	91%	0.913	81%	0.81	S	S	*	*				39.3	131.3	121.5	-65.9	-178.7	174.3	175.7	-1.1	121.5
311	K	23.5	Very low	25.8	Very low	218 Å²	218	152.1 Å²	152.1	95%	0.948	81%	0.812	S	S	*	*			trans	-152	150.2	130.2	-121.4	170.4	-174.1	173.7	0	113.2
312	R	26.8	Very low	25.9	Very low	253 Å²	253	156.4 Å²	156.4	96%	0.955	83%	0.825	S	S	*	*			trans	-105.8	131	-175	-166.5	178.9	-172.3	177.3	2.3	108.5
313	G	24.2	Very low	25.9	Very low	75 Å²	75	158.5 Å²	158.5	77%	0.773	83%	0.832	S	S	*	*			trans	-134.6	136.5	-175.9	0	0	0	0	0	113
314	K	25.2	Very low	26.2	Very low	217 Å²	217	161.1 Å²	161.1	94%	0.943	84%	0.835	S	S	*	*			trans	-72.3	147.4	177.3	-64.3	172.1	176.7	176.3	0	110.7
315	S	24.6	Very low	26.3	Very low	120 Å²	120	158.4 Å²	158.4	84%	0.839	84%	0.835	S	S	*	*			trans	-117.2	117.9	167.2	50.3	0	0	0	0	111.8
316	Q	25.8	Very low	26.6	Very low	172 Å²	172	160.7 Å²	160.7	80%	0.804	84%	0.839	S	S	*	*			trans	-94	146.2	155.2	-64.2	173	-76.1	0	0	108
317	P	30.7	Very low	26.9	Very low	130 Å²	130	159.5 Å²	159.5	84%	0.844	84%	0.837	S	S	*	*			trans	-93.3	107.2	162.4	30.5	-23	0	0	0	110.3
318	N	26.2	Very low	27	Very low	149 Å²	149	161.1 Å²	161.1	80%	0.797	84%	0.84	S	S	*	*			trans	-63.8	141.4	170.1	-84.7	-45	0	0	0	111.5
319	C	23.1	Very low	27.4	Very low	129 Å²	129	163.8 Å²	163.8	87%	0.872	85%	0.848	S	S	*	*			trans	-102.8	95.3	166.4	-175.9	0	0	0	0	109.3
320	A	27.4	Very low	27.5	Very low	96 Å²	96	160.1 Å²	160.1	79%	0.793	85%	0.852	S	S	*	*			trans	-97.4	114.8	177.1	0	0	0	0	0	111.3
321	L	29.4	Very low	27.6	Very low	161 Å²	161	153.8 Å²	153.8	84%	0.843	85%	0.845	S	S	*	*			trans	-74.7	147.9	158.9	-75.4	157.5	0	0	0	109.2
322	K	29.4	Very low	28	Very low	213 Å²	213	149.3 Å²	149.3	93%	0.926	84%	0.836	S	S	*	*			trans	-144.5	147	150.3	-136.2	174.1	-175	-179.8	0	111.1
323	E	28.4	Very low	28.1	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	83%	0.834	S	S	*	*			trans	-99.5	175.1	-160.7	-59.4	-174.7	127.7	0	0	113.6
324	H	31.8	Very low	28.2	Very low	186 Å²	186	148.9 Å²	148.9	86%	0.861	83%	0.833	S	S	*	*			trans	-73.8	148.6	175.9	-75.5	-101.7	0	0	0	113.5
325	S	29.2	Very low	29.4	Very low	112 Å²	112	144 Å²	144	78%	0.783	82%	0.823	S	S	*	*			trans	175.1	156.7	137.8	-82.2	0	0	0	0	109.2
326	M	30.6	Very low	29.6	Very low	166 Å²	166	149 Å²	149	82%	0.818	83%	0.826	S	S	*	*			cis	-156.4	166.4	-17.2	-105	-73.4	-82.1	0	0	106.7
327	S	32.3	Very low	29.8	Very low	101 Å²	101	149.5 Å²	149.5	71%	0.706	83%	0.828	S	S	*	*			trans	-72.5	151.7	-178.8	45.6	0	0	0	0	114.5
328	N	26.3	Very low	29.8	Very low	170 Å²	170	148 Å²	148	91%	0.909	83%	0.827	S	S	*	*			trans	-141.7	157.3	164.9	-111	-16.6	0	0	0	112.2
329	I	31.3	Very low	29.9	Very low	169 Å²	169	149 Å²	149	87%	0.867	83%	0.826	S	S	*	*			trans	-98.8	140.9	-169.6	-62.9	160	0	0	0	110.9
330	A	26.3	Very low	30.3	Very low	105 Å²	105	149.7 Å²	149.7	87%	0.868	82%	0.821	S	S	*	*			trans	-158.4	159.8	157.1	0	0	0	0	0	111.9
331	S	27.9	Very low	30.3	Very low	109 Å²	109	151 Å²	151	76%	0.762	83%	0.825	S	S	*	*			trans	-118.5	147.1	-165.9	-170.2	0	0	0	0	113.3
332	V	31.2	Very low	30.3	Very low	125 Å²	125	147.1 Å²	147.1	76%	0.758	82%	0.824	S	S	*	*			trans	29.6	117.2	151.9	-177.8	0	0	0	0	119.5
333	K	28.1	Very low	30.7	Very low	209 Å²	209	146.4 Å²	146.4	91%	0.909	82%	0.824	S	S	*	*				-170.7	159.2	122.7	-104.9	171.7	-174.4	-178.2	0	113.1
334	S	26	Very low	31	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	83%	0.825	S	S	*	*			trans	-153.4	171.8	-177.7	-178.4	0	0	0	0	106.7
335	P	51.8	Low	31.7	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	82%	0.821	S	S	*	*			cis	-118.3	177.6	-25.8	28.4	-9.5	0	0	0	112.2
336	Y	27.7	Very low	32	Very low	225 Å²	225	145 Å²	145	88%	0.882	81%	0.813	S	S	*	*			trans	-158.5	152.7	140.3	69.4	-89.3	0	0	0	111.4
337	E	30.6	Very low	32.7	Very low	184 Å²	184	145.5 Å²	145.5	86%	0.86	81%	0.813	S	S	*	*			trans	-98.2	156.6	-176.4	-59.7	-179.5	150.1	0	0	112
338	A	29.7	Very low	33.2	Very low	98 Å²	98	150.1 Å²	150.1	81%	0.81	82%	0.815	S	S	*	*			trans	-155.9	126.2	156.6	0	0	0	0	0	109
339	E	30	Very low	34	Very low	169 Å²	169	152.8 Å²	152.8	79%	0.79	81%	0.814	S	S	*	*			trans	-90.4	152.4	-176.7	-62.2	-173	131.1	0	0	113.3
340	N	30.6	Very low	34.9	Very low	144 Å²	144	150.1 Å²	150.1	77%	0.77	81%	0.81	S	S	*	*			trans	42.9	121.1	146.2	-63.6	-26.5	0	0	0	121.3
341	S	28.2	Very low	36.4	Very low	124 Å²	124	154.3 Å²	154.3	87%	0.867	81%	0.809	S	S	*	*				179.9	155.1	113.8	40.8	0	0	0	0	112.8
342	G	28.3	Very low	38.4	Very low	79 Å²	79	153.3 Å²	153.3	81%	0.814	81%	0.808	S	S	*	*			trans	91.4	108.8	154.6	0	0	0	0	0	117
343	E	39.4	Very low	40.7	Very low	198 Å²	198	154.7 Å²	154.7	93%	0.925	80%	0.803	S	S	*	*			trans	-78.4	123	167.3	-58.3	167.8	123	0	0	110.6
344	E	33.1	Very low	43.3	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	77%	0.771	S	S	*	*			trans	-158.6	107.4	142.7	-127.5	-177	142	0	0	113.1
345	L	46.3	Very low	45.9	Very low	147 Å²	147	146 Å²	146	77%	0.77	76%	0.758	S	S	*	*			trans	32.6	91.9	138.4	-117.2	147.7	0	0	0	119.5	Q347	L345-Q347 HydrophobicContact CD2-CG 4.43Å
346	D	36.7	Very low	47.7	Very low	114 Å²	114	140.6 Å²	140.6	61%	0.61	72%	0.723	S	S	*	*			trans	-136.6	105	140	-160.9	6.8	0	0	0	111.7	R348	D346-R348 PolarHBondContact O-N 2.85Å; D346-R348 IonicContact OD1-NE 2.68Å; D346-R348 WeakPolarHBondContact OD2-CD 3.2Å; D346-R348 IonicContact OD2-CZ 2.78Å; D346-R348 IonicContact OD2-NE 2.57Å; D346-R348 PolarHBondContact OD2-NE 3.23Å; D346-R348 IonicContact OD2-NH2 2.61Å
347	Q	46.2	Very low	50.3	Low	177 Å²	177	137.1 Å²	137.1	83%	0.827	72%	0.72	S	S	*	*			trans	-77	61.4	179.4	-72.7	177.6	-17.7	0	0	111.7	L345 Y349	L345-Q347 HydrophobicContact CD2-CG 4.43Å; Q347-Y349 PolarHBondContact O-N 2.94Å
348	R	41.8	Very low	52.8	Low	197 Å²	197	132.6 Å²	132.6	74%	0.743	70%	0.704	S	S	*	*			trans	-96.5	79.8	168.6	-66.2	-173.4	-161.8	-114	-5	110.4	D346 S350	D346-R348 PolarHBondContact O-N 2.85Å; D346-R348 IonicContact OD1-NE 2.68Å; D346-R348 WeakPolarHBondContact OD2-CD 3.2Å; D346-R348 IonicContact OD2-CZ 2.78Å; D346-R348 IonicContact OD2-NE 2.57Å; D346-R348 PolarHBondContact OD2-NE 3.23Å; D346-R348 IonicContact OD2-NH2 2.61Å; R348-S350 VanDerWaalsContact C-N 3.31Å; R348-S350 PolarHBondContact O-N 3.26Å
349	Y	43.4	Very low	55.6	Low	226 Å²	226	130.1 Å²	130.1	89%	0.886	68%	0.681	S	S	*	*			trans	-55.9	92.6	172.2	-140.1	-89	0	0	0	109.8	Q347 K351	Q347-Y349 PolarHBondContact O-N 2.94Å; Y349-K351 VanDerWaalsContact C-N 3.3Å; Y349-K351 PolarHBondContact O-N 3.44Å
350	S	49.8	Very low	58.1	Low	113 Å²	113	124.3 Å²	124.3	79%	0.79	67%	0.666	S	S	*	*			trans	-66.9	92.1	177.9	-78.7	0	0	0	0	108.4	R348 A352	R348-S350 VanDerWaalsContact C-N 3.31Å; R348-S350 PolarHBondContact O-N 3.26Å; S350-A352 VanDerWaalsContact C-N 3.29Å; S350-A352 PolarHBondContact O-N 3.11Å
351	K	58.6	Low	60.7	Low	193 Å²	193	123.5 Å²	123.5	84%	0.839	66%	0.656	S	S	*	*			trans	-64.7	89.2	-175.5	-151.1	169	-167.4	168.1	0	108.8	Y349 K353	Y349-K351 VanDerWaalsContact C-N 3.3Å; Y349-K351 PolarHBondContact O-N 3.44Å; K351-K353 PolarHBondContact O-N 2.81Å; K351-K353 VanDerWaalsContact O-N 3.1Å
352	A	69.6	Low	63.5	Low	89 Å²	89	121.8 Å²	121.8	74%	0.736	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-52.7	118	-173.8	0	0	0	0	0	109.5	S350 P354	S350-A352 VanDerWaalsContact C-N 3.29Å; S350-A352 PolarHBondContact O-N 3.11Å; A352-P354 WeakPolarHBondContact O-CD 3.31Å
353	K	79.6	Confident	66.4	Low	154 Å²	154	120 Å²	120	67%	0.67	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-64.4	121	-174.2	-73.2	178	-178.3	170.2	0	108.7	K351 M355 V362	K351-K353 PolarHBondContact O-N 2.81Å; K351-K353 VanDerWaalsContact O-N 3.1Å; K353-M355 PolarHBondContact O-N 3.15Å; K353-V362 HydrophobicContact CB-CG1 3.33Å; K353-V362 HydrophobicContact CD-CG1 4.18Å; K353-V362 HydrophobicContact CG-CG1 4.39Å
354	P	81.1	Confident	68.6	Low	34 Å²	34	115 Å²	115	22%	0.221	60%	0.596	C	S	.	*	P	Polyproline II helix	trans	-60.2	120.9	-170.7	19.1	-31.2	0	0	0	111.5	A352 F363 E365 A366 L369	A352-P354 WeakPolarHBondContact O-CD 3.31Å; P354-F363 VanDerWaalsContact CD-O 3.27Å; P354-F363 WeakPolarHBondContact CD-O 3.4Å; P354-F363 WeakPolarHBondContact O-CB 3.45Å; P354-F363 PolarHBondContact O-N 3.47Å; P354-E365 VanDerWaalsContact CG-C 3.43Å; P354-A366 HydrophobicContact CG-CB 4.39Å; P354-L369 HydrophobicContact CB-CB 4.28Å; P354-L369 HydrophobicContact CB-CD2 3.75Å
355	M	82.5	Confident	71.2	Confident	102 Å²	102	110.6 Å²	110.6	50%	0.502	58%	0.576	S	S	.	*	B	Isolated β-bridge	trans	-105.3	154.1	-176.7	70.6	-176.1	-67.8	0	0	112.8	K353 N357 K361 V362 L369	K353-M355 PolarHBondContact O-N 3.15Å; M355-N357 PolarHBondContact O-OD1 2.93Å; M355-K361 CarbonylContact C-O 3.56Å; M355-K361 WeakPolarHBondContact CA-O 3.42Å; M355-V362 HydrophobicContact CB-CG2 4.14Å; M355-L369 VanDerWaalsContact O-CD2 3.25Å; M355-L369 WeakPolarHBondContact O-CD2 3.24Å
356	C	88.1	Confident	72.9	Confident	0 Å²	0	106.3 Å²	106.3	0%	0	56%	0.562	C	S	.	*			trans	-89.2	112.7	174.4	175.7	0	0	0	0	111.1	T358 C359 G360 K361 F363 L369 H372 M373 H376	C356-T358 PolarHBondContact O-N 3.42Å; C356-T358 VanDerWaalsContact O-N 3.11Å; C356-T358 PolarHBondContact SG-N 3.34Å; C356-T358 VanDerWaalsContact SG-N 3.44Å; C356-C359 PolarHBondContact O-N 3.03Å; C356-C359 VanDerWaalsContact SG-SG 3.65Å; C356-G360 WeakPolarHBondContact O-CA 3.36Å; C356-G360 PolarHBondContact O-N 3.43Å; C356-K361 PolarHBondContact N-O 3.44Å; C356-F363 HydrophobicContact CB-CE2 4.06Å; C356-L369 HydrophobicContact CB-CD1 3.68Å; C356-H372 PolarHBondContact SG-NE2 3.14Å; C356-M373 HydrophobicContact CB-SD 4.31Å; C356-H376 VanDerWaalsContact SG-CD2 3.59Å; C356-H376 PolarHBondContact SG-NE2 2.98Å
357	N	82.9	Confident	75.1	Confident	152 Å²	152	102.8 Å²	102.8	81%	0.813	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.2	178.9	-57.4	26.9	0	0	0	113.3	M355	M355-N357 PolarHBondContact O-OD1 2.93Å
358	T	83.8	Confident	76.9	Confident	88 Å²	88	95.1 Å²	95.1	54%	0.54	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-23.1	-179.8	-43.5	0	0	0	0	113.8	C356 H376	C356-T358 PolarHBondContact O-N 3.42Å; C356-T358 VanDerWaalsContact O-N 3.11Å; C356-T358 PolarHBondContact SG-N 3.34Å; C356-T358 VanDerWaalsContact SG-N 3.44Å; T358-H376 HydrophobicContact CG2-CB 4.3Å
359	C	86.9	Confident	79.1	Confident	46 Å²	46	87.2 Å²	87.2	31%	0.311	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.2	14.5	-177.7	75.8	0	0	0	0	115.5	C356 K361 H372 H376	C356-C359 PolarHBondContact O-N 3.03Å; C356-C359 VanDerWaalsContact SG-SG 3.65Å; C359-K361 PolarHBondContact O-N 3.07Å; C359-H372 VanDerWaalsContact SG-CE1 3.59Å; C359-H372 PolarHBondContact SG-NE2 3.13Å; C359-H376 WeakPolarHBondContact CB-CE1 3.39Å; C359-H376 WeakPolarHBondContact CB-NE2 3.43Å; C359-H376 PolarHBondContact SG-NE2 3.41Å
360	G	83.7	Confident	80.9	Confident	47 Å²	47	85.3 Å²	85.3	49%	0.485	48%	0.476	S	S	.	.			trans	67.6	-4.3	177	0	0	0	0	0	116.2	C356 V362	C356-G360 WeakPolarHBondContact O-CA 3.36Å; C356-G360 PolarHBondContact O-N 3.43Å; G360-V362 PolarHBondContact O-N 3.14Å
361	K	84.7	Confident	82.5	Confident	128 Å²	128	84.8 Å²	84.8	56%	0.557	46%	0.457	S	S	*	.			trans	-67.3	125.6	-175.3	-72.4	-178.4	-177.2	-180	0	111.7	M355 C356 C359 F363	M355-K361 CarbonylContact C-O 3.56Å; M355-K361 WeakPolarHBondContact CA-O 3.42Å; C356-K361 PolarHBondContact N-O 3.44Å; C359-K361 PolarHBondContact O-N 3.07Å; K361-F363 HydrophobicContact CB-CE2 3.74Å; K361-F363 HydrophobicContact CB-CZ 3.86Å; K361-F363 VanDerWaalsContact O-CD2 3.31Å; K361-F363 WeakPolarHBondContact O-CD2 3.2Å; K361-F363 WeakPolarHBondContact O-CE2 3.47Å
362	V	87.8	Confident	83.8	Confident	88 Å²	88	76.6 Å²	76.6	53%	0.533	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-90.6	134	177	-178.1	0	0	0	0	109.8	K353 M355 G360	K353-V362 HydrophobicContact CB-CG1 3.33Å; K353-V362 HydrophobicContact CD-CG1 4.18Å; K353-V362 HydrophobicContact CG-CG1 4.39Å; M355-V362 HydrophobicContact CB-CG2 4.14Å; G360-V362 PolarHBondContact O-N 3.14Å
363	F	88.5	Confident	84.5	Confident	41 Å²	41	74.8 Å²	74.8	18%	0.18	40%	0.398	C	S	.	.			trans	-115.2	151.4	-180	-63.7	-87.8	0	0	0	111	P354 C356 K361 E365 L369 H372	P354-F363 VanDerWaalsContact CD-O 3.27Å; P354-F363 WeakPolarHBondContact CD-O 3.4Å; P354-F363 WeakPolarHBondContact O-CB 3.45Å; P354-F363 PolarHBondContact O-N 3.47Å; C356-F363 HydrophobicContact CB-CE2 4.06Å; K361-F363 HydrophobicContact CB-CE2 3.74Å; K361-F363 HydrophobicContact CB-CZ 3.86Å; K361-F363 VanDerWaalsContact O-CD2 3.31Å; K361-F363 WeakPolarHBondContact O-CD2 3.2Å; K361-F363 WeakPolarHBondContact O-CE2 3.47Å; F363-E365 VanDerWaalsContact C-N 3.26Å; F363-E365 PolarHBondContact O-N 2.86Å; F363-L369 HydrophobicContact CB-CB 4.26Å; F363-L369 HydrophobicContact CD2-CB 3.87Å; F363-L369 HydrophobicContact CD2-CD1 3.76Å; F363-L369 HydrophobicContact CD2-CG 4.4Å; F363-L369 HydrophobicContact CE2-CD1 3.88Å; F363-L369 HydrophobicContact CG-CB 4.15Å; F363-H372 HydrophobicContact CE1-CB 3.81Å; F363-H372 HydrophobicContact CE2-CB 4.06Å; F363-H372 AromaticContact CE2-CD2 3.48Å; F363-H372 VanDerWaalsContact CE2-CD2 3.48Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.45Å; F363-H372 AromaticContact CE2-CG 3.79Å; F363-H372 HydrophobicContact CZ-CB 3.46Å; F363-H372 VanDerWaalsContact CZ-CB 3.46Å; F363-H372 AromaticContact CZ-CD2 3.39Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.23Å; F363-H372 AromaticContact CZ-CG 3.23Å; F363-H372 AromaticContact CZ-ND1 3.76Å; F363-H372 AromaticContact CZ-NE2 3.98Å
364	S	85.6	Confident	84.8	Confident	92 Å²	92	70.5 Å²	70.5	64%	0.643	38%	0.378	S	S	*	.	S	Bend	trans	-67.8	-27.3	172.7	51.6	0	0	0	0	112.9
365	E	86.8	Confident	84.9	Confident	94 Å²	94	74 Å²	74	44%	0.439	39%	0.393	S	S	.	.	S	Bend	trans	-142	144.8	-170	-66.4	163.1	-137.5	0	0	111.7	P354 F363 S367 S368 L369	P354-E365 VanDerWaalsContact CG-C 3.43Å; F363-E365 VanDerWaalsContact C-N 3.26Å; F363-E365 PolarHBondContact O-N 2.86Å; E365-S367 VanDerWaalsContact CB-OG 3.26Å; E365-S367 WeakPolarHBondContact CB-OG 3.45Å; E365-S367 PolarHBondContact O-N 2.82Å; E365-S367 PolarHBondContact OE2-OG 3.14Å; E365-S368 PolarHBondContact O-N 3.39Å; E365-S368 VanDerWaalsContact O-N 3.09Å; E365-L369 PolarHBondContact O-N 3Å; E365-L369 VanDerWaalsContact O-N 3.08Å
366	A	82.6	Confident	84.9	Confident	58 Å²	58	73.3 Å²	73.3	48%	0.479	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-29.4	175.9	0	0	0	0	0	112.4	P354 S368 L369 R370	P354-A366 HydrophobicContact CG-CB 4.39Å; A366-S368 VanDerWaalsContact C-N 3.31Å; A366-S368 PolarHBondContact O-N 3.24Å; A366-L369 PolarHBondContact O-N 3.11Å; A366-R370 VanDerWaalsContact O-CB 3.29Å; A366-R370 WeakPolarHBondContact O-CB 3.35Å; A366-R370 PolarHBondContact O-N 3.05Å
367	S	82.7	Confident	84.6	Confident	40 Å²	40	81.1 Å²	81.1	28%	0.28	42%	0.423	S	S	.	.	H	α-helix	trans	-56.4	-43.7	170.9	64.6	0	0	0	0	111.7	E365 R371	E365-S367 VanDerWaalsContact CB-OG 3.26Å; E365-S367 WeakPolarHBondContact CB-OG 3.45Å; E365-S367 PolarHBondContact O-N 2.82Å; E365-S367 PolarHBondContact OE2-OG 3.14Å; S367-R371 WeakPolarHBondContact O-CB 3.36Å; S367-R371 PolarHBondContact O-N 3.15Å
368	S	85.5	Confident	84.5	Confident	16 Å²	16	76.1 Å²	76.1	11%	0.112	41%	0.407	C	S	.	.	H	α-helix	trans	-77.4	-37.1	-178.1	-76	0	0	0	0	111.8	E365 A366 R371 H372	E365-S368 PolarHBondContact O-N 3.39Å; E365-S368 VanDerWaalsContact O-N 3.09Å; A366-S368 VanDerWaalsContact C-N 3.31Å; A366-S368 PolarHBondContact O-N 3.24Å; S368-R371 PolarHBondContact O-N 3.4Å; S368-R371 PolarHBondContact OG-NH2 3.15Å; S368-H372 VanDerWaalsContact O-CB 3.32Å; S368-H372 WeakPolarHBondContact O-CB 3.38Å; S368-H372 PolarHBondContact O-N 3.1Å
369	L	86.6	Confident	84.5	Confident	31 Å²	31	75.5 Å²	75.5	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-59.5	-52.1	167.4	174.1	59.5	0	0	0	111.1	P354 M355 C356 F363 E365 A366 R371 H372 M373	P354-L369 HydrophobicContact CB-CB 4.28Å; P354-L369 HydrophobicContact CB-CD2 3.75Å; M355-L369 VanDerWaalsContact O-CD2 3.25Å; M355-L369 WeakPolarHBondContact O-CD2 3.24Å; C356-L369 HydrophobicContact CB-CD1 3.68Å; F363-L369 HydrophobicContact CB-CB 4.26Å; F363-L369 HydrophobicContact CD2-CB 3.87Å; F363-L369 HydrophobicContact CD2-CD1 3.76Å; F363-L369 HydrophobicContact CD2-CG 4.4Å; F363-L369 HydrophobicContact CE2-CD1 3.88Å; F363-L369 HydrophobicContact CG-CB 4.15Å; E365-L369 PolarHBondContact O-N 3Å; E365-L369 VanDerWaalsContact O-N 3.08Å; A366-L369 PolarHBondContact O-N 3.11Å; L369-R371 VanDerWaalsContact C-N 3.29Å; L369-R371 PolarHBondContact O-N 3.16Å; L369-H372 CarbonylContact O-C 3.57Å; L369-H372 WeakPolarHBondContact O-CA 3.18Å; L369-H372 WeakPolarHBondContact O-CB 3.42Å; L369-H372 PolarHBondContact O-N 3.19Å; L369-M373 HydrophobicContact CD1-CG 4.07Å; L369-M373 HydrophobicContact CD1-SD 3.98Å; L369-M373 HydrophobicContact CG-CG 4.36Å; L369-M373 WeakPolarHBondContact O-CG 3.34Å; L369-M373 PolarHBondContact O-N 2.84Å
370	R	81.3	Confident	84.4	Confident	185 Å²	185	78.9 Å²	78.9	70%	0.698	41%	0.412	S	S	*	.	H	α-helix	trans	-56	-43.4	178.6	-170.4	-172.5	-59.8	146.4	0.6	111.7	A366 H372 M373	A366-R370 VanDerWaalsContact O-CB 3.29Å; A366-R370 WeakPolarHBondContact O-CB 3.35Å; A366-R370 PolarHBondContact O-N 3.05Å; R370-H372 VanDerWaalsContact C-N 3.35Å; R370-H372 PolarHBondContact O-N 3.27Å; R370-M373 PolarHBondContact O-N 3.3Å
371	R	84.2	Confident	84.4	Confident	103 Å²	103	80 Å²	80	39%	0.389	41%	0.411	S	S	.	.	H	α-helix	trans	-62.7	-38.4	173.7	170.2	171.4	58.9	171.1	-6.9	112.6	S367 S368 L369 R374 Q393	S367-R371 WeakPolarHBondContact O-CB 3.36Å; S367-R371 PolarHBondContact O-N 3.15Å; S368-R371 PolarHBondContact O-N 3.4Å; S368-R371 PolarHBondContact OG-NH2 3.15Å; L369-R371 VanDerWaalsContact C-N 3.29Å; L369-R371 PolarHBondContact O-N 3.16Å; R371-R374 WeakPolarHBondContact O-CB 3.48Å; R371-Q393 VanDerWaalsContact CD-CD 3.49Å; R371-Q393 HydrophobicContact CG-CG 4.32Å
372	H	85.7	Confident	84.5	Confident	20 Å²	20	77.6 Å²	77.6	9%	0.093	40%	0.399	C	S	.	.	H	α-helix	trans	-70.3	-37.4	176.2	167.4	71.9	0	0	0	112.6	C356 C359 F363 S368 L369 R370 R374 I375 H376	C356-H372 PolarHBondContact SG-NE2 3.14Å; C359-H372 VanDerWaalsContact SG-CE1 3.59Å; C359-H372 PolarHBondContact SG-NE2 3.13Å; F363-H372 HydrophobicContact CE1-CB 3.81Å; F363-H372 HydrophobicContact CE2-CB 4.06Å; F363-H372 AromaticContact CE2-CD2 3.48Å; F363-H372 VanDerWaalsContact CE2-CD2 3.48Å; F363-H372 WeakPolarHBondContact CE2-CD2 3.45Å; F363-H372 AromaticContact CE2-CG 3.79Å; F363-H372 HydrophobicContact CZ-CB 3.46Å; F363-H372 VanDerWaalsContact CZ-CB 3.46Å; F363-H372 AromaticContact CZ-CD2 3.39Å; F363-H372 WeakPolarHBondContact CZ-CD2 3.23Å; F363-H372 AromaticContact CZ-CG 3.23Å; F363-H372 AromaticContact CZ-ND1 3.76Å; F363-H372 AromaticContact CZ-NE2 3.98Å; S368-H372 VanDerWaalsContact O-CB 3.32Å; S368-H372 WeakPolarHBondContact O-CB 3.38Å; S368-H372 PolarHBondContact O-N 3.1Å; L369-H372 CarbonylContact O-C 3.57Å; L369-H372 WeakPolarHBondContact O-CA 3.18Å; L369-H372 WeakPolarHBondContact O-CB 3.42Å; L369-H372 PolarHBondContact O-N 3.19Å; R370-H372 VanDerWaalsContact C-N 3.35Å; R370-H372 PolarHBondContact O-N 3.27Å; H372-R374 PolarHBondContact O-N 3.45Å; H372-R374 VanDerWaalsContact O-N 3.13Å; H372-I375 VanDerWaalsContact O-CB 3.24Å; H372-I375 WeakPolarHBondContact O-CB 3.38Å; H372-I375 WeakPolarHBondContact O-CG1 3.29Å; H372-I375 PolarHBondContact O-N 2.84Å; H372-H376 AromaticContact CD2-NE2 3.43Å; H372-H376 PolarHBondContact CD2-NE2 3.03Å; H372-H376 AromaticContact CE1-NE2 2.83Å; H372-H376 PolarHBondContact CE1-NE2 3.29Å; H372-H376 AromaticContact NE2-CD2 3.58Å; H372-H376 AromaticContact NE2-NE2 2.29Å; H372-H376 PolarHBondContact NE2-NE2 3.47Å
373	M	83.3	Confident	84.4	Confident	51 Å²	51	77.3 Å²	77.3	25%	0.251	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-24.2	176.6	-66.1	-51.8	-68.4	0	0	113.3	C356 L369 R370 I375 H376 K377	C356-M373 HydrophobicContact CB-SD 4.31Å; L369-M373 HydrophobicContact CD1-CG 4.07Å; L369-M373 HydrophobicContact CD1-SD 3.98Å; L369-M373 HydrophobicContact CG-CG 4.36Å; L369-M373 WeakPolarHBondContact O-CG 3.34Å; L369-M373 PolarHBondContact O-N 2.84Å; R370-M373 PolarHBondContact O-N 3.3Å; M373-I375 PolarHBondContact O-N 2.83Å; M373-H376 PolarHBondContact O-N 3.07Å; M373-K377 PolarHBondContact O-N 3.15Å
374	R	86.2	Confident	84.5	Confident	64 Å²	64	75.4 Å²	75.4	24%	0.242	39%	0.389	C	S	.	.	H	α-helix	trans	-61.6	-24	170.4	-68.7	-169.9	-76.8	-157.8	-8.2	113.7	R371 H372 G378 V379 T392	R371-R374 WeakPolarHBondContact O-CB 3.48Å; H372-R374 PolarHBondContact O-N 3.45Å; H372-R374 VanDerWaalsContact O-N 3.13Å; R374-G378 CarbonylContact O-C 3.52Å; R374-G378 PolarHBondContact O-N 3.15Å; R374-V379 PolarHBondContact O-N 3.02Å; R374-V379 VanDerWaalsContact O-N 3.16Å; R374-T392 PolarHBondContact NE-O 3.37Å; R374-T392 PolarHBondContact NH1-O 3.28Å; R374-T392 PolarHBondContact NH2-O 3.29Å
375	I	83.2	Confident	84.5	Confident	108 Å²	108	75 Å²	75	55%	0.554	38%	0.377	S	S	*	.	H	α-helix	trans	-70.3	-48.3	174.8	-56	175.2	0	0	0	109.5	H372 M373 G378	H372-I375 VanDerWaalsContact O-CB 3.24Å; H372-I375 WeakPolarHBondContact O-CB 3.38Å; H372-I375 WeakPolarHBondContact O-CG1 3.29Å; H372-I375 PolarHBondContact O-N 2.84Å; M373-I375 PolarHBondContact O-N 2.83Å; I375-G378 PolarHBondContact O-N 3.27Å
376	H	82.6	Confident	84.4	Confident	87 Å²	87	74.1 Å²	74.1	40%	0.403	38%	0.375	S	S	.	.	H	α-helix	trans	-67.4	-41.3	179	-65.8	-59.1	0	0	0	112.9	C356 T358 C359 H372 M373 G378	C356-H376 VanDerWaalsContact SG-CD2 3.59Å; C356-H376 PolarHBondContact SG-NE2 2.98Å; T358-H376 HydrophobicContact CG2-CB 4.3Å; C359-H376 WeakPolarHBondContact CB-CE1 3.39Å; C359-H376 WeakPolarHBondContact CB-NE2 3.43Å; C359-H376 PolarHBondContact SG-NE2 3.41Å; H372-H376 AromaticContact CD2-NE2 3.43Å; H372-H376 PolarHBondContact CD2-NE2 3.03Å; H372-H376 AromaticContact CE1-NE2 2.83Å; H372-H376 PolarHBondContact CE1-NE2 3.29Å; H372-H376 AromaticContact NE2-CD2 3.58Å; H372-H376 AromaticContact NE2-NE2 2.29Å; H372-H376 PolarHBondContact NE2-NE2 3.47Å; M373-H376 PolarHBondContact O-N 3.07Å; H376-G378 PolarHBondContact O-N 3.33Å
377	K	81.9	Confident	84.6	Confident	165 Å²	165	73.8 Å²	73.8	72%	0.717	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-1.5	176.3	-63.5	-167	174.1	-167.3	0	113.9	M373 V379	M373-K377 PolarHBondContact O-N 3.15Å; K377-V379 HydrophobicContact CB-CG2 3.87Å; K377-V379 PolarHBondContact O-N 3.25Å
378	G	82.1	Confident	84.8	Confident	47 Å²	47	74.5 Å²	74.5	49%	0.485	38%	0.382	S	S	.	.			trans	65.4	-2.5	-176.5	0	0	0	0	0	116.2	R374 I375 H376 K380	R374-G378 CarbonylContact O-C 3.52Å; R374-G378 PolarHBondContact O-N 3.15Å; I375-G378 PolarHBondContact O-N 3.27Å; H376-G378 PolarHBondContact O-N 3.33Å; G378-K380 PolarHBondContact O-N 3.02Å
379	V	82.2	Confident	84.8	Confident	74 Å²	74	79.8 Å²	79.8	45%	0.448	40%	0.403	S	S	.	.			trans	-66.1	119.1	-172.2	-178	0	0	0	0	111.2	R374 K377 P381	R374-V379 PolarHBondContact O-N 3.02Å; R374-V379 VanDerWaalsContact O-N 3.16Å; K377-V379 HydrophobicContact CB-CG2 3.87Å; K377-V379 PolarHBondContact O-N 3.25Å; V379-P381 HydrophobicContact CG1-CG 4.01Å
380	K	86.6	Confident	84.8	Confident	117 Å²	117	80 Å²	80	51%	0.509	41%	0.41	S	S	.	.			trans	-123	81.4	-179	-72.3	163.4	174.1	-178.1	0	110.4	G378 Y382 A390 F391 T392	G378-K380 PolarHBondContact O-N 3.02Å; K380-Y382 PolarHBondContact O-N 3.41Å; K380-Y382 VanDerWaalsContact O-N 3.14Å; K380-A390 HydrophobicContact CB-CB 3.62Å; K380-A390 HydrophobicContact CD-CB 4.1Å; K380-A390 WeakPolarHBondContact CD-O 3.41Å; K380-A390 HydrophobicContact CG-CB 4.46Å; K380-F391 CarbonylContact C-O 3.56Å; K380-F391 VanDerWaalsContact CA-O 3.28Å; K380-F391 WeakPolarHBondContact CA-O 3.48Å; K380-T392 HydrophobicContact CG-CG2 3.84Å
381	P	82.6	Confident	85.1	Confident	70 Å²	70	73.4 Å²	73.4	46%	0.455	39%	0.386	S	S	.	.			trans	-65.9	-18.4	-170.7	-21.2	33.3	0	0	0	115.1	V379	V379-P381 HydrophobicContact CG1-CG 4.01Å
382	Y	86.6	Confident	85.2	Confident	78 Å²	78	70.1 Å²	70.1	31%	0.306	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	97	-168.9	-53.9	-79.9	0	0	0	110.1	K380 A390 F391 C394	K380-Y382 PolarHBondContact O-N 3.41Å; K380-Y382 VanDerWaalsContact O-N 3.14Å; Y382-A390 CarbonylContact O-C 3.51Å; Y382-A390 WeakPolarHBondContact O-CA 3.42Å; Y382-F391 WeakPolarHBondContact CD2-O 3.48Å; Y382-F391 PolarHBondContact N-O 3.27Å; Y382-F391 VanDerWaalsContact N-O 3.15Å; Y382-F391 PolarHBondContact O-N 2.83Å; Y382-C394 HydrophobicContact CD1-CB 3.9Å; Y382-C394 HydrophobicContact CE1-CB 3.65Å; Y382-C394 VanDerWaalsContact CE2-N 3.35Å; Y382-C394 HydrophobicContact CG-CB 4.43Å
383	V	86.9	Confident	85.1	Confident	83 Å²	83	71.7 Å²	71.7	50%	0.503	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136.6	-177.6	-172	0	0	0	0	111	A390	V383-A390 HydrophobicContact CG2-CB 3.99Å
384	C	90.5	Very high	85	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.394	C	S	.	.			trans	-83.1	115.5	172.5	-174.2	0	0	0	0	110.9	L386 C387 G388 K389 F391 L397 H404	C384-L386 PolarHBondContact O-N 3.39Å; C384-C387 PolarHBondContact O-N 3.46Å; C384-G388 VanDerWaalsContact O-CA 3.3Å; C384-G388 WeakPolarHBondContact O-CA 3.42Å; C384-G388 PolarHBondContact O-N 2.92Å; C384-K389 WeakPolarHBondContact CB-O 3.41Å; C384-K389 PolarHBondContact N-O 3.41Å; C384-F391 HydrophobicContact CB-CE2 4.38Å; C384-L397 HydrophobicContact CB-CD1 3.58Å; C384-H404 PolarHBondContact SG-NE2 3.28Å
385	H	84.8	Confident	84.9	Confident	84 Å²	84	74.8 Å²	74.8	39%	0.389	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22	178.8	65.2	93.9	0	0	0	114.1	C195	C195-H385 WeakPolarHBondContact CB-NE2 3.45Å
386	L	84.9	Confident	85	Confident	75 Å²	75	73.9 Å²	73.9	39%	0.393	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-20.5	-178.5	-61.8	175.4	0	0	0	114.2	L199 C384 H404	L199-L386 HydrophobicContact CD1-CD2 4.33Å; C384-L386 PolarHBondContact O-N 3.39Å; L386-H404 HydrophobicContact CD1-CB 3.42Å; L386-H404 VanDerWaalsContact CD1-CB 3.42Å
387	C	87.4	Confident	85.3	Confident	52 Å²	52	71.3 Å²	71.3	35%	0.351	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	9.9	-175.9	71.5	0	0	0	0	115.2	C384 K389 H400 H404	C384-C387 PolarHBondContact O-N 3.46Å; C387-K389 PolarHBondContact O-N 2.96Å; C387-H400 PolarHBondContact SG-NE2 3.07Å; C387-H404 PolarHBondContact SG-NE2 3.33Å; C387-H404 VanDerWaalsContact SG-NE2 3.45Å
388	G	85.1	Confident	85.4	Confident	55 Å²	55	69.9 Å²	69.9	57%	0.567	39%	0.388	S	S	*	.			trans	68.2	-2.4	-179.5	0	0	0	0	0	116	C384 A390	C384-G388 VanDerWaalsContact O-CA 3.3Å; C384-G388 WeakPolarHBondContact O-CA 3.42Å; C384-G388 PolarHBondContact O-N 2.92Å; G388-A390 PolarHBondContact O-N 3.33Å
389	K	85.8	Confident	85.7	Confident	127 Å²	127	69 Å²	69	55%	0.552	37%	0.373	S	S	*	.			trans	-69.2	125.3	-175.6	-71	179.6	-177.3	176.4	0	111.5	C384 C387 F391	C384-K389 WeakPolarHBondContact CB-O 3.41Å; C384-K389 PolarHBondContact N-O 3.41Å; C387-K389 PolarHBondContact O-N 2.96Å; K389-F391 HydrophobicContact CB-CE2 3.92Å; K389-F391 HydrophobicContact CB-CZ 4.05Å; K389-F391 WeakPolarHBondContact O-CD2 3.21Å; K389-F391 WeakPolarHBondContact O-CE2 3.45Å
390	A	87.7	Confident	86	Confident	36 Å²	36	66.6 Å²	66.6	30%	0.298	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	141	-178.1	0	0	0	0	0	113	K380 Y382 V383 G388	K380-A390 HydrophobicContact CB-CB 3.62Å; K380-A390 HydrophobicContact CD-CB 4.1Å; K380-A390 WeakPolarHBondContact CD-O 3.41Å; K380-A390 HydrophobicContact CG-CB 4.46Å; Y382-A390 CarbonylContact O-C 3.51Å; Y382-A390 WeakPolarHBondContact O-CA 3.42Å; V383-A390 HydrophobicContact CG2-CB 3.99Å; G388-A390 PolarHBondContact O-N 3.33Å
391	F	87.6	Confident	86	Confident	46 Å²	46	62.9 Å²	62.9	20%	0.202	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.9	-175.2	-59.8	-88.2	0	0	0	112.1	K380 Y382 C384 K389 Q393 Q396 L397 H400	K380-F391 CarbonylContact C-O 3.56Å; K380-F391 VanDerWaalsContact CA-O 3.28Å; K380-F391 WeakPolarHBondContact CA-O 3.48Å; Y382-F391 WeakPolarHBondContact CD2-O 3.48Å; Y382-F391 PolarHBondContact N-O 3.27Å; Y382-F391 VanDerWaalsContact N-O 3.15Å; Y382-F391 PolarHBondContact O-N 2.83Å; C384-F391 HydrophobicContact CB-CE2 4.38Å; K389-F391 HydrophobicContact CB-CE2 3.92Å; K389-F391 HydrophobicContact CB-CZ 4.05Å; K389-F391 WeakPolarHBondContact O-CD2 3.21Å; K389-F391 WeakPolarHBondContact O-CE2 3.45Å; F391-Q393 VanDerWaalsContact C-N 3.35Å; F391-Q396 HydrophobicContact CB-CB 4.2Å; F391-Q396 HydrophobicContact CD1-CB 3.93Å; F391-Q396 HydrophobicContact CG-CB 4.3Å; F391-L397 HydrophobicContact CB-CB 4.5Å; F391-L397 HydrophobicContact CD2-CB 4.07Å; F391-L397 HydrophobicContact CD2-CD1 3.99Å; F391-L397 HydrophobicContact CE2-CD1 4.17Å; F391-L397 HydrophobicContact CG-CB 4.48Å; F391-H400 HydrophobicContact CE1-CB 4.08Å; F391-H400 HydrophobicContact CE2-CB 3.89Å; F391-H400 AromaticContact CE2-CD2 3.31Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.39Å; F391-H400 AromaticContact CE2-CG 3.71Å; F391-H400 HydrophobicContact CZ-CB 3.51Å; F391-H400 AromaticContact CZ-CD2 3.36Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.34Å; F391-H400 AromaticContact CZ-CG 3.31Å
392	T	86	Confident	86.4	Confident	34 Å²	34	61.5 Å²	61.5	21%	0.209	33%	0.33	C	S	.	.	S	Bend	trans	-82.1	-9.4	178.3	57.1	0	0	0	0	113.8	R374 K380	R374-T392 PolarHBondContact NE-O 3.37Å; R374-T392 PolarHBondContact NH1-O 3.28Å; R374-T392 PolarHBondContact NH2-O 3.29Å; K380-T392 HydrophobicContact CG-CG2 3.84Å
393	Q	83.8	Confident	86.4	Confident	53 Å²	53	62.2 Å²	62.2	25%	0.248	34%	0.342	C	S	.	.	S	Bend	trans	-146.3	139.4	-175.7	-60.9	-180	61.2	0	0	111.6	R371 F391 N395 Q396 L397	R371-Q393 VanDerWaalsContact CD-CD 3.49Å; R371-Q393 HydrophobicContact CG-CG 4.32Å; F391-Q393 VanDerWaalsContact C-N 3.35Å; Q393-N395 VanDerWaalsContact C-N 3.34Å; Q393-N395 PolarHBondContact O-N 3.13Å; Q393-Q396 HydrophobicContact CB-CG 4.02Å; Q393-Q396 WeakPolarHBondContact O-CB 3.49Å; Q393-Q396 PolarHBondContact O-N 3.49Å; Q393-L397 PolarHBondContact O-N 3.11Å
394	C	81.3	Confident	86.4	Confident	65 Å²	65	61.9 Å²	61.9	44%	0.439	34%	0.335	S	S	.	.	H	α-helix	trans	-55.4	-44.1	178.7	-177.6	0	0	0	0	112.8	Y382 Q396 L397 K398	Y382-C394 HydrophobicContact CD1-CB 3.9Å; Y382-C394 HydrophobicContact CE1-CB 3.65Å; Y382-C394 VanDerWaalsContact CE2-N 3.35Å; Y382-C394 HydrophobicContact CG-CB 4.43Å; C394-Q396 PolarHBondContact O-N 2.95Å; C394-Q396 VanDerWaalsContact O-N 3.15Å; C394-L397 WeakPolarHBondContact O-CB 3.28Å; C394-L397 PolarHBondContact O-N 2.91Å; C394-K398 PolarHBondContact O-N 3.29Å
395	N	83.1	Confident	86.2	Confident	114 Å²	114	64.1 Å²	64.1	61%	0.61	35%	0.349	S	S	*	.	H	α-helix	trans	-59.4	-28.8	178	-70.6	-10.6	0	0	0	113.5	Q393 T399	Q393-N395 VanDerWaalsContact C-N 3.34Å; Q393-N395 PolarHBondContact O-N 3.13Å; N395-T399 WeakPolarHBondContact O-CG2 3.48Å; N395-T399 PolarHBondContact O-N 3.16Å; N395-T399 PolarHBondContact O-OG1 2.83Å
396	Q	85.6	Confident	86.3	Confident	90 Å²	90	62.6 Å²	62.6	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-78.9	-34.7	176.8	-56.9	-66.8	45.9	0	0	111.6	F391 Q393 C394 T399 H400	F391-Q396 HydrophobicContact CB-CB 4.2Å; F391-Q396 HydrophobicContact CD1-CB 3.93Å; F391-Q396 HydrophobicContact CG-CB 4.3Å; Q393-Q396 HydrophobicContact CB-CG 4.02Å; Q393-Q396 WeakPolarHBondContact O-CB 3.49Å; Q393-Q396 PolarHBondContact O-N 3.49Å; C394-Q396 PolarHBondContact O-N 2.95Å; C394-Q396 VanDerWaalsContact O-N 3.15Å; Q396-T399 PolarHBondContact O-OG1 3.17Å; Q396-H400 WeakPolarHBondContact O-CB 3.28Å; Q396-H400 PolarHBondContact O-N 3.31Å
397	L	88.7	Confident	86.3	Confident	33 Å²	33	64 Å²	64	17%	0.173	36%	0.36	C	S	.	.	H	α-helix	trans	-64	-47.2	168.2	175.1	60.5	0	0	0	110.6	C384 F391 Q393 C394 T399 H400 V401	C384-L397 HydrophobicContact CB-CD1 3.58Å; F391-L397 HydrophobicContact CB-CB 4.5Å; F391-L397 HydrophobicContact CD2-CB 4.07Å; F391-L397 HydrophobicContact CD2-CD1 3.99Å; F391-L397 HydrophobicContact CE2-CD1 4.17Å; F391-L397 HydrophobicContact CG-CB 4.48Å; Q393-L397 PolarHBondContact O-N 3.11Å; C394-L397 WeakPolarHBondContact O-CB 3.28Å; C394-L397 PolarHBondContact O-N 2.91Å; L397-T399 PolarHBondContact O-N 2.81Å; L397-H400 CarbonylContact O-C 3.6Å; L397-H400 WeakPolarHBondContact O-CA 3.39Å; L397-H400 WeakPolarHBondContact O-CB 3.47Å; L397-H400 PolarHBondContact O-N 2.83Å; L397-V401 HydrophobicContact CD1-CG2 4.03Å; L397-V401 HydrophobicContact CG-CG2 4.4Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 2.97Å
398	K	85.4	Confident	86.4	Confident	134 Å²	134	66.4 Å²	66.4	58%	0.583	36%	0.364	S	S	*	.	H	α-helix	trans	-61.7	-40.8	-179.8	-171.8	168	-174.6	167.2	0	112.7	C394	C394-K398 PolarHBondContact O-N 3.29Å
399	T	87.5	Confident	86.5	Confident	29 Å²	29	67.1 Å²	67.1	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-73.7	-26	173.7	56.2	0	0	0	0	113	N395 Q396 L397 Q421	N395-T399 WeakPolarHBondContact O-CG2 3.48Å; N395-T399 PolarHBondContact O-N 3.16Å; N395-T399 PolarHBondContact O-OG1 2.83Å; Q396-T399 PolarHBondContact O-OG1 3.17Å; L397-T399 PolarHBondContact O-N 2.81Å; T399-Q421 HydrophobicContact CG2-CG 4.19Å
400	H	88.3	Confident	86.7	Confident	23 Å²	23	64.9 Å²	64.9	11%	0.106	35%	0.348	C	S	.	.	H	α-helix	trans	-73.1	-39.4	171.7	175.1	50.4	0	0	0	113	C387 F391 Q396 L397 R402 T403 H404	C387-H400 PolarHBondContact SG-NE2 3.07Å; F391-H400 HydrophobicContact CE1-CB 4.08Å; F391-H400 HydrophobicContact CE2-CB 3.89Å; F391-H400 AromaticContact CE2-CD2 3.31Å; F391-H400 WeakPolarHBondContact CE2-CD2 3.39Å; F391-H400 AromaticContact CE2-CG 3.71Å; F391-H400 HydrophobicContact CZ-CB 3.51Å; F391-H400 AromaticContact CZ-CD2 3.36Å; F391-H400 WeakPolarHBondContact CZ-CD2 3.34Å; F391-H400 AromaticContact CZ-CG 3.31Å; Q396-H400 WeakPolarHBondContact O-CB 3.28Å; Q396-H400 PolarHBondContact O-N 3.31Å; L397-H400 CarbonylContact O-C 3.6Å; L397-H400 WeakPolarHBondContact O-CA 3.39Å; L397-H400 WeakPolarHBondContact O-CB 3.47Å; L397-H400 PolarHBondContact O-N 2.83Å; H400-R402 PolarHBondContact O-N 2.89Å; H400-R402 VanDerWaalsContact O-N 3.14Å; H400-T403 PolarHBondContact CE1-OG1 2.81Å; H400-T403 PolarHBondContact ND1-OG1 3.45Å; H400-T403 WeakPolarHBondContact O-CB 3.39Å; H400-T403 PolarHBondContact O-N 3.4Å; H400-T403 PolarHBondContact O-OG1 3.36Å; H400-H404 AromaticContact CD2-NE2 3.95Å; H400-H404 AromaticContact CE1-CE1 3.96Å; H400-H404 AromaticContact CE1-NE2 3.37Å; H400-H404 PolarHBondContact CE1-NE2 3.44Å; H400-H404 AromaticContact NE2-CD2 3.97Å; H400-H404 AromaticContact NE2-CE1 3.94Å; H400-H404 AromaticContact NE2-NE2 3.08Å; H400-H404 PolarHBondContact NE2-NE2 3.2Å
401	V	87.6	Confident	86.7	Confident	39 Å²	39	70.5 Å²	70.5	24%	0.236	37%	0.365	C	S	.	.	H	α-helix	trans	-56.6	-33.6	178.9	168.7	0	0	0	0	111.6	L397 T403 H404 T405	L397-V401 HydrophobicContact CD1-CG2 4.03Å; L397-V401 HydrophobicContact CG-CG2 4.4Å; L397-V401 WeakPolarHBondContact O-CG2 3.38Å; L397-V401 PolarHBondContact O-N 2.97Å; V401-T403 PolarHBondContact O-N 3.34Å; V401-T403 VanDerWaalsContact O-N 3.13Å; V401-H404 PolarHBondContact O-N 3.46Å; V401-T405 HydrophobicContact CG1-CG2 4.12Å; V401-T405 PolarHBondContact O-N 3.12Å; V401-T405 VanDerWaalsContact O-N 3.12Å
402	R	89.6	Confident	86.8	Confident	42 Å²	42	69 Å²	69	16%	0.158	36%	0.36	C	S	.	.	H	α-helix	trans	-58	-22.4	172.2	-63.1	-176.5	175.6	154	2.6	114.8	H400 H404 G406 E407 A420	H400-R402 PolarHBondContact O-N 2.89Å; H400-R402 VanDerWaalsContact O-N 3.14Å; R402-H404 PolarHBondContact O-N 3.4Å; R402-G406 PolarHBondContact O-N 2.8Å; R402-G406 VanDerWaalsContact O-N 3.1Å; R402-E407 HydrophobicContact CB-CB 4.25Å; R402-E407 HydrophobicContact CG-CB 3.99Å; R402-E407 IonicContact NE-OE2 3.7Å; R402-A420 HydrophobicContact CB-CB 4.04Å; R402-A420 WeakPolarHBondContact CD-O 3.48Å; R402-A420 PolarHBondContact NH1-O 2.98Å
403	T	87.8	Confident	86.8	Confident	93 Å²	93	76.8 Å²	76.8	57%	0.571	40%	0.395	S	S	*	.	H	α-helix	trans	-74.7	-16.9	174.4	70.4	0	0	0	0	112.9	H400 V401	H400-T403 PolarHBondContact CE1-OG1 2.81Å; H400-T403 PolarHBondContact ND1-OG1 3.45Å; H400-T403 WeakPolarHBondContact O-CB 3.39Å; H400-T403 PolarHBondContact O-N 3.4Å; H400-T403 PolarHBondContact O-OG1 3.36Å; V401-T403 PolarHBondContact O-N 3.34Å; V401-T403 VanDerWaalsContact O-N 3.13Å
404	H	86.4	Confident	86.8	Confident	76 Å²	76	79.9 Å²	79.9	35%	0.352	41%	0.412	S	S	.	.	H	α-helix	trans	-97.5	-41	174.2	-54.9	-67.3	0	0	0	111.9	C384 L386 C387 H400 V401 R402 G406	C384-H404 PolarHBondContact SG-NE2 3.28Å; L386-H404 HydrophobicContact CD1-CB 3.42Å; L386-H404 VanDerWaalsContact CD1-CB 3.42Å; C387-H404 PolarHBondContact SG-NE2 3.33Å; C387-H404 VanDerWaalsContact SG-NE2 3.45Å; H400-H404 AromaticContact CD2-NE2 3.95Å; H400-H404 AromaticContact CE1-CE1 3.96Å; H400-H404 AromaticContact CE1-NE2 3.37Å; H400-H404 PolarHBondContact CE1-NE2 3.44Å; H400-H404 AromaticContact NE2-CD2 3.97Å; H400-H404 AromaticContact NE2-CE1 3.94Å; H400-H404 AromaticContact NE2-NE2 3.08Å; H400-H404 PolarHBondContact NE2-NE2 3.2Å; V401-H404 PolarHBondContact O-N 3.46Å; R402-H404 PolarHBondContact O-N 3.4Å; H404-G406 VanDerWaalsContact C-N 3.27Å; H404-G406 PolarHBondContact O-N 2.94Å
405	T	86	Confident	87.1	Confident	47 Å²	47	78.5 Å²	78.5	29%	0.288	40%	0.403	S	S	.	.	H	α-helix	trans	-78.3	-10	179.2	63.3	0	0	0	0	113.7	V401 E407	V401-T405 HydrophobicContact CG1-CG2 4.12Å; V401-T405 PolarHBondContact O-N 3.12Å; V401-T405 VanDerWaalsContact O-N 3.12Å; T405-E407 PolarHBondContact O-N 2.8Å; T405-E407 VanDerWaalsContact O-N 3.15Å; T405-E407 WeakPolarHBondContact OG1-CG 3.4Å
406	G	85.9	Confident	87.2	Confident	51 Å²	51	81.2 Å²	81.2	53%	0.526	42%	0.417	S	S	.	.			trans	70	2.9	-175.9	0	0	0	0	0	114.4	R402 H404 K408	R402-G406 PolarHBondContact O-N 2.8Å; R402-G406 VanDerWaalsContact O-N 3.1Å; H404-G406 VanDerWaalsContact C-N 3.27Å; H404-G406 PolarHBondContact O-N 2.94Å; G406-K408 PolarHBondContact O-N 2.93Å
407	E	86	Confident	87.2	Confident	104 Å²	104	80.2 Å²	80.2	49%	0.486	41%	0.412	S	S	.	.			trans	-56	120.4	-179.7	-84.8	178.6	-150	0	0	112	R402 T405 P409	R402-E407 HydrophobicContact CB-CB 4.25Å; R402-E407 HydrophobicContact CG-CB 3.99Å; R402-E407 IonicContact NE-OE2 3.7Å; T405-E407 PolarHBondContact O-N 2.8Å; T405-E407 VanDerWaalsContact O-N 3.15Å; T405-E407 WeakPolarHBondContact OG1-CG 3.4Å; E407-P409 WeakPolarHBondContact O-CD 3.5Å
408	K	89.4	Confident	87.2	Confident	104 Å²	104	79.3 Å²	79.3	45%	0.452	41%	0.41	S	S	.	.			trans	-122.1	72.1	178.2	-76.9	166	167.4	-177.4	0	110.7	G406 Y410 G418 F419 E652	G406-K408 PolarHBondContact O-N 2.93Å; K408-Y410 PolarHBondContact O-N 3.35Å; K408-G418 WeakPolarHBondContact CD-O 3.4Å; K408-G418 WeakPolarHBondContact CE-O 3.39Å; K408-G418 WeakPolarHBondContact CG-O 3.37Å; K408-F419 CarbonylContact C-O 3.58Å; K408-F419 VanDerWaalsContact C-O 3.31Å; K408-F419 WeakPolarHBondContact CA-O 3.42Å; K408-E652 IonicContact NZ-OE2 3.58Å
409	P	88	Confident	87.3	Confident	70 Å²	70	74.8 Å²	74.8	46%	0.455	39%	0.39	S	S	.	.			trans	-67.7	-17.6	-173.1	-20.5	34.3	0	0	0	114.6	E407	E407-P409 WeakPolarHBondContact O-CD 3.5Å
410	Y	89.3	Confident	87.3	Confident	79 Å²	79	74.1 Å²	74.1	31%	0.31	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	92.1	-177.1	-54.3	-75.7	0	0	0	109.4	K408 F419 K422	K408-Y410 PolarHBondContact O-N 3.35Å; Y410-F419 PolarHBondContact N-O 3.05Å; Y410-F419 VanDerWaalsContact N-O 3.12Å; Y410-F419 PolarHBondContact O-N 3.29Å; Y410-K422 HydrophobicContact CD1-CB 3.88Å; Y410-K422 HydrophobicContact CD1-CG 4.32Å; Y410-K422 HydrophobicContact CD2-CB 4.49Å; Y410-K422 VanDerWaalsContact CD2-N 3.29Å; Y410-K422 HydrophobicContact CE1-CB 3.77Å; Y410-K422 HydrophobicContact CE1-CG 4.41Å; Y410-K422 HydrophobicContact CE2-CB 4.37Å; Y410-K422 HydrophobicContact CG-CB 4.24Å
411	K	87.9	Confident	87.2	Confident	154 Å²	154	75.8 Å²	75.8	67%	0.67	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	147.3	175.7	-61.7	-175.6	-179.5	-176.2	0	110.8	L425	K411-L425 VanDerWaalsContact O-CD2 3.29Å; K411-L425 WeakPolarHBondContact O-CD2 3.4Å
412	C	89.1	Confident	87.1	Confident	15 Å²	15	80.6 Å²	80.6	10%	0.101	41%	0.413	C	S	.	.			trans	-77.4	144.1	165.1	-168.6	0	0	0	0	109.4	C415 K417 L425	C412-C415 CarbonylContact C-O 3.31Å; C412-C415 WeakPolarHBondContact CB-O 3.48Å; C412-K417 PolarHBondContact N-O 3.42Å; C412-L425 HydrophobicContact CB-CD1 3.68Å
413	E	85.3	Confident	86.8	Confident	198 Å²	198	82.3 Å²	82.3	93%	0.925	43%	0.431	S	S	*	.	S	Bend	trans	-86.4	-16	177.6	-67.7	165.5	-170.2	0	0	111.6
414	L	84.8	Confident	86.6	Confident	118 Å²	118	81.7 Å²	81.7	62%	0.618	42%	0.421	S	S	*	.	S	Bend	trans	-106.3	-5.8	-175.8	-57.4	174.7	0	0	0	113.3	H433	L414-H433 HydrophobicContact CD1-CB 3.56Å; L414-H433 PolarHBondContact O-CE1 3.15Å
415	C	88.3	Confident	86.7	Confident	35 Å²	35	79.6 Å²	79.6	24%	0.236	41%	0.413	C	S	.	.	S	Bend	trans	-160.4	159.7	165.4	69.9	0	0	0	0	110.9	C412 K417 H428	C412-C415 CarbonylContact C-O 3.31Å; C412-C415 WeakPolarHBondContact CB-O 3.48Å; C415-K417 PolarHBondContact O-N 2.85Å; C415-H428 PolarHBondContact SG-NE2 2.84Å
416	D	84.5	Confident	86.6	Confident	171 Å²	171	80.3 Å²	80.3	91%	0.914	42%	0.417	S	S	*	.	S	Bend	trans	-68.5	13.2	-173.9	-57.7	-60.4	0	0	0	116	G418	D416-G418 PolarHBondContact O-N 3.07Å
417	K	85.2	Confident	86.4	Confident	70 Å²	70	83 Å²	83	30%	0.304	41%	0.414	S	S	.	.			trans	-81.2	119.6	-177	-71.4	175.6	-177.7	160.5	0	111.9	C412 C415 F419	C412-K417 PolarHBondContact N-O 3.42Å; C415-K417 PolarHBondContact O-N 2.85Å; K417-F419 HydrophobicContact CB-CE2 3.88Å; K417-F419 HydrophobicContact CB-CZ 3.89Å; K417-F419 WeakPolarHBondContact O-CE2 3.36Å
418	G	88.4	Confident	86.4	Confident	13 Å²	13	78.6 Å²	78.6	13%	0.134	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	146.4	170.4	0	0	0	0	0	113.8	K408 D416	K408-G418 WeakPolarHBondContact CD-O 3.4Å; K408-G418 WeakPolarHBondContact CE-O 3.39Å; K408-G418 WeakPolarHBondContact CG-O 3.37Å; D416-G418 PolarHBondContact O-N 3.07Å
419	F	88.4	Confident	86.1	Confident	39 Å²	39	75.8 Å²	75.8	17%	0.171	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.2	179.9	-59.3	-84.3	0	0	0	112	K408 Y410 K417 Q421 Q424 L425 H428	K408-F419 CarbonylContact C-O 3.58Å; K408-F419 VanDerWaalsContact C-O 3.31Å; K408-F419 WeakPolarHBondContact CA-O 3.42Å; Y410-F419 PolarHBondContact N-O 3.05Å; Y410-F419 VanDerWaalsContact N-O 3.12Å; Y410-F419 PolarHBondContact O-N 3.29Å; K417-F419 HydrophobicContact CB-CE2 3.88Å; K417-F419 HydrophobicContact CB-CZ 3.89Å; K417-F419 WeakPolarHBondContact O-CE2 3.36Å; F419-Q421 VanDerWaalsContact C-N 3.34Å; F419-Q424 HydrophobicContact CB-CB 4.02Å; F419-Q424 HydrophobicContact CD1-CB 3.89Å; F419-Q424 HydrophobicContact CG-CB 4.2Å; F419-L425 HydrophobicContact CB-CB 4.3Å; F419-L425 HydrophobicContact CD2-CB 3.88Å; F419-L425 HydrophobicContact CD2-CD1 3.88Å; F419-L425 HydrophobicContact CD2-CG 4.49Å; F419-L425 HydrophobicContact CE2-CD1 4.1Å; F419-L425 HydrophobicContact CG-CB 4.27Å; F419-H428 HydrophobicContact CE1-CB 3.82Å; F419-H428 HydrophobicContact CE2-CB 3.84Å; F419-H428 AromaticContact CE2-CD2 3.39Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.32Å; F419-H428 AromaticContact CE2-CG 3.58Å; F419-H428 HydrophobicContact CZ-CB 3.38Å; F419-H428 AromaticContact CZ-CD2 3.45Å; F419-H428 VanDerWaalsContact CZ-CD2 3.45Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.22Å; F419-H428 AromaticContact CZ-CG 3.15Å; F419-H428 AromaticContact CZ-ND1 3.63Å
420	A	87.1	Confident	85.9	Confident	16 Å²	16	78.5 Å²	78.5	13%	0.132	39%	0.388	C	S	.	.	S	Bend	trans	-76.9	-19.8	179.1	0	0	0	0	0	113.1	R402	R402-A420 HydrophobicContact CB-CB 4.04Å; R402-A420 WeakPolarHBondContact CD-O 3.48Å; R402-A420 PolarHBondContact NH1-O 2.98Å
421	Q	86.9	Confident	85.4	Confident	58 Å²	58	78.2 Å²	78.2	27%	0.271	39%	0.391	S	S	.	.	S	Bend	trans	-135.4	142.6	-179.3	-52.8	-174.6	12.3	0	0	112.5	T399 F419 C423 Q424 L425	T399-Q421 HydrophobicContact CG2-CG 4.19Å; F419-Q421 VanDerWaalsContact C-N 3.34Å; Q421-C423 VanDerWaalsContact C-N 3.29Å; Q421-C423 PolarHBondContact O-N 3.04Å; Q421-C423 PolarHBondContact OE1-SG 3.29Å; Q421-C423 VanDerWaalsContact OE1-SG 3.41Å; Q421-Q424 HydrophobicContact CB-CG 4.11Å; Q421-Q424 WeakPolarHBondContact O-CB 3.16Å; Q421-Q424 PolarHBondContact O-N 3.5Å; Q421-L425 PolarHBondContact O-N 3.29Å
422	K	85.6	Confident	84.8	Confident	139 Å²	139	74.6 Å²	74.6	60%	0.604	38%	0.376	S	S	*	.	H	α-helix	trans	-59.7	-36.5	-179.9	-173.5	171.6	-178.9	171.8	0	113.1	Y410 Q424 L425 V426	Y410-K422 HydrophobicContact CD1-CB 3.88Å; Y410-K422 HydrophobicContact CD1-CG 4.32Å; Y410-K422 HydrophobicContact CD2-CB 4.49Å; Y410-K422 VanDerWaalsContact CD2-N 3.29Å; Y410-K422 HydrophobicContact CE1-CB 3.77Å; Y410-K422 HydrophobicContact CE1-CG 4.41Å; Y410-K422 HydrophobicContact CE2-CB 4.37Å; Y410-K422 HydrophobicContact CG-CB 4.24Å; K422-Q424 VanDerWaalsContact C-N 3.29Å; K422-Q424 PolarHBondContact O-N 2.83Å; K422-L425 PolarHBondContact O-N 3.41Å; K422-V426 HydrophobicContact CG-CG2 4.49Å; K422-V426 WeakPolarHBondContact O-CG2 3.37Å; K422-V426 PolarHBondContact O-N 2.93Å
423	C	81.6	Confident	84.4	Confident	78 Å²	78	77 Å²	77	53%	0.527	39%	0.386	S	S	.	.	H	α-helix	trans	-63.6	-33.6	176.8	54.3	0	0	0	0	112.7	Q421 V426 F427	Q421-C423 VanDerWaalsContact C-N 3.29Å; Q421-C423 PolarHBondContact O-N 3.04Å; Q421-C423 PolarHBondContact OE1-SG 3.29Å; Q421-C423 VanDerWaalsContact OE1-SG 3.41Å; C423-V426 PolarHBondContact O-N 2.83Å; C423-F427 VanDerWaalsContact O-CB 3.28Å; C423-F427 WeakPolarHBondContact O-CB 3.47Å; C423-F427 PolarHBondContact O-N 3.41Å
424	Q	85.4	Confident	83.7	Confident	80 Å²	80	68.8 Å²	68.8	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-69.5	-40.7	175.6	-64.7	169.4	-27.1	0	0	111.1	F419 Q421 K422 F427 H428	F419-Q424 HydrophobicContact CB-CB 4.02Å; F419-Q424 HydrophobicContact CD1-CB 3.89Å; F419-Q424 HydrophobicContact CG-CB 4.2Å; Q421-Q424 HydrophobicContact CB-CG 4.11Å; Q421-Q424 WeakPolarHBondContact O-CB 3.16Å; Q421-Q424 PolarHBondContact O-N 3.5Å; K422-Q424 VanDerWaalsContact C-N 3.29Å; K422-Q424 PolarHBondContact O-N 2.83Å; Q424-F427 PolarHBondContact O-N 3.25Å; Q424-H428 VanDerWaalsContact O-CB 3.28Å; Q424-H428 WeakPolarHBondContact O-CB 3.3Å; Q424-H428 PolarHBondContact O-N 3.43Å
425	L	87.4	Confident	82.7	Confident	33 Å²	33	72.1 Å²	72.1	17%	0.173	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-47.7	172.4	170.9	60.8	0	0	0	111.6	K411 C412 F419 Q421 K422 F427 H428 S429	K411-L425 VanDerWaalsContact O-CD2 3.29Å; K411-L425 WeakPolarHBondContact O-CD2 3.4Å; C412-L425 HydrophobicContact CB-CD1 3.68Å; F419-L425 HydrophobicContact CB-CB 4.3Å; F419-L425 HydrophobicContact CD2-CB 3.88Å; F419-L425 HydrophobicContact CD2-CD1 3.88Å; F419-L425 HydrophobicContact CD2-CG 4.49Å; F419-L425 HydrophobicContact CE2-CD1 4.1Å; F419-L425 HydrophobicContact CG-CB 4.27Å; Q421-L425 PolarHBondContact O-N 3.29Å; K422-L425 PolarHBondContact O-N 3.41Å; L425-F427 VanDerWaalsContact C-N 3.31Å; L425-F427 PolarHBondContact O-N 3.01Å; L425-H428 PolarHBondContact O-N 3.45Å; L425-S429 VanDerWaalsContact O-CB 3.31Å; L425-S429 WeakPolarHBondContact O-CB 3.5Å; L425-S429 PolarHBondContact O-N 2.85Å
426	V	84.3	Confident	81.7	Confident	61 Å²	61	78.3 Å²	78.3	37%	0.37	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-41.3	177.8	171.4	0	0	0	0	111.2	K422 C423 R430	K422-V426 HydrophobicContact CG-CG2 4.49Å; K422-V426 WeakPolarHBondContact O-CG2 3.37Å; K422-V426 PolarHBondContact O-N 2.93Å; C423-V426 PolarHBondContact O-N 2.83Å; V426-R430 WeakPolarHBondContact O-CG 3.43Å; V426-R430 PolarHBondContact O-N 3.46Å
427	F	82.5	Confident	81.5	Confident	108 Å²	108	73.4 Å²	73.4	47%	0.474	36%	0.362	S	S	.	.	H	α-helix	trans	-64	-47.6	175.3	-178.4	-86.9	0	0	0	112	C423 Q424 L425 R430 M431 T450	C423-F427 VanDerWaalsContact O-CB 3.28Å; C423-F427 WeakPolarHBondContact O-CB 3.47Å; C423-F427 PolarHBondContact O-N 3.41Å; Q424-F427 PolarHBondContact O-N 3.25Å; L425-F427 VanDerWaalsContact C-N 3.31Å; L425-F427 PolarHBondContact O-N 3.01Å; F427-R430 PolarHBondContact O-N 3.17Å; F427-M431 HydrophobicContact CD1-CG 4.13Å; F427-M431 HydrophobicContact CD1-SD 4.34Å; F427-M431 HydrophobicContact CE1-CG 3.82Å; F427-M431 HydrophobicContact CE1-SD 3.45Å; F427-M431 WeakPolarHBondContact CE1-SD 3.37Å; F427-M431 HydrophobicContact CE2-SD 4.44Å; F427-M431 HydrophobicContact CZ-CG 4.12Å; F427-M431 HydrophobicContact CZ-SD 3.52Å; F427-M431 VanDerWaalsContact CZ-SD 3.52Å; F427-M431 WeakPolarHBondContact O-CB 3.38Å; F427-M431 WeakPolarHBondContact O-CG 3.36Å; F427-M431 PolarHBondContact O-N 3.31Å; F427-T450 HydrophobicContact CD2-CG2 4.27Å; F427-T450 HydrophobicContact CE2-CG2 3.42Å; F427-T450 VanDerWaalsContact CE2-CG2 3.42Å; F427-T450 HydrophobicContact CZ-CG2 3.81Å
428	H	84.8	Confident	81.3	Confident	11 Å²	11	73.9 Å²	73.9	5%	0.051	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-48	177.2	164.7	71.4	0	0	0	111.8	C415 F419 Q424 L425 R430 M431 H432 H433	C415-H428 PolarHBondContact SG-NE2 2.84Å; F419-H428 HydrophobicContact CE1-CB 3.82Å; F419-H428 HydrophobicContact CE2-CB 3.84Å; F419-H428 AromaticContact CE2-CD2 3.39Å; F419-H428 WeakPolarHBondContact CE2-CD2 3.32Å; F419-H428 AromaticContact CE2-CG 3.58Å; F419-H428 HydrophobicContact CZ-CB 3.38Å; F419-H428 AromaticContact CZ-CD2 3.45Å; F419-H428 VanDerWaalsContact CZ-CD2 3.45Å; F419-H428 WeakPolarHBondContact CZ-CD2 3.22Å; F419-H428 AromaticContact CZ-CG 3.15Å; F419-H428 AromaticContact CZ-ND1 3.63Å; Q424-H428 VanDerWaalsContact O-CB 3.28Å; Q424-H428 WeakPolarHBondContact O-CB 3.3Å; Q424-H428 PolarHBondContact O-N 3.43Å; L425-H428 PolarHBondContact O-N 3.45Å; H428-R430 PolarHBondContact O-N 2.96Å; H428-M431 PolarHBondContact O-N 3.29Å; H428-H432 AromaticContact CE1-CD2 3.47Å; H428-H432 PolarHBondContact CE1-CD2 3.02Å; H428-H432 VanDerWaalsContact CE1-CD2 3.47Å; H428-H432 AromaticContact CE1-CG 3.77Å; H428-H432 AromaticContact ND1-CD2 3.15Å; H428-H432 PolarHBondContact ND1-CD2 3.38Å; H428-H432 AromaticContact ND1-CG 3.9Å; H428-H432 AromaticContact ND1-NE2 3.83Å; H428-H432 PolarHBondContact O-N 3.47Å; H428-H433 AromaticContact NE2-CD2 3.96Å; H428-H433 AromaticContact NE2-NE2 3.82Å
429	S	83.1	Confident	81.1	Confident	46 Å²	46	77 Å²	77	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-55.1	-51	175.6	176.8	0	0	0	0	110.5	L425 M431 H432 H433 G434	L425-S429 VanDerWaalsContact O-CB 3.31Å; L425-S429 WeakPolarHBondContact O-CB 3.5Å; L425-S429 PolarHBondContact O-N 2.85Å; S429-M431 VanDerWaalsContact C-N 3.28Å; S429-M431 PolarHBondContact O-N 3.44Å; S429-H432 PolarHBondContact O-N 3.17Å; S429-H433 CarbonylContact O-C 3.59Å; S429-H433 WeakPolarHBondContact O-CA 3.32Å; S429-H433 PolarHBondContact O-N 3.08Å; S429-G434 PolarHBondContact O-N 2.81Å
430	R	83.3	Confident	81.1	Confident	126 Å²	126	80.9 Å²	80.9	48%	0.475	40%	0.398	S	S	.	.	H	α-helix	trans	-60.8	-29.4	175.1	-72.5	176	-178.3	-173.6	-1.5	114.8	V426 F427 H428 A449	V426-R430 WeakPolarHBondContact O-CG 3.43Å; V426-R430 PolarHBondContact O-N 3.46Å; F427-R430 PolarHBondContact O-N 3.17Å; H428-R430 PolarHBondContact O-N 2.96Å; R430-A449 WeakPolarHBondContact O-CB 3.32Å
431	M	79.2	Confident	81.3	Confident	74 Å²	74	80.3 Å²	80.3	37%	0.365	39%	0.393	S	S	.	.	H	α-helix	trans	-86.6	-28.2	-178.4	-74.1	-135.9	67.3	0	0	114.3	F427 H428 S429 A449 T450	F427-M431 HydrophobicContact CD1-CG 4.13Å; F427-M431 HydrophobicContact CD1-SD 4.34Å; F427-M431 HydrophobicContact CE1-CG 3.82Å; F427-M431 HydrophobicContact CE1-SD 3.45Å; F427-M431 WeakPolarHBondContact CE1-SD 3.37Å; F427-M431 HydrophobicContact CE2-SD 4.44Å; F427-M431 HydrophobicContact CZ-CG 4.12Å; F427-M431 HydrophobicContact CZ-SD 3.52Å; F427-M431 VanDerWaalsContact CZ-SD 3.52Å; F427-M431 WeakPolarHBondContact O-CB 3.38Å; F427-M431 WeakPolarHBondContact O-CG 3.36Å; F427-M431 PolarHBondContact O-N 3.31Å; H428-M431 PolarHBondContact O-N 3.29Å; S429-M431 VanDerWaalsContact C-N 3.28Å; S429-M431 PolarHBondContact O-N 3.44Å; M431-A449 HydrophobicContact CG-CB 4.07Å; M431-T450 HydrophobicContact CG-CG2 4.41Å; M431-T450 HydrophobicContact SD-CG2 4.14Å
432	H	76.1	Confident	81.3	Confident	77 Å²	77	83.7 Å²	83.7	36%	0.356	41%	0.413	S	S	.	.	H	α-helix	trans	-115.7	-28	-173.7	-72.9	-83.2	0	0	0	114.7	H428 S429	H428-H432 AromaticContact CE1-CD2 3.47Å; H428-H432 PolarHBondContact CE1-CD2 3.02Å; H428-H432 VanDerWaalsContact CE1-CD2 3.47Å; H428-H432 AromaticContact CE1-CG 3.77Å; H428-H432 AromaticContact ND1-CD2 3.15Å; H428-H432 PolarHBondContact ND1-CD2 3.38Å; H428-H432 AromaticContact ND1-CG 3.9Å; H428-H432 AromaticContact ND1-NE2 3.83Å; H428-H432 PolarHBondContact O-N 3.47Å; S429-H432 PolarHBondContact O-N 3.17Å
433	H	80.3	Confident	81.5	Confident	67 Å²	67	82.1 Å²	82.1	31%	0.31	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.7	-0.1	-174.6	-56	-75.2	0	0	0	112.6	L414 H428 S429 E435	L414-H433 HydrophobicContact CD1-CB 3.56Å; L414-H433 PolarHBondContact O-CE1 3.15Å; H428-H433 AromaticContact NE2-CD2 3.96Å; H428-H433 AromaticContact NE2-NE2 3.82Å; S429-H433 CarbonylContact O-C 3.59Å; S429-H433 WeakPolarHBondContact O-CA 3.32Å; S429-H433 PolarHBondContact O-N 3.08Å; H433-E435 PolarHBondContact O-N 2.85Å
434	G	71.4	Confident	81.9	Confident	25 Å²	25	80.5 Å²	80.5	26%	0.258	40%	0.404	S	S	.	.			trans	-82.1	112.9	178.8	0	0	0	0	0	110.7	S429	S429-G434 PolarHBondContact O-N 2.81Å
435	E	62.6	Low	81.9	Confident	188 Å²	188	82.3 Å²	82.3	88%	0.879	42%	0.416	S	S	*	.	S	Bend	trans	-66.9	-44.5	169	-63.8	176.7	-172.6	0	0	110.3	H433 K437	H433-E435 PolarHBondContact O-N 2.85Å; E435-K437 PolarHBondContact O-N 3.33Å
436	E	67.3	Low	81.7	Confident	164 Å²	164	83.1 Å²	83.1	77%	0.766	42%	0.42	S	S	*	.			trans	-77.1	120.8	174.8	-66.1	-166.9	164.3	0	0	112.4	P438	E436-P438 WeakPolarHBondContact O-CD 3.47Å
437	K	80.8	Confident	81.8	Confident	68 Å²	68	85.5 Å²	85.5	30%	0.296	43%	0.427	S	S	.	.			trans	-110.2	91.9	171.7	-71.1	177	-167.9	165.9	0	108.7	E435 Y439 Q447 F448	E435-K437 PolarHBondContact O-N 3.33Å; K437-Y439 PolarHBondContact O-N 3.21Å; K437-Q447 HydrophobicContact CB-CB 3.56Å; K437-Q447 HydrophobicContact CD-CB 4.21Å; K437-Q447 WeakPolarHBondContact CD-O 3.28Å; K437-F448 CarbonylContact C-O 3.56Å
438	P	80.8	Confident	81.8	Confident	80 Å²	80	81 Å²	81	52%	0.519	41%	0.407	S	S	.	.			trans	-67.1	-15.8	-163.3	-23.6	35.4	0	0	0	115.4	E436	E436-P438 WeakPolarHBondContact O-CD 3.47Å
439	Y	84.9	Confident	81.8	Confident	80 Å²	80	81 Å²	81	31%	0.314	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	89.1	-172.6	-57.1	-76.5	0	0	0	110.3	K437 F448 T450 S451	K437-Y439 PolarHBondContact O-N 3.21Å; Y439-F448 WeakPolarHBondContact CB-O 3.36Å; Y439-F448 WeakPolarHBondContact CD2-O 3.39Å; Y439-F448 PolarHBondContact N-O 3.45Å; Y439-F448 VanDerWaalsContact N-O 3.16Å; Y439-F448 WeakPolarHBondContact O-CD2 3.49Å; Y439-F448 PolarHBondContact O-N 2.9Å; Y439-T450 VanDerWaalsContact CD2-CA 3.49Å; Y439-S451 VanDerWaalsContact CD2-N 3.29Å
440	K	88.2	Confident	81.8	Confident	119 Å²	119	79.4 Å²	79.4	52%	0.517	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	149.6	173.4	65.2	175	-172.6	167.7	0	112	D442 L446 Q447 L454	K440-D442 WeakPolarHBondContact CE-OD1 3.33Å; K440-L446 CarbonylContact C-O 3.52Å; K440-Q447 HydrophobicContact CB-CG 4.36Å; K440-L454 VanDerWaalsContact O-CD2 3.22Å; K440-L454 WeakPolarHBondContact O-CD2 3.31Å
441	C	91	Very high	82	Confident	5 Å²	5	76.3 Å²	76.3	3%	0.034	40%	0.396	C	S	.	.			trans	-94	120.8	168	-179.1	0	0	0	0	110.3	V443 C444 N445 L446 F448 L454 H461	C441-V443 PolarHBondContact O-N 2.79Å; C441-V443 VanDerWaalsContact O-N 3.15Å; C441-C444 PolarHBondContact O-N 2.92Å; C441-N445 WeakPolarHBondContact O-CA 3.31Å; C441-N445 PolarHBondContact O-N 3.2Å; C441-L446 PolarHBondContact N-O 2.99Å; C441-F448 HydrophobicContact CB-CE2 4.19Å; C441-L454 HydrophobicContact CB-CD1 3.56Å; C441-H461 VanDerWaalsContact SG-CD2 3.55Å
442	D	87.8	Confident	82.3	Confident	128 Å²	128	76.4 Å²	76.4	68%	0.684	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-12	-175.3	-51.6	-60.6	0	0	0	114.3	K440	K440-D442 WeakPolarHBondContact CE-OD1 3.33Å
443	V	88.9	Confident	82.8	Confident	106 Å²	106	74.8 Å²	74.8	64%	0.642	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-37.5	179.8	-178.4	0	0	0	0	112.8	C441 H461	C441-V443 PolarHBondContact O-N 2.79Å; C441-V443 VanDerWaalsContact O-N 3.15Å; V443-H461 HydrophobicContact CB-CB 4.47Å; V443-H461 HydrophobicContact CG1-CB 4.21Å; V443-H461 HydrophobicContact CG2-CB 4.28Å
444	C	89.1	Confident	83.3	Confident	45 Å²	45	73.3 Å²	73.3	30%	0.304	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	9.2	-172.6	64.9	0	0	0	0	113.6	C441 L446 H457 H461	C441-C444 PolarHBondContact O-N 2.92Å; C444-L446 HydrophobicContact CB-CD1 4.11Å; C444-L446 PolarHBondContact O-N 3.49Å; C444-L446 VanDerWaalsContact SG-CD1 3.54Å; C444-H457 PolarHBondContact SG-NE2 2.78Å; C444-H461 PolarHBondContact SG-NE2 3.42Å
445	N	85.5	Confident	84.1	Confident	117 Å²	117	78.6 Å²	78.6	63%	0.626	41%	0.408	S	S	*	.			trans	56.2	1.8	-179.5	-64.1	-57.5	0	0	0	117	C441 Q447	C441-N445 WeakPolarHBondContact O-CA 3.31Å; C441-N445 PolarHBondContact O-N 3.2Å; N445-Q447 PolarHBondContact O-N 3.38Å
446	L	84.6	Confident	85.4	Confident	50 Å²	50	72.7 Å²	72.7	26%	0.262	38%	0.381	S	S	.	.			trans	-57.1	132.9	172.5	-89.9	96.2	0	0	0	110.9	K440 C441 C444 F448	K440-L446 CarbonylContact C-O 3.52Å; C441-L446 PolarHBondContact N-O 2.99Å; C444-L446 HydrophobicContact CB-CD1 4.11Å; C444-L446 PolarHBondContact O-N 3.49Å; C444-L446 VanDerWaalsContact SG-CD1 3.54Å; L446-F448 HydrophobicContact CB-CE2 3.89Å; L446-F448 HydrophobicContact CB-CZ 3.94Å; L446-F448 HydrophobicContact CD2-CZ 4.4Å; L446-F448 VanDerWaalsContact O-CE2 3.29Å; L446-F448 WeakPolarHBondContact O-CE2 3.29Å
447	Q	84.8	Confident	86.4	Confident	111 Å²	111	66.3 Å²	66.3	52%	0.519	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	141.9	-178.1	-56.5	-178.8	2.9	0	0	111.7	K437 K440 N445	K437-Q447 HydrophobicContact CB-CB 3.56Å; K437-Q447 HydrophobicContact CD-CB 4.21Å; K437-Q447 WeakPolarHBondContact CD-O 3.28Å; K440-Q447 HydrophobicContact CB-CG 4.36Å; N445-Q447 PolarHBondContact O-N 3.38Å
448	F	84.3	Confident	86.8	Confident	13 Å²	13	64.9 Å²	64.9	6%	0.057	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.5	-177.9	-59.4	-86.1	0	0	0	111.3	K437 Y439 C441 L446 T450 N453 L454 H457	K437-F448 CarbonylContact C-O 3.56Å; Y439-F448 WeakPolarHBondContact CB-O 3.36Å; Y439-F448 WeakPolarHBondContact CD2-O 3.39Å; Y439-F448 PolarHBondContact N-O 3.45Å; Y439-F448 VanDerWaalsContact N-O 3.16Å; Y439-F448 WeakPolarHBondContact O-CD2 3.49Å; Y439-F448 PolarHBondContact O-N 2.9Å; C441-F448 HydrophobicContact CB-CE2 4.19Å; L446-F448 HydrophobicContact CB-CE2 3.89Å; L446-F448 HydrophobicContact CB-CZ 3.94Å; L446-F448 HydrophobicContact CD2-CZ 4.4Å; L446-F448 VanDerWaalsContact O-CE2 3.29Å; L446-F448 WeakPolarHBondContact O-CE2 3.29Å; F448-T450 PolarHBondContact O-N 3.14Å; F448-N453 HydrophobicContact CB-CB 4.3Å; F448-N453 HydrophobicContact CD1-CB 4.02Å; F448-N453 HydrophobicContact CG-CB 4.44Å; F448-L454 HydrophobicContact CB-CB 4.2Å; F448-L454 HydrophobicContact CD2-CB 3.88Å; F448-L454 HydrophobicContact CD2-CD1 3.8Å; F448-L454 HydrophobicContact CD2-CG 4.44Å; F448-L454 HydrophobicContact CE2-CD1 4.03Å; F448-L454 HydrophobicContact CG-CB 4.19Å; F448-H457 HydrophobicContact CE1-CB 3.91Å; F448-H457 HydrophobicContact CE2-CB 4Å; F448-H457 AromaticContact CE2-CD2 3.63Å; F448-H457 AromaticContact CE2-CG 3.71Å; F448-H457 HydrophobicContact CZ-CB 3.52Å; F448-H457 AromaticContact CZ-CD2 3.6Å; F448-H457 AromaticContact CZ-CE1 3.89Å; F448-H457 AromaticContact CZ-CG 3.23Å; F448-H457 AromaticContact CZ-ND1 3.45Å; F448-H457 WeakPolarHBondContact CZ-ND1 3.39Å
449	A	83.6	Confident	87.3	Confident	12 Å²	12	62.6 Å²	62.6	10%	0.099	33%	0.333	C	S	.	.	S	Bend	trans	-70.4	-12.7	174.7	0	0	0	0	0	113.4	R430 M431	R430-A449 WeakPolarHBondContact O-CB 3.32Å; M431-A449 HydrophobicContact CG-CB 4.07Å
450	T	83.7	Confident	87.4	Confident	12 Å²	12	66.6 Å²	66.6	7%	0.074	35%	0.353	C	S	.	.	S	Bend	trans	-142.7	142	-175.6	89.6	0	0	0	0	111.7	F427 M431 Y439 F448 S452 N453 L454	F427-T450 HydrophobicContact CD2-CG2 4.27Å; F427-T450 HydrophobicContact CE2-CG2 3.42Å; F427-T450 VanDerWaalsContact CE2-CG2 3.42Å; F427-T450 HydrophobicContact CZ-CG2 3.81Å; M431-T450 HydrophobicContact CG-CG2 4.41Å; M431-T450 HydrophobicContact SD-CG2 4.14Å; Y439-T450 VanDerWaalsContact CD2-CA 3.49Å; F448-T450 PolarHBondContact O-N 3.14Å; T450-S452 PolarHBondContact O-N 3.34Å; T450-N453 PolarHBondContact O-N 3.37Å; T450-N453 WeakPolarHBondContact OG1-CB 3.44Å; T450-N453 PolarHBondContact OG1-N 2.97Å; T450-N453 PolarHBondContact OG1-OD1 3.28Å; T450-L454 PolarHBondContact O-N 3.01Å; T450-L454 VanDerWaalsContact O-N 3.11Å
451	S	86.9	Confident	87.4	Confident	61 Å²	61	64.4 Å²	64.4	43%	0.427	34%	0.344	S	S	.	.	H	α-helix	trans	-63.2	-29.6	175.4	56.8	0	0	0	0	112.9	Y439 K455	Y439-S451 VanDerWaalsContact CD2-N 3.29Å; S451-K455 WeakPolarHBondContact O-CB 3.48Å; S451-K455 PolarHBondContact O-N 3.4Å
452	S	86.4	Confident	87.3	Confident	77 Å²	77	67.6 Å²	67.6	54%	0.538	37%	0.366	S	S	.	.	H	α-helix	trans	-68.6	-40.2	176.6	-64.4	0	0	0	0	111.7	T450 K455 I456	T450-S452 PolarHBondContact O-N 3.34Å; S452-K455 PolarHBondContact O-N 3.12Å; S452-I456 WeakPolarHBondContact O-CB 3.25Å; S452-I456 WeakPolarHBondContact O-CD1 3.35Å; S452-I456 VanDerWaalsContact O-CG1 3.26Å; S452-I456 WeakPolarHBondContact O-CG1 2.93Å; S452-I456 PolarHBondContact O-N 3.39Å
453	N	87.1	Confident	87.3	Confident	43 Å²	43	63.8 Å²	63.8	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-69	-41.4	176.3	-67.6	9.2	0	0	0	110.7	F448 T450 I456 H457	F448-N453 HydrophobicContact CB-CB 4.3Å; F448-N453 HydrophobicContact CD1-CB 4.02Å; F448-N453 HydrophobicContact CG-CB 4.44Å; T450-N453 PolarHBondContact O-N 3.37Å; T450-N453 WeakPolarHBondContact OG1-CB 3.44Å; T450-N453 PolarHBondContact OG1-N 2.97Å; T450-N453 PolarHBondContact OG1-OD1 3.28Å; N453-I456 PolarHBondContact O-N 3.45Å; N453-H457 WeakPolarHBondContact O-CB 3.44Å; N453-H457 PolarHBondContact O-N 3.33Å
454	L	89.8	Confident	87.3	Confident	35 Å²	35	63.7 Å²	63.7	18%	0.183	35%	0.35	C	S	.	.	H	α-helix	trans	-57.1	-48.9	171	171.6	60.6	0	0	0	111.3	K440 C441 F448 T450 I456 H457 A458	K440-L454 VanDerWaalsContact O-CD2 3.22Å; K440-L454 WeakPolarHBondContact O-CD2 3.31Å; C441-L454 HydrophobicContact CB-CD1 3.56Å; F448-L454 HydrophobicContact CB-CB 4.2Å; F448-L454 HydrophobicContact CD2-CB 3.88Å; F448-L454 HydrophobicContact CD2-CD1 3.8Å; F448-L454 HydrophobicContact CD2-CG 4.44Å; F448-L454 HydrophobicContact CE2-CD1 4.03Å; F448-L454 HydrophobicContact CG-CB 4.19Å; T450-L454 PolarHBondContact O-N 3.01Å; T450-L454 VanDerWaalsContact O-N 3.11Å; L454-I456 VanDerWaalsContact C-N 3.31Å; L454-I456 PolarHBondContact O-N 3.09Å; L454-H457 CarbonylContact O-C 3.56Å; L454-H457 PolarHBondContact O-N 2.94Å; L454-H457 VanDerWaalsContact O-N 3.14Å; L454-A458 WeakPolarHBondContact O-CB 3.16Å; L454-A458 PolarHBondContact O-N 3.45Å
455	K	88.8	Confident	87.4	Confident	136 Å²	136	66.9 Å²	66.9	59%	0.591	36%	0.358	S	S	*	.	H	α-helix	trans	-62.7	-36.1	179.4	-174.5	166.4	-173.6	166.5	0	112.6	S451 S452	S451-K455 WeakPolarHBondContact O-CB 3.48Å; S451-K455 PolarHBondContact O-N 3.4Å; S452-K455 PolarHBondContact O-N 3.12Å
456	I	88.8	Confident	87.6	Confident	64 Å²	64	64.4 Å²	64.4	33%	0.328	35%	0.348	S	S	.	.	H	α-helix	trans	-68.4	-41.5	174.1	-71.4	165.2	0	0	0	110.9	S452 N453 L454 R459 Q478	S452-I456 WeakPolarHBondContact O-CB 3.25Å; S452-I456 WeakPolarHBondContact O-CD1 3.35Å; S452-I456 VanDerWaalsContact O-CG1 3.26Å; S452-I456 WeakPolarHBondContact O-CG1 2.93Å; S452-I456 PolarHBondContact O-N 3.39Å; N453-I456 PolarHBondContact O-N 3.45Å; L454-I456 VanDerWaalsContact C-N 3.31Å; L454-I456 PolarHBondContact O-N 3.09Å; I456-R459 WeakPolarHBondContact O-CB 3.39Å; I456-R459 PolarHBondContact O-N 2.75Å; I456-Q478 HydrophobicContact CG2-CG 4.02Å
457	H	88.9	Confident	88	Confident	31 Å²	31	66 Å²	66	14%	0.144	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-41	176.5	169.9	88.9	0	0	0	112.3	C444 F448 N453 L454 R459 K460 H461	C444-H457 PolarHBondContact SG-NE2 2.78Å; F448-H457 HydrophobicContact CE1-CB 3.91Å; F448-H457 HydrophobicContact CE2-CB 4Å; F448-H457 AromaticContact CE2-CD2 3.63Å; F448-H457 AromaticContact CE2-CG 3.71Å; F448-H457 HydrophobicContact CZ-CB 3.52Å; F448-H457 AromaticContact CZ-CD2 3.6Å; F448-H457 AromaticContact CZ-CE1 3.89Å; F448-H457 AromaticContact CZ-CG 3.23Å; F448-H457 AromaticContact CZ-ND1 3.45Å; F448-H457 WeakPolarHBondContact CZ-ND1 3.39Å; N453-H457 WeakPolarHBondContact O-CB 3.44Å; N453-H457 PolarHBondContact O-N 3.33Å; L454-H457 CarbonylContact O-C 3.56Å; L454-H457 PolarHBondContact O-N 2.94Å; L454-H457 VanDerWaalsContact O-N 3.14Å; H457-R459 PolarHBondContact O-N 3.47Å; H457-R459 VanDerWaalsContact O-N 3.11Å; H457-K460 WeakPolarHBondContact O-CB 3.29Å; H457-K460 PolarHBondContact O-N 3.1Å; H457-H461 AromaticContact CD2-NE2 3.72Å; H457-H461 AromaticContact CE1-NE2 3.74Å; H457-H461 AromaticContact NE2-CD2 3.78Å; H457-H461 AromaticContact NE2-CE1 3.93Å; H457-H461 AromaticContact NE2-NE2 2.98Å; H457-H461 PolarHBondContact NE2-NE2 3.12Å
458	A	88.8	Confident	88.4	Confident	37 Å²	37	63.4 Å²	63.4	31%	0.306	34%	0.343	S	S	.	.	H	α-helix	trans	-58.1	-26.8	179	0	0	0	0	0	113.2	L454 K460 H461 S462	L454-A458 WeakPolarHBondContact O-CB 3.16Å; L454-A458 PolarHBondContact O-N 3.45Å; A458-K460 PolarHBondContact O-N 2.84Å; A458-H461 PolarHBondContact O-N 3.39Å; A458-S462 PolarHBondContact O-N 3.37Å; A458-S462 PolarHBondContact O-OG 3.04Å
459	R	91.4	Very high	88.9	Confident	33 Å²	33	62.9 Å²	62.9	13%	0.125	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-20	171.6	-62.1	-174.2	-179.1	132.6	8.9	114.2	I456 H457 H461 G463 E464 A477	I456-R459 WeakPolarHBondContact O-CB 3.39Å; I456-R459 PolarHBondContact O-N 2.75Å; H457-R459 PolarHBondContact O-N 3.47Å; H457-R459 VanDerWaalsContact O-N 3.11Å; R459-H461 VanDerWaalsContact C-N 3.31Å; R459-G463 WeakPolarHBondContact O-CA 3.35Å; R459-G463 PolarHBondContact O-N 3.39Å; R459-G463 VanDerWaalsContact O-N 3.1Å; R459-E464 HydrophobicContact CB-CB 4.27Å; R459-E464 HydrophobicContact CG-CB 3.96Å; R459-A477 HydrophobicContact CB-CB 4.18Å; R459-A477 VanDerWaalsContact CD-O 3.28Å; R459-A477 WeakPolarHBondContact CD-O 3.27Å; R459-A477 PolarHBondContact NH1-O 3.21Å
460	K	87.8	Confident	89.3	Confident	164 Å²	164	70.1 Å²	70.1	71%	0.713	38%	0.378	S	S	*	.	H	α-helix	trans	-66.4	-36.8	170.9	-170.6	-172.4	174.3	-169	0	110.8	H457 A458	H457-K460 WeakPolarHBondContact O-CB 3.29Å; H457-K460 PolarHBondContact O-N 3.1Å; A458-K460 PolarHBondContact O-N 2.84Å
461	H	88.3	Confident	89.6	Confident	73 Å²	73	77.3 Å²	77.3	34%	0.338	40%	0.404	S	S	.	.	H	α-helix	trans	-84.2	-46.3	-179.1	-56.7	-53.8	0	0	0	112.2	C441 V443 C444 H457 A458 R459 G463	C441-H461 VanDerWaalsContact SG-CD2 3.55Å; V443-H461 HydrophobicContact CB-CB 4.47Å; V443-H461 HydrophobicContact CG1-CB 4.21Å; V443-H461 HydrophobicContact CG2-CB 4.28Å; C444-H461 PolarHBondContact SG-NE2 3.42Å; H457-H461 AromaticContact CD2-NE2 3.72Å; H457-H461 AromaticContact CE1-NE2 3.74Å; H457-H461 AromaticContact NE2-CD2 3.78Å; H457-H461 AromaticContact NE2-CE1 3.93Å; H457-H461 AromaticContact NE2-NE2 2.98Å; H457-H461 PolarHBondContact NE2-NE2 3.12Å; A458-H461 PolarHBondContact O-N 3.39Å; R459-H461 VanDerWaalsContact C-N 3.31Å; H461-G463 VanDerWaalsContact C-N 3.27Å; H461-G463 PolarHBondContact O-N 3.1Å
462	S	88.3	Confident	89.8	Confident	72 Å²	72	77.3 Å²	77.3	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-77.1	-10.2	179.5	62.3	0	0	0	0	114.2	A458 E464	A458-S462 PolarHBondContact O-N 3.37Å; A458-S462 PolarHBondContact O-OG 3.04Å; S462-E464 PolarHBondContact O-N 2.87Å; S462-E464 VanDerWaalsContact O-N 3.13Å; S462-E464 WeakPolarHBondContact OG-CG 3.5Å
463	G	87.8	Confident	90	Very high	47 Å²	47	75.9 Å²	75.9	49%	0.485	40%	0.401	S	S	.	.			trans	67.8	4.3	-174.4	0	0	0	0	0	114.6	R459 H461 K465	R459-G463 WeakPolarHBondContact O-CA 3.35Å; R459-G463 PolarHBondContact O-N 3.39Å; R459-G463 VanDerWaalsContact O-N 3.1Å; H461-G463 VanDerWaalsContact C-N 3.27Å; H461-G463 PolarHBondContact O-N 3.1Å; G463-K465 PolarHBondContact O-N 3.47Å
464	E	89.1	Confident	90.2	Very high	105 Å²	105	78.6 Å²	78.6	49%	0.491	41%	0.412	S	S	.	.			trans	-55.7	119.9	-177.3	-85.9	-174.5	-168.3	0	0	112.2	R459 S462 P466	R459-E464 HydrophobicContact CB-CB 4.27Å; R459-E464 HydrophobicContact CG-CB 3.96Å; S462-E464 PolarHBondContact O-N 2.87Å; S462-E464 VanDerWaalsContact O-N 3.13Å; S462-E464 WeakPolarHBondContact OG-CG 3.5Å; E464-P466 WeakPolarHBondContact O-CD 3.29Å
465	K	91.1	Very high	90.3	Very high	112 Å²	112	84 Å²	84	49%	0.487	43%	0.43	S	S	.	.			trans	-122.6	81.1	174.4	-69.3	164.2	-179.6	177.4	0	109.9	G463 Y467 R475 F476	G463-K465 PolarHBondContact O-N 3.47Å; K465-Y467 VanDerWaalsContact C-N 3.33Å; K465-Y467 PolarHBondContact O-N 3.24Å; K465-R475 HydrophobicContact CB-CB 3.59Å; K465-R475 HydrophobicContact CD-CB 4.24Å; K465-R475 HydrophobicContact CG-CB 4.48Å; K465-R475 PolarHBondContact O-NE 3.33Å; K465-R475 VanDerWaalsContact O-NE 3.14Å; K465-R475 PolarHBondContact O-NH2 3.14Å; K465-F476 CarbonylContact C-O 3.23Å; K465-F476 VanDerWaalsContact C-O 3.31Å; K465-F476 VanDerWaalsContact CA-O 3.29Å; K465-F476 WeakPolarHBondContact CA-O 3.48Å
466	P	90.6	Very high	90.4	Very high	64 Å²	64	79 Å²	79	42%	0.416	41%	0.408	S	S	.	.			trans	-72.9	-23.4	-174.1	-18	33	0	0	0	113.8	E464	E464-P466 WeakPolarHBondContact O-CD 3.29Å
467	Y	92.9	Very high	90.4	Very high	84 Å²	84	77.5 Å²	77.5	33%	0.329	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123	-174.3	-56	-80.2	0	0	0	109.3	K465 R475 F476 A479	K465-Y467 VanDerWaalsContact C-N 3.33Å; K465-Y467 PolarHBondContact O-N 3.24Å; Y467-R475 CarbonylContact O-C 3.33Å; Y467-R475 WeakPolarHBondContact O-CA 3.03Å; Y467-F476 WeakPolarHBondContact CD2-O 3.42Å; Y467-F476 PolarHBondContact N-O 2.95Å; Y467-F476 VanDerWaalsContact N-O 3.14Å; Y467-F476 PolarHBondContact O-N 3.43Å; Y467-A479 HydrophobicContact CD1-CB 3.92Å; Y467-A479 HydrophobicContact CE1-CB 3.67Å; Y467-A479 HydrophobicContact CE2-CB 4.5Å; Y467-A479 HydrophobicContact CG-CB 4.44Å
468	V	93.1	Very high	90.5	Very high	56 Å²	56	79.5 Å²	79.5	34%	0.339	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.1	-177.6	-171.8	0	0	0	0	108.9	R475 L482	V468-R475 HydrophobicContact CG1-CG 4.43Å; V468-R475 HydrophobicContact CG2-CG 4.17Å; V468-L482 VanDerWaalsContact O-CD2 3.3Å; V468-L482 WeakPolarHBondContact O-CD2 3.33Å
469	C	94.1	Very high	90.6	Very high	2 Å²	2	79.8 Å²	79.8	1%	0.014	42%	0.417	C	S	.	.			trans	-87.4	114.6	168.8	-175.4	0	0	0	0	110.2	R471 C472 G473 Q474 F476 L482 H485	C469-R471 PolarHBondContact O-N 3.07Å; C469-R471 VanDerWaalsContact O-N 3.08Å; C469-C472 PolarHBondContact O-N 3.45Å; C469-G473 WeakPolarHBondContact O-CA 3.34Å; C469-G473 PolarHBondContact O-N 3.44Å; C469-Q474 PolarHBondContact N-O 2.97Å; C469-F476 HydrophobicContact CB-CE2 4.21Å; C469-L482 HydrophobicContact CB-CD1 3.58Å; C469-H485 VanDerWaalsContact SG-CD2 3.57Å; C469-H485 PolarHBondContact SG-NE2 3.32Å
470	D	91.7	Very high	90.5	Very high	165 Å²	165	80.4 Å²	80.4	88%	0.882	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.2	-177.7	-49.2	-43.9	0	0	0	113.6
471	R	89.3	Confident	90.5	Very high	163 Å²	163	75.3 Å²	75.3	62%	0.615	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-28.6	-179.8	-69.6	-172.2	178.5	-163.7	1.4	115	C469 H489	C469-R471 PolarHBondContact O-N 3.07Å; C469-R471 VanDerWaalsContact O-N 3.08Å; R471-H489 PolarHBondContact NH1-O 3.09Å
472	C	92	Very high	90.8	Very high	61 Å²	61	73.2 Å²	73.2	41%	0.412	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.2	7.6	-175.3	69	0	0	0	0	114.4	C469 Q474 H485 H489	C469-C472 PolarHBondContact O-N 3.45Å; C472-Q474 PolarHBondContact O-N 3.45Å; C472-Q474 VanDerWaalsContact SG-CB 3.56Å; C472-H485 PolarHBondContact SG-NE2 2.99Å; C472-H489 PolarHBondContact SG-NE2 2.55Å; C472-H489 VanDerWaalsContact SG-NE2 3.38Å
473	G	90.3	Very high	90.9	Very high	47 Å²	47	73.1 Å²	73.1	49%	0.485	40%	0.397	S	S	.	.			trans	67.5	-5.6	-178.2	0	0	0	0	0	115.5	C469 R475	C469-G473 WeakPolarHBondContact O-CA 3.34Å; C469-G473 PolarHBondContact O-N 3.44Å; G473-R475 WeakPolarHBondContact O-CG 3.48Å; G473-R475 PolarHBondContact O-N 2.87Å
474	Q	91.4	Very high	90.9	Very high	99 Å²	99	75.7 Å²	75.7	46%	0.463	39%	0.393	S	S	.	.			trans	-63.4	133.2	-174.5	-166.2	173.3	27.3	0	0	111.2	C469 C472 F476 H485	C469-Q474 PolarHBondContact N-O 2.97Å; C472-Q474 PolarHBondContact O-N 3.45Å; C472-Q474 VanDerWaalsContact SG-CB 3.56Å; Q474-F476 HydrophobicContact CB-CE2 3.92Å; Q474-F476 HydrophobicContact CB-CZ 4.06Å; Q474-F476 HydrophobicContact CG-CE1 4.47Å; Q474-F476 HydrophobicContact CG-CE2 3.95Å; Q474-F476 HydrophobicContact CG-CZ 3.7Å; Q474-F476 WeakPolarHBondContact O-CD2 3.26Å; Q474-F476 VanDerWaalsContact O-CE2 3.23Å; Q474-F476 WeakPolarHBondContact O-CE2 3.44Å; Q474-H485 PolarHBondContact OE1-CE1 3.32Å; Q474-H485 PolarHBondContact OE1-ND1 2.86Å
475	R	92.6	Very high	90.9	Very high	149 Å²	149	71.3 Å²	71.3	56%	0.562	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	139.8	-173.2	-49.8	-174.7	64.3	152.8	1.9	112.2	K465 Y467 V468 G473	K465-R475 HydrophobicContact CB-CB 3.59Å; K465-R475 HydrophobicContact CD-CB 4.24Å; K465-R475 HydrophobicContact CG-CB 4.48Å; K465-R475 PolarHBondContact O-NE 3.33Å; K465-R475 VanDerWaalsContact O-NE 3.14Å; K465-R475 PolarHBondContact O-NH2 3.14Å; Y467-R475 CarbonylContact O-C 3.33Å; Y467-R475 WeakPolarHBondContact O-CA 3.03Å; V468-R475 HydrophobicContact CG1-CG 4.43Å; V468-R475 HydrophobicContact CG2-CG 4.17Å; G473-R475 WeakPolarHBondContact O-CG 3.48Å; G473-R475 PolarHBondContact O-N 2.87Å
476	F	90.6	Very high	90.9	Very high	31 Å²	31	68.3 Å²	68.3	14%	0.136	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	146.4	-174.5	-59.8	-86.5	0	0	0	111.9	K465 Y467 C469 Q474 Q478 L482 H485	K465-F476 CarbonylContact C-O 3.23Å; K465-F476 VanDerWaalsContact C-O 3.31Å; K465-F476 VanDerWaalsContact CA-O 3.29Å; K465-F476 WeakPolarHBondContact CA-O 3.48Å; Y467-F476 WeakPolarHBondContact CD2-O 3.42Å; Y467-F476 PolarHBondContact N-O 2.95Å; Y467-F476 VanDerWaalsContact N-O 3.14Å; Y467-F476 PolarHBondContact O-N 3.43Å; C469-F476 HydrophobicContact CB-CE2 4.21Å; Q474-F476 HydrophobicContact CB-CE2 3.92Å; Q474-F476 HydrophobicContact CB-CZ 4.06Å; Q474-F476 HydrophobicContact CG-CE1 4.47Å; Q474-F476 HydrophobicContact CG-CE2 3.95Å; Q474-F476 HydrophobicContact CG-CZ 3.7Å; Q474-F476 WeakPolarHBondContact O-CD2 3.26Å; Q474-F476 VanDerWaalsContact O-CE2 3.23Å; Q474-F476 WeakPolarHBondContact O-CE2 3.44Å; F476-Q478 VanDerWaalsContact C-N 3.34Å; F476-L482 HydrophobicContact CB-CB 4.21Å; F476-L482 HydrophobicContact CD2-CB 3.92Å; F476-L482 HydrophobicContact CD2-CD1 3.75Å; F476-L482 HydrophobicContact CD2-CG 4.42Å; F476-L482 HydrophobicContact CE2-CD1 3.92Å; F476-L482 HydrophobicContact CG-CB 4.15Å; F476-H485 HydrophobicContact CE1-CB 3.94Å; F476-H485 HydrophobicContact CE2-CB 4.09Å; F476-H485 AromaticContact CE2-CD2 3.67Å; F476-H485 AromaticContact CE2-CG 3.76Å; F476-H485 HydrophobicContact CZ-CB 3.54Å; F476-H485 AromaticContact CZ-CD2 3.64Å; F476-H485 AromaticContact CZ-CE1 3.97Å; F476-H485 AromaticContact CZ-CG 3.26Å; F476-H485 AromaticContact CZ-ND1 3.51Å
477	A	89.4	Confident	90.9	Very high	32 Å²	32	67.3 Å²	67.3	26%	0.264	35%	0.351	S	S	.	.	S	Bend	trans	-80.6	-11.9	177.2	0	0	0	0	0	113.8	R459	R459-A477 HydrophobicContact CB-CB 4.18Å; R459-A477 VanDerWaalsContact CD-O 3.28Å; R459-A477 WeakPolarHBondContact CD-O 3.27Å; R459-A477 PolarHBondContact NH1-O 3.21Å
478	Q	91	Very high	90.6	Very high	73 Å²	73	68.2 Å²	68.2	34%	0.341	35%	0.354	S	S	.	.	S	Bend	trans	-138.6	147	-178.5	-59.2	-179.4	10	0	0	111.2	I456 F476 S480 T481 L482	I456-Q478 HydrophobicContact CG2-CG 4.02Å; F476-Q478 VanDerWaalsContact C-N 3.34Å; Q478-S480 VanDerWaalsContact C-N 3.35Å; Q478-S480 PolarHBondContact OE1-OG 3.25Å; Q478-T481 HydrophobicContact CB-CG2 4.46Å; Q478-T481 PolarHBondContact O-OG1 2.57Å; Q478-L482 PolarHBondContact O-N 3.43Å
479	A	90.4	Very high	90.4	Very high	44 Å²	44	68.2 Å²	68.2	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-66.4	-37.2	176.2	0	0	0	0	0	112.2	Y467 T481 L482 T483	Y467-A479 HydrophobicContact CD1-CB 3.92Å; Y467-A479 HydrophobicContact CE1-CB 3.67Å; Y467-A479 HydrophobicContact CE2-CB 4.5Å; Y467-A479 HydrophobicContact CG-CB 4.44Å; A479-T481 PolarHBondContact O-N 3.27Å; A479-L482 WeakPolarHBondContact O-CB 3.45Å; A479-L482 PolarHBondContact O-N 3.17Å; A479-T483 PolarHBondContact O-N 2.76Å; A479-T483 PolarHBondContact O-OG1 3.35Å
480	S	88.2	Confident	90.1	Very high	46 Å²	46	70.5 Å²	70.5	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-59.1	-46.1	177.5	48	0	0	0	0	112.2	Q478 T483 Y484	Q478-S480 VanDerWaalsContact C-N 3.35Å; Q478-S480 PolarHBondContact OE1-OG 3.25Å; S480-T483 WeakPolarHBondContact O-CB 3.31Å; S480-T483 PolarHBondContact O-N 2.89Å; S480-T483 VanDerWaalsContact O-N 3.17Å; S480-Y484 WeakPolarHBondContact O-CD2 3.35Å; S480-Y484 WeakPolarHBondContact O-CE2 3.42Å; S480-Y484 VanDerWaalsContact O-CG 3.29Å; S480-Y484 PolarHBondContact O-N 3.45Å
481	T	89.6	Confident	89.9	Confident	56 Å²	56	64.9 Å²	64.9	34%	0.344	35%	0.345	S	S	.	.	H	α-helix	trans	-68.5	-36.4	178.7	54.5	0	0	0	0	112.1	Q478 A479 Y484 H485	Q478-T481 HydrophobicContact CB-CG2 4.46Å; Q478-T481 PolarHBondContact O-OG1 2.57Å; A479-T481 PolarHBondContact O-N 3.27Å; T481-Y484 PolarHBondContact O-N 3.1Å; T481-H485 WeakPolarHBondContact O-CB 3.46Å; T481-H485 PolarHBondContact O-N 3.09Å
482	L	92.6	Very high	89.9	Confident	29 Å²	29	62 Å²	62	15%	0.152	34%	0.339	C	S	.	.	H	α-helix	trans	-59	-46.9	167.1	172.3	62.1	0	0	0	111.5	V468 C469 F476 Q478 A479 Y484 H485 V486	V468-L482 VanDerWaalsContact O-CD2 3.3Å; V468-L482 WeakPolarHBondContact O-CD2 3.33Å; C469-L482 HydrophobicContact CB-CD1 3.58Å; F476-L482 HydrophobicContact CB-CB 4.21Å; F476-L482 HydrophobicContact CD2-CB 3.92Å; F476-L482 HydrophobicContact CD2-CD1 3.75Å; F476-L482 HydrophobicContact CD2-CG 4.42Å; F476-L482 HydrophobicContact CE2-CD1 3.92Å; F476-L482 HydrophobicContact CG-CB 4.15Å; Q478-L482 PolarHBondContact O-N 3.43Å; A479-L482 WeakPolarHBondContact O-CB 3.45Å; A479-L482 PolarHBondContact O-N 3.17Å; L482-Y484 PolarHBondContact O-N 3.3Å; L482-H485 WeakPolarHBondContact O-CB 3.4Å; L482-H485 PolarHBondContact O-N 3.34Å; L482-H485 VanDerWaalsContact O-N 3.13Å; L482-V486 HydrophobicContact CD1-CG2 3.83Å; L482-V486 HydrophobicContact CG-CG2 4.3Å; L482-V486 WeakPolarHBondContact O-CG2 3.26Å; L482-V486 PolarHBondContact O-N 3.25Å
483	T	90.4	Very high	89.9	Confident	70 Å²	70	65 Å²	65	43%	0.429	35%	0.345	S	S	.	.	H	α-helix	trans	-59.8	-44	179.4	-53.2	0	0	0	0	112.1	A479 S480 H485 V486 R487	A479-T483 PolarHBondContact O-N 2.76Å; A479-T483 PolarHBondContact O-OG1 3.35Å; S480-T483 WeakPolarHBondContact O-CB 3.31Å; S480-T483 PolarHBondContact O-N 2.89Å; S480-T483 VanDerWaalsContact O-N 3.17Å; T483-H485 VanDerWaalsContact C-N 3.32Å; T483-H485 PolarHBondContact O-N 3.23Å; T483-V486 PolarHBondContact O-N 2.81Å; T483-R487 PolarHBondContact O-N 3.26Å
484	Y	88.2	Confident	89.9	Confident	102 Å²	102	66.2 Å²	66.2	40%	0.4	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-34.9	175.7	-54.3	-44.3	0	0	0	112.5	S480 T481 L482 R487 V506	S480-Y484 WeakPolarHBondContact O-CD2 3.35Å; S480-Y484 WeakPolarHBondContact O-CE2 3.42Å; S480-Y484 VanDerWaalsContact O-CG 3.29Å; S480-Y484 PolarHBondContact O-N 3.45Å; T481-Y484 PolarHBondContact O-N 3.1Å; L482-Y484 PolarHBondContact O-N 3.3Å; Y484-R487 PolarHBondContact O-N 3.44Å; Y484-V506 HydrophobicContact CD1-CG2 4.03Å; Y484-V506 HydrophobicContact CG-CG2 4.14Å
485	H	90	Very high	89.9	Confident	13 Å²	13	65 Å²	65	6%	0.06	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-44.5	174.4	168.6	86.5	0	0	0	112	C469 C472 Q474 F476 T481 L482 T483 R487 R488 H489	C469-H485 VanDerWaalsContact SG-CD2 3.57Å; C469-H485 PolarHBondContact SG-NE2 3.32Å; C472-H485 PolarHBondContact SG-NE2 2.99Å; Q474-H485 PolarHBondContact OE1-CE1 3.32Å; Q474-H485 PolarHBondContact OE1-ND1 2.86Å; F476-H485 HydrophobicContact CE1-CB 3.94Å; F476-H485 HydrophobicContact CE2-CB 4.09Å; F476-H485 AromaticContact CE2-CD2 3.67Å; F476-H485 AromaticContact CE2-CG 3.76Å; F476-H485 HydrophobicContact CZ-CB 3.54Å; F476-H485 AromaticContact CZ-CD2 3.64Å; F476-H485 AromaticContact CZ-CE1 3.97Å; F476-H485 AromaticContact CZ-CG 3.26Å; F476-H485 AromaticContact CZ-ND1 3.51Å; T481-H485 WeakPolarHBondContact O-CB 3.46Å; T481-H485 PolarHBondContact O-N 3.09Å; L482-H485 WeakPolarHBondContact O-CB 3.4Å; L482-H485 PolarHBondContact O-N 3.34Å; L482-H485 VanDerWaalsContact O-N 3.13Å; T483-H485 VanDerWaalsContact C-N 3.32Å; T483-H485 PolarHBondContact O-N 3.23Å; H485-R487 PolarHBondContact O-N 3.49Å; H485-R488 VanDerWaalsContact O-CB 3.3Å; H485-R488 WeakPolarHBondContact O-CB 3.12Å; H485-R488 PolarHBondContact O-N 3.28Å; H485-H489 AromaticContact CD2-NE2 3.84Å; H485-H489 AromaticContact CE1-NE2 3.51Å; H485-H489 AromaticContact NE2-CD2 3.57Å; H485-H489 AromaticContact NE2-NE2 2.96Å; H485-H489 PolarHBondContact NE2-NE2 3.07Å
486	V	90.6	Very high	89.9	Confident	48 Å²	48	61.4 Å²	61.4	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-58.1	-32.3	177.5	170.1	0	0	0	0	111.7	L482 T483 R488 H489 T490	L482-V486 HydrophobicContact CD1-CG2 3.83Å; L482-V486 HydrophobicContact CG-CG2 4.3Å; L482-V486 WeakPolarHBondContact O-CG2 3.26Å; L482-V486 PolarHBondContact O-N 3.25Å; T483-V486 PolarHBondContact O-N 2.81Å; V486-R488 VanDerWaalsContact C-N 3.25Å; V486-R488 PolarHBondContact O-N 3.37Å; V486-H489 WeakPolarHBondContact O-CA 3.3Å; V486-H489 WeakPolarHBondContact O-CB 3.37Å; V486-H489 PolarHBondContact O-N 2.63Å; V486-T490 HydrophobicContact CG1-CG2 4.18Å; V486-T490 PolarHBondContact O-N 3.01Å
487	R	90.7	Very high	90.1	Very high	43 Å²	43	60.1 Å²	60.1	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-22.4	173.1	-68.5	-179.4	-179.6	164.4	3	114.7	T483 Y484 H485 H489 G491 E492 A505	T483-R487 PolarHBondContact O-N 3.26Å; Y484-R487 PolarHBondContact O-N 3.44Å; H485-R487 PolarHBondContact O-N 3.49Å; R487-H489 VanDerWaalsContact C-N 3.32Å; R487-G491 WeakPolarHBondContact O-CA 3.44Å; R487-G491 PolarHBondContact O-N 3.04Å; R487-E492 HydrophobicContact CG-CB 4.14Å; R487-A505 HydrophobicContact CB-CB 4.04Å; R487-A505 WeakPolarHBondContact CD-O 3.26Å; R487-A505 PolarHBondContact NH1-O 3.13Å
488	R	87.1	Confident	90.2	Very high	103 Å²	103	66.3 Å²	66.3	39%	0.389	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-38.6	167.9	-79	166.5	47.1	155.5	-8.8	111	H485 V486 E586 D587	H485-R488 VanDerWaalsContact O-CB 3.3Å; H485-R488 WeakPolarHBondContact O-CB 3.12Å; H485-R488 PolarHBondContact O-N 3.28Å; V486-R488 VanDerWaalsContact C-N 3.25Å; V486-R488 PolarHBondContact O-N 3.37Å; R488-E586 PolarHBondContact NH2-O 3.38Å; R488-D587 IonicContact NH1-OD1 3.52Å
489	H	87.7	Confident	90.1	Very high	56 Å²	56	67.7 Å²	67.7	26%	0.259	37%	0.367	S	S	.	.	H	α-helix	trans	-80	-32.9	-178.7	-62.4	-56.6	0	0	0	113.8	R471 C472 H485 V486 R487	R471-H489 PolarHBondContact NH1-O 3.09Å; C472-H489 PolarHBondContact SG-NE2 2.55Å; C472-H489 VanDerWaalsContact SG-NE2 3.38Å; H485-H489 AromaticContact CD2-NE2 3.84Å; H485-H489 AromaticContact CE1-NE2 3.51Å; H485-H489 AromaticContact NE2-CD2 3.57Å; H485-H489 AromaticContact NE2-NE2 2.96Å; H485-H489 PolarHBondContact NE2-NE2 3.07Å; V486-H489 WeakPolarHBondContact O-CA 3.3Å; V486-H489 WeakPolarHBondContact O-CB 3.37Å; V486-H489 PolarHBondContact O-N 2.63Å; R487-H489 VanDerWaalsContact C-N 3.32Å
490	T	88.2	Confident	90.2	Very high	50 Å²	50	68 Å²	68	31%	0.307	37%	0.366	S	S	.	.	H	α-helix	trans	-86.7	-15.8	177.3	60.7	0	0	0	0	113.1	V486 E492	V486-T490 HydrophobicContact CG1-CG2 4.18Å; V486-T490 PolarHBondContact O-N 3.01Å; T490-E492 PolarHBondContact O-N 3.47Å; T490-E492 WeakPolarHBondContact OG1-CB 3.49Å; T490-E492 WeakPolarHBondContact OG1-CG 3.34Å; T490-E492 PolarHBondContact OG1-N 2.94Å; T490-E492 PolarHBondContact OG1-OE1 2.92Å
491	G	87.8	Confident	90.3	Very high	47 Å²	47	68.4 Å²	68.4	49%	0.485	38%	0.377	S	S	.	.			trans	71.6	2.5	-172.6	0	0	0	0	0	114	R487 K493	R487-G491 WeakPolarHBondContact O-CA 3.44Å; R487-G491 PolarHBondContact O-N 3.04Å; G491-K493 PolarHBondContact O-N 2.97Å
492	E	89.8	Confident	90.4	Very high	104 Å²	104	71.9 Å²	71.9	49%	0.486	39%	0.387	S	S	.	.			trans	-59.8	121.2	-178.9	-79.6	171.8	-147.7	0	0	111.8	R487 T490	R487-E492 HydrophobicContact CG-CB 4.14Å; T490-E492 PolarHBondContact O-N 3.47Å; T490-E492 WeakPolarHBondContact OG1-CB 3.49Å; T490-E492 WeakPolarHBondContact OG1-CG 3.34Å; T490-E492 PolarHBondContact OG1-N 2.94Å; T490-E492 PolarHBondContact OG1-OE1 2.92Å
493	K	90.6	Very high	90.4	Very high	124 Å²	124	72.2 Å²	72.2	54%	0.539	39%	0.394	S	S	.	.			trans	-125.7	75.6	178.6	-71.8	165	176	179.6	0	110.3	G491 Y495 A503 F504	G491-K493 PolarHBondContact O-N 2.97Å; K493-Y495 PolarHBondContact O-N 3.48Å; K493-Y495 VanDerWaalsContact O-N 3.15Å; K493-A503 HydrophobicContact CB-CB 3.57Å; K493-A503 HydrophobicContact CD-CB 4.23Å; K493-A503 WeakPolarHBondContact CD-O 3.47Å; K493-A503 HydrophobicContact CG-CB 4.47Å; K493-F504 CarbonylContact C-O 3.58Å; K493-F504 VanDerWaalsContact C-O 3.23Å; K493-F504 VanDerWaalsContact CA-O 3.28Å; K493-F504 WeakPolarHBondContact CA-O 3.1Å
494	P	90.1	Very high	90.4	Very high	71 Å²	71	70.9 Å²	70.9	46%	0.461	38%	0.383	S	S	.	.			trans	-67.6	-14.8	-172.1	-20.8	34.4	0	0	0	114.9
495	Y	92.5	Very high	90.4	Very high	74 Å²	74	67.3 Å²	67.3	29%	0.29	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	94.2	-173.1	-53.8	-72.5	0	0	0	110.1	K493 A503 F504 S507	K493-Y495 PolarHBondContact O-N 3.48Å; K493-Y495 VanDerWaalsContact O-N 3.15Å; Y495-A503 CarbonylContact O-C 3.23Å; Y495-A503 WeakPolarHBondContact O-CA 3.47Å; Y495-F504 WeakPolarHBondContact CD2-O 3.45Å; Y495-F504 PolarHBondContact N-O 2.61Å; Y495-F504 VanDerWaalsContact N-O 3.13Å; Y495-F504 PolarHBondContact O-N 2.9Å; Y495-S507 VanDerWaalsContact CD2-N 3.34Å
496	V	92.7	Very high	90.3	Very high	73 Å²	73	68.2 Å²	68.2	44%	0.442	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	142.9	178.9	-173.2	0	0	0	0	110.3	A503 L510	V496-A503 HydrophobicContact CG2-CB 4.06Å; V496-L510 WeakPolarHBondContact O-CD2 3.29Å
497	C	94.2	Very high	90.3	Very high	4 Å²	4	67.5 Å²	67.5	3%	0.027	38%	0.378	C	S	.	.			trans	-90.3	114.4	171.5	-177.5	0	0	0	0	110.9	T499 C500 G501 K502 F504 L510 H517	C497-T499 PolarHBondContact O-N 3.38Å; C497-T499 VanDerWaalsContact O-N 3.17Å; C497-C500 PolarHBondContact O-N 3Å; C497-C500 VanDerWaalsContact SG-SG 3.66Å; C497-G501 WeakPolarHBondContact O-CA 3.3Å; C497-G501 PolarHBondContact O-N 2.87Å; C497-K502 WeakPolarHBondContact CB-O 3.45Å; C497-K502 PolarHBondContact N-O 2.91Å; C497-F504 HydrophobicContact CB-CE2 4.34Å; C497-L510 HydrophobicContact CB-CD1 3.49Å; C497-L510 VanDerWaalsContact CB-CD1 3.49Å; C497-H517 PolarHBondContact SG-NE2 3.31Å
498	D	91.1	Very high	90.2	Very high	162 Å²	162	68.2 Å²	68.2	87%	0.866	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.5	-176.7	-50.9	-46.8	0	0	0	113.3
499	T	90.6	Very high	90.4	Very high	102 Å²	102	65.7 Å²	65.7	63%	0.626	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-28	-178.1	-39	0	0	0	0	113.8	C497 H517	C497-T499 PolarHBondContact O-N 3.38Å; C497-T499 VanDerWaalsContact O-N 3.17Å; T499-H517 HydrophobicContact CG2-CB 4.1Å
500	C	92.4	Very high	90.6	Very high	52 Å²	52	64.7 Å²	64.7	35%	0.351	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.9	4.7	-169.8	73.1	0	0	0	0	115.2	C497 K502 H513 H517	C497-C500 PolarHBondContact O-N 3Å; C497-C500 VanDerWaalsContact SG-SG 3.66Å; C500-K502 PolarHBondContact O-N 3.02Å; C500-H513 PolarHBondContact SG-NE2 3.04Å; C500-H517 PolarHBondContact SG-NE2 2.92Å; C500-H517 VanDerWaalsContact SG-NE2 3.41Å
501	G	90.1	Very high	90.8	Very high	54 Å²	54	64.3 Å²	64.3	56%	0.557	38%	0.38	S	S	*	.			trans	68.3	-2.5	-178.7	0	0	0	0	0	115.8	C497 A503	C497-G501 WeakPolarHBondContact O-CA 3.3Å; C497-G501 PolarHBondContact O-N 2.87Å; G501-A503 PolarHBondContact O-N 3.21Å
502	K	91.6	Very high	90.9	Very high	128 Å²	128	64.4 Å²	64.4	56%	0.557	37%	0.371	S	S	*	.			trans	-70.1	125.5	-176.5	-68.6	-174.8	178.2	-174	0	111	C497 C500 F504	C497-K502 WeakPolarHBondContact CB-O 3.45Å; C497-K502 PolarHBondContact N-O 2.91Å; C500-K502 PolarHBondContact O-N 3.02Å; K502-F504 HydrophobicContact CB-CE2 3.97Å; K502-F504 HydrophobicContact CB-CZ 4.06Å; K502-F504 WeakPolarHBondContact O-CD2 3.48Å; K502-F504 VanDerWaalsContact O-CE2 3.23Å; K502-F504 WeakPolarHBondContact O-CE2 3.39Å
503	A	91.9	Very high	91	Very high	36 Å²	36	60.8 Å²	60.8	30%	0.298	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.2	-177.5	0	0	0	0	0	112.5	K493 Y495 V496 G501	K493-A503 HydrophobicContact CB-CB 3.57Å; K493-A503 HydrophobicContact CD-CB 4.23Å; K493-A503 WeakPolarHBondContact CD-O 3.47Å; K493-A503 HydrophobicContact CG-CB 4.47Å; Y495-A503 CarbonylContact O-C 3.23Å; Y495-A503 WeakPolarHBondContact O-CA 3.47Å; V496-A503 HydrophobicContact CG2-CB 4.06Å; G501-A503 PolarHBondContact O-N 3.21Å
504	F	89.8	Confident	91	Very high	43 Å²	43	56.8 Å²	56.8	19%	0.189	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.6	-175.9	-58.9	-87	0	0	0	111.7	K493 Y495 C497 K502 L510 H513	K493-F504 CarbonylContact C-O 3.58Å; K493-F504 VanDerWaalsContact C-O 3.23Å; K493-F504 VanDerWaalsContact CA-O 3.28Å; K493-F504 WeakPolarHBondContact CA-O 3.1Å; Y495-F504 WeakPolarHBondContact CD2-O 3.45Å; Y495-F504 PolarHBondContact N-O 2.61Å; Y495-F504 VanDerWaalsContact N-O 3.13Å; Y495-F504 PolarHBondContact O-N 2.9Å; C497-F504 HydrophobicContact CB-CE2 4.34Å; K502-F504 HydrophobicContact CB-CE2 3.97Å; K502-F504 HydrophobicContact CB-CZ 4.06Å; K502-F504 WeakPolarHBondContact O-CD2 3.48Å; K502-F504 VanDerWaalsContact O-CE2 3.23Å; K502-F504 WeakPolarHBondContact O-CE2 3.39Å; F504-L510 HydrophobicContact CB-CB 4.44Å; F504-L510 HydrophobicContact CD2-CB 3.97Å; F504-L510 HydrophobicContact CD2-CD1 3.94Å; F504-L510 HydrophobicContact CE2-CD1 4.12Å; F504-L510 HydrophobicContact CG-CB 4.41Å; F504-H513 HydrophobicContact CE1-CB 4.14Å; F504-H513 HydrophobicContact CE2-CB 3.84Å; F504-H513 AromaticContact CE2-CD2 3.6Å; F504-H513 AromaticContact CE2-CG 3.7Å; F504-H513 HydrophobicContact CZ-CB 3.5Å; F504-H513 VanDerWaalsContact CZ-CB 3.5Å; F504-H513 AromaticContact CZ-CD2 3.61Å; F504-H513 AromaticContact CZ-CG 3.29Å; F504-H513 AromaticContact CZ-ND1 3.75Å
505	A	88.8	Confident	91.1	Very high	27 Å²	27	55 Å²	55	22%	0.223	33%	0.326	C	S	.	.	S	Bend	trans	-78.9	-17.4	177.5	0	0	0	0	0	113.8	R487	R487-A505 HydrophobicContact CB-CB 4.04Å; R487-A505 WeakPolarHBondContact CD-O 3.26Å; R487-A505 PolarHBondContact NH1-O 3.13Å
506	V	89	Confident	91	Very high	32 Å²	32	57.4 Å²	57.4	19%	0.194	34%	0.338	C	S	.	.	S	Bend	trans	-135.2	138.2	-176.8	-170.2	0	0	0	0	110.2	Y484 S508 S509 L510	Y484-V506 HydrophobicContact CD1-CG2 4.03Å; Y484-V506 HydrophobicContact CG-CG2 4.14Å; V506-S508 WeakPolarHBondContact CG1-OG 3.33Å; V506-S508 PolarHBondContact O-N 3.39Å; V506-S509 WeakPolarHBondContact O-CB 3.3Å; V506-S509 PolarHBondContact O-N 3.08Å; V506-L510 PolarHBondContact O-N 3.2Å
507	S	90.6	Very high	90.8	Very high	33 Å²	33	57.6 Å²	57.6	23%	0.231	33%	0.334	C	S	.	.	H	α-helix	trans	-64.7	-35.2	-176.6	54.1	0	0	0	0	113.7	Y495 S509 L510 I511	Y495-S507 VanDerWaalsContact CD2-N 3.34Å; S507-S509 VanDerWaalsContact C-N 3.27Å; S507-S509 PolarHBondContact O-N 2.79Å; S507-L510 WeakPolarHBondContact O-CB 3.25Å; S507-L510 PolarHBondContact O-N 2.68Å; S507-L510 VanDerWaalsContact O-N 3.1Å; S507-I511 WeakPolarHBondContact O-CG1 3.41Å; S507-I511 PolarHBondContact O-N 3.47Å
508	S	88.4	Confident	90.6	Very high	58 Å²	58	61.5 Å²	61.5	41%	0.406	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-31.9	175.6	56.8	0	0	0	0	112.8	V506 I511 T512	V506-S508 WeakPolarHBondContact CG1-OG 3.33Å; V506-S508 PolarHBondContact O-N 3.39Å; S508-I511 PolarHBondContact O-N 3.3Å; S508-T512 WeakPolarHBondContact O-CB 3.45Å; S508-T512 WeakPolarHBondContact O-CG2 3.45Å; S508-T512 PolarHBondContact O-N 3.12Å; S508-T512 PolarHBondContact O-OG1 3.07Å
509	S	90.2	Very high	90.4	Very high	50 Å²	50	56.1 Å²	56.1	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-68.3	-38.1	171.6	-52.9	0	0	0	0	111.8	V506 S507 T512 H513	V506-S509 WeakPolarHBondContact O-CB 3.3Å; V506-S509 PolarHBondContact O-N 3.08Å; S507-S509 VanDerWaalsContact C-N 3.27Å; S507-S509 PolarHBondContact O-N 2.79Å; S509-T512 WeakPolarHBondContact CA-OG1 3.32Å; S509-T512 PolarHBondContact O-OG1 3.44Å; S509-H513 WeakPolarHBondContact O-CB 3.28Å; S509-H513 PolarHBondContact O-N 2.77Å
510	L	92.8	Very high	90.4	Very high	34 Å²	34	56.3 Å²	56.3	18%	0.178	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-46.5	171.9	173.1	60.9	0	0	0	111.5	V496 C497 F504 V506 S507 T512 H513 S514	V496-L510 WeakPolarHBondContact O-CD2 3.29Å; C497-L510 HydrophobicContact CB-CD1 3.49Å; C497-L510 VanDerWaalsContact CB-CD1 3.49Å; F504-L510 HydrophobicContact CB-CB 4.44Å; F504-L510 HydrophobicContact CD2-CB 3.97Å; F504-L510 HydrophobicContact CD2-CD1 3.94Å; F504-L510 HydrophobicContact CE2-CD1 4.12Å; F504-L510 HydrophobicContact CG-CB 4.41Å; V506-L510 PolarHBondContact O-N 3.2Å; S507-L510 WeakPolarHBondContact O-CB 3.25Å; S507-L510 PolarHBondContact O-N 2.68Å; S507-L510 VanDerWaalsContact O-N 3.1Å; L510-T512 PolarHBondContact O-N 2.73Å; L510-H513 CarbonylContact O-C 3.54Å; L510-H513 WeakPolarHBondContact O-CA 3.26Å; L510-H513 WeakPolarHBondContact O-CB 3.15Å; L510-H513 PolarHBondContact O-N 3.39Å; L510-H513 VanDerWaalsContact O-N 3.11Å; L510-S514 PolarHBondContact O-N 3.04Å; L510-S514 PolarHBondContact O-OG 2.72Å
511	I	91.1	Very high	90.3	Very high	42 Å²	42	59.2 Å²	59.2	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-43.2	-179.5	-65.3	162.3	0	0	0	111.5	S507 S508 H513 S514 R515	S507-I511 WeakPolarHBondContact O-CG1 3.41Å; S507-I511 PolarHBondContact O-N 3.47Å; S508-I511 PolarHBondContact O-N 3.3Å; I511-H513 PolarHBondContact O-N 2.96Å; I511-S514 PolarHBondContact O-N 3.06Å; I511-S514 PolarHBondContact O-OG 3.37Å; I511-S514 VanDerWaalsContact O-OG 3.05Å; I511-R515 WeakPolarHBondContact O-CG 3.36Å; I511-R515 PolarHBondContact O-N 3.32Å
512	T	90.5	Very high	90.3	Very high	50 Å²	50	60 Å²	60	31%	0.307	34%	0.335	S	S	.	.	H	α-helix	trans	-70.2	-22.5	175	50.1	0	0	0	0	112.9	S508 S509 L510	S508-T512 WeakPolarHBondContact O-CB 3.45Å; S508-T512 WeakPolarHBondContact O-CG2 3.45Å; S508-T512 PolarHBondContact O-N 3.12Å; S508-T512 PolarHBondContact O-OG1 3.07Å; S509-T512 WeakPolarHBondContact CA-OG1 3.32Å; S509-T512 PolarHBondContact O-OG1 3.44Å; L510-T512 PolarHBondContact O-N 2.73Å
513	H	91.6	Very high	90.3	Very high	28 Å²	28	56.2 Å²	56.2	13%	0.13	32%	0.318	C	S	.	.	H	α-helix	trans	-77.5	-45.1	170.4	-179.8	70.4	0	0	0	112.8	C500 F504 S509 L510 I511 R515 K516 H517	C500-H513 PolarHBondContact SG-NE2 3.04Å; F504-H513 HydrophobicContact CE1-CB 4.14Å; F504-H513 HydrophobicContact CE2-CB 3.84Å; F504-H513 AromaticContact CE2-CD2 3.6Å; F504-H513 AromaticContact CE2-CG 3.7Å; F504-H513 HydrophobicContact CZ-CB 3.5Å; F504-H513 VanDerWaalsContact CZ-CB 3.5Å; F504-H513 AromaticContact CZ-CD2 3.61Å; F504-H513 AromaticContact CZ-CG 3.29Å; F504-H513 AromaticContact CZ-ND1 3.75Å; S509-H513 WeakPolarHBondContact O-CB 3.28Å; S509-H513 PolarHBondContact O-N 2.77Å; L510-H513 CarbonylContact O-C 3.54Å; L510-H513 WeakPolarHBondContact O-CA 3.26Å; L510-H513 WeakPolarHBondContact O-CB 3.15Å; L510-H513 PolarHBondContact O-N 3.39Å; L510-H513 VanDerWaalsContact O-N 3.11Å; I511-H513 PolarHBondContact O-N 2.96Å; H513-R515 VanDerWaalsContact C-N 3.28Å; H513-R515 PolarHBondContact O-N 3.46Å; H513-K516 WeakPolarHBondContact O-CB 3.34Å; H513-K516 WeakPolarHBondContact O-CG 3.28Å; H513-K516 PolarHBondContact O-N 3.36Å; H513-H517 AromaticContact CD2-NE2 3.7Å; H513-H517 AromaticContact CE1-NE2 3.91Å; H513-H517 AromaticContact NE2-CE1 3.75Å; H513-H517 AromaticContact NE2-NE2 3.12Å; H513-H517 PolarHBondContact NE2-NE2 3.41Å; H513-H517 VanDerWaalsContact NE2-NE2 3.12Å
514	S	90.7	Very high	90.3	Very high	39 Å²	39	59.5 Å²	59.5	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-34.1	-177.3	62.8	0	0	0	0	112.5	L510 I511 K516 H517 T518	L510-S514 PolarHBondContact O-N 3.04Å; L510-S514 PolarHBondContact O-OG 2.72Å; I511-S514 PolarHBondContact O-N 3.06Å; I511-S514 PolarHBondContact O-OG 3.37Å; I511-S514 VanDerWaalsContact O-OG 3.05Å; S514-K516 PolarHBondContact O-N 3.15Å; S514-K516 VanDerWaalsContact O-N 3.09Å; S514-H517 WeakPolarHBondContact O-CB 3.34Å; S514-H517 PolarHBondContact O-N 3.11Å; S514-T518 PolarHBondContact O-N 3.34Å; S514-T518 VanDerWaalsContact O-N 3.16Å
515	R	92.9	Very high	90.4	Very high	34 Å²	34	57.5 Å²	57.5	13%	0.128	32%	0.321	C	S	.	.	H	α-helix	trans	-56.7	-21.1	170.2	-71.3	177.7	-175.6	163.4	3.7	114.5	I511 H513 H517 T518 G519 E520 I533	I511-R515 WeakPolarHBondContact O-CG 3.36Å; I511-R515 PolarHBondContact O-N 3.32Å; H513-R515 VanDerWaalsContact C-N 3.28Å; H513-R515 PolarHBondContact O-N 3.46Å; R515-H517 VanDerWaalsContact C-N 3.32Å; R515-T518 WeakPolarHBondContact CA-OG1 3.17Å; R515-G519 WeakPolarHBondContact O-CA 3.46Å; R515-G519 PolarHBondContact O-N 2.98Å; R515-E520 HydrophobicContact CB-CB 4.39Å; R515-E520 HydrophobicContact CG-CB 4.11Å; R515-E520 PolarHBondContact O-N 3.32Å; R515-I533 HydrophobicContact CB-CG2 3.58Å; R515-I533 PolarHBondContact NH1-O 3.31Å
516	K	89.9	Confident	90.4	Very high	125 Å²	125	60.2 Å²	60.2	54%	0.543	35%	0.351	S	S	.	.	H	α-helix	trans	-73.6	-24.9	173.1	-56.8	-172.7	176.7	-167.8	0	112.7	H513 S514 I533	H513-K516 WeakPolarHBondContact O-CB 3.34Å; H513-K516 WeakPolarHBondContact O-CG 3.28Å; H513-K516 PolarHBondContact O-N 3.36Å; S514-K516 PolarHBondContact O-N 3.15Å; S514-K516 VanDerWaalsContact O-N 3.09Å; K516-I533 HydrophobicContact CG-CD1 3.91Å
517	H	89.6	Confident	90.3	Very high	77 Å²	77	63.5 Å²	63.5	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-86.3	-40.6	174.9	-55.7	-53.4	0	0	0	111.6	C497 T499 C500 H513 S514 R515 G519	C497-H517 PolarHBondContact SG-NE2 3.31Å; T499-H517 HydrophobicContact CG2-CB 4.1Å; C500-H517 PolarHBondContact SG-NE2 2.92Å; C500-H517 VanDerWaalsContact SG-NE2 3.41Å; H513-H517 AromaticContact CD2-NE2 3.7Å; H513-H517 AromaticContact CE1-NE2 3.91Å; H513-H517 AromaticContact NE2-CE1 3.75Å; H513-H517 AromaticContact NE2-NE2 3.12Å; H513-H517 PolarHBondContact NE2-NE2 3.41Å; H513-H517 VanDerWaalsContact NE2-NE2 3.12Å; S514-H517 WeakPolarHBondContact O-CB 3.34Å; S514-H517 PolarHBondContact O-N 3.11Å; R515-H517 VanDerWaalsContact C-N 3.32Å; H517-G519 VanDerWaalsContact C-N 3.32Å
518	T	88.3	Confident	90.3	Very high	86 Å²	86	64.3 Å²	64.3	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-77.2	-19.1	177.8	63.7	0	0	0	0	113.2	S514 R515 E520	S514-T518 PolarHBondContact O-N 3.34Å; S514-T518 VanDerWaalsContact O-N 3.16Å; R515-T518 WeakPolarHBondContact CA-OG1 3.17Å; T518-E520 PolarHBondContact O-N 3.1Å; T518-E520 WeakPolarHBondContact OG1-CB 3.21Å; T518-E520 WeakPolarHBondContact OG1-CG 3.24Å; T518-E520 PolarHBondContact OG1-N 3.34Å
519	G	88.2	Confident	90.3	Very high	48 Å²	48	63.9 Å²	63.9	50%	0.495	38%	0.376	S	S	.	.			trans	76.8	1.9	-175.2	0	0	0	0	0	114.1	R515 H517 K521	R515-G519 WeakPolarHBondContact O-CA 3.46Å; R515-G519 PolarHBondContact O-N 2.98Å; H517-G519 VanDerWaalsContact C-N 3.32Å; G519-K521 PolarHBondContact O-N 2.9Å
520	E	89.8	Confident	90.3	Very high	107 Å²	107	67.5 Å²	67.5	50%	0.5	39%	0.386	S	S	.	.			trans	-59.1	126.8	179.4	-77.6	170.9	-154.7	0	0	112.1	R515 T518	R515-E520 HydrophobicContact CB-CB 4.39Å; R515-E520 HydrophobicContact CG-CB 4.11Å; R515-E520 PolarHBondContact O-N 3.32Å; T518-E520 PolarHBondContact O-N 3.1Å; T518-E520 WeakPolarHBondContact OG1-CB 3.21Å; T518-E520 WeakPolarHBondContact OG1-CG 3.24Å; T518-E520 PolarHBondContact OG1-N 3.34Å
521	K	90.9	Very high	90.2	Very high	112 Å²	112	68.1 Å²	68.1	49%	0.487	39%	0.393	S	S	.	.			trans	-128.3	75.8	179.6	-74.1	167	168	-168.7	0	110.9	G519 Y523 S531 F532 I533	G519-K521 PolarHBondContact O-N 2.9Å; K521-Y523 PolarHBondContact O-N 3.42Å; K521-S531 VanDerWaalsContact CB-CB 3.5Å; K521-S531 WeakPolarHBondContact CD-O 3.44Å; K521-F532 CarbonylContact C-O 3.57Å; K521-F532 VanDerWaalsContact C-O 3.23Å; K521-F532 WeakPolarHBondContact CA-O 3.21Å; K521-I533 HydrophobicContact CG-CG1 3.75Å
522	P	90.2	Very high	90.2	Very high	70 Å²	70	68.1 Å²	68.1	46%	0.455	39%	0.391	S	S	.	.			trans	-68	-18.1	-172.3	-20.9	34.5	0	0	0	114.6
523	Y	91.4	Very high	90.2	Very high	50 Å²	50	66.9 Å²	66.9	20%	0.196	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	96.9	-172.5	-56.7	-79.5	0	0	0	110.3	K521 S531 F532 I533 S534	K521-Y523 PolarHBondContact O-N 3.42Å; Y523-S531 CarbonylContact O-C 3.53Å; Y523-S531 WeakPolarHBondContact O-CA 3.33Å; Y523-F532 PolarHBondContact N-O 3.4Å; Y523-F532 PolarHBondContact O-N 3.4Å; Y523-I533 WeakPolarHBondContact CE2-O 3.22Å; Y523-S534 VanDerWaalsContact CD2-CA 3.45Å; Y523-S534 VanDerWaalsContact CE2-CA 3.48Å
524	I	90.6	Very high	90.1	Very high	104 Å²	104	66.8 Å²	66.8	53%	0.533	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135	-178	-53.7	178.4	0	0	0	109.9	G526	I524-G526 PolarHBondContact O-N 2.9Å
525	C	92.7	Very high	90	Very high	2 Å²	2	67 Å²	67	1%	0.014	39%	0.387	C	S	.	.			trans	-77.1	115.8	172.4	-178.9	0	0	0	0	110.8	I527 C528 G529 K530 F532 L538 H545	C525-I527 PolarHBondContact O-N 3.37Å; C525-C528 PolarHBondContact O-N 2.89Å; C525-G529 WeakPolarHBondContact O-CA 3.31Å; C525-G529 PolarHBondContact O-N 3.24Å; C525-K530 WeakPolarHBondContact CB-O 3.46Å; C525-K530 PolarHBondContact N-O 3.41Å; C525-F532 HydrophobicContact CB-CE2 4.33Å; C525-L538 HydrophobicContact CB-CD1 3.65Å; C525-H545 PolarHBondContact SG-NE2 3.06Å
526	G	88.5	Confident	89.8	Confident	83 Å²	83	67.3 Å²	67.3	86%	0.856	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.9	178.4	0	0	0	0	0	115	I524	I524-G526 PolarHBondContact O-N 2.9Å
527	I	88.3	Confident	89.7	Confident	101 Å²	101	64.8 Å²	64.8	52%	0.518	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-34.5	-178.1	-61.2	174.2	0	0	0	112.3	C525 F542 H545	C525-I527 PolarHBondContact O-N 3.37Å; I527-F542 HydrophobicContact CD1-CD2 4.19Å; I527-F542 HydrophobicContact CD1-CE2 3.48Å; I527-F542 VanDerWaalsContact CD1-CE2 3.48Å; I527-F542 HydrophobicContact CD1-CZ 3.88Å; I527-F542 HydrophobicContact CG1-CE2 4.12Å; I527-H545 HydrophobicContact CD1-CB 3.63Å; I527-H545 HydrophobicContact CG2-CB 4.36Å
528	C	90.2	Very high	89.7	Confident	51 Å²	51	62.8 Å²	62.8	35%	0.345	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	12.2	-172.1	73.3	0	0	0	0	115.4	C525 K530 H541 H545	C525-C528 PolarHBondContact O-N 2.89Å; C528-K530 PolarHBondContact O-N 2.96Å; C528-H541 PolarHBondContact SG-NE2 3.04Å; C528-H545 PolarHBondContact SG-NE2 2.88Å; C528-H545 VanDerWaalsContact SG-NE2 3.38Å
529	G	87.4	Confident	89.8	Confident	48 Å²	48	62.9 Å²	62.9	50%	0.495	38%	0.38	S	S	.	.			trans	68	-3.9	176.6	0	0	0	0	0	116.2	C525 S531	C525-G529 WeakPolarHBondContact O-CA 3.31Å; C525-G529 PolarHBondContact O-N 3.24Å; G529-S531 PolarHBondContact O-N 3.34Å
530	K	90	Very high	89.7	Confident	126 Å²	126	65.2 Å²	65.2	55%	0.548	38%	0.376	S	S	.	.			trans	-66.2	129.7	-178.1	-70.2	178.6	-176.2	174.1	0	111.5	C525 C528 F532	C525-K530 WeakPolarHBondContact CB-O 3.46Å; C525-K530 PolarHBondContact N-O 3.41Å; C528-K530 PolarHBondContact O-N 2.96Å; K530-F532 HydrophobicContact CB-CE2 3.73Å; K530-F532 HydrophobicContact CB-CZ 3.91Å; K530-F532 WeakPolarHBondContact O-CD2 3.3Å; K530-F532 WeakPolarHBondContact O-CE2 3.23Å
531	S	91.3	Very high	89.6	Confident	47 Å²	47	61.3 Å²	61.3	33%	0.329	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	139.9	-177.9	-32.2	0	0	0	0	112.7	K521 Y523 G529	K521-S531 VanDerWaalsContact CB-CB 3.5Å; K521-S531 WeakPolarHBondContact CD-O 3.44Å; Y523-S531 CarbonylContact O-C 3.53Å; Y523-S531 WeakPolarHBondContact O-CA 3.33Å; G529-S531 PolarHBondContact O-N 3.34Å
532	F	90.9	Very high	89.4	Confident	42 Å²	42	60 Å²	60	18%	0.184	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157.9	-174.9	-60.2	-87.9	0	0	0	112.2	K521 Y523 C525 K530 E537 L538 H541	K521-F532 CarbonylContact C-O 3.57Å; K521-F532 VanDerWaalsContact C-O 3.23Å; K521-F532 WeakPolarHBondContact CA-O 3.21Å; Y523-F532 PolarHBondContact N-O 3.4Å; Y523-F532 PolarHBondContact O-N 3.4Å; C525-F532 HydrophobicContact CB-CE2 4.33Å; K530-F532 HydrophobicContact CB-CE2 3.73Å; K530-F532 HydrophobicContact CB-CZ 3.91Å; K530-F532 WeakPolarHBondContact O-CD2 3.3Å; K530-F532 WeakPolarHBondContact O-CE2 3.23Å; F532-E537 HydrophobicContact CB-CB 4Å; F532-E537 HydrophobicContact CD1-CB 3.96Å; F532-E537 HydrophobicContact CG-CB 4.29Å; F532-L538 HydrophobicContact CB-CB 4.27Å; F532-L538 HydrophobicContact CD2-CB 4.07Å; F532-L538 HydrophobicContact CD2-CD1 3.83Å; F532-L538 HydrophobicContact CE2-CD1 4.09Å; F532-L538 HydrophobicContact CG-CB 4.33Å; F532-H541 HydrophobicContact CE1-CB 3.91Å; F532-H541 HydrophobicContact CE2-CB 3.97Å; F532-H541 AromaticContact CE2-CD2 3.24Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.49Å; F532-H541 AromaticContact CE2-CG 3.74Å; F532-H541 HydrophobicContact CZ-CB 3.49Å; F532-H541 VanDerWaalsContact CZ-CB 3.49Å; F532-H541 AromaticContact CZ-CD2 3.26Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.26Å; F532-H541 AromaticContact CZ-CG 3.3Å
533	I	89.8	Confident	89.3	Confident	25 Å²	25	58.9 Å²	58.9	13%	0.128	34%	0.339	C	S	.	.	S	Bend	trans	-84.3	-27.3	-174	-62	-179.7	0	0	0	111.2	R515 K516 K521 Y523 E537	R515-I533 HydrophobicContact CB-CG2 3.58Å; R515-I533 PolarHBondContact NH1-O 3.31Å; K516-I533 HydrophobicContact CG-CD1 3.91Å; K521-I533 HydrophobicContact CG-CG1 3.75Å; Y523-I533 WeakPolarHBondContact CE2-O 3.22Å; I533-E537 WeakPolarHBondContact CB-OE2 3.49Å; I533-E537 PolarHBondContact N-OE2 2.8Å; I533-E537 VanDerWaalsContact N-OE2 3.12Å
534	S	90.9	Very high	89	Confident	25 Å²	25	60.3 Å²	60.3	18%	0.175	36%	0.356	C	S	.	.	S	Bend	trans	-132.9	153.8	177	66.3	0	0	0	0	113.2	Y523 G536 E537 L538	Y523-S534 VanDerWaalsContact CD2-CA 3.45Å; Y523-S534 VanDerWaalsContact CE2-CA 3.48Å; S534-G536 PolarHBondContact O-N 3.21Å; S534-E537 PolarHBondContact N-OE2 3.3Å; S534-E537 PolarHBondContact O-N 3.1Å; S534-E537 VanDerWaalsContact OG-CD 3.29Å; S534-E537 VanDerWaalsContact OG-CG 3.28Å; S534-E537 WeakPolarHBondContact OG-CG 3.38Å; S534-E537 PolarHBondContact OG-N 3.02Å; S534-E537 PolarHBondContact OG-OE2 3.26Å; S534-L538 PolarHBondContact O-N 3.41Å; S534-L538 VanDerWaalsContact O-N 3.14Å
535	S	88.9	Confident	88.8	Confident	44 Å²	44	58.7 Å²	58.7	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-60.8	-32.9	174	53	0	0	0	0	112.7	L538 N539	S535-L538 PolarHBondContact O-N 3.14Å; S535-N539 WeakPolarHBondContact O-CB 3.29Å; S535-N539 PolarHBondContact O-N 3.33Å
536	G	86.9	Confident	88.4	Confident	40 Å²	40	61.6 Å²	61.6	41%	0.412	36%	0.364	S	S	.	.	H	α-helix	trans	-66.9	-36.2	175.9	0	0	0	0	0	113.4	S534 K540	S534-G536 PolarHBondContact O-N 3.21Å; G536-K540 WeakPolarHBondContact O-CG 3.37Å; G536-K540 PolarHBondContact O-N 3.01Å; G536-K540 VanDerWaalsContact O-N 3.1Å
537	E	88.4	Confident	88	Confident	72 Å²	72	60 Å²	60	34%	0.336	35%	0.348	S	S	.	.	H	α-helix	trans	-67.3	-44	171.3	-74	163.1	178.4	0	0	111.2	F532 I533 S534 N539 K540 H541	F532-E537 HydrophobicContact CB-CB 4Å; F532-E537 HydrophobicContact CD1-CB 3.96Å; F532-E537 HydrophobicContact CG-CB 4.29Å; I533-E537 WeakPolarHBondContact CB-OE2 3.49Å; I533-E537 PolarHBondContact N-OE2 2.8Å; I533-E537 VanDerWaalsContact N-OE2 3.12Å; S534-E537 PolarHBondContact N-OE2 3.3Å; S534-E537 PolarHBondContact O-N 3.1Å; S534-E537 VanDerWaalsContact OG-CD 3.29Å; S534-E537 VanDerWaalsContact OG-CG 3.28Å; S534-E537 WeakPolarHBondContact OG-CG 3.38Å; S534-E537 PolarHBondContact OG-N 3.02Å; S534-E537 PolarHBondContact OG-OE2 3.26Å; E537-N539 PolarHBondContact O-N 2.8Å; E537-K540 PolarHBondContact O-N 3.2Å; E537-H541 PolarHBondContact O-N 2.97Å
538	L	91	Very high	87.7	Confident	36 Å²	36	59.7 Å²	59.7	19%	0.188	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-45.6	175.2	173	60.5	0	0	0	111.8	C525 F532 S534 S535 H541 F542	C525-L538 HydrophobicContact CB-CD1 3.65Å; F532-L538 HydrophobicContact CB-CB 4.27Å; F532-L538 HydrophobicContact CD2-CB 4.07Å; F532-L538 HydrophobicContact CD2-CD1 3.83Å; F532-L538 HydrophobicContact CE2-CD1 4.09Å; F532-L538 HydrophobicContact CG-CB 4.33Å; S534-L538 PolarHBondContact O-N 3.41Å; S534-L538 VanDerWaalsContact O-N 3.14Å; S535-L538 PolarHBondContact O-N 3.14Å; L538-H541 CarbonylContact O-C 3.55Å; L538-H541 WeakPolarHBondContact O-CB 3.4Å; L538-H541 PolarHBondContact O-N 2.75Å; L538-H541 VanDerWaalsContact O-N 3.16Å; L538-F542 WeakPolarHBondContact O-CB 3.32Å; L538-F542 PolarHBondContact O-N 3.04Å
539	N	88.3	Confident	87.4	Confident	88 Å²	88	63.1 Å²	63.1	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-64.9	-42.5	179.6	-170.8	-11.3	0	0	0	111.6	S535 E537 H541 F542 R543	S535-N539 WeakPolarHBondContact O-CB 3.29Å; S535-N539 PolarHBondContact O-N 3.33Å; E537-N539 PolarHBondContact O-N 2.8Å; N539-H541 PolarHBondContact O-N 2.74Å; N539-F542 WeakPolarHBondContact O-CB 3.31Å; N539-F542 PolarHBondContact O-N 3.36Å; N539-R543 PolarHBondContact O-N 3.25Å
540	K	87	Confident	87.2	Confident	96 Å²	96	64 Å²	64	42%	0.417	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-36.9	172.2	-76.2	-175.2	177.8	-154.8	0	112.9	G536 E537 D562	G536-K540 WeakPolarHBondContact O-CG 3.37Å; G536-K540 PolarHBondContact O-N 3.01Å; G536-K540 VanDerWaalsContact O-N 3.1Å; E537-K540 PolarHBondContact O-N 3.2Å; K540-D562 IonicContact NZ-OD1 3.87Å; K540-D562 PolarHBondContact NZ-OD1 2.87Å; K540-D562 IonicContact NZ-OD2 3.25Å; K540-D562 PolarHBondContact NZ-OD2 3.06Å
541	H	88.6	Confident	86.9	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.12	33%	0.331	C	S	.	.	H	α-helix	trans	-72.7	-36.6	173.1	171.8	50.8	0	0	0	112.6	C528 F532 E537 L538 N539 R543 S544 H545	C528-H541 PolarHBondContact SG-NE2 3.04Å; F532-H541 HydrophobicContact CE1-CB 3.91Å; F532-H541 HydrophobicContact CE2-CB 3.97Å; F532-H541 AromaticContact CE2-CD2 3.24Å; F532-H541 WeakPolarHBondContact CE2-CD2 3.49Å; F532-H541 AromaticContact CE2-CG 3.74Å; F532-H541 HydrophobicContact CZ-CB 3.49Å; F532-H541 VanDerWaalsContact CZ-CB 3.49Å; F532-H541 AromaticContact CZ-CD2 3.26Å; F532-H541 WeakPolarHBondContact CZ-CD2 3.26Å; F532-H541 AromaticContact CZ-CG 3.3Å; E537-H541 PolarHBondContact O-N 2.97Å; L538-H541 CarbonylContact O-C 3.55Å; L538-H541 WeakPolarHBondContact O-CB 3.4Å; L538-H541 PolarHBondContact O-N 2.75Å; L538-H541 VanDerWaalsContact O-N 3.16Å; N539-H541 PolarHBondContact O-N 2.74Å; H541-R543 PolarHBondContact O-N 3.33Å; H541-S544 PolarHBondContact ND1-OG 3.38Å; H541-S544 WeakPolarHBondContact O-CB 3.29Å; H541-S544 PolarHBondContact O-N 3.23Å; H541-S544 PolarHBondContact O-OG 2.89Å; H541-H545 AromaticContact CD2-NE2 3.94Å; H541-H545 AromaticContact CE1-CD2 3.98Å; H541-H545 AromaticContact CE1-CE1 3.8Å; H541-H545 AromaticContact CE1-NE2 3.15Å; H541-H545 PolarHBondContact CE1-NE2 3.07Å; H541-H545 AromaticContact NE2-CD2 3.85Å; H541-H545 AromaticContact NE2-CE1 3.94Å; H541-H545 AromaticContact NE2-NE2 3Å; H541-H545 PolarHBondContact NE2-NE2 2.88Å
542	F	86.5	Confident	86.6	Confident	84 Å²	84	63 Å²	63	37%	0.368	34%	0.34	S	S	.	.	H	α-helix	trans	-58.5	-36.2	179.4	-162.1	-100.6	0	0	0	112	I527 L538 N539 S544 H545 T546	I527-F542 HydrophobicContact CD1-CD2 4.19Å; I527-F542 HydrophobicContact CD1-CE2 3.48Å; I527-F542 VanDerWaalsContact CD1-CE2 3.48Å; I527-F542 HydrophobicContact CD1-CZ 3.88Å; I527-F542 HydrophobicContact CG1-CE2 4.12Å; L538-F542 WeakPolarHBondContact O-CB 3.32Å; L538-F542 PolarHBondContact O-N 3.04Å; N539-F542 WeakPolarHBondContact O-CB 3.31Å; N539-F542 PolarHBondContact O-N 3.36Å; F542-S544 PolarHBondContact O-N 2.9Å; F542-H545 WeakPolarHBondContact O-CA 3.35Å; F542-H545 WeakPolarHBondContact O-CB 3.36Å; F542-H545 PolarHBondContact O-N 3.02Å; F542-T546 HydrophobicContact CD1-CG2 3.76Å; F542-T546 HydrophobicContact CE1-CG2 3.45Å; F542-T546 VanDerWaalsContact CE1-CG2 3.45Å; F542-T546 HydrophobicContact CZ-CG2 4.29Å; F542-T546 PolarHBondContact O-N 3.26Å; F542-T546 VanDerWaalsContact O-N 3.12Å
543	R	87.5	Confident	86.5	Confident	46 Å²	46	61.2 Å²	61.2	17%	0.174	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-20.2	172	-64.9	176.4	-178.2	-169.6	-7.6	115.1	N539 H541 H545 G547 E548 T561	N539-R543 PolarHBondContact O-N 3.25Å; H541-R543 PolarHBondContact O-N 3.33Å; R543-H545 VanDerWaalsContact C-N 3.27Å; R543-G547 WeakPolarHBondContact O-CA 3.39Å; R543-G547 PolarHBondContact O-N 2.89Å; R543-G547 VanDerWaalsContact O-N 3.08Å; R543-E548 HydrophobicContact CG-CB 4.25Å; R543-T561 PolarHBondContact NH1-O 3.31Å; R543-T561 VanDerWaalsContact NH1-O 3.15Å
544	S	86	Confident	86.3	Confident	81 Å²	81	69.3 Å²	69.3	57%	0.566	37%	0.37	S	S	*	.	H	α-helix	trans	-76.3	-15.8	171.3	71.7	0	0	0	0	113.2	H541 F542	H541-S544 PolarHBondContact ND1-OG 3.38Å; H541-S544 WeakPolarHBondContact O-CB 3.29Å; H541-S544 PolarHBondContact O-N 3.23Å; H541-S544 PolarHBondContact O-OG 2.89Å; F542-S544 PolarHBondContact O-N 2.9Å
545	H	85.9	Confident	86	Confident	70 Å²	70	72.5 Å²	72.5	32%	0.324	39%	0.385	S	S	.	.	H	α-helix	trans	-94.6	-41.9	173.3	-58.5	-63.4	0	0	0	111.8	C525 I527 C528 H541 F542 R543 G547	C525-H545 PolarHBondContact SG-NE2 3.06Å; I527-H545 HydrophobicContact CD1-CB 3.63Å; I527-H545 HydrophobicContact CG2-CB 4.36Å; C528-H545 PolarHBondContact SG-NE2 2.88Å; C528-H545 VanDerWaalsContact SG-NE2 3.38Å; H541-H545 AromaticContact CD2-NE2 3.94Å; H541-H545 AromaticContact CE1-CD2 3.98Å; H541-H545 AromaticContact CE1-CE1 3.8Å; H541-H545 AromaticContact CE1-NE2 3.15Å; H541-H545 PolarHBondContact CE1-NE2 3.07Å; H541-H545 AromaticContact NE2-CD2 3.85Å; H541-H545 AromaticContact NE2-CE1 3.94Å; H541-H545 AromaticContact NE2-NE2 3Å; H541-H545 PolarHBondContact NE2-NE2 2.88Å; F542-H545 WeakPolarHBondContact O-CA 3.35Å; F542-H545 WeakPolarHBondContact O-CB 3.36Å; F542-H545 PolarHBondContact O-N 3.02Å; R543-H545 VanDerWaalsContact C-N 3.27Å; H545-G547 VanDerWaalsContact C-N 3.31Å
546	T	83.9	Confident	85.8	Confident	63 Å²	63	72.9 Å²	72.9	39%	0.387	39%	0.387	S	S	.	.	H	α-helix	trans	-77.8	-15.8	178.4	63.7	0	0	0	0	113.6	F542 E548	F542-T546 HydrophobicContact CD1-CG2 3.76Å; F542-T546 HydrophobicContact CE1-CG2 3.45Å; F542-T546 VanDerWaalsContact CE1-CG2 3.45Å; F542-T546 HydrophobicContact CZ-CG2 4.29Å; F542-T546 PolarHBondContact O-N 3.26Å; F542-T546 VanDerWaalsContact O-N 3.12Å; T546-E548 WeakPolarHBondContact CB-OE1 3.34Å; T546-E548 PolarHBondContact O-N 2.85Å; T546-E548 WeakPolarHBondContact OG1-CG 3.41Å; T546-E548 PolarHBondContact OG1-OE1 2.94Å
547	G	80.7	Confident	85.6	Confident	49 Å²	49	73.6 Å²	73.6	51%	0.505	39%	0.394	S	S	.	.			trans	73	2.6	-176.3	0	0	0	0	0	114.2	R543 H545 R549	R543-G547 WeakPolarHBondContact O-CA 3.39Å; R543-G547 PolarHBondContact O-N 2.89Å; R543-G547 VanDerWaalsContact O-N 3.08Å; H545-G547 VanDerWaalsContact C-N 3.31Å; G547-R549 WeakPolarHBondContact O-CG 3.38Å; G547-R549 PolarHBondContact O-N 3.37Å
548	E	82.1	Confident	85.4	Confident	94 Å²	94	73.7 Å²	73.7	44%	0.439	40%	0.397	S	S	.	.			trans	-58.1	126.4	179	-79.8	167.1	-125	0	0	112.2	R543 T546 P550	R543-E548 HydrophobicContact CG-CB 4.25Å; T546-E548 WeakPolarHBondContact CB-OE1 3.34Å; T546-E548 PolarHBondContact O-N 2.85Å; T546-E548 WeakPolarHBondContact OG1-CG 3.41Å; T546-E548 PolarHBondContact OG1-OE1 2.94Å; E548-P550 WeakPolarHBondContact O-CD 3.4Å
549	R	82.3	Confident	85	Confident	123 Å²	123	73.8 Å²	73.8	46%	0.464	40%	0.401	S	S	.	.			trans	-125.9	70	179	-68.9	167.4	81.1	131.2	0.9	110.8	G547 F551 S559 Y560 T561	G547-R549 WeakPolarHBondContact O-CG 3.38Å; G547-R549 PolarHBondContact O-N 3.37Å; R549-F551 PolarHBondContact O-N 3.31Å; R549-F551 VanDerWaalsContact O-N 3.07Å; R549-S559 WeakPolarHBondContact CB-OG 3.49Å; R549-S559 WeakPolarHBondContact CD-OG 3.3Å; R549-S559 PolarHBondContact NE-O 2.72Å; R549-S559 PolarHBondContact NE-OG 2.9Å; R549-S559 VanDerWaalsContact NE-OG 3.15Å; R549-S559 PolarHBondContact NH2-O 3.38Å; R549-Y560 CarbonylContact C-O 3.5Å; R549-Y560 VanDerWaalsContact C-O 3.23Å; R549-Y560 VanDerWaalsContact CA-O 3.3Å; R549-Y560 WeakPolarHBondContact CA-O 3.49Å; R549-T561 HydrophobicContact CG-CG2 3.8Å
550	P	83.8	Confident	84.8	Confident	66 Å²	66	71.5 Å²	71.5	43%	0.429	39%	0.385	S	S	.	.			trans	-68.8	-10.2	-169.9	-20.2	34.9	0	0	0	114.9	E548	E548-P550 WeakPolarHBondContact O-CD 3.4Å
551	F	83.6	Confident	84.6	Confident	52 Å²	52	69.1 Å²	69.1	23%	0.228	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	92.1	-174.6	-53.7	-60.2	0	0	0	110.2	R549 S559 Y560 T561 D562 I563 L566	R549-F551 PolarHBondContact O-N 3.31Å; R549-F551 VanDerWaalsContact O-N 3.07Å; F551-S559 CarbonylContact O-C 3.31Å; F551-Y560 PolarHBondContact N-O 2.88Å; F551-Y560 PolarHBondContact O-N 3.38Å; F551-T561 WeakPolarHBondContact CE2-O 3.29Å; F551-D562 VanDerWaalsContact CD2-C 3.48Å; F551-I563 HydrophobicContact CD1-CD1 4.31Å; F551-I563 HydrophobicContact CD1-CG1 3.58Å; F551-I563 HydrophobicContact CD2-CG1 3.94Å; F551-I563 HydrophobicContact CE1-CD1 3.73Å; F551-I563 HydrophobicContact CE1-CG1 3.38Å; F551-I563 HydrophobicContact CE2-CG1 3.72Å; F551-I563 HydrophobicContact CG-CG1 3.86Å; F551-I563 HydrophobicContact CZ-CD1 3.88Å; F551-I563 HydrophobicContact CZ-CG1 3.45Å; F551-I563 VanDerWaalsContact CZ-CG1 3.45Å; F551-L566 HydrophobicContact CB-CB 4.32Å; F551-L566 HydrophobicContact CB-CD2 3.9Å
552	I	85.7	Confident	84.3	Confident	101 Å²	101	69.2 Å²	69.2	52%	0.518	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	139	-179.4	-56.6	174.8	0	0	0	109.8	E554	I552-E554 PolarHBondContact O-N 3.27Å
553	C	88.1	Confident	84.2	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.034	38%	0.383	C	S	.	.			trans	-82.3	109.7	168.4	-168.5	0	0	0	0	109.6	L555 C556 G557 N558 Y560 L566	C553-L555 PolarHBondContact O-N 3.27Å; C553-L555 VanDerWaalsContact O-N 3.11Å; C553-C556 PolarHBondContact O-N 3.09Å; C553-C556 VanDerWaalsContact O-N 3.16Å; C553-G557 WeakPolarHBondContact O-CA 3.44Å; C553-G557 PolarHBondContact O-N 3.06Å; C553-N558 HydrophobicContact CB-CB 4.47Å; C553-N558 WeakPolarHBondContact CB-O 3.48Å; C553-N558 PolarHBondContact N-O 3.15Å; C553-Y560 HydrophobicContact CB-CE2 4.46Å; C553-L566 HydrophobicContact CB-CD1 3.46Å; C553-L566 VanDerWaalsContact CB-CD1 3.46Å
554	E	85.9	Confident	84.1	Confident	194 Å²	194	73.8 Å²	73.8	91%	0.907	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.1	179.3	-66.5	162.1	-175	0	0	113	I552	I552-E554 PolarHBondContact O-N 3.27Å
555	L	83.9	Confident	84.1	Confident	93 Å²	93	73.1 Å²	73.1	49%	0.487	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-12.2	-178.2	-60.2	178.4	0	0	0	114.7	C553 K570 H574	C553-L555 PolarHBondContact O-N 3.27Å; C553-L555 VanDerWaalsContact O-N 3.11Å; L555-K570 HydrophobicContact CD1-CG 4.37Å; L555-H574 VanDerWaalsContact CB-CE1 3.47Å; L555-H574 WeakPolarHBondContact CB-CE1 3.28Å; L555-H574 HydrophobicContact CD1-CB 3.65Å
556	C	85.9	Confident	84.2	Confident	52 Å²	52	71.4 Å²	71.4	35%	0.351	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.9	8.5	-178.1	64.4	0	0	0	0	115.7	C553 N558 H569 H574	C553-C556 PolarHBondContact O-N 3.09Å; C553-C556 VanDerWaalsContact O-N 3.16Å; C556-N558 PolarHBondContact O-N 2.82Å; C556-N558 PolarHBondContact SG-ND2 2.84Å; C556-H569 PolarHBondContact SG-NE2 3.45Å; C556-H574 PolarHBondContact SG-NE2 2.63Å
557	G	81.8	Confident	84.3	Confident	54 Å²	54	75.2 Å²	75.2	56%	0.557	40%	0.399	S	S	*	.			trans	70	-5.9	-179.1	0	0	0	0	0	115.9	C553 S559	C553-G557 WeakPolarHBondContact O-CA 3.44Å; C553-G557 PolarHBondContact O-N 3.06Å; G557-S559 PolarHBondContact O-N 3.31Å
558	N	84	Confident	84.7	Confident	75 Å²	75	78.9 Å²	78.9	40%	0.401	40%	0.401	S	S	.	.			trans	-65.9	119.6	-176.8	-78.7	-55.6	0	0	0	111.9	C553 C556 Y560	C553-N558 HydrophobicContact CB-CB 4.47Å; C553-N558 WeakPolarHBondContact CB-O 3.48Å; C553-N558 PolarHBondContact N-O 3.15Å; C556-N558 PolarHBondContact O-N 2.82Å; C556-N558 PolarHBondContact SG-ND2 2.84Å; N558-Y560 HydrophobicContact CB-CE2 3.71Å; N558-Y560 WeakPolarHBondContact CB-OH 3.44Å; N558-Y560 WeakPolarHBondContact O-CD2 3.3Å; N558-Y560 WeakPolarHBondContact O-CE2 3.44Å
559	S	83.6	Confident	84.9	Confident	38 Å²	38	75.4 Å²	75.4	27%	0.266	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	149.4	179	68.7	0	0	0	0	112.3	R549 F551 G557	R549-S559 WeakPolarHBondContact CB-OG 3.49Å; R549-S559 WeakPolarHBondContact CD-OG 3.3Å; R549-S559 PolarHBondContact NE-O 2.72Å; R549-S559 PolarHBondContact NE-OG 2.9Å; R549-S559 VanDerWaalsContact NE-OG 3.15Å; R549-S559 PolarHBondContact NH2-O 3.38Å; F551-S559 CarbonylContact O-C 3.31Å; G557-S559 PolarHBondContact O-N 3.31Å
560	Y	83.3	Confident	85	Confident	39 Å²	39	73.7 Å²	73.7	15%	0.153	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	150.6	-179.9	-63.4	-82.3	0	0	0	112.9	R549 F551 C553 N558 N565 L566 H569	R549-Y560 CarbonylContact C-O 3.5Å; R549-Y560 VanDerWaalsContact C-O 3.23Å; R549-Y560 VanDerWaalsContact CA-O 3.3Å; R549-Y560 WeakPolarHBondContact CA-O 3.49Å; F551-Y560 PolarHBondContact N-O 2.88Å; F551-Y560 PolarHBondContact O-N 3.38Å; C553-Y560 HydrophobicContact CB-CE2 4.46Å; N558-Y560 HydrophobicContact CB-CE2 3.71Å; N558-Y560 WeakPolarHBondContact CB-OH 3.44Å; N558-Y560 WeakPolarHBondContact O-CD2 3.3Å; N558-Y560 WeakPolarHBondContact O-CE2 3.44Å; Y560-N565 HydrophobicContact CD1-CB 4Å; Y560-N565 HydrophobicContact CG-CB 4.42Å; Y560-L566 HydrophobicContact CD2-CB 3.89Å; Y560-L566 HydrophobicContact CD2-CD1 3.83Å; Y560-L566 HydrophobicContact CD2-CG 4.46Å; Y560-L566 HydrophobicContact CE2-CD1 4.1Å; Y560-L566 HydrophobicContact CG-CB 4.25Å; Y560-H569 HydrophobicContact CE1-CB 4.31Å; Y560-H569 HydrophobicContact CE2-CB 4Å; Y560-H569 AromaticContact CE2-CD2 3.67Å; Y560-H569 AromaticContact CE2-CG 3.82Å; Y560-H569 AromaticContact CZ-CD2 3.9Å; Y560-H569 AromaticContact CZ-CG 3.59Å; Y560-H569 PolarHBondContact OH-CE1 3.48Å; Y560-H569 PolarHBondContact OH-ND1 2.76Å; Y560-H569 VanDerWaalsContact OH-ND1 3.07Å
561	T	83	Confident	85.2	Confident	46 Å²	46	75.1 Å²	75.1	28%	0.282	39%	0.388	S	S	.	.	S	Bend	trans	-76.9	-26.1	179.3	54.2	0	0	0	0	114	R543 R549 F551	R543-T561 PolarHBondContact NH1-O 3.31Å; R543-T561 VanDerWaalsContact NH1-O 3.15Å; R549-T561 HydrophobicContact CG-CG2 3.8Å; F551-T561 WeakPolarHBondContact CE2-O 3.29Å
562	D	82.9	Confident	85.2	Confident	29 Å²	29	80.9 Å²	80.9	16%	0.155	41%	0.413	C	S	.	.	S	Bend	trans	-136.8	139.9	179.9	-167.4	-8.4	0	0	0	111.3	K540 F551 K564 N565 L566	K540-D562 IonicContact NZ-OD1 3.87Å; K540-D562 PolarHBondContact NZ-OD1 2.87Å; K540-D562 IonicContact NZ-OD2 3.25Å; K540-D562 PolarHBondContact NZ-OD2 3.06Å; F551-D562 VanDerWaalsContact CD2-C 3.48Å; D562-K564 PolarHBondContact O-N 3.37Å; D562-K564 PolarHBondContact OD1-N 2.84Å; D562-N565 WeakPolarHBondContact O-CB 3.44Å; D562-N565 PolarHBondContact O-N 2.83Å; D562-L566 PolarHBondContact O-N 2.68Å
563	I	84.7	Confident	85.1	Confident	81 Å²	81	80.5 Å²	80.5	42%	0.415	42%	0.415	S	S	.	.	H	α-helix	trans	-53.8	-34.6	174.7	-58	175.1	0	0	0	110.9	F551 N565 L566 K567	F551-I563 HydrophobicContact CD1-CD1 4.31Å; F551-I563 HydrophobicContact CD1-CG1 3.58Å; F551-I563 HydrophobicContact CD2-CG1 3.94Å; F551-I563 HydrophobicContact CE1-CD1 3.73Å; F551-I563 HydrophobicContact CE1-CG1 3.38Å; F551-I563 HydrophobicContact CE2-CG1 3.72Å; F551-I563 HydrophobicContact CG-CG1 3.86Å; F551-I563 HydrophobicContact CZ-CD1 3.88Å; F551-I563 HydrophobicContact CZ-CG1 3.45Å; F551-I563 VanDerWaalsContact CZ-CG1 3.45Å; I563-N565 PolarHBondContact O-N 2.88Å; I563-L566 PolarHBondContact O-N 3.04Å; I563-K567 HydrophobicContact CG2-CD 4.32Å; I563-K567 HydrophobicContact CG2-CG 4.2Å; I563-K567 WeakPolarHBondContact O-CB 3.33Å; I563-K567 WeakPolarHBondContact O-CG 3.36Å; I563-K567 PolarHBondContact O-N 3.29Å
564	K	85.8	Confident	84.8	Confident	144 Å²	144	82 Å²	82	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-61.7	-33.1	177	-66.3	-170.7	175	-173.7	0	112.7	D562 K568	D562-K564 PolarHBondContact O-N 3.37Å; D562-K564 PolarHBondContact OD1-N 2.84Å; K564-K568 WeakPolarHBondContact O-CB 3.34Å; K564-K568 VanDerWaalsContact O-CG 3.26Å; K564-K568 WeakPolarHBondContact O-CG 3.49Å; K564-K568 PolarHBondContact O-N 3.03Å; K564-K568 VanDerWaalsContact O-N 3.12Å
565	N	85.5	Confident	83.9	Confident	68 Å²	68	76.7 Å²	76.7	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-79	-40.3	178.4	-64.6	-20.2	0	0	0	110.7	Y560 D562 I563 K568 H569	Y560-N565 HydrophobicContact CD1-CB 4Å; Y560-N565 HydrophobicContact CG-CB 4.42Å; D562-N565 WeakPolarHBondContact O-CB 3.44Å; D562-N565 PolarHBondContact O-N 2.83Å; I563-N565 PolarHBondContact O-N 2.88Å; N565-K568 PolarHBondContact O-N 3.23Å; N565-H569 WeakPolarHBondContact O-CB 3.5Å; N565-H569 PolarHBondContact O-N 2.79Å
566	L	87.8	Confident	82.7	Confident	34 Å²	34	76.2 Å²	76.2	18%	0.178	42%	0.424	C	S	.	.	H	α-helix	trans	-59.1	-48	170.9	173.4	59.4	0	0	0	112	F551 C553 Y560 D562 I563 K568 H569 K570	F551-L566 HydrophobicContact CB-CB 4.32Å; F551-L566 HydrophobicContact CB-CD2 3.9Å; C553-L566 HydrophobicContact CB-CD1 3.46Å; C553-L566 VanDerWaalsContact CB-CD1 3.46Å; Y560-L566 HydrophobicContact CD2-CB 3.89Å; Y560-L566 HydrophobicContact CD2-CD1 3.83Å; Y560-L566 HydrophobicContact CD2-CG 4.46Å; Y560-L566 HydrophobicContact CE2-CD1 4.1Å; Y560-L566 HydrophobicContact CG-CB 4.25Å; D562-L566 PolarHBondContact O-N 2.68Å; I563-L566 PolarHBondContact O-N 3.04Å; L566-K568 PolarHBondContact O-N 2.99Å; L566-H569 WeakPolarHBondContact O-CB 3.27Å; L566-H569 PolarHBondContact O-N 2.94Å; L566-H569 VanDerWaalsContact O-N 3.11Å; L566-K570 PolarHBondContact O-N 3.22Å
567	K	87.1	Confident	81.1	Confident	142 Å²	142	77.7 Å²	77.7	62%	0.617	44%	0.44	S	S	*	.	H	α-helix	trans	-58.1	-49.9	175.8	-76.1	-170.2	175.9	-168.4	0	111	I563 H569 K570 T571	I563-K567 HydrophobicContact CG2-CD 4.32Å; I563-K567 HydrophobicContact CG2-CG 4.2Å; I563-K567 WeakPolarHBondContact O-CB 3.33Å; I563-K567 WeakPolarHBondContact O-CG 3.36Å; I563-K567 PolarHBondContact O-N 3.29Å; K567-H569 PolarHBondContact O-N 3.48Å; K567-K570 PolarHBondContact O-N 3.27Å; K567-T571 WeakPolarHBondContact O-CG2 3.11Å; K567-T571 PolarHBondContact O-N 3.47Å; K567-T571 PolarHBondContact O-OG1 3.15Å; K567-T571 VanDerWaalsContact O-OG1 3.08Å
568	K	87.3	Confident	79.3	Confident	127 Å²	127	79.2 Å²	79.2	55%	0.552	44%	0.435	S	S	*	.	H	α-helix	trans	-57.2	-32.2	175.3	-79.3	176.1	178	-176.5	0	113.5	K564 N565 L566 T571 K572	K564-K568 WeakPolarHBondContact O-CB 3.34Å; K564-K568 VanDerWaalsContact O-CG 3.26Å; K564-K568 WeakPolarHBondContact O-CG 3.49Å; K564-K568 PolarHBondContact O-N 3.03Å; K564-K568 VanDerWaalsContact O-N 3.12Å; N565-K568 PolarHBondContact O-N 3.23Å; L566-K568 PolarHBondContact O-N 2.99Å; K568-T571 WeakPolarHBondContact CA-OG1 3.47Å; K568-T571 PolarHBondContact O-OG1 2.81Å; K568-K572 WeakPolarHBondContact O-CB 3.35Å; K568-K572 WeakPolarHBondContact O-CG 3.37Å; K568-K572 PolarHBondContact O-N 3.38Å
569	H	86.9	Confident	77.7	Confident	20 Å²	20	85.7 Å²	85.7	9%	0.093	46%	0.46	C	S	.	.	H	α-helix	trans	-74.4	-48.8	175.3	166.1	74.5	0	0	0	111.6	C556 Y560 N565 L566 K567 T571 K572 V573 H574	C556-H569 PolarHBondContact SG-NE2 3.45Å; Y560-H569 HydrophobicContact CE1-CB 4.31Å; Y560-H569 HydrophobicContact CE2-CB 4Å; Y560-H569 AromaticContact CE2-CD2 3.67Å; Y560-H569 AromaticContact CE2-CG 3.82Å; Y560-H569 AromaticContact CZ-CD2 3.9Å; Y560-H569 AromaticContact CZ-CG 3.59Å; Y560-H569 PolarHBondContact OH-CE1 3.48Å; Y560-H569 PolarHBondContact OH-ND1 2.76Å; Y560-H569 VanDerWaalsContact OH-ND1 3.07Å; N565-H569 WeakPolarHBondContact O-CB 3.5Å; N565-H569 PolarHBondContact O-N 2.79Å; L566-H569 WeakPolarHBondContact O-CB 3.27Å; L566-H569 PolarHBondContact O-N 2.94Å; L566-H569 VanDerWaalsContact O-N 3.11Å; K567-H569 PolarHBondContact O-N 3.48Å; H569-T571 VanDerWaalsContact C-N 3.26Å; H569-T571 PolarHBondContact O-N 3.25Å; H569-K572 PolarHBondContact O-N 3.33Å; H569-V573 VanDerWaalsContact ND1-CG2 3.34Å; H569-V573 WeakPolarHBondContact ND1-CG2 3.46Å; H569-V573 PolarHBondContact O-N 2.81Å; H569-H574 AromaticContact NE2-CD2 3.81Å; H569-H574 AromaticContact NE2-NE2 3.48Å; H569-H574 PolarHBondContact NE2-NE2 2.91Å
570	K	85.5	Confident	75.8	Confident	87 Å²	87	89.3 Å²	89.3	38%	0.378	48%	0.48	S	S	.	.	H	α-helix	trans	-56.2	-42.5	174.4	-163.5	-176.4	175.8	-175.7	0	110.9	L555 L566 K567 K572 H574 S575 D578	L555-K570 HydrophobicContact CD1-CG 4.37Å; L566-K570 PolarHBondContact O-N 3.22Å; K567-K570 PolarHBondContact O-N 3.27Å; K570-K572 PolarHBondContact O-N 3.28Å; K570-H574 HydrophobicContact CG-CB 4.18Å; K570-H574 CarbonylContact O-C 3.56Å; K570-H574 PolarHBondContact O-N 2.89Å; K570-S575 PolarHBondContact O-OG 3.08Å; K570-D578 IonicContact NZ-OD2 3.79Å; K570-D578 PolarHBondContact NZ-OD2 3.08Å
571	T	86.2	Confident	73.6	Confident	96 Å²	96	95.3 Å²	95.3	59%	0.589	51%	0.514	S	S	*	.	H	α-helix	trans	-76.5	7	177.3	65.8	0	0	0	0	115.3	K567 K568 H569 S575	K567-T571 WeakPolarHBondContact O-CG2 3.11Å; K567-T571 PolarHBondContact O-N 3.47Å; K567-T571 PolarHBondContact O-OG1 3.15Å; K567-T571 VanDerWaalsContact O-OG1 3.08Å; K568-T571 WeakPolarHBondContact CA-OG1 3.47Å; K568-T571 PolarHBondContact O-OG1 2.81Å; H569-T571 VanDerWaalsContact C-N 3.26Å; H569-T571 PolarHBondContact O-N 3.25Å; T571-S575 WeakPolarHBondContact CA-OG 3.41Å; T571-S575 PolarHBondContact O-OG 3Å
572	K	85.4	Confident	71	Confident	173 Å²	173	98.9 Å²	98.9	75%	0.752	53%	0.531	S	S	*	.	H	α-helix	trans	-129.8	-36.3	177.7	-77.4	-174.6	174	-158.9	0	113.7	K568 H569 K570	K568-K572 WeakPolarHBondContact O-CB 3.35Å; K568-K572 WeakPolarHBondContact O-CG 3.37Å; K568-K572 PolarHBondContact O-N 3.38Å; H569-K572 PolarHBondContact O-N 3.33Å; K570-K572 PolarHBondContact O-N 3.28Å
573	V	83	Confident	68.7	Low	93 Å²	93	103.5 Å²	103.5	56%	0.564	57%	0.566	S	S	*	*	H	α-helix	trans	-100.6	-34.4	-175.3	-179.2	0	0	0	0	111.3	H569	H569-V573 VanDerWaalsContact ND1-CG2 3.34Å; H569-V573 WeakPolarHBondContact ND1-CG2 3.46Å; H569-V573 PolarHBondContact O-N 2.81Å
574	H	80.8	Confident	66.3	Low	37 Å²	37	103.9 Å²	103.9	17%	0.171	58%	0.576	C	S	.	*	S	Bend	trans	-102.5	21.5	179.8	-58.8	-67.2	0	0	0	112.6	L555 C556 H569 K570 G576 A577	L555-H574 VanDerWaalsContact CB-CE1 3.47Å; L555-H574 WeakPolarHBondContact CB-CE1 3.28Å; L555-H574 HydrophobicContact CD1-CB 3.65Å; C556-H574 PolarHBondContact SG-NE2 2.63Å; H569-H574 AromaticContact NE2-CD2 3.81Å; H569-H574 AromaticContact NE2-NE2 3.48Å; H569-H574 PolarHBondContact NE2-NE2 2.91Å; K570-H574 HydrophobicContact CG-CB 4.18Å; K570-H574 CarbonylContact O-C 3.56Å; K570-H574 PolarHBondContact O-N 2.89Å; H574-G576 PolarHBondContact O-N 2.75Å; H574-G576 VanDerWaalsContact O-N 3.1Å; H574-A577 PolarHBondContact O-N 3.21Å
575	S	67.1	Low	63.6	Low	83 Å²	83	103.4 Å²	103.4	58%	0.58	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-20.8	-176.5	43.5	0	0	0	0	116.3	K570 T571	K570-S575 PolarHBondContact O-OG 3.08Å; T571-S575 WeakPolarHBondContact CA-OG 3.41Å; T571-S575 PolarHBondContact O-OG 3Å
576	G	59.5	Low	60.9	Low	83 Å²	83	106.9 Å²	106.9	86%	0.856	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-2.4	-173.5	0	0	0	0	0	116.1	H574	H574-G576 PolarHBondContact O-N 2.75Å; H574-G576 VanDerWaalsContact O-N 3.1Å
577	A	51.3	Low	58	Low	83 Å²	83	111 Å²	111	69%	0.686	62%	0.621	S	S	*	*	S	Bend	trans	-143.3	57.2	-168.9	0	0	0	0	0	113.3	H574	H574-A577 PolarHBondContact O-N 3.21Å
578	D	45	Very low	55.2	Low	86 Å²	86	108.5 Å²	108.5	46%	0.46	61%	0.612	S	S	.	*			trans	-152.6	90.4	159.4	-149.4	-21.4	0	0	0	111.4	K570 T580	K570-D578 IonicContact NZ-OD2 3.79Å; K570-D578 PolarHBondContact NZ-OD2 3.08Å; D578-T580 PolarHBondContact OD1-N 3.37Å
579	K	49.5	Very low	52.3	Low	211 Å²	211	108.6 Å²	108.6	92%	0.917	62%	0.623	S	S	*	*			trans	-118.5	25.6	165.7	-108.1	-163.7	-176.8	-173.6	0	111.3
580	T	43.5	Very low	49.6	Very low	114 Å²	114	114.8 Å²	114.8	70%	0.699	66%	0.656	S	S	*	*	S	Bend	trans	-159.3	92.3	173.1	45.4	0	0	0	0	110.9	D578	D578-T580 PolarHBondContact OD1-N 3.37Å
581	L	38.4	Very low	46.7	Very low	164 Å²	164	115.7 Å²	115.7	86%	0.859	67%	0.673	S	S	*	*	S	Bend		165.6	144.2	117	-90.2	145.1	0	0	0	112.7
582	D	28.5	Very low	43.9	Very low	121 Å²	121	118.9 Å²	118.9	65%	0.647	68%	0.681	S	S	*	*			trans	64	90.7	165.9	-158.4	3.7	0	0	0	119.4	S584	D582-S584 WeakPolarHBondContact OD1-CB 3.16Å; D582-S584 PolarHBondContact OD1-N 3Å; D582-S584 PolarHBondContact OD1-OG 3.04Å
583	S	34.9	Very low	41.3	Very low	127 Å²	127	118.7 Å²	118.7	89%	0.888	68%	0.683	S	S	*	*			trans	-93.3	78	156.8	59.7	0	0	0	0	111.5
584	S	33.9	Very low	38.7	Very low	88 Å²	88	120.4 Å²	120.4	62%	0.615	69%	0.689	S	S	*	*			trans	-150.9	35.8	172.2	71.4	0	0	0	0	117.4	D582	D582-S584 WeakPolarHBondContact OD1-CB 3.16Å; D582-S584 PolarHBondContact OD1-N 3Å; D582-S584 PolarHBondContact OD1-OG 3.04Å
585	V	29.6	Very low	36.1	Very low	135 Å²	135	123.4 Å²	123.4	82%	0.818	71%	0.714	S	S	*	*			trans	-129.2	94.3	164.1	-170.5	0	0	0	0	112.6	D587	V585-D587 PolarHBondContact O-N 3.04Å
586	E	28.3	Very low	34.2	Very low	141 Å²	141	126.6 Å²	126.6	66%	0.659	72%	0.723	S	S	*	*			trans	-74	98.1	169.9	-70	-164.8	132.3	0	0	112.5	R488 H588	R488-E586 PolarHBondContact NH2-O 3.38Å; E586-H588 IonicContact OE1-CE1 3.36Å; E586-H588 PolarHBondContact OE1-CE1 3.5Å; E586-H588 IonicContact OE1-NE2 3.66Å; E586-H588 IonicContact OE2-CE1 2.88Å; E586-H588 IonicContact OE2-NE2 3.39Å
587	D	25.9	Very low	32.6	Very low	120 Å²	120	129.7 Å²	129.7	64%	0.642	72%	0.715	S	S	*	*			trans	-96.5	85.5	159.5	-158.5	21	0	0	0	110.5	R488 V585 T589	R488-D587 IonicContact NH1-OD1 3.52Å; V585-D587 PolarHBondContact O-N 3.04Å; D587-T589 PolarHBondContact O-N 2.9Å
588	H	29.6	Very low	31.4	Very low	90 Å²	90	134 Å²	134	42%	0.417	72%	0.719	S	S	.	*			trans	-64.4	93.8	173.9	-69	-47	0	0	0	111.8	E586	E586-H588 IonicContact OE1-CE1 3.36Å; E586-H588 PolarHBondContact OE1-CE1 3.5Å; E586-H588 IonicContact OE1-NE2 3.66Å; E586-H588 IonicContact OE2-CE1 2.88Å; E586-H588 IonicContact OE2-NE2 3.39Å
589	T	25.1	Very low	30.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	73%	0.733	S	S	*	*			trans	-91.2	102.8	149.8	53.1	0	0	0	0	109	D587	D587-T589 PolarHBondContact O-N 2.9Å
590	L	30.3	Very low	29.7	Very low	150 Å²	150	130 Å²	130	79%	0.785	72%	0.721	S	S	*	*			trans	-86.2	126	-179.8	-81.1	173.8	0	0	0	113.6
591	S	25.9	Very low	28.7	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	73%	0.73	S	S	*	*			trans	177.8	133.4	137.9	-118.1	0	0	0	0	106.3
592	E	26.7	Very low	28.1	Very low	163 Å²	163	129.1 Å²	129.1	76%	0.762	72%	0.72	S	S	*	*			cis	-148.8	167.9	15.1	-60.9	-179.8	104.4	0	0	112.3
593	Q	31.6	Very low	27.9	Very low	169 Å²	169	131.4 Å²	131.4	79%	0.79	73%	0.726	S	S	*	*			trans	75.4	122.7	150.9	-76.3	168.1	-6.4	0	0	124.1
594	D	26.5	Very low	27.3	Very low	129 Å²	129	131.1 Å²	131.1	69%	0.69	72%	0.72	S	S	*	*			trans	68.9	104.8	136.6	-75.5	-58.2	0	0	0	125.3
595	S	26.5	Very low	26.9	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	73%	0.734	S	S	*	*				65.3	136.8	109.1	-55.7	0	0	0	0	122.9
596	I	27.8	Very low	26.6	Very low	151 Å²	151	137 Å²	137	77%	0.774	74%	0.735	S	S	*	*			trans	106	99.3	155.8	-56.6	-175.7	0	0	0	119.4
597	Q	25.6	Very low	26.6	Very low	147 Å²	147	137.2 Å²	137.2	69%	0.687	75%	0.746	S	S	*	*			trans	72.4	131.9	137.6	-72.3	-174.2	22.7	0	0	125.2
598	K	26.4	Very low	26.6	Very low	175 Å²	175	140.9 Å²	140.9	76%	0.761	76%	0.757	S	S	*	*			trans	84.2	105.7	136.5	-77.8	168	-179.7	156.6	0	121.1
599	S	22.6	Very low	26.8	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	77%	0.773	S	S	*	*			trans	-43.5	170.7	136.8	-37.5	0	0	0	0	112.9
600	P	35.7	Very low	26.9	Very low	103 Å²	103	141 Å²	141	67%	0.669	77%	0.77	S	S	*	*			cis	-151.9	166.4	29.3	43.9	-23.6	0	0	0	120.3
601	L	23.8	Very low	26.6	Very low	169 Å²	169	141.1 Å²	141.1	89%	0.885	77%	0.772	S	S	*	*			trans	61.1	160.7	149.4	-64.8	159.9	0	0	0	117
602	S	24.8	Very low	26.6	Very low	92 Å²	92	144.6 Å²	144.6	64%	0.643	78%	0.778	S	S	*	*			cis	-151.4	149.4	12.9	50	0	0	0	0	112.8
603	E	24.5	Very low	26.5	Very low	169 Å²	169	143.8 Å²	143.8	79%	0.79	78%	0.784	S	S	*	*			trans	54.7	112.2	134.3	-63.3	177.7	145.4	0	0	123.6
604	T	22.4	Very low	26.2	Very low	121 Å²	121	143.5 Å²	143.5	74%	0.742	79%	0.787	S	S	*	*				56.7	128.2	123.8	68.4	0	0	0	0	122.6
605	M	26.2	Very low	26.3	Very low	187 Å²	187	142.8 Å²	142.8	92%	0.921	79%	0.79	S	S	*	*				-171.3	149.7	103.3	-103	-170	163.3	0	0	113.4
606	D	23.1	Very low	26.2	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	80%	0.799	S	S	*	*			trans	-80.1	138	176.7	-67.1	-92.3	0	0	0	113.4
607	V	26.9	Very low	26	Very low	147 Å²	147	143 Å²	143	89%	0.891	80%	0.796	S	S	*	*			trans	-141.4	131.2	151.6	-176.9	0	0	0	0	109.7
608	K	27.4	Very low	26	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.857	80%	0.803	S	S	*	*			trans	-103	170.8	175.8	-115	-150	167	174.8	0	110.7
609	P	34	Very low	26.3	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	80%	0.802	S	S	*	*			trans	-114.2	167.4	-137	42.1	-34.1	0	0	0	114.7
610	S	25.8	Very low	26.5	Very low	104 Å²	104	143.4 Å²	143.4	73%	0.727	81%	0.807	S	S	*	*			trans	-151.4	140.9	161.3	51.6	0	0	0	0	113.6
611	D	24.9	Very low	25.9	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	81%	0.814	S	S	*	*			trans	75.6	101.9	149.8	-53.4	-23.1	0	0	0	123.2
612	M	25.2	Very low	26	Very low	180 Å²	180	139.9 Å²	139.9	89%	0.887	81%	0.806	S	S	*	*			trans	5.6	132.2	139.7	-65.3	-164.7	176.1	0	0	120.2
613	T	25.3	Very low	26.1	Very low	145 Å²	145	142.9 Å²	142.9	89%	0.89	81%	0.81	S	S	*	*				-158.3	139	108.6	1.7	0	0	0	0	112
614	L	25.4	Very low	26.1	Very low	164 Å²	164	141.7 Å²	141.7	86%	0.859	81%	0.809	S	S	*	*			trans	-89.4	153.3	162.8	-72.3	167.8	0	0	0	108.5
615	P	27.8	Very low	26.4	Very low	114 Å²	114	143.5 Å²	143.5	74%	0.74	81%	0.809	S	S	*	*				-143.7	147.2	100	25.3	-5	0	0	0	117
616	L	24.6	Very low	26.4	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	80%	0.803	S	S	*	*			trans	59.9	119.4	148.2	-85.2	64.8	0	0	0	121.3
617	A	23.9	Very low	26.5	Very low	86 Å²	86	142.8 Å²	142.8	71%	0.711	80%	0.8	S	S	*	*			trans	-91.3	147	151.8	0	0	0	0	0	109.4
618	L	25	Very low	26.4	Very low	158 Å²	158	143.2 Å²	143.2	83%	0.827	80%	0.797	S	S	*	*				161.7	173	98	-87.1	-179	0	0	0	107.6
619	P	33.2	Very low	26.4	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	79%	0.794	S	S	*	*			cis	-124.9	160.5	2	29.2	-9	0	0	0	116.1
620	L	26.5	Very low	26.3	Very low	164 Å²	164	141.2 Å²	141.2	86%	0.859	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.9	124.5	158.2	-75.4	156.5	0	0	0	109
621	G	22.5	Very low	26.3	Very low	78 Å²	78	142.2 Å²	142.2	80%	0.804	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.6	117	171.3	0	0	0	0	0	111.8
622	T	27.3	Very low	26.5	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-97.8	119	162.2	47.9	0	0	0	0	108.6
623	E	26.1	Very low	26.4	Very low	155 Å²	155	139.4 Å²	139.4	72%	0.724	79%	0.789	S	S	*	*			trans	-125.4	100.9	173	-75	-71.8	129.7	0	0	109.2	H625	E623-H625 PolarHBondContact O-N 3.12Å; E623-H625 IonicContact OE2-CE1 2.73Å
624	D	24.8	Very low	26.5	Very low	145 Å²	145	138.4 Å²	138.4	78%	0.775	78%	0.783	S	S	*	*			trans	-81.1	95.1	170.2	-76.2	-50.6	0	0	0	109.3	H626	D624-H626 PolarHBondContact O-N 3.02Å
625	H	28.1	Very low	26.6	Very low	158 Å²	158	139.5 Å²	139.5	73%	0.731	78%	0.784	S	S	*	*			trans	-76.4	87.3	173.1	-80.1	-40.2	0	0	0	112.2	E623 M627	E623-H625 PolarHBondContact O-N 3.12Å; E623-H625 IonicContact OE2-CE1 2.73Å; H625-M627 PolarHBondContact O-N 3.4Å; H625-M627 VanDerWaalsContact O-N 3.14Å
626	H	26	Very low	26.5	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.787	79%	0.787	S	S	*	*			trans	-59.3	104.5	155.3	-82.5	-97.3	0	0	0	110.2	D624 L628	D624-H626 PolarHBondContact O-N 3.02Å; H626-L628 PolarHBondContact O-N 3.38Å
627	M	26.7	Very low	26.8	Very low	160 Å²	160	136.5 Å²	136.5	79%	0.788	78%	0.778	S	S	*	*			trans	-82.4	100.1	166.8	-73.8	-63.5	-66.8	0	0	109.9	H625	H625-M627 PolarHBondContact O-N 3.4Å; H625-M627 VanDerWaalsContact O-N 3.14Å
628	L	25.1	Very low	26.8	Very low	157 Å²	157	139.1 Å²	139.1	82%	0.822	79%	0.785	S	S	*	*			trans	-68.3	140.6	160.1	-67.4	167.7	0	0	0	109.1	H626	H626-L628 PolarHBondContact O-N 3.38Å
629	L	27.2	Very low	26.9	Very low	152 Å²	152	136.1 Å²	136.1	80%	0.796	78%	0.777	S	S	*	*			trans	-118.6	150.2	162.3	-73.1	176.9	0	0	0	109.4
630	P	32.1	Very low	26.5	Very low	120 Å²	120	137.1 Å²	137.1	78%	0.779	78%	0.776	S	S	*	*			trans	-78.2	151.9	-169.6	-8.3	25.8	0	0	0	112.7
631	V	25.9	Very low	26.5	Very low	124 Å²	124	135.7 Å²	135.7	75%	0.752	77%	0.774	S	S	*	*			trans	-77.9	127.6	165.8	176.2	0	0	0	0	109.3
632	T	27.6	Very low	26.6	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	78%	0.777	S	S	*	*			trans	-137.8	112.5	156.7	53.3	0	0	0	0	108.5
633	D	24.4	Very low	26.6	Very low	141 Å²	141	142.1 Å²	142.1	75%	0.754	78%	0.784	S	S	*	*			trans	-67.9	133.3	172	-70.9	-58.5	0	0	0	110.8
634	T	26	Very low	26.6	Very low	125 Å²	125	145.2 Å²	145.2	77%	0.767	79%	0.789	S	S	*	*				171.8	147.9	113.2	33.8	0	0	0	0	112.5
635	Q	27.7	Very low	26.7	Very low	187 Å²	187	144.2 Å²	144.2	87%	0.874	79%	0.793	S	S	*	*			trans	72.1	107.2	163.6	-65.2	172.2	37.7	0	0	119
636	S	25.6	Very low	26.5	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	79%	0.793	S	S	*	*			trans	-71.6	163	154.1	53.7	0	0	0	0	111.2
637	P	31.2	Very low	26.5	Very low	106 Å²	106	141.3 Å²	141.3	69%	0.688	80%	0.799	S	S	*	*				-150.4	153.7	100.2	38.4	-22	0	0	0	117.8
638	T	24.6	Very low	26.4	Very low	140 Å²	140	141.2 Å²	141.2	86%	0.859	80%	0.801	S	S	*	*			trans	69.9	165	145	51	0	0	0	0	121.7
639	S	25.9	Very low	26.3	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	80%	0.797	S	S	*	*			trans	-116.1	-177.9	-148.7	52.6	0	0	0	0	115.1
640	D	24.8	Very low	26.2	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	80%	0.801	S	S	*	*			trans	75.5	114	159.4	-56.4	-57.4	0	0	0	119.3
641	T	26.9	Very low	25.8	Very low	133 Å²	133	140.7 Å²	140.7	82%	0.816	80%	0.804	S	S	*	*				-169.8	110.3	94.4	-63.8	0	0	0	0	110.2
642	L	25.3	Very low	25.9	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	80%	0.799	S	S	*	*			trans	-82.8	139.8	156.1	-77.5	167.4	0	0	0	108.6
643	L	26.5	Very low	26.3	Very low	165 Å²	165	140.2 Å²	140.2	86%	0.864	79%	0.794	S	S	*	*			trans	-161.4	141.1	137	-109.5	176.9	0	0	0	113.8
644	R	26.7	Very low	26.4	Very low	221 Å²	221	139.7 Å²	139.7	83%	0.834	79%	0.787	S	S	*	*			trans	-59.5	155.3	175.7	-70.6	164.5	156.7	164.7	-8.6	113.1
645	S	25.8	Very low	26.4	Very low	124 Å²	124	138.8 Å²	138.8	87%	0.867	78%	0.776	S	S	*	*				-151.4	145.4	114.9	57.8	0	0	0	0	111.8
646	T	25	Very low	26.6	Very low	117 Å²	117	135.4 Å²	135.4	72%	0.718	76%	0.763	S	S	*	*			trans	-121.5	137.7	-175.4	47.2	0	0	0	0	110.2
647	V	25.4	Very low	26.6	Very low	150 Å²	150	135.8 Å²	135.8	91%	0.909	75%	0.751	S	S	*	*			trans	-137.7	130.9	157.4	-178	0	0	0	0	109.1
648	N	24.2	Very low	26.4	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	76%	0.755	S	S	*	*			trans	-84	155.2	-176.6	-70	-31.5	0	0	0	112.6
649	G	23.2	Very low	26.5	Very low	70 Å²	70	137.2 Å²	137.2	72%	0.722	74%	0.743	S	S	*	*			trans	178.6	65.4	175.5	0	0	0	0	0	115.4
650	Y	24.7	Very low	26.5	Very low	229 Å²	229	139.4 Å²	139.4	90%	0.898	74%	0.742	S	S	*	*			trans	11.4	112.3	163.2	-71.5	-95	0	0	0	120.6
651	S	25.4	Very low	26.7	Very low	119 Å²	119	140.8 Å²	140.8	83%	0.832	75%	0.749	S	S	*	*				177.8	122.3	117.7	54.8	0	0	0	0	112.9
652	E	27.5	Very low	26.9	Very low	137 Å²	137	145.4 Å²	145.4	64%	0.64	75%	0.753	S	S	*	*			trans	-71.6	159.8	157	-96.2	-166	128.3	0	0	109.7	K408	K408-E652 IonicContact NZ-OE2 3.58Å
653	P	35.3	Very low	26.9	Very low	109 Å²	109	144.3 Å²	144.3	71%	0.708	75%	0.747	S	S	*	*			cis	-137.4	129.8	19.4	35.3	-15	0	0	0	116.1
654	Q	26	Very low	27	Very low	130 Å²	130	143.2 Å²	143.2	61%	0.607	74%	0.741	S	S	*	*			trans	-136.3	85.2	158.3	-69.6	-162.1	22.6	0	0	112.3
655	L	27.2	Very low	27	Very low	105 Å²	105	138.9 Å²	138.9	55%	0.55	74%	0.735	S	S	.	*			trans	-106.9	74.4	156	-107.2	85.9	0	0	0	110.8
656	I	30.8	Very low	27	Very low	117 Å²	117	139.8 Å²	139.8	60%	0.6	73%	0.728	S	S	*	*			trans	-132.3	105.1	152.1	-57.8	176.6	0	0	0	105.1
657	F	26.1	Very low	27.2	Very low	121 Å²	121	141.2 Å²	141.2	53%	0.531	73%	0.728	S	S	.	*			trans	161.2	81.5	151	-103.1	-79.9	0	0	0	111	Q660	F657-Q660 HydrophobicContact CE1-CB 4.03Å
658	L	26.7	Very low	27.3	Very low	149 Å²	149	140.6 Å²	140.6	78%	0.78	72%	0.716	S	S	*	*	S	Bend	trans	-145.6	53.4	153.1	-94.7	-175.2	0	0	0	109.7
659	Q	27	Very low	27.5	Very low	128 Å²	128	139.4 Å²	139.4	60%	0.598	71%	0.707	S	S	*	*			trans	-157.6	70.3	161.2	-160.9	147.9	21.9	0	0	111.5
660	Q	27.1	Very low	27.8	Very low	140 Å²	140	144.7 Å²	144.7	65%	0.654	71%	0.706	S	S	*	*	S	Bend	trans	-154.7	59.7	165.6	-129.7	173.8	15.3	0	0	111	F657	F657-Q660 HydrophobicContact CE1-CB 4.03Å
661	L	29	Very low	28.1	Very low	168 Å²	168	137.7 Å²	137.7	88%	0.88	69%	0.69	S	S	*	*			trans	-173.8	62.1	159.6	-99.3	173.9	0	0	0	107.7
662	Y	29.2	Very low	28.3	Very low	229 Å²	229	139.4 Å²	139.4	90%	0.898	68%	0.677	S	S	*	*			trans	-165	0	167.4	-82.6	-64.5	0	0	0	107.5

Retrieved 662 of 662 residues in 2215.2 ms (Link to these results)

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