A0A087WXE9_HUMAN Loading...

Inactive serine protease PAMR1

May play a role in regeneration of skeletal muscle.

AlphaFold DB , UniProt , Accession A0A087WXE9, Species HUMAN (Homo sapiens, Human), Gene PAMR1, Length 680 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.2	Very low	41.5	Very low	238 Å²	238	139.1 Å²	139.1	100%	1.172	69%	0.686	S	S	*	*				0	114.6	0	-77.8	179.9	-122	0	0	107
2	C	34	Very low	41.4	Very low	114 Å²	114	138.5 Å²	138.5	77%	0.77	68%	0.68	S	S	*	*			trans	-156.2	112.7	139.5	-89.2	0	0	0	0	103
3	R	38.5	Very low	41.3	Very low	233 Å²	233	133.5 Å²	133.5	88%	0.879	67%	0.667	S	S	*	*			trans	-68.2	151.5	-172.2	-82.1	176.6	169.1	166.7	-3.5	110.6	C5	R3-C5 PolarHBondContact O-N 3.2Å
4	E	42.3	Very low	41.3	Very low	209 Å²	209	130.9 Å²	130.9	98%	0.977	66%	0.661	S	S	*	*	S	Bend	trans	-66.4	41.5	177.7	-63.5	178.9	143	0	0	113.9
5	C	40.3	Very low	41.2	Very low	73 Å²	73	125.3 Å²	125.3	49%	0.493	64%	0.638	S	S	.	*			trans	-111	91.4	179.3	-69.9	0	0	0	0	108.1	R3 E7	R3-C5 PolarHBondContact O-N 3.2Å; C5-E7 HydrophobicContact CB-CG 3.99Å; C5-E7 PolarHBondContact O-N 3.12Å
6	C	43.3	Very low	40.6	Very low	84 Å²	84	125.9 Å²	125.9	57%	0.568	65%	0.653	S	S	*	*			trans	-69.1	77.9	154.6	-73.4	0	0	0	0	106.9	Y8	C6-Y8 WeakPolarHBondContact O-CE2 2.99Å
7	E	45	Very low	40.7	Very low	141 Å²	141	123 Å²	123	66%	0.659	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-87.3	139.9	171.3	-81.3	173.1	-164	0	0	108.8	C5	C5-E7 HydrophobicContact CB-CG 3.99Å; C5-E7 PolarHBondContact O-N 3.12Å
8	Y	47.4	Very low	40.3	Very low	147 Å²	147	126.7 Å²	126.7	58%	0.576	67%	0.67	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.7	122.9	-167.5	-62.2	-82.2	0	0	0	109.7	C6 T25	C6-Y8 WeakPolarHBondContact O-CE2 2.99Å; Y8-T25 VanDerWaalsContact CB-CG2 3.44Å; Y8-T25 HydrophobicContact CD1-CG2 4.39Å; Y8-T25 HydrophobicContact CG-CG2 4.14Å
9	D	41.3	Very low	40.5	Very low	84 Å²	84	131.4 Å²	131.4	45%	0.449	68%	0.677	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.9	125.7	169.9	-118.7	-22.9	0	0	0	109.2	R30	D9-R30 IonicContact OD2-NH2 3.82Å
10	Q	43.3	Very low	40.5	Very low	126 Å²	126	130.5 Å²	130.5	59%	0.589	67%	0.67	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.1	112.5	-176.4	-171.5	177.1	3.9	0	0	109.5	T25	Q10-T25 HydrophobicContact CB-CG2 4.49Å
11	I	41.7	Very low	40.5	Very low	81 Å²	81	127.9 Å²	127.9	42%	0.415	66%	0.66	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.4	121.9	173.6	-62.5	172.8	0	0	0	108.4	G23 Y24	I11-G23 WeakPolarHBondContact O-CA 3.35Å; I11-Y24 HydrophobicContact CB-CE1 4.29Å; I11-Y24 HydrophobicContact CD1-CE2 3.95Å; I11-Y24 WeakPolarHBondContact CD1-OH 3.04Å; I11-Y24 HydrophobicContact CG2-CE1 4.38Å; I11-Y24 PolarHBondContact N-O 2.96Å
12	E	41.2	Very low	40.7	Very low	132 Å²	132	119.4 Å²	119.4	62%	0.617	62%	0.621	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.7	124.5	-175.5	-73.7	-172.6	171	0	0	112.7	V21	E12-V21 HydrophobicContact CB-CG1 3.5Å; E12-V21 HydrophobicContact CG-CG1 3.63Å
13	C	39.2	Very low	41.1	Very low	74 Å²	74	115.9 Å²	115.9	50%	0.5	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.4	133.8	172.1	-73.7	0	0	0	0	111.1	V21 V22	C13-V21 CarbonylContact O-C 3.6Å; C13-V21 VanDerWaalsContact O-CA 3.3Å; C13-V21 WeakPolarHBondContact O-CA 3.46Å; C13-V22 PolarHBondContact N-O 3.3Å; C13-V22 PolarHBondContact O-N 3.24Å
14	V	42.1	Very low	41.4	Very low	97 Å²	97	110.2 Å²	110.2	59%	0.588	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.1	119.9	-176.9	-174	0	0	0	0	111.3	V21	V14-V21 HydrophobicContact CG2-CG2 4.25Å
15	C	38.9	Very low	41.4	Very low	47 Å²	47	104 Å²	104	32%	0.318	56%	0.56	S	S	.	*			trans	-68.4	127.1	175.3	-76.6	0	0	0	0	112.1	G17 R19 E20	C15-G17 PolarHBondContact O-N 2.89Å; C15-R19 PolarHBondContact O-N 2.95Å; C15-E20 PolarHBondContact N-O 2.7Å
16	P	31.7	Very low	41.7	Very low	135 Å²	135	105 Å²	105	88%	0.877	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	109.5	-178.6	19.4	-11.8	0	0	0	110.7
17	G	42	Very low	41.9	Very low	76 Å²	76	104.9 Å²	104.9	78%	0.784	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.4	50.1	173.1	0	0	0	0	0	116.4	C15	C15-G17 PolarHBondContact O-N 2.89Å
18	K	34.1	Very low	41.9	Very low	189 Å²	189	99.8 Å²	99.8	82%	0.822	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	cis	-151.2	107.3	41.7	-70.3	-178.6	178.9	176.9	0	113.4	E20	K18-E20 VanDerWaalsContact C-N 3.34Å; K18-E20 PolarHBondContact O-N 3.18Å
19	R	44.2	Very low	42.1	Very low	217 Å²	217	97.5 Å²	97.5	82%	0.819	54%	0.542	S	S	*	.			trans	49.3	30.2	139.1	-65.7	-172.9	178.2	178.4	-1.2	118.8	C15	C15-R19 PolarHBondContact O-N 2.95Å
20	E	39.5	Very low	42.6	Very low	113 Å²	113	99.1 Å²	99.1	53%	0.528	54%	0.542	S	S	.	.			trans	-84.9	130	158.4	-84.4	177.6	142.4	0	0	109.8	C15 K18 C54	C15-E20 PolarHBondContact N-O 2.7Å; K18-E20 VanDerWaalsContact C-N 3.34Å; K18-E20 PolarHBondContact O-N 3.18Å; E20-C54 VanDerWaalsContact OE2-CB 3.29Å; E20-C54 WeakPolarHBondContact OE2-CB 3.39Å; E20-C54 PolarHBondContact OE2-SG 3.42Å
21	V	42.2	Very low	43	Very low	75 Å²	75	96.2 Å²	96.2	46%	0.455	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.1	174	-174.2	0	0	0	0	106.7	E12 C13 V14	E12-V21 HydrophobicContact CB-CG1 3.5Å; E12-V21 HydrophobicContact CG-CG1 3.63Å; C13-V21 CarbonylContact O-C 3.6Å; C13-V21 VanDerWaalsContact O-CA 3.3Å; C13-V21 WeakPolarHBondContact O-CA 3.46Å; V14-V21 HydrophobicContact CG2-CG2 4.25Å
22	V	43.3	Very low	43.5	Very low	60 Å²	60	101.8 Å²	101.8	36%	0.364	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	128.9	172.5	-110.6	0	0	0	0	107.7	C13	C13-V22 PolarHBondContact N-O 3.3Å; C13-V22 PolarHBondContact O-N 3.24Å
23	G	41.4	Very low	44.4	Very low	41 Å²	41	103.2 Å²	103.2	42%	0.423	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.9	152.3	175.4	0	0	0	0	0	112	I11	I11-G23 WeakPolarHBondContact O-CA 3.35Å
24	Y	44.5	Very low	45.1	Very low	113 Å²	113	104.5 Å²	104.5	44%	0.443	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.3	156.7	169.5	61.5	-90.8	0	0	0	109	I11 I26	I11-Y24 HydrophobicContact CB-CE1 4.29Å; I11-Y24 HydrophobicContact CD1-CE2 3.95Å; I11-Y24 WeakPolarHBondContact CD1-OH 3.04Å; I11-Y24 HydrophobicContact CG2-CE1 4.38Å; I11-Y24 PolarHBondContact N-O 2.96Å; Y24-I26 HydrophobicContact CD2-CD1 4.15Å; Y24-I26 HydrophobicContact CD2-CG1 3.78Å; Y24-I26 HydrophobicContact CE2-CD1 3.62Å; Y24-I26 HydrophobicContact CE2-CG1 3.75Å
25	T	42.4	Very low	45.6	Very low	78 Å²	78	106 Å²	106	48%	0.479	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	116.4	-178.5	35.4	0	0	0	0	109.6	Y8 Q10	Y8-T25 VanDerWaalsContact CB-CG2 3.44Å; Y8-T25 HydrophobicContact CD1-CG2 4.39Å; Y8-T25 HydrophobicContact CG-CG2 4.14Å; Q10-T25 HydrophobicContact CB-CG2 4.49Å
26	I	46	Very low	46.3	Very low	96 Å²	96	106.1 Å²	106.1	49%	0.492	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	128.8	172.4	-57.8	-178.9	0	0	0	107.8	Y24 C28	Y24-I26 HydrophobicContact CD2-CD1 4.15Å; Y24-I26 HydrophobicContact CD2-CG1 3.78Å; Y24-I26 HydrophobicContact CE2-CD1 3.62Å; Y24-I26 HydrophobicContact CE2-CG1 3.75Å; I26-C28 PolarHBondContact O-N 2.89Å
27	P	48.1	Very low	47.1	Very low	80 Å²	80	105.3 Å²	105.3	52%	0.519	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.6	119.4	170.1	27.3	-30	0	0	0	109.1
28	C	46.3	Very low	47.3	Very low	35 Å²	35	106.9 Å²	106.9	24%	0.236	55%	0.552	C	S	.	*			trans	-130.1	143.7	173.9	64.1	0	0	0	0	110.7	I26 C36	I26-C28 PolarHBondContact O-N 2.89Å; C28-C36 HydrophobicContact CB-CB 3.62Å; C28-C36 WeakPolarHBondContact CB-SG 3.3Å; C28-C36 WeakPolarHBondContact SG-CB 3.02Å; C28-C36 CovalentContact SG-SG 2.03Å; C28-C36 PolarHBondContact SG-SG 2.72Å
29	C	51.6	Low	47.9	Very low	99 Å²	99	103.4 Å²	103.4	67%	0.669	55%	0.55	S	S	*	*			trans	-93.3	125.5	172.7	-70.8	0	0	0	0	108.4
30	R	50	Low	47.9	Very low	117 Å²	117	101.3 Å²	101.3	44%	0.442	55%	0.554	S	S	.	*	B	Isolated β-bridge	trans	-74.9	136.5	173.3	-73.1	-167	175.8	-140.8	3	110.5	D9 N34 E35	D9-R30 IonicContact OD2-NH2 3.82Å; R30-N34 WeakPolarHBondContact CD-O 3.49Å; R30-N34 WeakPolarHBondContact CD-OD1 3.46Å; R30-N34 PolarHBondContact NH1-ND2 3.02Å; R30-N34 PolarHBondContact NH1-O 2.8Å; R30-E35 WeakPolarHBondContact CA-O 3.4Å
31	N	52.1	Low	48.2	Very low	65 Å²	65	102 Å²	102	35%	0.348	56%	0.561	S	S	.	*			trans	-73.6	176.5	168.7	66.4	15.8	0	0	0	110.7	E33 N34 E35	N31-E33 PolarHBondContact O-N 3.3Å; N31-E33 VanDerWaalsContact O-N 3.12Å; N31-E33 PolarHBondContact OD1-N 3.32Å; N31-N34 WeakPolarHBondContact O-CA 3.08Å; N31-N34 PolarHBondContact O-N 3.09Å; N31-N34 PolarHBondContact OD1-N 3.39Å; N31-E35 PolarHBondContact N-O 2.94Å; N31-E35 PolarHBondContact OD1-N 3.27Å; N31-E35 PolarHBondContact OD1-O 2.03Å
32	E	53.4	Low	47.9	Very low	199 Å²	199	105.6 Å²	105.6	93%	0.93	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-18	-177.4	-65.8	-172.5	158.7	0	0	113.8	N34	E32-N34 VanDerWaalsContact C-N 3.32Å
33	E	59.5	Low	47.5	Very low	162 Å²	162	108.4 Å²	108.4	76%	0.757	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	6.7	174	-63.2	-174.9	165	0	0	112.8	N31	N31-E33 PolarHBondContact O-N 3.3Å; N31-E33 VanDerWaalsContact O-N 3.12Å; N31-E33 PolarHBondContact OD1-N 3.32Å
34	N	54.5	Low	47.5	Very low	101 Å²	101	110.2 Å²	110.2	54%	0.54	61%	0.61	S	S	.	*	S	Bend	trans	69.6	26.1	175.4	-135.4	26.4	0	0	0	114.4	R30 N31 E32	R30-N34 WeakPolarHBondContact CD-O 3.49Å; R30-N34 WeakPolarHBondContact CD-OD1 3.46Å; R30-N34 PolarHBondContact NH1-ND2 3.02Å; R30-N34 PolarHBondContact NH1-O 2.8Å; N31-N34 WeakPolarHBondContact O-CA 3.08Å; N31-N34 PolarHBondContact O-N 3.09Å; N31-N34 PolarHBondContact OD1-N 3.39Å; E32-N34 VanDerWaalsContact C-N 3.32Å
35	E	51.6	Low	47.2	Very low	128 Å²	128	108.9 Å²	108.9	60%	0.598	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-103.7	143	173.8	-62.2	-173.7	159.7	0	0	111	R30 N31	R30-E35 WeakPolarHBondContact CA-O 3.4Å; N31-E35 PolarHBondContact N-O 2.94Å; N31-E35 PolarHBondContact OD1-N 3.27Å; N31-E35 PolarHBondContact OD1-O 2.03Å
36	C	53.3	Low	46.9	Very low	50 Å²	50	110.4 Å²	110.4	34%	0.338	63%	0.626	S	S	.	*	B	Isolated β-bridge	trans	-86.9	118.5	-178.3	-95.3	0	0	0	0	112.1	C28	C28-C36 HydrophobicContact CB-CB 3.62Å; C28-C36 WeakPolarHBondContact CB-SG 3.3Å; C28-C36 WeakPolarHBondContact SG-CB 3.02Å; C28-C36 CovalentContact SG-SG 2.03Å; C28-C36 PolarHBondContact SG-SG 2.72Å
37	D	49.2	Very low	46.6	Very low	117 Å²	117	112.4 Å²	112.4	63%	0.626	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-101.5	127.6	-177.8	-154.1	-9.3	0	0	0	111.4	C39	D37-C39 PolarHBondContact O-N 3.04Å
38	S	47	Very low	45.9	Very low	110 Å²	110	116.4 Å²	116.4	77%	0.769	65%	0.645	S	S	*	*	S	Bend	trans	-87.7	5	-153.9	-16.2	0	0	0	0	116
39	C	45.9	Very low	45.4	Very low	115 Å²	115	123.6 Å²	123.6	78%	0.777	68%	0.676	S	S	*	*			trans	-125.3	26.7	-162.2	-71.2	0	0	0	0	117.9	D37	D37-C39 PolarHBondContact O-N 3.04Å
40	L	43.3	Very low	44.5	Very low	174 Å²	174	125.5 Å²	125.5	91%	0.911	68%	0.679	S	S	*	*			trans	-131.2	93	172.1	-79.7	160.5	0	0	0	112.1
41	I	46	Very low	43.6	Very low	128 Å²	128	126 Å²	126	66%	0.656	70%	0.699	S	S	*	*			trans	-96.4	120.8	168.7	-60.5	171.9	0	0	0	108.6	I47	I41-I47 HydrophobicContact CD1-CD1 3.99Å
42	H	37.2	Very low	42.9	Very low	149 Å²	149	131.6 Å²	131.6	69%	0.69	72%	0.72	S	S	*	*			trans	-80.8	142.3	178.5	-158.2	-78.9	0	0	0	111.2	G44	H42-G44 PolarHBondContact O-N 2.97Å; H42-G44 VanDerWaalsContact O-N 3.09Å
43	P	34.2	Very low	42	Very low	120 Å²	120	126.8 Å²	126.8	78%	0.779	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	110.6	175.7	25.5	-32	0	0	0	109.6
44	G	41.8	Very low	41	Very low	79 Å²	79	121.9 Å²	121.9	81%	0.814	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	145.1	-16.2	-174.8	0	0	0	0	0	114.4	H42	H42-G44 PolarHBondContact O-N 2.97Å; H42-G44 VanDerWaalsContact O-N 3.09Å
45	C	38.2	Very low	40.1	Very low	84 Å²	84	128 Å²	128	57%	0.568	71%	0.707	S	S	*	*			trans	-109.6	117.4	173.9	-64.4	0	0	0	0	110.4
46	T	36.7	Very low	39.6	Very low	111 Å²	111	127.1 Å²	127.1	68%	0.681	71%	0.707	S	S	*	*			trans	-95	127.5	175.6	53.5	0	0	0	0	110.5	F48	T46-F48 PolarHBondContact O-N 3.24Å; T46-F48 WeakPolarHBondContact OG1-CE2 3.29Å
47	I	38.9	Very low	39.3	Very low	137 Å²	137	125.8 Å²	125.8	70%	0.703	70%	0.701	S	S	*	*			trans	-71.9	107.1	169.2	-66.8	168.7	0	0	0	107.8	I41	I41-I47 HydrophobicContact CD1-CD1 3.99Å
48	F	33.9	Very low	39.2	Very low	165 Å²	165	122.7 Å²	122.7	72%	0.724	69%	0.689	S	S	*	*			trans	-95.1	121.1	163.8	-83.4	-78	0	0	0	108.9	T46 N50	T46-F48 PolarHBondContact O-N 3.24Å; T46-F48 WeakPolarHBondContact OG1-CE2 3.29Å; F48-N50 PolarHBondContact O-N 3.39Å
49	E	35.7	Very low	39.2	Very low	186 Å²	186	121 Å²	121	87%	0.869	67%	0.665	S	S	*	*			trans	-65.1	94.1	177.1	-68.3	179.2	145.8	0	0	110.9
50	N	32	Very low	39.1	Very low	138 Å²	138	116.8 Å²	116.8	74%	0.738	64%	0.641	S	S	*	*			trans	-102.2	84.2	167.7	-78	-40.7	0	0	0	110.1	F48	F48-N50 PolarHBondContact O-N 3.39Å
51	C	32.3	Very low	39.1	Very low	127 Å²	127	112.1 Å²	112.1	86%	0.858	64%	0.636	S	S	*	*			trans	-105.8	90.1	158.1	-98.8	0	0	0	0	108.4	S53	C51-S53 PolarHBondContact O-N 3.27Å
52	K	36.5	Very low	39	Very low	184 Å²	184	111.6 Å²	111.6	80%	0.8	64%	0.639	S	S	*	*			trans	-84.8	103.6	166.7	-80.5	-171	178.6	-178.4	0	108.8
53	S	35	Very low	39.1	Very low	97 Å²	97	110.3 Å²	110.3	68%	0.678	64%	0.636	S	S	*	*			trans	-68.9	135.7	164.6	54.6	0	0	0	0	110.4	C51 R55	C51-S53 PolarHBondContact O-N 3.27Å; S53-R55 VanDerWaalsContact C-N 3.33Å; S53-R55 PolarHBondContact O-N 2.97Å
54	C	36.8	Very low	39.3	Very low	60 Å²	60	110.2 Å²	110.2	41%	0.405	63%	0.629	S	S	.	*	S	Bend	trans	-58.9	92	165.4	-57.1	0	0	0	0	110.1	E20	E20-C54 VanDerWaalsContact OE2-CB 3.29Å; E20-C54 WeakPolarHBondContact OE2-CB 3.39Å; E20-C54 PolarHBondContact OE2-SG 3.42Å
55	R	37.3	Very low	39	Very low	228 Å²	228	113.4 Å²	113.4	86%	0.86	63%	0.628	S	S	*	*			trans	173.4	50.6	161	-100.2	-179.5	-165.8	-158.4	5.5	110.6	S53	S53-R55 VanDerWaalsContact C-N 3.33Å; S53-R55 PolarHBondContact O-N 2.97Å
56	N	39.7	Very low	38.9	Very low	111 Å²	111	117.5 Å²	117.5	59%	0.594	64%	0.636	S	S	*	*			trans	-136.8	87.4	168.1	-123.4	13.8	0	0	0	108.8	R77	N56-R77 VanDerWaalsContact OD1-CD 3.25Å; N56-R77 WeakPolarHBondContact OD1-CD 3.24Å; N56-R77 PolarHBondContact OD1-NE 2.97Å
57	G	47.7	Very low	38.7	Very low	21 Å²	21	120.3 Å²	120.3	22%	0.216	64%	0.635	C	S	.	*	P	Polyproline II helix	trans	-53.2	150.6	163.7	0	0	0	0	0	110.2	E75	G57-E75 VanDerWaalsContact CA-O 3.24Å; G57-E75 WeakPolarHBondContact CA-O 3.35Å
58	S	47.3	Very low	38.6	Very low	53 Å²	53	118.5 Å²	118.5	37%	0.371	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-66.2	137	-178.2	49.7	0	0	0	0	111.6	G60	S58-G60 PolarHBondContact O-N 2.97Å
59	W	45.9	Very low	38.5	Very low	73 Å²	73	120.1 Å²	120.1	28%	0.277	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-68.7	117.2	157.4	-61.6	116.6	0	0	0	107.5	G61 W80 S103 P105	W59-G61 PolarHBondContact O-N 2.94Å; W59-W80 HydrophobicContact CE3-CD2 4.35Å; W59-W80 HydrophobicContact CE3-CE3 4.47Å; W59-W80 AromaticContact CH2-CD2 3.88Å; W59-W80 HydrophobicContact CH2-CD2 3.88Å; W59-W80 AromaticContact CH2-CE2 3.17Å; W59-W80 HydrophobicContact CH2-CE3 4.46Å; W59-W80 HydrophobicContact CH2-CG 4.43Å; W59-W80 AromaticContact CH2-CH2 3.88Å; W59-W80 HydrophobicContact CH2-CH2 3.88Å; W59-W80 AromaticContact CH2-CZ2 3.2Å; W59-W80 HydrophobicContact CH2-CZ2 3.2Å; W59-W80 HydrophobicContact CH2-CZ3 4.46Å; W59-W80 AromaticContact CH2-NE1 3.33Å; W59-W80 VanDerWaalsContact CH2-NE1 3.33Å; W59-W80 AromaticContact CZ3-CD2 3.32Å; W59-W80 HydrophobicContact CZ3-CD2 3.32Å; W59-W80 AromaticContact CZ3-CE2 3.14Å; W59-W80 AromaticContact CZ3-CE3 3.61Å; W59-W80 HydrophobicContact CZ3-CE3 3.61Å; W59-W80 AromaticContact CZ3-CG 3.94Å; W59-W80 HydrophobicContact CZ3-CG 3.94Å; W59-W80 AromaticContact CZ3-CH2 3.6Å; W59-W80 HydrophobicContact CZ3-CH2 3.6Å; W59-W80 AromaticContact CZ3-CZ2 3.32Å; W59-W80 HydrophobicContact CZ3-CZ2 3.32Å; W59-W80 AromaticContact CZ3-CZ3 3.74Å; W59-W80 HydrophobicContact CZ3-CZ3 3.74Å; W59-W80 AromaticContact CZ3-NE1 3.59Å; W59-S103 WeakPolarHBondContact CZ2-O 3.46Å; W59-P105 HydrophobicContact CB-CB 4.08Å; W59-P105 HydrophobicContact CD2-CB 3.66Å; W59-P105 HydrophobicContact CD2-CG 3.99Å; W59-P105 HydrophobicContact CE3-CB 3.42Å; W59-P105 VanDerWaalsContact CE3-CB 3.42Å; W59-P105 HydrophobicContact CE3-CG 3.25Å; W59-P105 HydrophobicContact CG-CB 3.99Å; W59-P105 VanDerWaalsContact CH2-CD 3.46Å; W59-P105 HydrophobicContact CH2-CG 4.03Å; W59-P105 HydrophobicContact CZ3-CB 3.91Å; W59-P105 HydrophobicContact CZ3-CG 3.27Å
60	G	44.3	Very low	38.5	Very low	27 Å²	27	113.4 Å²	113.4	28%	0.278	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	134.2	-171.6	0	0	0	0	0	112.9	S58 D84 M86	S58-G60 PolarHBondContact O-N 2.97Å; G60-D84 WeakPolarHBondContact CA-O 3.25Å; G60-M86 WeakPolarHBondContact O-CE 3.2Å
61	G	43.8	Very low	38.5	Very low	77 Å²	77	115.2 Å²	115.2	79%	0.794	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	158.2	-25.5	170.1	0	0	0	0	0	115.5	W59	W59-G61 PolarHBondContact O-N 2.94Å
62	T	43.5	Very low	38.9	Very low	117 Å²	117	116.3 Å²	116.3	72%	0.718	61%	0.607	S	S	*	*	S	Bend	trans	-104.1	110.6	159.3	41.2	0	0	0	0	106.6	D64	T62-D64 VanDerWaalsContact C-N 3.34Å; T62-D64 PolarHBondContact O-N 3.45Å
63	L	40.3	Very low	39.1	Very low	121 Å²	121	113.8 Å²	113.8	63%	0.634	61%	0.611	S	S	*	*			trans	-55.9	103.6	165.9	-74.2	147	0	0	0	105.9	D65 Y72	L63-D65 PolarHBondContact O-N 3.23Å; L63-D65 VanDerWaalsContact O-OD1 3.14Å; L63-Y72 HydrophobicContact CD2-CD1 4.33Å; L63-Y72 HydrophobicContact CD2-CE1 3.88Å
64	D	37.2	Very low	39.8	Very low	119 Å²	119	112.3 Å²	112.3	64%	0.636	60%	0.604	S	S	*	*			trans	-63.9	117.5	158.4	-85	-34.3	0	0	0	105.2	T62 F66	T62-D64 VanDerWaalsContact C-N 3.34Å; T62-D64 PolarHBondContact O-N 3.45Å; D64-F66 PolarHBondContact O-N 2.84Å
65	D	35	Very low	40.6	Very low	146 Å²	146	118 Å²	118	78%	0.781	63%	0.625	S	S	*	*			trans	-68.2	36.6	-169.5	-55	-33	0	0	0	114.2	L63 Y67	L63-D65 PolarHBondContact O-N 3.23Å; L63-D65 VanDerWaalsContact O-OD1 3.14Å; D65-Y67 VanDerWaalsContact C-N 3.26Å; D65-Y67 PolarHBondContact O-N 2.84Å
66	F	36.9	Very low	41.7	Very low	169 Å²	169	108.8 Å²	108.8	74%	0.741	60%	0.596	S	S	*	*			trans	-80.9	77.3	174.3	-86.8	-84	0	0	0	110.7	D64 V68	D64-F66 PolarHBondContact O-N 2.84Å; F66-V68 PolarHBondContact O-N 3.39Å
67	Y	32.3	Very low	43	Very low	171 Å²	171	106.2 Å²	106.2	67%	0.671	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.7	103.4	168.3	-169	-93.8	0	0	0	110	D65	D65-Y67 VanDerWaalsContact C-N 3.26Å; D65-Y67 PolarHBondContact O-N 2.84Å
68	V	37	Very low	43.9	Very low	98 Å²	98	109.5 Å²	109.5	59%	0.594	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-124.1	111.3	168.7	-175.7	0	0	0	0	109.4	F66 G70	F66-V68 PolarHBondContact O-N 3.39Å; V68-G70 PolarHBondContact O-N 3.46Å
69	K	31.7	Very low	45.1	Very low	199 Å²	199	109.6 Å²	109.6	87%	0.865	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.1	48.6	169	-67.8	-174.7	175	179.4	0	115.4	F71	K69-F71 PolarHBondContact O-N 3Å
70	G	35	Very low	46.6	Very low	46 Å²	46	107.4 Å²	107.4	47%	0.474	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	78.2	10.2	164.9	0	0	0	0	0	116.8	V68	V68-G70 PolarHBondContact O-N 3.46Å
71	F	33.3	Very low	48.2	Very low	175 Å²	175	111.2 Å²	111.2	77%	0.768	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-139.1	133.8	170.3	-69.5	-83.9	0	0	0	110.6	K69	K69-F71 PolarHBondContact O-N 3Å
72	Y	41.4	Very low	49.4	Very low	150 Å²	150	109 Å²	109	59%	0.588	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.8	130.8	172.4	-67.3	-84.8	0	0	0	110	L63	L63-Y72 HydrophobicContact CD2-CD1 4.33Å; L63-Y72 HydrophobicContact CD2-CE1 3.88Å
73	C	40.3	Very low	50.4	Low	132 Å²	132	108 Å²	108	89%	0.892	60%	0.601	S	S	*	*			trans	-98.4	91	171.1	-74.4	0	0	0	0	109.8
74	A	49.5	Very low	51.7	Low	65 Å²	65	105.9 Å²	105.9	54%	0.537	59%	0.59	S	S	.	*			trans	-116.4	113.3	166.3	0	0	0	0	0	108.6
75	E	53.8	Low	53.5	Low	179 Å²	179	100.5 Å²	100.5	84%	0.836	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-89.5	124.4	167.2	-74.3	-171.4	172.9	0	0	108.9	G57	G57-E75 VanDerWaalsContact CA-O 3.24Å; G57-E75 WeakPolarHBondContact CA-O 3.35Å
76	C	60.7	Low	55.7	Low	36 Å²	36	94.6 Å²	94.6	24%	0.243	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-68.8	154	180	-54.4	0	0	0	0	112.2	W80 C85	C76-W80 HydrophobicContact CB-CB 4.01Å; C76-W80 VanDerWaalsContact CB-O 3.28Å; C76-W80 WeakPolarHBondContact CB-O 3.36Å; C76-C85 WeakPolarHBondContact CA-SG 3.49Å; C76-C85 HydrophobicContact CB-CB 3.64Å; C76-C85 WeakPolarHBondContact CB-SG 3.48Å; C76-C85 WeakPolarHBondContact SG-CA 3.07Å; C76-C85 WeakPolarHBondContact SG-CB 3.02Å; C76-C85 CovalentContact SG-SG 2.04Å; C76-C85 PolarHBondContact SG-SG 2.94Å
77	R	65.3	Low	58.1	Low	56 Å²	56	92.7 Å²	92.7	21%	0.211	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-53.3	144.7	171	-173.8	177.6	-178.3	-156.6	-4.9	110	N56 G79 W80 E102	N56-R77 VanDerWaalsContact OD1-CD 3.25Å; N56-R77 WeakPolarHBondContact OD1-CD 3.24Å; N56-R77 PolarHBondContact OD1-NE 2.97Å; R77-G79 PolarHBondContact O-N 2.84Å; R77-W80 HydrophobicContact CB-CG 4.5Å; R77-W80 WeakPolarHBondContact O-CA 3.35Å; R77-W80 VanDerWaalsContact O-CB 3.31Å; R77-W80 WeakPolarHBondContact O-CB 3.32Å; R77-W80 PolarHBondContact O-N 2.78Å; R77-E102 PolarHBondContact NH1-O 2.04Å
78	A	67.6	Low	60.8	Low	90 Å²	90	84.7 Å²	84.7	74%	0.744	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	127	180	0	0	0	0	0	111.3
79	G	72.4	Confident	63.2	Low	56 Å²	56	81 Å²	81	58%	0.577	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-10.9	-173.7	0	0	0	0	0	114.7	R77 C88	R77-G79 PolarHBondContact O-N 2.84Å; G79-C88 WeakPolarHBondContact O-CA 3.31Å; G79-C88 WeakPolarHBondContact O-CB 3.49Å
80	W	78.4	Confident	66	Low	27 Å²	27	77 Å²	77	10%	0.102	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	148.1	178.9	-61.1	79.8	0	0	0	111.9	W59 C76 R77 M86 R87 C88 L101 P105 A108 C110	W59-W80 HydrophobicContact CE3-CD2 4.35Å; W59-W80 HydrophobicContact CE3-CE3 4.47Å; W59-W80 AromaticContact CH2-CD2 3.88Å; W59-W80 HydrophobicContact CH2-CD2 3.88Å; W59-W80 AromaticContact CH2-CE2 3.17Å; W59-W80 HydrophobicContact CH2-CE3 4.46Å; W59-W80 HydrophobicContact CH2-CG 4.43Å; W59-W80 AromaticContact CH2-CH2 3.88Å; W59-W80 HydrophobicContact CH2-CH2 3.88Å; W59-W80 AromaticContact CH2-CZ2 3.2Å; W59-W80 HydrophobicContact CH2-CZ2 3.2Å; W59-W80 HydrophobicContact CH2-CZ3 4.46Å; W59-W80 AromaticContact CH2-NE1 3.33Å; W59-W80 VanDerWaalsContact CH2-NE1 3.33Å; W59-W80 AromaticContact CZ3-CD2 3.32Å; W59-W80 HydrophobicContact CZ3-CD2 3.32Å; W59-W80 AromaticContact CZ3-CE2 3.14Å; W59-W80 AromaticContact CZ3-CE3 3.61Å; W59-W80 HydrophobicContact CZ3-CE3 3.61Å; W59-W80 AromaticContact CZ3-CG 3.94Å; W59-W80 HydrophobicContact CZ3-CG 3.94Å; W59-W80 AromaticContact CZ3-CH2 3.6Å; W59-W80 HydrophobicContact CZ3-CH2 3.6Å; W59-W80 AromaticContact CZ3-CZ2 3.32Å; W59-W80 HydrophobicContact CZ3-CZ2 3.32Å; W59-W80 AromaticContact CZ3-CZ3 3.74Å; W59-W80 HydrophobicContact CZ3-CZ3 3.74Å; W59-W80 AromaticContact CZ3-NE1 3.59Å; C76-W80 HydrophobicContact CB-CB 4.01Å; C76-W80 VanDerWaalsContact CB-O 3.28Å; C76-W80 WeakPolarHBondContact CB-O 3.36Å; R77-W80 HydrophobicContact CB-CG 4.5Å; R77-W80 WeakPolarHBondContact O-CA 3.35Å; R77-W80 VanDerWaalsContact O-CB 3.31Å; R77-W80 WeakPolarHBondContact O-CB 3.32Å; R77-W80 PolarHBondContact O-N 2.78Å; W80-M86 WeakPolarHBondContact CZ3-O 3.04Å; W80-R87 CarbonylContact C-O 3.6Å; W80-R87 WeakPolarHBondContact CA-O 3.19Å; W80-C88 HydrophobicContact CD2-CB 3.61Å; W80-C88 HydrophobicContact CE3-CB 3.65Å; W80-C88 HydrophobicContact CG-CB 4.16Å; W80-C88 HydrophobicContact CH2-CB 4.17Å; W80-C88 HydrophobicContact CZ2-CB 4.11Å; W80-C88 HydrophobicContact CZ3-CB 3.95Å; W80-L101 HydrophobicContact CH2-CD1 3.98Å; W80-L101 HydrophobicContact CZ2-CD1 3.5Å; W80-P105 VanDerWaalsContact CH2-CD 3.41Å; W80-P105 HydrophobicContact CH2-CG 3.95Å; W80-P105 HydrophobicContact CZ3-CG 3.94Å; W80-A108 HydrophobicContact CH2-CB 3.83Å; W80-A108 HydrophobicContact CZ3-CB 3.85Å; W80-C110 VanDerWaalsContact CH2-SG 3.54Å
81	Y	77.6	Confident	68.7	Low	107 Å²	107	78.8 Å²	78.8	42%	0.42	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	178.4	-177	63.7	-91.6	0	0	0	110.7	R87	Y81-R87 HydrophobicContact CD2-CB 3.9Å; Y81-R87 HydrophobicContact CE1-CB 4.42Å; Y81-R87 HydrophobicContact CE2-CB 3.65Å; Y81-R87 HydrophobicContact CG-CB 4.37Å; Y81-R87 PolarHBondContact N-O 3.16Å; Y81-R87 WeakPolarHBondContact O-CA 3.17Å; Y81-R87 WeakPolarHBondContact O-CB 3.2Å; Y81-R87 PolarHBondContact O-N 3.17Å
82	G	68.3	Low	71.6	Confident	30 Å²	30	71.3 Å²	71.3	31%	0.309	42%	0.423	S	S	.	.	S	Bend	trans	95.1	151.5	-172.5	0	0	0	0	0	111.3	D84 C85	G82-D84 PolarHBondContact O-N 2.99Å; G82-C85 PolarHBondContact O-N 3.04Å
83	G	63.8	Low	73.9	Confident	97 Å²	97	73.9 Å²	73.9	100%	1	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-11.9	-177.6	0	0	0	0	0	114.6
84	D	69.1	Low	76.1	Confident	75 Å²	75	69.1 Å²	69.1	40%	0.401	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-2.4	176.6	54.5	7.5	0	0	0	113.5	G60 G82 M86	G60-D84 WeakPolarHBondContact CA-O 3.25Å; G82-D84 PolarHBondContact O-N 2.99Å; D84-M86 HydrophobicContact CB-CB 4.5Å; D84-M86 HydrophobicContact CB-CG 4.14Å; D84-M86 WeakPolarHBondContact O-CG 3.28Å; D84-M86 PolarHBondContact O-N 3.21Å; D84-M86 VanDerWaalsContact O-N 3.16Å; D84-M86 PolarHBondContact OD1-N 2.86Å; D84-M86 VanDerWaalsContact OD1-N 3.17Å
85	C	73.8	Confident	77.8	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.041	40%	0.399	C	S	.	.	S	Bend	trans	54.5	24.2	-173	-60.5	0	0	0	0	115.1	C76 G82	C76-C85 WeakPolarHBondContact CA-SG 3.49Å; C76-C85 HydrophobicContact CB-CB 3.64Å; C76-C85 WeakPolarHBondContact CB-SG 3.48Å; C76-C85 WeakPolarHBondContact SG-CA 3.07Å; C76-C85 WeakPolarHBondContact SG-CB 3.02Å; C76-C85 CovalentContact SG-SG 2.04Å; C76-C85 PolarHBondContact SG-SG 2.94Å; G82-C85 PolarHBondContact O-N 3.04Å
86	M	81.6	Confident	79.6	Confident	23 Å²	23	66.9 Å²	66.9	11%	0.113	38%	0.384	C	S	.	.			trans	-100.6	-1.7	-179.1	-64.7	-54.3	-145.9	0	0	113.7	G60 W80 D84 P105 L106 N107 A108 H109	G60-M86 WeakPolarHBondContact O-CE 3.2Å; W80-M86 WeakPolarHBondContact CZ3-O 3.04Å; D84-M86 HydrophobicContact CB-CB 4.5Å; D84-M86 HydrophobicContact CB-CG 4.14Å; D84-M86 WeakPolarHBondContact O-CG 3.28Å; D84-M86 PolarHBondContact O-N 3.21Å; D84-M86 VanDerWaalsContact O-N 3.16Å; D84-M86 PolarHBondContact OD1-N 2.86Å; D84-M86 VanDerWaalsContact OD1-N 3.17Å; M86-P105 HydrophobicContact CE-CB 4.43Å; M86-P105 HydrophobicContact SD-CB 4.03Å; M86-P105 HydrophobicContact SD-CG 3.78Å; M86-L106 WeakPolarHBondContact CE-O 3.43Å; M86-N107 HydrophobicContact CE-CB 4.44Å; M86-A108 CarbonylContact O-C 3.59Å; M86-A108 WeakPolarHBondContact O-CA 3.36Å; M86-H109 PolarHBondContact O-N 2.75Å
87	R	86.5	Confident	81	Confident	128 Å²	128	66.1 Å²	66.1	48%	0.483	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	141.3	179.1	-57.7	-177.1	-177.4	166.2	1.8	111.8	W80 Y81 H109	W80-R87 CarbonylContact C-O 3.6Å; W80-R87 WeakPolarHBondContact CA-O 3.19Å; Y81-R87 HydrophobicContact CD2-CB 3.9Å; Y81-R87 HydrophobicContact CE1-CB 4.42Å; Y81-R87 HydrophobicContact CE2-CB 3.65Å; Y81-R87 HydrophobicContact CG-CB 4.37Å; Y81-R87 PolarHBondContact N-O 3.16Å; Y81-R87 WeakPolarHBondContact O-CA 3.17Å; Y81-R87 WeakPolarHBondContact O-CB 3.2Å; Y81-R87 PolarHBondContact O-N 3.17Å; R87-H109 WeakPolarHBondContact CA-O 2.86Å
88	C	88.9	Confident	82.2	Confident	4 Å²	4	68.9 Å²	68.9	3%	0.027	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	172	174.4	86.4	0	0	0	0	112.7	G79 W80 H109 C110 E111	G79-C88 WeakPolarHBondContact O-CA 3.31Å; G79-C88 WeakPolarHBondContact O-CB 3.49Å; W80-C88 HydrophobicContact CD2-CB 3.61Å; W80-C88 HydrophobicContact CE3-CB 3.65Å; W80-C88 HydrophobicContact CG-CB 4.16Å; W80-C88 HydrophobicContact CH2-CB 4.17Å; W80-C88 HydrophobicContact CZ2-CB 4.11Å; W80-C88 HydrophobicContact CZ3-CB 3.95Å; C88-H109 PolarHBondContact N-O 3.06Å; C88-C110 HydrophobicContact CB-CB 3.99Å; C88-C110 WeakPolarHBondContact CB-SG 3.49Å; C88-C110 CarbonylContact O-C 3.59Å; C88-C110 WeakPolarHBondContact O-CA 3.15Å; C88-C110 WeakPolarHBondContact O-CB 3.38Å; C88-C110 WeakPolarHBondContact SG-CB 3.25Å; C88-C110 CovalentContact SG-SG 2.01Å; C88-C110 PolarHBondContact SG-SG 2.82Å; C88-E111 PolarHBondContact O-N 3.29Å
89	G	88.4	Confident	83.4	Confident	21 Å²	21	64.7 Å²	64.7	22%	0.216	36%	0.363	C	S	.	.			trans	109.9	177.4	175.4	0	0	0	0	0	115.4	E111	G89-E111 CarbonylContact C-O 3.41Å; G89-E111 VanDerWaalsContact C-O 3.29Å; G89-E111 WeakPolarHBondContact CA-O 3.28Å
90	Q	90.6	Very high	84	Confident	113 Å²	113	66 Å²	66	53%	0.528	36%	0.356	S	S	.	.			trans	-166	164.8	-164.7	58.2	-176.9	-8.3	0	0	112.8	L92 E111 W112 T113	Q90-L92 HydrophobicContact CG-CD2 3.97Å; Q90-L92 HydrophobicContact CG-CG 4.15Å; Q90-E111 PolarHBondContact N-O 3.25Å; Q90-W112 VanDerWaalsContact O-CA 3.29Å; Q90-W112 WeakPolarHBondContact O-CA 3.07Å; Q90-T113 PolarHBondContact O-N 3.12Å
91	V	92.3	Very high	84.3	Confident	84 Å²	84	65 Å²	65	51%	0.509	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.5	171.6	-177.6	0	0	0	0	110.2	R93 T113 H115	V91-R93 HydrophobicContact CG1-CG 4.35Å; V91-T113 CarbonylContact C-O 3.58Å; V91-T113 WeakPolarHBondContact CA-O 3.28Å; V91-H115 VanDerWaalsContact CG1-CD2 3.41Å; V91-H115 WeakPolarHBondContact CG1-CD2 3.26Å
92	L	92.4	Very high	84.3	Confident	19 Å²	19	64.9 Å²	64.9	10%	0.099	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.4	-173.5	-68.1	169.1	0	0	0	110.5	Q90 I99 W112 T113 I114 H115 Y193	Q90-L92 HydrophobicContact CG-CD2 3.97Å; Q90-L92 HydrophobicContact CG-CG 4.15Å; L92-I99 HydrophobicContact CD1-CD1 4.15Å; L92-I99 HydrophobicContact CD1-CG1 3.76Å; L92-W112 HydrophobicContact CD1-CB 4.43Å; L92-T113 PolarHBondContact N-O 2.8Å; L92-I114 HydrophobicContact CB-CG1 4.22Å; L92-I114 HydrophobicContact CD1-CG1 3.99Å; L92-I114 WeakPolarHBondContact O-CA 3.25Å; L92-H115 PolarHBondContact O-N 2.87Å; L92-Y193 HydrophobicContact CB-CE1 4.42Å; L92-Y193 HydrophobicContact CD1-CE1 3.75Å
93	R	91.2	Very high	84.6	Confident	204 Å²	204	66.3 Å²	66.3	77%	0.77	36%	0.361	S	S	*	.			trans	-119.2	71.7	-179.9	-61.8	-175.3	-179.7	-167.7	-0.9	111	V91 H115	V91-R93 HydrophobicContact CG1-CG 4.35Å; R93-H115 HydrophobicContact CG-CB 4.35Å
94	A	86.4	Confident	85.2	Confident	31 Å²	31	61.7 Å²	61.7	26%	0.256	31%	0.314	S	S	.	.	S	Bend	trans	-145.4	150.4	-179.9	0	0	0	0	0	110.6	K96 Y193	A94-K96 PolarHBondContact O-N 2.66Å; A94-Y193 WeakPolarHBondContact O-CE2 3.16Å
95	P	85.3	Confident	85.6	Confident	76 Å²	76	58.5 Å²	58.5	49%	0.494	30%	0.297	S	S	.	.	S	Bend	trans	-69.4	-18.8	179	29.4	-36.2	0	0	0	113.1	E194 E195	P95-E194 CarbonylContact O-C 3.6Å; P95-E194 WeakPolarHBondContact O-CA 3.46Å; P95-E195 VanDerWaalsContact CA-CD 3.43Å; P95-E195 HydrophobicContact CB-CB 4.5Å; P95-E195 HydrophobicContact CB-CG 4.22Å; P95-E195 WeakPolarHBondContact CB-OE2 3.41Å; P95-E195 PolarHBondContact O-N 2.91Å
96	K	90.6	Very high	85.9	Confident	121 Å²	121	61 Å²	61	53%	0.526	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.1	174.1	-178	166.8	-171.3	143.9	0	109.1	A94 Y193 E194	A94-K96 PolarHBondContact O-N 2.66Å; K96-Y193 VanDerWaalsContact CA-O 3.31Å; K96-Y193 WeakPolarHBondContact CA-O 3.23Å; K96-Y193 WeakPolarHBondContact CG-O 3.35Å; K96-E194 HydrophobicContact CB-CB 4.23Å; K96-E194 HydrophobicContact CD-CB 4.29Å; K96-E194 HydrophobicContact CG-CB 4.07Å; K96-E194 IonicContact NZ-OE2 3.26Å; K96-E194 PolarHBondContact NZ-OE2 3.22Å
97	G	90	Very high	86	Confident	20 Å²	20	64.6 Å²	64.6	21%	0.206	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	-171.2	176	0	0	0	0	0	112.6	I192 Y193	G97-I192 WeakPolarHBondContact O-CA 3.49Å; G97-I192 WeakPolarHBondContact O-CG2 3.15Å; G97-Y193 VanDerWaalsContact C-CD1 3.5Å; G97-Y193 VanDerWaalsContact CA-CZ 3.48Å; G97-Y193 PolarHBondContact N-O 3.48Å; G97-Y193 WeakPolarHBondContact O-CD1 3.19Å; G97-Y193 PolarHBondContact O-N 3.43Å
98	Q	92	Very high	86	Confident	115 Å²	115	58.5 Å²	58.5	54%	0.537	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	148.4	-179.3	63.8	-176.6	-2.9	0	0	111.5	H190 A191 I192	Q98-H190 PolarHBondContact OE1-NE2 2.78Å; Q98-A191 CarbonylContact C-O 3.49Å; Q98-A191 VanDerWaalsContact CA-O 3.22Å; Q98-A191 WeakPolarHBondContact CA-O 3.22Å; Q98-I192 HydrophobicContact CB-CG1 4.32Å
99	I	91.3	Very high	86.2	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.5	170.1	-61.1	171.2	0	0	0	106.2	L92 W112 I114 L124 V176 F189 H190 A191	L92-I99 HydrophobicContact CD1-CD1 4.15Å; L92-I99 HydrophobicContact CD1-CG1 3.76Å; I99-W112 HydrophobicContact CD1-CB 3.94Å; I99-W112 HydrophobicContact CD1-CG 4.07Å; I99-W112 HydrophobicContact CG1-CG 4.29Å; I99-W112 HydrophobicContact CG2-CD2 3.71Å; I99-W112 HydrophobicContact CG2-CE3 4.09Å; I99-W112 HydrophobicContact CG2-CG 4.15Å; I99-W112 HydrophobicContact CG2-CH2 4.21Å; I99-W112 HydrophobicContact CG2-CZ2 3.86Å; I99-W112 HydrophobicContact CG2-CZ3 4.33Å; I99-I114 HydrophobicContact CD1-CD1 4.05Å; I99-L124 HydrophobicContact CD1-CD1 4.49Å; I99-V176 HydrophobicContact CD1-CB 4.37Å; I99-V176 HydrophobicContact CD1-CG2 4.17Å; I99-F189 HydrophobicContact CB-CE2 4.29Å; I99-F189 HydrophobicContact CG2-CE2 3.61Å; I99-F189 HydrophobicContact CG2-CZ 3.86Å; I99-H190 CarbonylContact O-C 3.59Å; I99-H190 WeakPolarHBondContact O-CA 3.47Å; I99-H190 PolarHBondContact O-CD2 3.35Å; I99-A191 HydrophobicContact CB-CB 4.49Å; I99-A191 PolarHBondContact N-O 3.47Å; I99-A191 PolarHBondContact O-N 2.86Å
100	L	86.3	Confident	86.4	Confident	83 Å²	83	59.1 Å²	59.1	44%	0.435	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124.8	-178.9	179.6	63.4	0	0	0	108.5	E102 H190	L100-E102 HydrophobicContact CD1-CG 3.92Å; L100-E102 HydrophobicContact CD2-CG 4.16Å; L100-E102 WeakPolarHBondContact CD2-OE1 3.2Å; L100-E102 HydrophobicContact CG-CG 3.87Å; L100-H190 HydrophobicContact CD1-CB 3.94Å
101	L	84.3	Confident	86.6	Confident	6 Å²	6	55.8 Å²	55.8	3%	0.031	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	111.6	172.8	-175.3	70.8	0	0	0	107.4	W80 W112 F178 G188 F189	W80-L101 HydrophobicContact CH2-CD1 3.98Å; W80-L101 HydrophobicContact CZ2-CD1 3.5Å; L101-W112 HydrophobicContact CB-CH2 4.48Å; L101-W112 HydrophobicContact CD1-CH2 4.3Å; L101-F178 HydrophobicContact CD2-CB 4.41Å; L101-F178 HydrophobicContact CD2-CD1 3.28Å; L101-F178 HydrophobicContact CD2-CD2 4.11Å; L101-F178 HydrophobicContact CD2-CE1 3.42Å; L101-F178 VanDerWaalsContact CD2-CE1 3.42Å; L101-F178 HydrophobicContact CD2-CE2 4.25Å; L101-F178 HydrophobicContact CD2-CG 3.64Å; L101-F178 HydrophobicContact CD2-CZ 3.91Å; L101-G188 CarbonylContact O-C 3.42Å; L101-G188 WeakPolarHBondContact O-CA 3.33Å; L101-F189 HydrophobicContact CB-CD1 3.93Å; L101-F189 HydrophobicContact CB-CE1 3.86Å; L101-F189 HydrophobicContact CB-CZ 4.44Å; L101-F189 HydrophobicContact CD2-CD1 3.91Å; L101-F189 HydrophobicContact CD2-CE1 3.67Å; L101-F189 HydrophobicContact CG-CE1 4.42Å; L101-F189 PolarHBondContact N-O 3.26Å; L101-F189 PolarHBondContact O-N 3.27Å
102	E	76.6	Confident	86.7	Confident	105 Å²	105	52.3 Å²	52.3	49%	0.491	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.5	-177	-67.5	178	166	0	0	111.1	R77 L100 D187	R77-E102 PolarHBondContact NH1-O 2.04Å; L100-E102 HydrophobicContact CD1-CG 3.92Å; L100-E102 HydrophobicContact CD2-CG 4.16Å; L100-E102 WeakPolarHBondContact CD2-OE1 3.2Å; L100-E102 HydrophobicContact CG-CG 3.87Å; E102-D187 CarbonylContact C-O 3.52Å; E102-D187 WeakPolarHBondContact CA-O 3.47Å
103	S	75.8	Confident	86.8	Confident	59 Å²	59	52.2 Å²	52.2	41%	0.413	27%	0.266	S	S	.	.	S	Bend	trans	49	69.2	173.8	-52.8	0	0	0	0	112	W59 D187	W59-S103 WeakPolarHBondContact CZ2-O 3.46Å; S103-D187 PolarHBondContact N-O 2.49Å
104	Y	76.8	Confident	86.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-69.1	152.8	-173.2	63.5	-88.3	0	0	0	112.2	L131 E132 D140 F178 N185 F186	Y104-L131 HydrophobicContact CD1-CD2 4.19Å; Y104-L131 HydrophobicContact CE1-CD2 3.59Å; Y104-E132 PolarHBondContact OH-N 3.39Å; Y104-D140 HydrophobicContact CE2-CB 4.43Å; Y104-D140 WeakPolarHBondContact CE2-OD2 3.42Å; Y104-D140 PolarHBondContact OH-OD2 3.47Å; Y104-F178 AromaticContact CD1-CZ 3.97Å; Y104-F178 HydrophobicContact CD1-CZ 3.97Å; Y104-F178 AromaticContact CD2-CE1 3.91Å; Y104-F178 HydrophobicContact CD2-CE1 3.91Å; Y104-F178 AromaticContact CD2-CZ 3.56Å; Y104-F178 HydrophobicContact CD2-CZ 3.56Å; Y104-F178 HydrophobicContact CE1-CZ 4.27Å; Y104-F178 AromaticContact CE2-CZ 3.9Å; Y104-F178 HydrophobicContact CE2-CZ 3.9Å; Y104-F178 AromaticContact CG-CE1 3.85Å; Y104-F178 HydrophobicContact CG-CE1 3.85Å; Y104-F178 AromaticContact CG-CZ 3.6Å; Y104-F178 HydrophobicContact CG-CZ 3.6Å; Y104-N185 HydrophobicContact CD2-CB 4.13Å; Y104-N185 HydrophobicContact CE2-CB 3.85Å; Y104-N185 WeakPolarHBondContact O-CB 3.08Å; Y104-N185 PolarHBondContact O-ND2 2.93Å; Y104-F186 VanDerWaalsContact CD1-O 3.26Å; Y104-F186 WeakPolarHBondContact CD1-O 3.33Å; Y104-F186 HydrophobicContact CE1-CB 3.97Å; Y104-F186 VanDerWaalsContact CE1-O 3.28Å; Y104-F186 WeakPolarHBondContact CE1-O 3.36Å; Y104-F186 VanDerWaalsContact CZ-N 3.32Å; Y104-F186 WeakPolarHBondContact OH-CD2 2.91Å; Y104-F186 PolarHBondContact OH-N 3.12Å
105	P	76.9	Confident	87.2	Confident	8 Å²	8	43.2 Å²	43.2	5%	0.052	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-85.7	169.8	176.5	39.3	-35.9	0	0	0	110.3	W59 W80 M86 A108 S180	W59-P105 HydrophobicContact CB-CB 4.08Å; W59-P105 HydrophobicContact CD2-CB 3.66Å; W59-P105 HydrophobicContact CD2-CG 3.99Å; W59-P105 HydrophobicContact CE3-CB 3.42Å; W59-P105 VanDerWaalsContact CE3-CB 3.42Å; W59-P105 HydrophobicContact CE3-CG 3.25Å; W59-P105 HydrophobicContact CG-CB 3.99Å; W59-P105 VanDerWaalsContact CH2-CD 3.46Å; W59-P105 HydrophobicContact CH2-CG 4.03Å; W59-P105 HydrophobicContact CZ3-CB 3.91Å; W59-P105 HydrophobicContact CZ3-CG 3.27Å; W80-P105 VanDerWaalsContact CH2-CD 3.41Å; W80-P105 HydrophobicContact CH2-CG 3.95Å; W80-P105 HydrophobicContact CZ3-CG 3.94Å; M86-P105 HydrophobicContact CE-CB 4.43Å; M86-P105 HydrophobicContact SD-CB 4.03Å; M86-P105 HydrophobicContact SD-CG 3.78Å; P105-A108 HydrophobicContact CG-CB 3.74Å; P105-S180 PolarHBondContact O-OG 3.21Å
106	L	80.3	Confident	87.4	Confident	58 Å²	58	40.2 Å²	40.2	30%	0.304	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	148.2	168.9	-54.1	178.8	0	0	0	109.7	M86 A108 D181 G182 S183 N185	M86-L106 WeakPolarHBondContact CE-O 3.43Å; L106-A108 PolarHBondContact O-N 3.08Å; L106-D181 CarbonylContact C-O 3.56Å; L106-D181 VanDerWaalsContact CA-O 3.25Å; L106-D181 WeakPolarHBondContact CA-O 3.41Å; L106-D181 WeakPolarHBondContact CB-O 3.46Å; L106-G182 WeakPolarHBondContact CD1-O 3.44Å; L106-S183 WeakPolarHBondContact CD2-O 3.42Å; L106-N185 HydrophobicContact CD2-CB 4.13Å
107	N	83.9	Confident	87.1	Confident	99 Å²	99	40.5 Å²	40.5	53%	0.529	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	28.5	179.7	-51.4	-65.1	0	0	0	115.2	M86 S180 D181 G182	M86-N107 HydrophobicContact CE-CB 4.44Å; N107-S180 VanDerWaalsContact CA-O 3.28Å; N107-S180 WeakPolarHBondContact CA-O 3.3Å; N107-S180 PolarHBondContact N-OG 2.82Å; N107-D181 PolarHBondContact N-O 3.27Å; N107-G182 PolarHBondContact OD1-N 3.27Å
108	A	86.5	Confident	86.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.237	C	C	.	.			trans	-73	142.8	176.1	0	0	0	0	0	111.5	W80 M86 P105 L106 F178 H179 S180	W80-A108 HydrophobicContact CH2-CB 3.83Å; W80-A108 HydrophobicContact CZ3-CB 3.85Å; M86-A108 CarbonylContact O-C 3.59Å; M86-A108 WeakPolarHBondContact O-CA 3.36Å; P105-A108 HydrophobicContact CG-CB 3.74Å; L106-A108 PolarHBondContact O-N 3.08Å; A108-F178 HydrophobicContact CB-CD1 4.4Å; A108-F178 HydrophobicContact CB-CE1 3.96Å; A108-H179 WeakPolarHBondContact O-CA 3.22Å; A108-S180 WeakPolarHBondContact CB-OG 3.37Å; A108-S180 PolarHBondContact N-OG 3.35Å; A108-S180 PolarHBondContact O-N 2.79Å
109	H	91.8	Very high	86.1	Confident	39 Å²	39	43.7 Å²	43.7	18%	0.181	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	104.7	176.7	-170.6	91.8	0	0	0	111.1	M86 R87 C88 E111 R150 L177 F178	M86-H109 PolarHBondContact O-N 2.75Å; R87-H109 WeakPolarHBondContact CA-O 2.86Å; C88-H109 PolarHBondContact N-O 3.06Å; H109-E111 IonicContact CD2-OE1 3.91Å; H109-E111 PolarHBondContact CD2-OE1 2.98Å; H109-E111 IonicContact CE1-OE1 3.85Å; H109-E111 IonicContact NE2-OE1 3.87Å; H109-E111 PolarHBondContact NE2-OE1 2.89Å; H109-R150 PolarHBondContact NE2-NH2 3.48Å; H109-L177 VanDerWaalsContact CE1-CD1 3.43Å; H109-L177 WeakPolarHBondContact CE1-CD1 3.37Å; H109-L177 WeakPolarHBondContact NE2-CD1 3.28Å; H109-F178 WeakPolarHBondContact CA-O 3.03Å
110	C	92.8	Very high	85.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	140.6	-174.9	-55.5	0	0	0	0	114.2	W80 C88 W112 L177 F178	W80-C110 VanDerWaalsContact CH2-SG 3.54Å; C88-C110 HydrophobicContact CB-CB 3.99Å; C88-C110 WeakPolarHBondContact CB-SG 3.49Å; C88-C110 CarbonylContact O-C 3.59Å; C88-C110 WeakPolarHBondContact O-CA 3.15Å; C88-C110 WeakPolarHBondContact O-CB 3.38Å; C88-C110 WeakPolarHBondContact SG-CB 3.25Å; C88-C110 CovalentContact SG-SG 2.01Å; C88-C110 PolarHBondContact SG-SG 2.82Å; C110-W112 HydrophobicContact CB-CE3 4.29Å; C110-W112 HydrophobicContact CB-CH2 3.3Å; C110-W112 HydrophobicContact CB-CZ2 4.05Å; C110-W112 HydrophobicContact CB-CZ3 3.45Å; C110-W112 VanDerWaalsContact CB-CZ3 3.45Å; C110-L177 CarbonylContact O-C 3.53Å; C110-L177 WeakPolarHBondContact O-CA 3.47Å; C110-F178 HydrophobicContact CB-CB 4.17Å; C110-F178 PolarHBondContact N-O 2.01Å; C110-F178 PolarHBondContact O-N 3.24Å
111	E	94.3	Very high	86	Confident	43 Å²	43	44 Å²	44	20%	0.201	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.5	-176.6	-81.3	172	-126.7	0	0	112.8	C88 G89 Q90 H109 R150 H175 V176 L177	C88-E111 PolarHBondContact O-N 3.29Å; G89-E111 CarbonylContact C-O 3.41Å; G89-E111 VanDerWaalsContact C-O 3.29Å; G89-E111 WeakPolarHBondContact CA-O 3.28Å; Q90-E111 PolarHBondContact N-O 3.25Å; H109-E111 IonicContact CD2-OE1 3.91Å; H109-E111 PolarHBondContact CD2-OE1 2.98Å; H109-E111 IonicContact CE1-OE1 3.85Å; H109-E111 IonicContact NE2-OE1 3.87Å; H109-E111 PolarHBondContact NE2-OE1 2.89Å; E111-R150 VanDerWaalsContact CD-NE 3.32Å; E111-R150 IonicContact OE1-CZ 2.98Å; E111-R150 IonicContact OE1-NE 2.68Å; E111-R150 PolarHBondContact OE1-NE 2.97Å; E111-R150 IonicContact OE1-NH2 2.55Å; E111-R150 PolarHBondContact OE1-NH2 3.26Å; E111-R150 IonicContact OE2-NE 3.65Å; E111-R150 PolarHBondContact OE2-NE 2.74Å; E111-H175 IonicContact OE2-CE1 2.82Å; E111-H175 PolarHBondContact OE2-CE1 3Å; E111-H175 IonicContact OE2-NE2 3.41Å; E111-V176 WeakPolarHBondContact CA-O 3.33Å; E111-L177 HydrophobicContact CG-CD1 3.51Å
112	W	94.9	Very high	86.4	Confident	11 Å²	11	43.8 Å²	43.8	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132	172	-60.6	-93.9	0	0	0	110.3	Q90 L92 I99 L101 C110 H175 V176 F178 F189	Q90-W112 VanDerWaalsContact O-CA 3.29Å; Q90-W112 WeakPolarHBondContact O-CA 3.07Å; L92-W112 HydrophobicContact CD1-CB 4.43Å; I99-W112 HydrophobicContact CD1-CB 3.94Å; I99-W112 HydrophobicContact CD1-CG 4.07Å; I99-W112 HydrophobicContact CG1-CG 4.29Å; I99-W112 HydrophobicContact CG2-CD2 3.71Å; I99-W112 HydrophobicContact CG2-CE3 4.09Å; I99-W112 HydrophobicContact CG2-CG 4.15Å; I99-W112 HydrophobicContact CG2-CH2 4.21Å; I99-W112 HydrophobicContact CG2-CZ2 3.86Å; I99-W112 HydrophobicContact CG2-CZ3 4.33Å; L101-W112 HydrophobicContact CB-CH2 4.48Å; L101-W112 HydrophobicContact CD1-CH2 4.3Å; C110-W112 HydrophobicContact CB-CE3 4.29Å; C110-W112 HydrophobicContact CB-CH2 3.3Å; C110-W112 HydrophobicContact CB-CZ2 4.05Å; C110-W112 HydrophobicContact CB-CZ3 3.45Å; C110-W112 VanDerWaalsContact CB-CZ3 3.45Å; W112-H175 CarbonylContact O-C 3.59Å; W112-H175 WeakPolarHBondContact O-CA 3.37Å; W112-V176 HydrophobicContact CB-CB 4.37Å; W112-V176 HydrophobicContact CE3-CG1 4.35Å; W112-V176 PolarHBondContact N-O 2.99Å; W112-V176 PolarHBondContact O-N 2.95Å; W112-F178 HydrophobicContact CH2-CB 4.49Å; W112-F178 HydrophobicContact CZ3-CB 3.95Å; W112-F189 HydrophobicContact CE3-CZ 4.42Å; W112-F189 HydrophobicContact CH2-CE1 4.32Å; W112-F189 HydrophobicContact CH2-CZ 4.01Å; W112-F189 HydrophobicContact CZ3-CE1 4.25Å; W112-F189 AromaticContact CZ3-CZ 3.75Å; W112-F189 HydrophobicContact CZ3-CZ 3.75Å
113	T	94.2	Very high	87.2	Confident	17 Å²	17	40.9 Å²	40.9	10%	0.104	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	117	170.4	-62.3	0	0	0	0	109	Q90 V91 L92 D148 H175	Q90-T113 PolarHBondContact O-N 3.12Å; V91-T113 CarbonylContact C-O 3.58Å; V91-T113 WeakPolarHBondContact CA-O 3.28Å; L92-T113 PolarHBondContact N-O 2.8Å; T113-D148 HydrophobicContact CG2-CB 3.88Å; T113-D148 WeakPolarHBondContact CG2-O 3.22Å; T113-D148 PolarHBondContact OG1-O 3.02Å; T113-H175 PolarHBondContact OG1-ND1 3.48Å
114	I	94.6	Very high	88.1	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.6	177.6	-55	162.6	0	0	0	108.1	L92 I99 I122 L124 S173 L174 V176 Y193	L92-I114 HydrophobicContact CB-CG1 4.22Å; L92-I114 HydrophobicContact CD1-CG1 3.99Å; L92-I114 WeakPolarHBondContact O-CA 3.25Å; I99-I114 HydrophobicContact CD1-CD1 4.05Å; I114-I122 HydrophobicContact CB-CD1 4.08Å; I114-I122 HydrophobicContact CD1-CG2 4.49Å; I114-I122 HydrophobicContact CG2-CD1 3.72Å; I114-I122 HydrophobicContact CG2-CG1 4.26Å; I114-I122 HydrophobicContact CG2-CG2 4.1Å; I114-I122 WeakPolarHBondContact O-CD1 3.24Å; I114-L124 HydrophobicContact CD1-CD1 4.29Å; I114-S173 CarbonylContact O-C 3.59Å; I114-S173 VanDerWaalsContact O-CA 3.24Å; I114-S173 WeakPolarHBondContact O-CA 3.31Å; I114-L174 HydrophobicContact CB-CB 4.43Å; I114-L174 HydrophobicContact CD1-CD2 4.33Å; I114-L174 PolarHBondContact N-O 3.23Å; I114-L174 PolarHBondContact O-N 2.04Å; I114-V176 HydrophobicContact CD1-CG2 4.44Å; I114-Y193 HydrophobicContact CD1-CD1 3.88Å; I114-Y193 HydrophobicContact CD1-CD2 4.29Å; I114-Y193 HydrophobicContact CD1-CG 3.76Å; I114-Y193 HydrophobicContact CG1-CD1 4.34Å; I114-Y193 HydrophobicContact CG1-CG 4.37Å; I114-Y193 HydrophobicContact CG2-CD2 3.49Å; I114-Y193 VanDerWaalsContact CG2-CD2 3.49Å; I114-Y193 HydrophobicContact CG2-CE2 3.53Å; I114-Y193 HydrophobicContact CG2-CG 4.1Å
115	H	92.7	Very high	88.9	Confident	45 Å²	45	44.1 Å²	44.1	21%	0.208	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.2	171.1	-62.1	-73.8	0	0	0	110.6	V91 L92 R93 S173	V91-H115 VanDerWaalsContact CG1-CD2 3.41Å; V91-H115 WeakPolarHBondContact CG1-CD2 3.26Å; L92-H115 PolarHBondContact O-N 2.87Å; R93-H115 HydrophobicContact CG-CB 4.35Å; H115-S173 PolarHBondContact ND1-OG 2.89Å
116	A	88.5	Confident	89.6	Confident	12 Å²	12	44.3 Å²	44.3	10%	0.099	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-88.9	166.6	165.7	0	0	0	0	0	110.8	F120 I122 S172 E195	A116-F120 HydrophobicContact CB-CB 4.33Å; A116-I122 HydrophobicContact CB-CD1 3.98Å; A116-I122 HydrophobicContact CB-CG1 3.57Å; A116-S172 PolarHBondContact N-O 3.16Å; A116-E195 VanDerWaalsContact CA-OE1 3.3Å; A116-E195 WeakPolarHBondContact CA-OE1 3.33Å; A116-E195 HydrophobicContact CB-CG 3.75Å
117	K	85	Confident	90	Very high	127 Å²	127	44 Å²	44	55%	0.552	24%	0.243	S	C	*	.	P	Polyproline II helix	trans	-58.3	145.9	168.2	-71.9	173.1	-175.3	166.5	0	111.2	G119 F120 E195	K117-G119 PolarHBondContact O-N 3.39Å; K117-F120 HydrophobicContact CB-CD2 3.64Å; K117-F120 HydrophobicContact CB-CE2 4.17Å; K117-F120 PolarHBondContact O-N 2.95Å; K117-E195 PolarHBondContact N-OE1 2.94Å
118	P	82.3	Confident	90.2	Very high	119 Å²	119	43.3 Å²	43.3	77%	0.773	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	128.4	176.4	-25.5	33.8	0	0	0	111.6
119	G	78.7	Confident	90.3	Very high	83 Å²	83	43.7 Å²	43.7	86%	0.856	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.2	-6.7	-178.9	0	0	0	0	0	115.7	K117	K117-G119 PolarHBondContact O-N 3.39Å
120	F	85.4	Confident	90.1	Very high	48 Å²	48	42.5 Å²	42.5	21%	0.211	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-102.1	146.8	172.4	-65.2	-86.3	0	0	0	110.9	A116 K117 S172 I196 T197	A116-F120 HydrophobicContact CB-CB 4.33Å; K117-F120 HydrophobicContact CB-CD2 3.64Å; K117-F120 HydrophobicContact CB-CE2 4.17Å; K117-F120 PolarHBondContact O-N 2.95Å; F120-S172 WeakPolarHBondContact O-CA 3.03Å; F120-I196 WeakPolarHBondContact CD1-O 3.34Å; F120-T197 HydrophobicContact CD1-CG2 4.01Å; F120-T197 HydrophobicContact CE1-CG2 3.85Å
121	V	90	Very high	90	Very high	45 Å²	45	42.6 Å²	42.6	27%	0.273	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	154.3	174.1	-60.6	0	0	0	0	110.6	I196	V121-I196 HydrophobicContact CG2-CB 3.85Å; V121-I196 HydrophobicContact CG2-CG1 4.18Å; V121-I196 HydrophobicContact CG2-CG2 4.5Å; V121-I196 PolarHBondContact O-N 2.96Å
122	I	92.7	Very high	89.8	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.8	-176.8	-60.2	156.5	0	0	0	108.4	I114 A116 Q168 S169 L174 Y193	I114-I122 HydrophobicContact CB-CD1 4.08Å; I114-I122 HydrophobicContact CD1-CG2 4.49Å; I114-I122 HydrophobicContact CG2-CD1 3.72Å; I114-I122 HydrophobicContact CG2-CG1 4.26Å; I114-I122 HydrophobicContact CG2-CG2 4.1Å; I114-I122 WeakPolarHBondContact O-CD1 3.24Å; A116-I122 HydrophobicContact CB-CD1 3.98Å; A116-I122 HydrophobicContact CB-CG1 3.57Å; I122-Q168 CarbonylContact O-C 3.58Å; I122-Q168 WeakPolarHBondContact O-CA 3.35Å; I122-S169 PolarHBondContact N-OG 2.94Å; I122-S169 PolarHBondContact O-N 3.29Å; I122-L174 HydrophobicContact CB-CB 4.45Å; I122-L174 HydrophobicContact CD1-CB 3.88Å; I122-L174 HydrophobicContact CG2-CB 4.46Å; I122-L174 HydrophobicContact CG2-CD2 4.19Å; I122-Y193 HydrophobicContact CG2-CD2 4.42Å
123	Q	93.4	Very high	89.6	Confident	44 Å²	44	46.5 Å²	46.5	21%	0.206	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.6	166.8	-175.2	172.4	38.2	0	0	109.9	P166 I167 Q168 Y193 E194 I196	Q123-P166 HydrophobicContact CG-CB 4.01Å; Q123-I167 CarbonylContact C-O 3.51Å; Q123-I167 WeakPolarHBondContact CA-O 3.41Å; Q123-Q168 HydrophobicContact CB-CG 4.14Å; Q123-Q168 HydrophobicContact CG-CG 4.01Å; Q123-Y193 CarbonylContact O-C 3.56Å; Q123-Y193 WeakPolarHBondContact O-CA 3.44Å; Q123-E194 PolarHBondContact N-O 2.89Å; Q123-E194 PolarHBondContact O-N 3.39Å; Q123-I196 HydrophobicContact CB-CD1 3.68Å; Q123-I196 HydrophobicContact CB-CG1 3.83Å
124	L	93.8	Very high	89.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.9	175.3	-176.5	74.9	0	0	0	109.8	I99 I114 F126 V144 P166 I167 L174 V176 A191	I99-L124 HydrophobicContact CD1-CD1 4.49Å; I114-L124 HydrophobicContact CD1-CD1 4.29Å; L124-F126 HydrophobicContact CD2-CE2 4.26Å; L124-F126 HydrophobicContact CD2-CZ 4.41Å; L124-V144 HydrophobicContact CD2-CG1 4.15Å; L124-V144 HydrophobicContact CD2-CG2 3.9Å; L124-P166 WeakPolarHBondContact O-CA 3.49Å; L124-I167 PolarHBondContact N-O 3.24Å; L124-I167 PolarHBondContact O-N 2.88Å; L124-L174 HydrophobicContact CB-CD2 3.85Å; L124-L174 HydrophobicContact CD2-CD2 4.15Å; L124-V176 HydrophobicContact CD2-CG2 3.85Å; L124-A191 HydrophobicContact CD1-CB 3.79Å; L124-A191 HydrophobicContact CG-CB 4.32Å
125	R	94.4	Very high	89	Confident	126 Å²	126	56.6 Å²	56.6	48%	0.475	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.9	173.6	80	-176.3	-171	177	3	110.9	P166 A191 I192	R125-P166 HydrophobicContact CB-CB 4.46Å; R125-P166 HydrophobicContact CB-CG 4.49Å; R125-A191 CarbonylContact O-C 3.49Å; R125-A191 WeakPolarHBondContact O-CA 3.17Å; R125-I192 HydrophobicContact CG-CB 4.2Å; R125-I192 PolarHBondContact N-O 3.44Å; R125-I192 PolarHBondContact O-N 2.88Å
126	F	92.1	Very high	88.8	Confident	12 Å²	12	60.9 Å²	60.9	5%	0.053	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121.7	170.5	-68.9	-94.1	0	0	0	109.5	L124 L129 V142 V144 V158 R163 P164 I167 F189 H190 A191	L124-F126 HydrophobicContact CD2-CE2 4.26Å; L124-F126 HydrophobicContact CD2-CZ 4.41Å; F126-L129 HydrophobicContact CD1-CD1 4.06Å; F126-L129 HydrophobicContact CE1-CD1 4.2Å; F126-V142 HydrophobicContact CE1-CB 4.46Å; F126-V142 HydrophobicContact CE1-CG1 4.13Å; F126-V142 HydrophobicContact CE1-CG2 4.49Å; F126-V142 HydrophobicContact CZ-CB 4.36Å; F126-V142 HydrophobicContact CZ-CG1 3.78Å; F126-V144 HydrophobicContact CE2-CG2 4.47Å; F126-V144 HydrophobicContact CZ-CG2 4.38Å; F126-V158 HydrophobicContact CE2-CG2 4.46Å; F126-V158 HydrophobicContact CZ-CG2 4.22Å; F126-R163 HydrophobicContact CB-CG 4.5Å; F126-P164 HydrophobicContact CD2-CG 3.56Å; F126-P164 HydrophobicContact CE2-CG 4.02Å; F126-P164 HydrophobicContact CG-CG 4.4Å; F126-I167 HydrophobicContact CE2-CD1 4.23Å; F126-F189 HydrophobicContact CD1-CB 4.3Å; F126-F189 AromaticContact CD1-CD2 3.96Å; F126-F189 HydrophobicContact CD1-CD2 3.96Å; F126-F189 HydrophobicContact CD1-CG 4.43Å; F126-F189 HydrophobicContact CE1-CB 4.42Å; F126-F189 AromaticContact CE1-CD2 3.59Å; F126-F189 HydrophobicContact CE1-CD2 3.59Å; F126-F189 HydrophobicContact CE1-CE2 4.06Å; F126-F189 HydrophobicContact CE1-CG 4.12Å; F126-H190 CarbonylContact C-O 3.49Å; F126-A191 HydrophobicContact CD1-CB 4Å; F126-A191 HydrophobicContact CE1-CB 4.13Å; F126-A191 HydrophobicContact CG-CB 4.39Å
127	V	88.6	Confident	89	Confident	52 Å²	52	61.2 Å²	61.2	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-41.8	171.7	-178.1	0	0	0	0	109.6	R163 H190 I192	V127-R163 VanDerWaalsContact O-CD 3.24Å; V127-R163 WeakPolarHBondContact O-CD 3.05Å; V127-R163 PolarHBondContact O-NH1 2.79Å; V127-H190 HydrophobicContact CB-CB 4.43Å; V127-H190 PolarHBondContact N-O 2.69Å; V127-I192 HydrophobicContact CG2-CB 4.45Å; V127-I192 HydrophobicContact CG2-CD1 3.46Å; V127-I192 VanDerWaalsContact CG2-CD1 3.46Å; V127-I192 HydrophobicContact CG2-CG1 3.69Å
128	M	87.1	Confident	89.2	Confident	84 Å²	84	61.2 Å²	61.2	41%	0.414	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.7	176.6	179.9	179.4	172.5	0	0	109.5	D187 F189 H190	M128-D187 HydrophobicContact CE-CB 3.53Å; M128-F189 WeakPolarHBondContact O-CA 3.37Å; M128-F189 WeakPolarHBondContact O-CB 3.36Å; M128-H190 HydrophobicContact CB-CB 4.02Å; M128-H190 PolarHBondContact N-O 3.12Å; M128-H190 VanDerWaalsContact N-O 3.14Å; M128-H190 PolarHBondContact O-N 3.49Å
129	L	88.4	Confident	89.6	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.042	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	123.6	173.1	-173.9	70.1	0	0	0	107.1	F126 L131 V158 N161 E162 R163 F189	F126-L129 HydrophobicContact CD1-CD1 4.06Å; F126-L129 HydrophobicContact CE1-CD1 4.2Å; L129-L131 HydrophobicContact CD1-CD1 3.71Å; L129-L131 HydrophobicContact CD1-CG 4.01Å; L129-L131 HydrophobicContact CG-CD1 4.49Å; L129-V158 HydrophobicContact CD1-CG2 4.41Å; L129-V158 HydrophobicContact CD2-CB 4.27Å; L129-V158 HydrophobicContact CD2-CG2 4.16Å; L129-N161 WeakPolarHBondContact O-CA 3.47Å; L129-E162 WeakPolarHBondContact CD2-O 3.17Å; L129-R163 HydrophobicContact CB-CG 4.32Å; L129-F189 HydrophobicContact CD1-CB 3.77Å
130	S	88.8	Confident	90.3	Very high	14 Å²	14	56.3 Å²	56.3	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	93.2	175.9	-168.3	0	0	0	0	110.5	N161 F186 G188	S130-N161 VanDerWaalsContact CA-OD1 3.22Å; S130-N161 WeakPolarHBondContact CA-OD1 3.45Å; S130-N161 PolarHBondContact OG-OD1 2.86Å; S130-N161 VanDerWaalsContact OG-OD1 3.08Å; S130-F186 VanDerWaalsContact O-CB 3.25Å; S130-F186 WeakPolarHBondContact O-CB 3.4Å; S130-G188 CarbonylContact C-O 3.43Å; S130-G188 WeakPolarHBondContact CA-O 3.35Å; S130-G188 PolarHBondContact N-O 2.87Å; S130-G188 WeakPolarHBondContact O-CA 3.49Å; S130-G188 PolarHBondContact O-N 2.77Å
131	L	90.8	Very high	90.7	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	25%	0.254	C	S	.	.			trans	-129.1	165	-177.7	-56.3	178.9	0	0	0	109.8	Y104 L129 F133 D140 V142 G160 F178	Y104-L131 HydrophobicContact CD1-CD2 4.19Å; Y104-L131 HydrophobicContact CE1-CD2 3.59Å; L129-L131 HydrophobicContact CD1-CD1 3.71Å; L129-L131 HydrophobicContact CD1-CG 4.01Å; L129-L131 HydrophobicContact CG-CD1 4.49Å; L131-F133 PolarHBondContact O-N 2.55Å; L131-D140 HydrophobicContact CB-CB 4.17Å; L131-V142 HydrophobicContact CD1-CG2 3.87Å; L131-G160 PolarHBondContact N-O 3.39Å; L131-G160 VanDerWaalsContact N-O 3.12Å; L131-G160 VanDerWaalsContact O-CA 3.24Å; L131-G160 WeakPolarHBondContact O-CA 3.48Å; L131-F178 HydrophobicContact CD1-CD2 4.49Å; L131-F178 HydrophobicContact CD1-CE2 4.07Å; L131-F178 HydrophobicContact CD2-CD2 4.33Å; L131-F178 HydrophobicContact CD2-CE2 3.4Å; L131-F178 VanDerWaalsContact CD2-CE2 3.4Å; L131-F178 HydrophobicContact CD2-CZ 3.97Å; L131-F178 HydrophobicContact CG-CE2 4.36Å
132	E	89.6	Confident	91	Very high	11 Å²	11	53.5 Å²	53.5	5%	0.051	24%	0.241	C	C	.	.			trans	-56.6	133.8	169.1	-176.8	164.6	-162.1	0	0	110.4	Y104 Y139 D140 C159 G160 K184 F186	Y104-E132 PolarHBondContact OH-N 3.39Å; E132-Y139 HydrophobicContact CG-CD2 4.12Å; E132-D140 HydrophobicContact CB-CB 4.01Å; E132-D140 WeakPolarHBondContact CB-OD2 3.43Å; E132-C159 WeakPolarHBondContact O-CB 3.44Å; E132-G160 PolarHBondContact O-N 2.85Å; E132-K184 WeakPolarHBondContact OE1-CD 3.24Å; E132-K184 IonicContact OE1-NZ 2.78Å; E132-K184 PolarHBondContact OE1-NZ 2.92Å; E132-F186 HydrophobicContact CB-CD2 4.27Å; E132-F186 HydrophobicContact CB-CE2 3.91Å; E132-F186 HydrophobicContact CG-CE2 4.45Å
133	F	89.6	Confident	91.1	Very high	124 Å²	124	53.5 Å²	53.5	54%	0.544	24%	0.241	S	C	.	.			trans	-88.8	129.3	178.1	175.1	-97.6	0	0	0	110.7	L131 Y135	L131-F133 PolarHBondContact O-N 2.55Å; F133-Y135 HydrophobicContact CE1-CD2 4.36Å; F133-Y135 HydrophobicContact CE1-CE1 4.48Å; F133-Y135 HydrophobicContact CE1-CE2 4.26Å; F133-Y135 HydrophobicContact CZ-CD1 4.26Å; F133-Y135 HydrophobicContact CZ-CE1 4.27Å
134	D	91.9	Very high	91.2	Very high	26 Å²	26	51.4 Å²	51.4	14%	0.139	23%	0.232	C	C	.	.			trans	-140.2	146.8	167.5	173.4	54	0	0	0	109.9	M136 C137 Q138 Y139 C159	D134-M136 PolarHBondContact O-N 3.01Å; D134-M136 VanDerWaalsContact OD2-C 3.28Å; D134-M136 WeakPolarHBondContact OD2-CA 3.15Å; D134-M136 PolarHBondContact OD2-N 2.73Å; D134-C137 PolarHBondContact O-N 2.82Å; D134-C137 VanDerWaalsContact O-N 3.17Å; D134-C137 PolarHBondContact OD2-N 3.41Å; D134-Q138 PolarHBondContact OD2-N 2.86Å; D134-Y139 HydrophobicContact CB-CD2 3.66Å; D134-Y139 HydrophobicContact CB-CE2 3.98Å; D134-Y139 HydrophobicContact CB-CG 4.48Å; D134-C159 PolarHBondContact O-SG 2.97Å
135	Y	86.3	Confident	91.2	Very high	204 Å²	204	53.4 Å²	53.4	80%	0.8	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-29	-179.2	-78	-78.8	0	0	0	113.1	F133	F133-Y135 HydrophobicContact CE1-CD2 4.36Å; F133-Y135 HydrophobicContact CE1-CE1 4.48Å; F133-Y135 HydrophobicContact CE1-CE2 4.26Å; F133-Y135 HydrophobicContact CZ-CD1 4.26Å; F133-Y135 HydrophobicContact CZ-CE1 4.27Å
136	M	88.4	Confident	91.1	Very high	135 Å²	135	48.8 Å²	48.8	67%	0.665	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.2	5.9	179.1	-66	-65.2	-70.5	0	0	112.3	D134 Q138	D134-M136 PolarHBondContact O-N 3.01Å; D134-M136 VanDerWaalsContact OD2-C 3.28Å; D134-M136 WeakPolarHBondContact OD2-CA 3.15Å; D134-M136 PolarHBondContact OD2-N 2.73Å; M136-Q138 VanDerWaalsContact C-N 3.31Å; M136-Q138 HydrophobicContact CB-CG 3.76Å; M136-Q138 PolarHBondContact O-N 2.83Å
137	C	91.1	Very high	91	Very high	20 Å²	20	49.3 Å²	49.3	14%	0.135	23%	0.232	C	C	.	.			trans	46	51.5	-172.8	-62.1	0	0	0	0	112.8	D134 Y141 R157 C159	D134-C137 PolarHBondContact O-N 2.82Å; D134-C137 VanDerWaalsContact O-N 3.17Å; D134-C137 PolarHBondContact OD2-N 3.41Å; C137-Y141 VanDerWaalsContact O-CD1 3.3Å; C137-Y141 WeakPolarHBondContact O-CD1 3.29Å; C137-R157 HydrophobicContact CB-CG 4.17Å; C137-C159 WeakPolarHBondContact CA-SG 3.5Å; C137-C159 HydrophobicContact CB-CB 3.59Å; C137-C159 WeakPolarHBondContact CB-SG 3.18Å; C137-C159 WeakPolarHBondContact SG-CB 3.42Å; C137-C159 PolarHBondContact SG-N 2.8Å; C137-C159 VanDerWaalsContact SG-N 3.36Å; C137-C159 CovalentContact SG-SG 2.04Å; C137-C159 PolarHBondContact SG-SG 2.97Å
138	Q	89.8	Confident	91	Very high	126 Å²	126	50.7 Å²	50.7	59%	0.589	24%	0.238	S	C	*	.			trans	-89.6	-23.1	-178.6	-68.5	-176.5	-26.3	0	0	114.5	D134 M136	D134-Q138 PolarHBondContact OD2-N 2.86Å; M136-Q138 VanDerWaalsContact C-N 3.31Å; M136-Q138 HydrophobicContact CB-CG 3.76Å; M136-Q138 PolarHBondContact O-N 2.83Å
139	Y	90.4	Very high	91	Very high	98 Å²	98	49.9 Å²	49.9	38%	0.384	24%	0.236	S	C	.	.	S	Bend	trans	-83.9	-98.8	178.2	-53.4	-49.3	0	0	0	110.2	E132 D134 D181	E132-Y139 HydrophobicContact CG-CD2 4.12Å; D134-Y139 HydrophobicContact CB-CD2 3.66Å; D134-Y139 HydrophobicContact CB-CE2 3.98Å; D134-Y139 HydrophobicContact CB-CG 4.48Å; Y139-D181 WeakPolarHBondContact CD1-OD2 3.39Å
140	D	93.1	Very high	90.8	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	26%	0.257	C	S	.	.	S	Bend	trans	-94.9	126	178.2	-58.5	-21.1	0	0	0	111.2	Y104 L131 E132 C159 H179 S180 D181	Y104-D140 HydrophobicContact CE2-CB 4.43Å; Y104-D140 WeakPolarHBondContact CE2-OD2 3.42Å; Y104-D140 PolarHBondContact OH-OD2 3.47Å; L131-D140 HydrophobicContact CB-CB 4.17Å; E132-D140 HydrophobicContact CB-CB 4.01Å; E132-D140 WeakPolarHBondContact CB-OD2 3.43Å; D140-C159 WeakPolarHBondContact O-CB 3.38Å; D140-H179 WeakPolarHBondContact CA-O 3.49Å; D140-S180 WeakPolarHBondContact OD1-CA 3.32Å; D140-S180 WeakPolarHBondContact OD1-CB 3.47Å; D140-D181 PolarHBondContact OD1-N 3.23Å
141	Y	94.6	Very high	90.8	Very high	34 Å²	34	62.4 Å²	62.4	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	152.4	-179.4	64.8	-90.7	0	0	0	113.6	C137 E143 R157 V158 F178 H179	C137-Y141 VanDerWaalsContact O-CD1 3.3Å; C137-Y141 WeakPolarHBondContact O-CD1 3.29Å; Y141-E143 HydrophobicContact CD2-CB 3.98Å; Y141-E143 HydrophobicContact CE2-CB 3.99Å; Y141-R157 HydrophobicContact CD2-CG 3.65Å; Y141-R157 HydrophobicContact CE2-CG 4.45Å; Y141-R157 HydrophobicContact CG-CG 3.93Å; Y141-V158 CarbonylContact C-O 3.41Å; Y141-V158 VanDerWaalsContact CA-O 3.29Å; Y141-V158 WeakPolarHBondContact CA-O 3.4Å; Y141-V158 WeakPolarHBondContact CB-O 3.46Å; Y141-F178 WeakPolarHBondContact O-CA 3.19Å; Y141-F178 VanDerWaalsContact O-CD2 3.28Å; Y141-F178 WeakPolarHBondContact O-CD2 3.27Å; Y141-H179 HydrophobicContact CD1-CB 4.33Å; Y141-H179 HydrophobicContact CE1-CB 3.83Å; Y141-H179 AromaticContact CE1-CG 3.95Å; Y141-H179 AromaticContact CE1-ND1 3.79Å; Y141-H179 HydrophobicContact CE2-CB 4.18Å; Y141-H179 PolarHBondContact N-O 2.84Å; Y141-H179 PolarHBondContact O-N 2.83Å
142	V	95.8	Very high	90.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.8	162.2	179.7	0	0	0	0	108.6	F126 L131 V144 R157 V158 V176 L177 F178 F189	F126-V142 HydrophobicContact CE1-CB 4.46Å; F126-V142 HydrophobicContact CE1-CG1 4.13Å; F126-V142 HydrophobicContact CE1-CG2 4.49Å; F126-V142 HydrophobicContact CZ-CB 4.36Å; F126-V142 HydrophobicContact CZ-CG1 3.78Å; L131-V142 HydrophobicContact CD1-CG2 3.87Å; V142-V144 HydrophobicContact CG1-CG2 4.33Å; V142-R157 CarbonylContact O-C 3.52Å; V142-R157 WeakPolarHBondContact O-CA 3.43Å; V142-V158 HydrophobicContact CB-CG2 3.87Å; V142-V158 PolarHBondContact N-O 3Å; V142-V158 PolarHBondContact O-N 2.75Å; V142-V176 HydrophobicContact CG1-CG1 3.68Å; V142-L177 CarbonylContact C-O 3.29Å; V142-L177 VanDerWaalsContact CA-O 3.29Å; V142-L177 WeakPolarHBondContact CA-O 3.31Å; V142-F178 HydrophobicContact CG2-CB 4.34Å; V142-F178 HydrophobicContact CG2-CD2 3.63Å; V142-F178 HydrophobicContact CG2-CE2 4.47Å; V142-F178 HydrophobicContact CG2-CG 4.43Å; V142-F189 HydrophobicContact CG1-CZ 4.46Å; V142-F189 HydrophobicContact CG2-CD1 3.5Å; V142-F189 VanDerWaalsContact CG2-CD1 3.5Å; V142-F189 HydrophobicContact CG2-CE1 3.43Å; V142-F189 VanDerWaalsContact CG2-CE1 3.43Å; V142-F189 HydrophobicContact CG2-CG 4.11Å; V142-F189 HydrophobicContact CG2-CZ 3.97Å
143	E	94.7	Very high	90.6	Very high	1 Å²	1	69.2 Å²	69.2	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.1	177	-178.2	175.4	87.3	0	0	109.9	Y141 R145 I154 K156 R157 V176 L177	Y141-E143 HydrophobicContact CD2-CB 3.98Å; Y141-E143 HydrophobicContact CE2-CB 3.99Å; E143-R145 HydrophobicContact CG-CG 4.26Å; E143-R145 IonicContact OE1-CZ 3.24Å; E143-R145 IonicContact OE1-NE 3.48Å; E143-R145 PolarHBondContact OE1-NE 2.9Å; E143-R145 IonicContact OE1-NH2 2.99Å; E143-R145 PolarHBondContact OE1-NH2 2.82Å; E143-R145 IonicContact OE2-NH2 3.69Å; E143-I154 HydrophobicContact CG-CG1 4.32Å; E143-I154 HydrophobicContact CG-CG2 3.92Å; E143-I154 WeakPolarHBondContact OE2-CD1 3.45Å; E143-K156 WeakPolarHBondContact CA-O 3.44Å; E143-R157 IonicContact OE2-CZ 2.73Å; E143-R157 VanDerWaalsContact OE2-CZ 3.24Å; E143-R157 IonicContact OE2-NE 3.9Å; E143-R157 PolarHBondContact OE2-NE 2.77Å; E143-R157 IonicContact OE2-NH2 3.86Å; E143-R157 PolarHBondContact OE2-NH2 3.14Å; E143-V176 WeakPolarHBondContact O-CA 3.49Å; E143-L177 HydrophobicContact CB-CB 4.28Å; E143-L177 PolarHBondContact N-O 2.97Å; E143-L177 PolarHBondContact O-N 2.76Å
144	V	95.3	Very high	90.7	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124	-179.9	-174.8	0	0	0	0	108.2	L124 F126 V142 I155 K156 I167 L174 V176	L124-V144 HydrophobicContact CD2-CG1 4.15Å; L124-V144 HydrophobicContact CD2-CG2 3.9Å; F126-V144 HydrophobicContact CE2-CG2 4.47Å; F126-V144 HydrophobicContact CZ-CG2 4.38Å; V142-V144 HydrophobicContact CG1-CG2 4.33Å; V144-I155 HydrophobicContact CG1-CD1 4.36Å; V144-I155 WeakPolarHBondContact O-CB 3.22Å; V144-I155 PolarHBondContact O-N 2.74Å; V144-K156 PolarHBondContact N-O 2.85Å; V144-K156 PolarHBondContact O-N 2.67Å; V144-I167 HydrophobicContact CB-CD1 4.14Å; V144-I167 HydrophobicContact CG1-CD1 4.4Å; V144-I167 HydrophobicContact CG1-CG2 4.02Å; V144-I167 HydrophobicContact CG2-CD1 3.9Å; V144-L174 HydrophobicContact CG1-CD1 3.79Å; V144-L174 HydrophobicContact CG1-CD2 3.91Å; V144-L174 HydrophobicContact CG1-CG 3.94Å; V144-V176 HydrophobicContact CG1-CG2 4.44Å; V144-V176 HydrophobicContact CG2-CG1 4.47Å; V144-V176 HydrophobicContact CG2-CG2 4.48Å
145	R	94.2	Very high	90.7	Very high	44 Å²	44	68.7 Å²	68.7	17%	0.166	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.9	-177.2	-64.8	178.2	175.7	-106.9	4.8	110.9	E143 R150 G152 Q153 I154 L174 H175	E143-R145 HydrophobicContact CG-CG 4.26Å; E143-R145 IonicContact OE1-CZ 3.24Å; E143-R145 IonicContact OE1-NE 3.48Å; E143-R145 PolarHBondContact OE1-NE 2.9Å; E143-R145 IonicContact OE1-NH2 2.99Å; E143-R145 PolarHBondContact OE1-NH2 2.82Å; E143-R145 IonicContact OE2-NH2 3.69Å; R145-R150 PolarHBondContact NH1-O 2.83Å; R145-G152 PolarHBondContact NH1-O 2.66Å; R145-Q153 CarbonylContact C-O 3.37Å; R145-Q153 VanDerWaalsContact CA-O 3.22Å; R145-Q153 WeakPolarHBondContact CA-O 3.38Å; R145-I154 HydrophobicContact CG-CG1 4.12Å; R145-L174 VanDerWaalsContact O-CD1 3.27Å; R145-L174 WeakPolarHBondContact O-CD1 3.4Å; R145-H175 HydrophobicContact CB-CB 4.34Å; R145-H175 PolarHBondContact N-O 3.45Å; R145-H175 PolarHBondContact O-N 2.88Å
146	D	91.8	Very high	91	Very high	29 Å²	29	64.1 Å²	64.1	16%	0.155	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.6	172.4	-163.8	43.7	0	0	0	109.7	G152 Q153 I155 S169 I170 G171	D146-G152 VanDerWaalsContact O-CA 3.23Å; D146-G152 WeakPolarHBondContact O-CA 3.29Å; D146-Q153 PolarHBondContact N-O 2.86Å; D146-Q153 PolarHBondContact O-N 2.82Å; D146-I155 HydrophobicContact CB-CD1 3.82Å; D146-I155 HydrophobicContact CB-CG1 3.94Å; D146-S169 WeakPolarHBondContact OD1-CA 3.29Å; D146-S169 WeakPolarHBondContact OD1-CB 3.46Å; D146-I170 PolarHBondContact OD1-N 2.99Å; D146-I170 WeakPolarHBondContact OD2-CB 3.3Å; D146-I170 WeakPolarHBondContact OD2-CG1 3.49Å; D146-G171 PolarHBondContact OD1-N 2.93Å
147	G	90	Very high	91.2	Very high	22 Å²	22	62.2 Å²	62.2	23%	0.227	30%	0.297	C	S	.	.	S	Bend	trans	122.4	-175.4	-171.5	0	0	0	0	0	113.2	S173 L174 H175	G147-S173 PolarHBondContact N-O 2.93Å; G147-S173 VanDerWaalsContact N-O 3.12Å; G147-S173 CarbonylContact O-C 3.55Å; G147-S173 VanDerWaalsContact O-C 3.24Å; G147-L174 CarbonylContact O-C 3.58Å; G147-L174 VanDerWaalsContact O-C 3.26Å; G147-L174 WeakPolarHBondContact O-CA 3.24Å; G147-L174 PolarHBondContact O-N 3.36Å; G147-H175 PolarHBondContact O-N 3.17Å; G147-H175 VanDerWaalsContact O-N 3.12Å
148	D	89.5	Confident	91.4	Very high	82 Å²	82	61.9 Å²	61.9	44%	0.439	29%	0.294	S	S	.	.	S	Bend	trans	-103	-3.2	-175.2	63.2	-11.8	0	0	0	114.3	T113	T113-D148 HydrophobicContact CG2-CB 3.88Å; T113-D148 WeakPolarHBondContact CG2-O 3.22Å; T113-D148 PolarHBondContact OG1-O 3.02Å
149	N	87.4	Confident	91.5	Very high	67 Å²	67	56.4 Å²	56.4	36%	0.358	27%	0.27	S	S	.	.	S	Bend	trans	-146.1	179.7	-170.8	66.4	54.4	0	0	0	113.1	D151 G152	N149-D151 VanDerWaalsContact C-N 3.3Å; N149-D151 PolarHBondContact O-N 2.94Å; N149-D151 WeakPolarHBondContact OD1-CA 3.33Å; N149-D151 VanDerWaalsContact OD1-CB 3.31Å; N149-D151 WeakPolarHBondContact OD1-CB 3.43Å; N149-D151 PolarHBondContact OD1-N 2.77Å; N149-G152 PolarHBondContact O-N 3.18Å; N149-G152 PolarHBondContact OD1-N 2.78Å
150	R	84.6	Confident	91.5	Very high	131 Å²	131	51.8 Å²	51.8	49%	0.494	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.6	-177.5	-62.7	-174.8	-178	-167.4	7.1	114.6	H109 E111 R145 G152	H109-R150 PolarHBondContact NE2-NH2 3.48Å; E111-R150 VanDerWaalsContact CD-NE 3.32Å; E111-R150 IonicContact OE1-CZ 2.98Å; E111-R150 IonicContact OE1-NE 2.68Å; E111-R150 PolarHBondContact OE1-NE 2.97Å; E111-R150 IonicContact OE1-NH2 2.55Å; E111-R150 PolarHBondContact OE1-NH2 3.26Å; E111-R150 IonicContact OE2-NE 3.65Å; E111-R150 PolarHBondContact OE2-NE 2.74Å; R145-R150 PolarHBondContact NH1-O 2.83Å; R150-G152 PolarHBondContact O-N 2.8Å
151	D	87.1	Confident	91.3	Very high	154 Å²	154	57 Å²	57	82%	0.824	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.3	177.4	-56.1	-42.9	0	0	0	112.1	N149	N149-D151 VanDerWaalsContact C-N 3.3Å; N149-D151 PolarHBondContact O-N 2.94Å; N149-D151 WeakPolarHBondContact OD1-CA 3.33Å; N149-D151 VanDerWaalsContact OD1-CB 3.31Å; N149-D151 WeakPolarHBondContact OD1-CB 3.43Å; N149-D151 PolarHBondContact OD1-N 2.77Å
152	G	85.4	Confident	91	Very high	11 Å²	11	63.3 Å²	63.3	11%	0.113	31%	0.311	C	S	.	.	S	Bend	trans	-60.7	151.3	175.9	0	0	0	0	0	113.6	R145 D146 N149 R150 I154	R145-G152 PolarHBondContact NH1-O 2.66Å; D146-G152 VanDerWaalsContact O-CA 3.23Å; D146-G152 WeakPolarHBondContact O-CA 3.29Å; N149-G152 PolarHBondContact O-N 3.18Å; N149-G152 PolarHBondContact OD1-N 2.78Å; R150-G152 PolarHBondContact O-N 2.8Å; G152-I154 PolarHBondContact O-N 2.69Å
153	Q	90.8	Very high	90.7	Very high	145 Å²	145	70.7 Å²	70.7	68%	0.678	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	130.8	178.9	-176.7	179	11.9	0	0	110.3	R145 D146 I155	R145-Q153 CarbonylContact C-O 3.37Å; R145-Q153 VanDerWaalsContact CA-O 3.22Å; R145-Q153 WeakPolarHBondContact CA-O 3.38Å; D146-Q153 PolarHBondContact N-O 2.86Å; D146-Q153 PolarHBondContact O-N 2.82Å; Q153-I155 PolarHBondContact O-N 2.83Å
154	I	92	Very high	90.6	Very high	74 Å²	74	72.1 Å²	72.1	38%	0.379	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	118.3	175.7	-57.1	167.4	0	0	0	109.2	E143 R145 G152	E143-I154 HydrophobicContact CG-CG1 4.32Å; E143-I154 HydrophobicContact CG-CG2 3.92Å; E143-I154 WeakPolarHBondContact OE2-CD1 3.45Å; R145-I154 HydrophobicContact CG-CG1 4.12Å; G152-I154 PolarHBondContact O-N 2.69Å
155	I	92.7	Very high	90.4	Very high	65 Å²	65	75.9 Å²	75.9	33%	0.333	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-49.4	172.1	-56.8	166	0	0	0	109.3	V144 D146 Q153 I167 L174	V144-I155 HydrophobicContact CG1-CD1 4.36Å; V144-I155 WeakPolarHBondContact O-CB 3.22Å; V144-I155 PolarHBondContact O-N 2.74Å; D146-I155 HydrophobicContact CB-CD1 3.82Å; D146-I155 HydrophobicContact CB-CG1 3.94Å; Q153-I155 PolarHBondContact O-N 2.83Å; I155-I167 HydrophobicContact CB-CG2 4.25Å; I155-I167 HydrophobicContact CD1-CG2 4.04Å; I155-I167 HydrophobicContact CG2-CG2 3.62Å; I155-L174 HydrophobicContact CD1-CD1 3.56Å
156	K	91.4	Very high	90.3	Very high	108 Å²	108	77.2 Å²	77.2	47%	0.47	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	140.9	-177.8	-164.8	70.1	179.1	179.2	0	112	E143 V144 V158 I167	E143-K156 WeakPolarHBondContact CA-O 3.44Å; V144-K156 PolarHBondContact N-O 2.85Å; V144-K156 PolarHBondContact O-N 2.67Å; K156-V158 HydrophobicContact CG-CG1 3.68Å; K156-I167 HydrophobicContact CB-CD1 3.93Å; K156-I167 HydrophobicContact CG-CD1 4.45Å
157	R	93.7	Very high	90.3	Very high	95 Å²	95	76.4 Å²	76.4	36%	0.358	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135	164.2	-170.8	178.5	-66	-176.5	-3.3	109.3	C137 Y141 V142 E143	C137-R157 HydrophobicContact CB-CG 4.17Å; Y141-R157 HydrophobicContact CD2-CG 3.65Å; Y141-R157 HydrophobicContact CE2-CG 4.45Å; Y141-R157 HydrophobicContact CG-CG 3.93Å; V142-R157 CarbonylContact O-C 3.52Å; V142-R157 WeakPolarHBondContact O-CA 3.43Å; E143-R157 IonicContact OE2-CZ 2.73Å; E143-R157 VanDerWaalsContact OE2-CZ 3.24Å; E143-R157 IonicContact OE2-NE 3.9Å; E143-R157 PolarHBondContact OE2-NE 2.77Å; E143-R157 IonicContact OE2-NH2 3.86Å; E143-R157 PolarHBondContact OE2-NH2 3.14Å
158	V	94.3	Very high	90.4	Very high	12 Å²	12	80.5 Å²	80.5	7%	0.073	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.8	-175.7	-59.9	0	0	0	0	111.8	F126 L129 Y141 V142 K156 P164	F126-V158 HydrophobicContact CE2-CG2 4.46Å; F126-V158 HydrophobicContact CZ-CG2 4.22Å; L129-V158 HydrophobicContact CD1-CG2 4.41Å; L129-V158 HydrophobicContact CD2-CB 4.27Å; L129-V158 HydrophobicContact CD2-CG2 4.16Å; Y141-V158 CarbonylContact C-O 3.41Å; Y141-V158 VanDerWaalsContact CA-O 3.29Å; Y141-V158 WeakPolarHBondContact CA-O 3.4Å; Y141-V158 WeakPolarHBondContact CB-O 3.46Å; V142-V158 HydrophobicContact CB-CG2 3.87Å; V142-V158 PolarHBondContact N-O 3Å; V142-V158 PolarHBondContact O-N 2.75Å; K156-V158 HydrophobicContact CG-CG1 3.68Å; V158-P164 HydrophobicContact CG1-CB 4.06Å; V158-P164 HydrophobicContact CG1-CG 3.92Å
159	C	93.2	Very high	90.5	Very high	12 Å²	12	76.9 Å²	76.9	8%	0.081	38%	0.384	C	S	.	.			trans	-149.7	174.3	178.1	63.9	0	0	0	0	109.9	E132 D134 C137 D140	E132-C159 WeakPolarHBondContact O-CB 3.44Å; D134-C159 PolarHBondContact O-SG 2.97Å; C137-C159 WeakPolarHBondContact CA-SG 3.5Å; C137-C159 HydrophobicContact CB-CB 3.59Å; C137-C159 WeakPolarHBondContact CB-SG 3.18Å; C137-C159 WeakPolarHBondContact SG-CB 3.42Å; C137-C159 PolarHBondContact SG-N 2.8Å; C137-C159 VanDerWaalsContact SG-N 3.36Å; C137-C159 CovalentContact SG-SG 2.04Å; C137-C159 PolarHBondContact SG-SG 2.97Å; D140-C159 WeakPolarHBondContact O-CB 3.38Å
160	G	90.4	Very high	90.5	Very high	1 Å²	1	79.9 Å²	79.9	1%	0.01	40%	0.398	C	S	.	.	S	Bend	trans	73.2	-151.5	-175.4	0	0	0	0	0	114.1	L131 E132	L131-G160 PolarHBondContact N-O 3.39Å; L131-G160 VanDerWaalsContact N-O 3.12Å; L131-G160 VanDerWaalsContact O-CA 3.24Å; L131-G160 WeakPolarHBondContact O-CA 3.48Å; E132-G160 PolarHBondContact O-N 2.85Å
161	N	88.1	Confident	90.6	Very high	109 Å²	109	75.2 Å²	75.2	58%	0.583	39%	0.391	S	S	*	.	S	Bend	trans	-110.4	-2.7	-175.4	-61.6	-43.1	0	0	0	114	L129 S130	L129-N161 WeakPolarHBondContact O-CA 3.47Å; S130-N161 VanDerWaalsContact CA-OD1 3.22Å; S130-N161 WeakPolarHBondContact CA-OD1 3.45Å; S130-N161 PolarHBondContact OG-OD1 2.86Å; S130-N161 VanDerWaalsContact OG-OD1 3.08Å
162	E	89.1	Confident	90.8	Very high	167 Å²	167	69.8 Å²	69.8	78%	0.78	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-86.9	123.5	-176.8	-168.5	178.8	178.6	0	0	111.3	L129	L129-E162 WeakPolarHBondContact CD2-O 3.17Å
163	R	89.9	Confident	91.1	Very high	155 Å²	155	70.1 Å²	70.1	59%	0.585	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-82	127.8	-176	-63.5	177.4	-63.1	170.7	3.6	110.9	F126 V127 L129	F126-R163 HydrophobicContact CB-CG 4.5Å; V127-R163 VanDerWaalsContact O-CD 3.24Å; V127-R163 WeakPolarHBondContact O-CD 3.05Å; V127-R163 PolarHBondContact O-NH1 2.79Å; L129-R163 HydrophobicContact CB-CG 4.32Å
164	P	91.5	Very high	91.3	Very high	31 Å²	31	63.2 Å²	63.2	20%	0.201	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-70	161.7	175.8	33.3	-39.8	0	0	0	111.7	F126 V158	F126-P164 HydrophobicContact CD2-CG 3.56Å; F126-P164 HydrophobicContact CE2-CG 4.02Å; F126-P164 HydrophobicContact CG-CG 4.4Å; V158-P164 HydrophobicContact CG1-CB 4.06Å; V158-P164 HydrophobicContact CG1-CG 3.92Å
165	A	91.1	Very high	91.4	Very high	79 Å²	79	59.9 Å²	59.9	65%	0.653	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-58.3	152.5	166.2	0	0	0	0	0	110.8	I167	A165-I167 PolarHBondContact O-N 3.45Å
166	P	91.9	Very high	91.5	Very high	73 Å²	73	56.8 Å²	56.8	47%	0.474	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-53.7	128	179.2	-27.2	35.7	0	0	0	112.4	Q123 L124 R125	Q123-P166 HydrophobicContact CG-CB 4.01Å; L124-P166 WeakPolarHBondContact O-CA 3.49Å; R125-P166 HydrophobicContact CB-CB 4.46Å; R125-P166 HydrophobicContact CB-CG 4.49Å
167	I	92.8	Very high	91.7	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.062	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.6	-176.6	-60.3	169.8	0	0	0	108.4	Q123 L124 F126 V144 I155 K156 A165	Q123-I167 CarbonylContact C-O 3.51Å; Q123-I167 WeakPolarHBondContact CA-O 3.41Å; L124-I167 PolarHBondContact N-O 3.24Å; L124-I167 PolarHBondContact O-N 2.88Å; F126-I167 HydrophobicContact CE2-CD1 4.23Å; V144-I167 HydrophobicContact CB-CD1 4.14Å; V144-I167 HydrophobicContact CG1-CD1 4.4Å; V144-I167 HydrophobicContact CG1-CG2 4.02Å; V144-I167 HydrophobicContact CG2-CD1 3.9Å; I155-I167 HydrophobicContact CB-CG2 4.25Å; I155-I167 HydrophobicContact CD1-CG2 4.04Å; I155-I167 HydrophobicContact CG2-CG2 3.62Å; K156-I167 HydrophobicContact CB-CD1 3.93Å; K156-I167 HydrophobicContact CG-CD1 4.45Å; A165-I167 PolarHBondContact O-N 3.45Å
168	Q	91.3	Very high	91.8	Very high	107 Å²	107	47.7 Å²	47.7	50%	0.5	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.7	176.8	-67.6	-176.6	-0.7	0	0	110.5	I122 Q123	I122-Q168 CarbonylContact O-C 3.58Å; I122-Q168 WeakPolarHBondContact O-CA 3.35Å; Q123-Q168 HydrophobicContact CB-CG 4.14Å; Q123-Q168 HydrophobicContact CG-CG 4.01Å
169	S	91.4	Very high	91.8	Very high	7 Å²	7	50 Å²	50	5%	0.049	27%	0.274	C	S	.	.			trans	-74.7	156.9	171	67.9	0	0	0	0	111.1	I122 D146 G171	I122-S169 PolarHBondContact N-OG 2.94Å; I122-S169 PolarHBondContact O-N 3.29Å; D146-S169 WeakPolarHBondContact OD1-CA 3.29Å; D146-S169 WeakPolarHBondContact OD1-CB 3.46Å; S169-G171 WeakPolarHBondContact CB-O 3.34Å; S169-G171 PolarHBondContact OG-O 2.96Å
170	I	88	Confident	91.7	Very high	130 Å²	130	49.4 Å²	49.4	67%	0.667	27%	0.27	S	S	*	.	S	Bend	trans	-88.9	-38.3	171.1	-49	173	0	0	0	108.9	D146	D146-I170 PolarHBondContact OD1-N 2.99Å; D146-I170 WeakPolarHBondContact OD2-CB 3.3Å; D146-I170 WeakPolarHBondContact OD2-CG1 3.49Å
171	G	86.9	Confident	91.5	Very high	33 Å²	33	50.8 Å²	50.8	34%	0.34	28%	0.277	S	S	.	.	S	Bend	trans	-96.5	-169.8	176.9	0	0	0	0	0	114.2	D146 S169 S173	D146-G171 PolarHBondContact OD1-N 2.93Å; S169-G171 WeakPolarHBondContact CB-O 3.34Å; S169-G171 PolarHBondContact OG-O 2.96Å; G171-S173 VanDerWaalsContact C-N 3.26Å; G171-S173 PolarHBondContact O-N 2.78Å
172	S	90.3	Very high	91.2	Very high	39 Å²	39	47.9 Å²	47.9	27%	0.273	27%	0.272	S	S	.	.	S	Bend	trans	-87.5	10.5	174.6	56.3	0	0	0	0	113.4	A116 F120	A116-S172 PolarHBondContact N-O 3.16Å; F120-S172 WeakPolarHBondContact O-CA 3.03Å
173	S	92.1	Very high	90.7	Very high	19 Å²	19	42.5 Å²	42.5	13%	0.133	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.1	-179.9	-59.7	0	0	0	0	110.8	I114 H115 G147 G171	I114-S173 CarbonylContact O-C 3.59Å; I114-S173 VanDerWaalsContact O-CA 3.24Å; I114-S173 WeakPolarHBondContact O-CA 3.31Å; H115-S173 PolarHBondContact ND1-OG 2.89Å; G147-S173 PolarHBondContact N-O 2.93Å; G147-S173 VanDerWaalsContact N-O 3.12Å; G147-S173 CarbonylContact O-C 3.55Å; G147-S173 VanDerWaalsContact O-C 3.24Å; G171-S173 VanDerWaalsContact C-N 3.26Å; G171-S173 PolarHBondContact O-N 2.78Å
174	L	94.4	Very high	89.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.5	178.9	-168.7	75.3	0	0	0	109.4	I114 I122 L124 V144 R145 G147 I155	I114-L174 HydrophobicContact CB-CB 4.43Å; I114-L174 HydrophobicContact CD1-CD2 4.33Å; I114-L174 PolarHBondContact N-O 3.23Å; I114-L174 PolarHBondContact O-N 2.04Å; I122-L174 HydrophobicContact CB-CB 4.45Å; I122-L174 HydrophobicContact CD1-CB 3.88Å; I122-L174 HydrophobicContact CG2-CB 4.46Å; I122-L174 HydrophobicContact CG2-CD2 4.19Å; L124-L174 HydrophobicContact CB-CD2 3.85Å; L124-L174 HydrophobicContact CD2-CD2 4.15Å; V144-L174 HydrophobicContact CG1-CD1 3.79Å; V144-L174 HydrophobicContact CG1-CD2 3.91Å; V144-L174 HydrophobicContact CG1-CG 3.94Å; R145-L174 VanDerWaalsContact O-CD1 3.27Å; R145-L174 WeakPolarHBondContact O-CD1 3.4Å; G147-L174 CarbonylContact O-C 3.58Å; G147-L174 VanDerWaalsContact O-C 3.26Å; G147-L174 WeakPolarHBondContact O-CA 3.24Å; G147-L174 PolarHBondContact O-N 3.36Å; I155-L174 HydrophobicContact CD1-CD1 3.56Å
175	H	94.9	Very high	89.2	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.014	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129	179.7	-174.3	75.1	0	0	0	110.1	E111 W112 T113 R145 G147	E111-H175 IonicContact OE2-CE1 2.82Å; E111-H175 PolarHBondContact OE2-CE1 3Å; E111-H175 IonicContact OE2-NE2 3.41Å; W112-H175 CarbonylContact O-C 3.59Å; W112-H175 WeakPolarHBondContact O-CA 3.37Å; T113-H175 PolarHBondContact OG1-ND1 3.48Å; R145-H175 HydrophobicContact CB-CB 4.34Å; R145-H175 PolarHBondContact N-O 3.45Å; R145-H175 PolarHBondContact O-N 2.88Å; G147-H175 PolarHBondContact O-N 3.17Å; G147-H175 VanDerWaalsContact O-N 3.12Å
176	V	95.4	Very high	88.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.7	-178.6	-176.4	0	0	0	0	108.2	I99 E111 W112 I114 L124 V142 E143 V144	I99-V176 HydrophobicContact CD1-CB 4.37Å; I99-V176 HydrophobicContact CD1-CG2 4.17Å; E111-V176 WeakPolarHBondContact CA-O 3.33Å; W112-V176 HydrophobicContact CB-CB 4.37Å; W112-V176 HydrophobicContact CE3-CG1 4.35Å; W112-V176 PolarHBondContact N-O 2.99Å; W112-V176 PolarHBondContact O-N 2.95Å; I114-V176 HydrophobicContact CD1-CG2 4.44Å; L124-V176 HydrophobicContact CD2-CG2 3.85Å; V142-V176 HydrophobicContact CG1-CG1 3.68Å; E143-V176 WeakPolarHBondContact O-CA 3.49Å; V144-V176 HydrophobicContact CG1-CG2 4.44Å; V144-V176 HydrophobicContact CG2-CG1 4.47Å; V144-V176 HydrophobicContact CG2-CG2 4.48Å
177	L	94.6	Very high	88.2	Confident	13 Å²	13	45.2 Å²	45.2	7%	0.068	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.3	-178.5	174.4	70.3	0	0	0	109.1	H109 C110 E111 V142 E143	H109-L177 VanDerWaalsContact CE1-CD1 3.43Å; H109-L177 WeakPolarHBondContact CE1-CD1 3.37Å; H109-L177 WeakPolarHBondContact NE2-CD1 3.28Å; C110-L177 CarbonylContact O-C 3.53Å; C110-L177 WeakPolarHBondContact O-CA 3.47Å; E111-L177 HydrophobicContact CG-CD1 3.51Å; V142-L177 CarbonylContact C-O 3.29Å; V142-L177 VanDerWaalsContact CA-O 3.29Å; V142-L177 WeakPolarHBondContact CA-O 3.31Å; E143-L177 HydrophobicContact CB-CB 4.28Å; E143-L177 PolarHBondContact N-O 2.97Å; E143-L177 PolarHBondContact O-N 2.76Å
178	F	95.4	Very high	88	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.4	168.5	173.7	-104.7	0	0	0	110.2	L101 Y104 A108 H109 C110 W112 L131 Y141 V142 F189	L101-F178 HydrophobicContact CD2-CB 4.41Å; L101-F178 HydrophobicContact CD2-CD1 3.28Å; L101-F178 HydrophobicContact CD2-CD2 4.11Å; L101-F178 HydrophobicContact CD2-CE1 3.42Å; L101-F178 VanDerWaalsContact CD2-CE1 3.42Å; L101-F178 HydrophobicContact CD2-CE2 4.25Å; L101-F178 HydrophobicContact CD2-CG 3.64Å; L101-F178 HydrophobicContact CD2-CZ 3.91Å; Y104-F178 AromaticContact CD1-CZ 3.97Å; Y104-F178 HydrophobicContact CD1-CZ 3.97Å; Y104-F178 AromaticContact CD2-CE1 3.91Å; Y104-F178 HydrophobicContact CD2-CE1 3.91Å; Y104-F178 AromaticContact CD2-CZ 3.56Å; Y104-F178 HydrophobicContact CD2-CZ 3.56Å; Y104-F178 HydrophobicContact CE1-CZ 4.27Å; Y104-F178 AromaticContact CE2-CZ 3.9Å; Y104-F178 HydrophobicContact CE2-CZ 3.9Å; Y104-F178 AromaticContact CG-CE1 3.85Å; Y104-F178 HydrophobicContact CG-CE1 3.85Å; Y104-F178 AromaticContact CG-CZ 3.6Å; Y104-F178 HydrophobicContact CG-CZ 3.6Å; A108-F178 HydrophobicContact CB-CD1 4.4Å; A108-F178 HydrophobicContact CB-CE1 3.96Å; H109-F178 WeakPolarHBondContact CA-O 3.03Å; C110-F178 HydrophobicContact CB-CB 4.17Å; C110-F178 PolarHBondContact N-O 2.01Å; C110-F178 PolarHBondContact O-N 3.24Å; W112-F178 HydrophobicContact CH2-CB 4.49Å; W112-F178 HydrophobicContact CZ3-CB 3.95Å; L131-F178 HydrophobicContact CD1-CD2 4.49Å; L131-F178 HydrophobicContact CD1-CE2 4.07Å; L131-F178 HydrophobicContact CD2-CD2 4.33Å; L131-F178 HydrophobicContact CD2-CE2 3.4Å; L131-F178 VanDerWaalsContact CD2-CE2 3.4Å; L131-F178 HydrophobicContact CD2-CZ 3.97Å; L131-F178 HydrophobicContact CG-CE2 4.36Å; Y141-F178 WeakPolarHBondContact O-CA 3.19Å; Y141-F178 VanDerWaalsContact O-CD2 3.28Å; Y141-F178 WeakPolarHBondContact O-CD2 3.27Å; V142-F178 HydrophobicContact CG2-CB 4.34Å; V142-F178 HydrophobicContact CG2-CD2 3.63Å; V142-F178 HydrophobicContact CG2-CE2 4.47Å; V142-F178 HydrophobicContact CG2-CG 4.43Å; F178-F189 HydrophobicContact CB-CE1 4.01Å; F178-F189 HydrophobicContact CD2-CD1 4.43Å; F178-F189 HydrophobicContact CD2-CE1 4.11Å; F178-F189 HydrophobicContact CG-CE1 4.11Å
179	H	94.3	Very high	88	Confident	60 Å²	60	39.7 Å²	39.7	28%	0.278	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.3	177.6	179.6	-82.2	0	0	0	109.4	A108 D140 Y141	A108-H179 WeakPolarHBondContact O-CA 3.22Å; D140-H179 WeakPolarHBondContact CA-O 3.49Å; Y141-H179 HydrophobicContact CD1-CB 4.33Å; Y141-H179 HydrophobicContact CE1-CB 3.83Å; Y141-H179 AromaticContact CE1-CG 3.95Å; Y141-H179 AromaticContact CE1-ND1 3.79Å; Y141-H179 HydrophobicContact CE2-CB 4.18Å; Y141-H179 PolarHBondContact N-O 2.84Å; Y141-H179 PolarHBondContact O-N 2.83Å
180	S	91.6	Very high	87.9	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.232	C	C	.	.			trans	-120.8	156.1	166.6	65.7	0	0	0	0	112.8	P105 N107 A108 D140	P105-S180 PolarHBondContact O-OG 3.21Å; N107-S180 VanDerWaalsContact CA-O 3.28Å; N107-S180 WeakPolarHBondContact CA-O 3.3Å; N107-S180 PolarHBondContact N-OG 2.82Å; A108-S180 WeakPolarHBondContact CB-OG 3.37Å; A108-S180 PolarHBondContact N-OG 3.35Å; A108-S180 PolarHBondContact O-N 2.79Å; D140-S180 WeakPolarHBondContact OD1-CA 3.32Å; D140-S180 WeakPolarHBondContact OD1-CB 3.47Å
181	D	86.5	Confident	88.1	Confident	30 Å²	30	34.9 Å²	34.9	16%	0.16	20%	0.2	C	C	.	.			trans	-96	-170.9	-179.3	90.2	-3.9	0	0	0	113.1	L106 N107 Y139 D140 S183	L106-D181 CarbonylContact C-O 3.56Å; L106-D181 VanDerWaalsContact CA-O 3.25Å; L106-D181 WeakPolarHBondContact CA-O 3.41Å; L106-D181 WeakPolarHBondContact CB-O 3.46Å; N107-D181 PolarHBondContact N-O 3.27Å; Y139-D181 WeakPolarHBondContact CD1-OD2 3.39Å; D140-D181 PolarHBondContact OD1-N 3.23Å; D181-S183 VanDerWaalsContact C-N 3.28Å; D181-S183 PolarHBondContact O-N 3.03Å; D181-S183 PolarHBondContact OD1-N 2.81Å
182	G	82.3	Confident	88.5	Confident	47 Å²	47	34.7 Å²	34.7	49%	0.485	19%	0.191	S	C	.	.	S	Bend	trans	-79.7	7.1	-176.4	0	0	0	0	0	115.9	L106 N107	L106-G182 WeakPolarHBondContact CD1-O 3.44Å; N107-G182 PolarHBondContact OD1-N 3.27Å
183	S	78.4	Confident	88.6	Confident	54 Å²	54	33.2 Å²	33.2	38%	0.378	18%	0.18	S	C	.	.	S	Bend	trans	-148.6	160.6	-179.1	71.3	0	0	0	0	113.2	L106 D181	L106-S183 WeakPolarHBondContact CD2-O 3.42Å; D181-S183 VanDerWaalsContact C-N 3.28Å; D181-S183 PolarHBondContact O-N 3.03Å; D181-S183 PolarHBondContact OD1-N 2.81Å
184	K	72.4	Confident	88.6	Confident	129 Å²	129	35 Å²	35	56%	0.561	19%	0.186	S	C	*	.			trans	45.6	96.1	173.4	-61.6	167.8	-178.4	172.8	0	116.7	E132 F186	E132-K184 WeakPolarHBondContact OE1-CD 3.24Å; E132-K184 IonicContact OE1-NZ 2.78Å; E132-K184 PolarHBondContact OE1-NZ 2.92Å; K184-F186 HydrophobicContact CB-CE2 4.34Å
185	N	76.7	Confident	88.4	Confident	86 Å²	86	35.8 Å²	35.8	46%	0.46	19%	0.19	S	C	.	.			trans	-99.3	160.2	170.7	63.9	-35.8	0	0	0	113.6	Y104 L106	Y104-N185 HydrophobicContact CD2-CB 4.13Å; Y104-N185 HydrophobicContact CE2-CB 3.85Å; Y104-N185 WeakPolarHBondContact O-CB 3.08Å; Y104-N185 PolarHBondContact O-ND2 2.93Å; L106-N185 HydrophobicContact CD2-CB 4.13Å
186	F	82.9	Confident	88	Confident	87 Å²	87	38 Å²	38	38%	0.382	20%	0.201	S	C	.	.			trans	-136	-170.1	-179.7	-67.5	-88.7	0	0	0	111	Y104 S130 E132 K184 G188	Y104-F186 VanDerWaalsContact CD1-O 3.26Å; Y104-F186 WeakPolarHBondContact CD1-O 3.33Å; Y104-F186 HydrophobicContact CE1-CB 3.97Å; Y104-F186 VanDerWaalsContact CE1-O 3.28Å; Y104-F186 WeakPolarHBondContact CE1-O 3.36Å; Y104-F186 VanDerWaalsContact CZ-N 3.32Å; Y104-F186 WeakPolarHBondContact OH-CD2 2.91Å; Y104-F186 PolarHBondContact OH-N 3.12Å; S130-F186 VanDerWaalsContact O-CB 3.25Å; S130-F186 WeakPolarHBondContact O-CB 3.4Å; E132-F186 HydrophobicContact CB-CD2 4.27Å; E132-F186 HydrophobicContact CB-CE2 3.91Å; E132-F186 HydrophobicContact CG-CE2 4.45Å; K184-F186 HydrophobicContact CB-CE2 4.34Å; F186-G188 VanDerWaalsContact C-N 3.25Å; F186-G188 PolarHBondContact O-N 3.23Å
187	D	80.4	Confident	87.3	Confident	94 Å²	94	39.4 Å²	39.4	50%	0.503	21%	0.21	S	C	.	.			trans	-70.6	-16.6	-171.5	-65.5	-27.2	0	0	0	114.1	E102 S103 M128	E102-D187 CarbonylContact C-O 3.52Å; E102-D187 WeakPolarHBondContact CA-O 3.47Å; S103-D187 PolarHBondContact N-O 2.49Å; M128-D187 HydrophobicContact CE-CB 3.53Å
188	G	87.8	Confident	86.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91.7	-143.5	179.3	0	0	0	0	0	112.9	L101 S130 F186	L101-G188 CarbonylContact O-C 3.42Å; L101-G188 WeakPolarHBondContact O-CA 3.33Å; S130-G188 CarbonylContact C-O 3.43Å; S130-G188 WeakPolarHBondContact CA-O 3.35Å; S130-G188 PolarHBondContact N-O 2.87Å; S130-G188 WeakPolarHBondContact O-CA 3.49Å; S130-G188 PolarHBondContact O-N 2.77Å; F186-G188 VanDerWaalsContact C-N 3.25Å; F186-G188 PolarHBondContact O-N 3.23Å
189	F	90.3	Very high	85.8	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.009	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	152.6	-175.1	74.3	-89.5	0	0	0	113.8	I99 L101 W112 F126 M128 L129 V142 F178 A191	I99-F189 HydrophobicContact CB-CE2 4.29Å; I99-F189 HydrophobicContact CG2-CE2 3.61Å; I99-F189 HydrophobicContact CG2-CZ 3.86Å; L101-F189 HydrophobicContact CB-CD1 3.93Å; L101-F189 HydrophobicContact CB-CE1 3.86Å; L101-F189 HydrophobicContact CB-CZ 4.44Å; L101-F189 HydrophobicContact CD2-CD1 3.91Å; L101-F189 HydrophobicContact CD2-CE1 3.67Å; L101-F189 HydrophobicContact CG-CE1 4.42Å; L101-F189 PolarHBondContact N-O 3.26Å; L101-F189 PolarHBondContact O-N 3.27Å; W112-F189 HydrophobicContact CE3-CZ 4.42Å; W112-F189 HydrophobicContact CH2-CE1 4.32Å; W112-F189 HydrophobicContact CH2-CZ 4.01Å; W112-F189 HydrophobicContact CZ3-CE1 4.25Å; W112-F189 AromaticContact CZ3-CZ 3.75Å; W112-F189 HydrophobicContact CZ3-CZ 3.75Å; F126-F189 HydrophobicContact CD1-CB 4.3Å; F126-F189 AromaticContact CD1-CD2 3.96Å; F126-F189 HydrophobicContact CD1-CD2 3.96Å; F126-F189 HydrophobicContact CD1-CG 4.43Å; F126-F189 HydrophobicContact CE1-CB 4.42Å; F126-F189 AromaticContact CE1-CD2 3.59Å; F126-F189 HydrophobicContact CE1-CD2 3.59Å; F126-F189 HydrophobicContact CE1-CE2 4.06Å; F126-F189 HydrophobicContact CE1-CG 4.12Å; M128-F189 WeakPolarHBondContact O-CA 3.37Å; M128-F189 WeakPolarHBondContact O-CB 3.36Å; L129-F189 HydrophobicContact CD1-CB 3.77Å; V142-F189 HydrophobicContact CG1-CZ 4.46Å; V142-F189 HydrophobicContact CG2-CD1 3.5Å; V142-F189 VanDerWaalsContact CG2-CD1 3.5Å; V142-F189 HydrophobicContact CG2-CE1 3.43Å; V142-F189 VanDerWaalsContact CG2-CE1 3.43Å; V142-F189 HydrophobicContact CG2-CG 4.11Å; V142-F189 HydrophobicContact CG2-CZ 3.97Å; F178-F189 HydrophobicContact CB-CE1 4.01Å; F178-F189 HydrophobicContact CD2-CD1 4.43Å; F178-F189 HydrophobicContact CD2-CE1 4.11Å; F178-F189 HydrophobicContact CG-CE1 4.11Å; F189-A191 HydrophobicContact CD2-CB 4.19Å; F189-A191 HydrophobicContact CE2-CB 4.29Å
190	H	91	Very high	85.2	Confident	36 Å²	36	41.5 Å²	41.5	17%	0.167	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	117.7	171	179.8	-143.7	0	0	0	108.8	Q98 I99 L100 F126 V127 M128	Q98-H190 PolarHBondContact OE1-NE2 2.78Å; I99-H190 CarbonylContact O-C 3.59Å; I99-H190 WeakPolarHBondContact O-CA 3.47Å; I99-H190 PolarHBondContact O-CD2 3.35Å; L100-H190 HydrophobicContact CD1-CB 3.94Å; F126-H190 CarbonylContact C-O 3.49Å; V127-H190 HydrophobicContact CB-CB 4.43Å; V127-H190 PolarHBondContact N-O 2.69Å; M128-H190 HydrophobicContact CB-CB 4.02Å; M128-H190 PolarHBondContact N-O 3.12Å; M128-H190 VanDerWaalsContact N-O 3.14Å; M128-H190 PolarHBondContact O-N 3.49Å
191	A	92.4	Very high	84.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.9	175.5	0	0	0	0	0	110.8	Q98 I99 L124 R125 F126 F189	Q98-A191 CarbonylContact C-O 3.49Å; Q98-A191 VanDerWaalsContact CA-O 3.22Å; Q98-A191 WeakPolarHBondContact CA-O 3.22Å; I99-A191 HydrophobicContact CB-CB 4.49Å; I99-A191 PolarHBondContact N-O 3.47Å; I99-A191 PolarHBondContact O-N 2.86Å; L124-A191 HydrophobicContact CD1-CB 3.79Å; L124-A191 HydrophobicContact CG-CB 4.32Å; R125-A191 CarbonylContact O-C 3.49Å; R125-A191 WeakPolarHBondContact O-CA 3.17Å; F126-A191 HydrophobicContact CD1-CB 4Å; F126-A191 HydrophobicContact CE1-CB 4.13Å; F126-A191 HydrophobicContact CG-CB 4.39Å; F189-A191 HydrophobicContact CD2-CB 4.19Å; F189-A191 HydrophobicContact CE2-CB 4.29Å
192	I	93.7	Very high	84.4	Confident	29 Å²	29	49.4 Å²	49.4	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.7	174.7	-61.7	175	0	0	0	107.3	G97 Q98 R125 V127	G97-I192 WeakPolarHBondContact O-CA 3.49Å; G97-I192 WeakPolarHBondContact O-CG2 3.15Å; Q98-I192 HydrophobicContact CB-CG1 4.32Å; R125-I192 HydrophobicContact CG-CB 4.2Å; R125-I192 PolarHBondContact N-O 3.44Å; R125-I192 PolarHBondContact O-N 2.88Å; V127-I192 HydrophobicContact CG2-CB 4.45Å; V127-I192 HydrophobicContact CG2-CD1 3.46Å; V127-I192 VanDerWaalsContact CG2-CD1 3.46Å; V127-I192 HydrophobicContact CG2-CG1 3.69Å
193	Y	93.5	Very high	84.5	Confident	9 Å²	9	48.2 Å²	48.2	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	147.7	173.6	70	-87.2	0	0	0	111.1	L92 A94 K96 G97 I114 I122 Q123	L92-Y193 HydrophobicContact CB-CE1 4.42Å; L92-Y193 HydrophobicContact CD1-CE1 3.75Å; A94-Y193 WeakPolarHBondContact O-CE2 3.16Å; K96-Y193 VanDerWaalsContact CA-O 3.31Å; K96-Y193 WeakPolarHBondContact CA-O 3.23Å; K96-Y193 WeakPolarHBondContact CG-O 3.35Å; G97-Y193 VanDerWaalsContact C-CD1 3.5Å; G97-Y193 VanDerWaalsContact CA-CZ 3.48Å; G97-Y193 PolarHBondContact N-O 3.48Å; G97-Y193 WeakPolarHBondContact O-CD1 3.19Å; G97-Y193 PolarHBondContact O-N 3.43Å; I114-Y193 HydrophobicContact CD1-CD1 3.88Å; I114-Y193 HydrophobicContact CD1-CD2 4.29Å; I114-Y193 HydrophobicContact CD1-CG 3.76Å; I114-Y193 HydrophobicContact CG1-CD1 4.34Å; I114-Y193 HydrophobicContact CG1-CG 4.37Å; I114-Y193 HydrophobicContact CG2-CD2 3.49Å; I114-Y193 VanDerWaalsContact CG2-CD2 3.49Å; I114-Y193 HydrophobicContact CG2-CE2 3.53Å; I114-Y193 HydrophobicContact CG2-CG 4.1Å; I122-Y193 HydrophobicContact CG2-CD2 4.42Å; Q123-Y193 CarbonylContact O-C 3.56Å; Q123-Y193 WeakPolarHBondContact O-CA 3.44Å
194	E	91.9	Very high	84.9	Confident	55 Å²	55	46.5 Å²	46.5	26%	0.257	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150	171.6	66	-167.7	165.1	0	0	112.3	P95 K96 Q123	P95-E194 CarbonylContact O-C 3.6Å; P95-E194 WeakPolarHBondContact O-CA 3.46Å; K96-E194 HydrophobicContact CB-CB 4.23Å; K96-E194 HydrophobicContact CD-CB 4.29Å; K96-E194 HydrophobicContact CG-CB 4.07Å; K96-E194 IonicContact NZ-OE2 3.26Å; K96-E194 PolarHBondContact NZ-OE2 3.22Å; Q123-E194 PolarHBondContact N-O 2.89Å; Q123-E194 PolarHBondContact O-N 3.39Å
195	E	90.2	Very high	85.5	Confident	18 Å²	18	45.1 Å²	45.1	8%	0.084	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127.6	170.5	-74	179	176.7	0	0	109.5	P95 A116 K117 T197 S200	P95-E195 VanDerWaalsContact CA-CD 3.43Å; P95-E195 HydrophobicContact CB-CB 4.5Å; P95-E195 HydrophobicContact CB-CG 4.22Å; P95-E195 WeakPolarHBondContact CB-OE2 3.41Å; P95-E195 PolarHBondContact O-N 2.91Å; A116-E195 VanDerWaalsContact CA-OE1 3.3Å; A116-E195 WeakPolarHBondContact CA-OE1 3.33Å; A116-E195 HydrophobicContact CB-CG 3.75Å; K117-E195 PolarHBondContact N-OE1 2.94Å; E195-T197 PolarHBondContact O-N 3.25Å; E195-S200 PolarHBondContact O-OG 3.05Å
196	I	85.4	Confident	85.7	Confident	50 Å²	50	45.5 Å²	45.5	26%	0.256	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	114	174	-60.5	-59.9	0	0	0	109.3	F120 V121 Q123	F120-I196 WeakPolarHBondContact CD1-O 3.34Å; V121-I196 HydrophobicContact CG2-CB 3.85Å; V121-I196 HydrophobicContact CG2-CG1 4.18Å; V121-I196 HydrophobicContact CG2-CG2 4.5Å; V121-I196 PolarHBondContact O-N 2.96Å; Q123-I196 HydrophobicContact CB-CD1 3.68Å; Q123-I196 HydrophobicContact CB-CG1 3.83Å
197	T	81.8	Confident	85.7	Confident	29 Å²	29	48.3 Å²	48.3	18%	0.178	28%	0.275	C	S	.	.			trans	-116.8	167	177.6	73.5	0	0	0	0	110.9	F120 E195 C199 S200 L212	F120-T197 HydrophobicContact CD1-CG2 4.01Å; F120-T197 HydrophobicContact CE1-CG2 3.85Å; E195-T197 PolarHBondContact O-N 3.25Å; T197-C199 PolarHBondContact O-N 3.37Å; T197-C199 VanDerWaalsContact O-N 3.15Å; T197-C199 PolarHBondContact OG1-N 2.97Å; T197-S200 PolarHBondContact N-OG 2.93Å; T197-S200 VanDerWaalsContact O-CB 3.31Å; T197-S200 WeakPolarHBondContact O-CB 3.31Å; T197-S200 PolarHBondContact O-N 3.11Å; T197-S200 PolarHBondContact O-OG 3.32Å; T197-S200 PolarHBondContact OG1-N 3.31Å; T197-S200 PolarHBondContact OG1-OG 3.15Å; T197-S200 VanDerWaalsContact OG1-OG 3.11Å; T197-L212 HydrophobicContact CG2-CD1 4.03Å
198	A	76.9	Confident	85.9	Confident	35 Å²	35	44.5 Å²	44.5	29%	0.289	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.8	174.2	0	0	0	0	0	113.8	L212 Y218	A198-L212 HydrophobicContact CB-CD2 4.26Å; A198-Y218 HydrophobicContact CB-CD1 3.87Å; A198-Y218 HydrophobicContact CB-CG 4.38Å
199	C	82.1	Confident	85.9	Confident	24 Å²	24	48.9 Å²	48.9	16%	0.162	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-10.3	174.3	-70.5	0	0	0	0	113.6	T197 S201 S202 C210 L212	T197-C199 PolarHBondContact O-N 3.37Å; T197-C199 VanDerWaalsContact O-N 3.15Å; T197-C199 PolarHBondContact OG1-N 2.97Å; C199-S201 PolarHBondContact O-N 3.01Å; C199-S201 VanDerWaalsContact O-N 3.16Å; C199-S202 PolarHBondContact O-N 3.16Å; C199-C210 VanDerWaalsContact CA-SG 3.51Å; C199-C210 HydrophobicContact CB-CB 3.86Å; C199-C210 WeakPolarHBondContact CB-SG 3.08Å; C199-C210 WeakPolarHBondContact SG-CB 3.47Å; C199-C210 CovalentContact SG-SG 2.05Å; C199-C210 PolarHBondContact SG-SG 2.05Å; C199-L212 HydrophobicContact CB-CD2 4.37Å; C199-L212 HydrophobicContact CB-CG 4.3Å
200	S	80	Confident	85.7	Confident	58 Å²	58	50.5 Å²	50.5	41%	0.406	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-21.2	-177.9	-58.7	0	0	0	0	112.9	E195 T197	E195-S200 PolarHBondContact O-OG 3.05Å; T197-S200 PolarHBondContact N-OG 2.93Å; T197-S200 VanDerWaalsContact O-CB 3.31Å; T197-S200 WeakPolarHBondContact O-CB 3.31Å; T197-S200 PolarHBondContact O-N 3.11Å; T197-S200 PolarHBondContact O-OG 3.32Å; T197-S200 PolarHBondContact OG1-N 3.31Å; T197-S200 PolarHBondContact OG1-OG 3.15Å; T197-S200 VanDerWaalsContact OG1-OG 3.11Å
201	S	78.7	Confident	85.4	Confident	96 Å²	96	52.4 Å²	52.4	67%	0.671	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	3.2	175	58.7	0	0	0	0	114.8	C199	C199-S201 PolarHBondContact O-N 3.01Å; C199-S201 VanDerWaalsContact O-N 3.16Å
202	S	82.6	Confident	84.8	Confident	99 Å²	99	56.1 Å²	56.1	69%	0.692	33%	0.33	S	S	*	.			trans	50.4	62.9	-175.1	-58.6	0	0	0	0	113.8	C199 C204	C199-S202 PolarHBondContact O-N 3.16Å; S202-C204 VanDerWaalsContact C-N 3.29Å; S202-C204 PolarHBondContact O-N 3.36Å
203	P	84.4	Confident	83.9	Confident	22 Å²	22	58.7 Å²	58.7	14%	0.143	34%	0.344	C	S	.	.			trans	-75.4	-7.2	-169.6	31.6	-38.6	0	0	0	115.8	Y218 R230	P203-Y218 HydrophobicContact CB-CD2 4.21Å; P203-Y218 HydrophobicContact CB-CE1 4.34Å; P203-Y218 HydrophobicContact CB-CE2 3.59Å; P203-Y218 HydrophobicContact CG-CD1 4.37Å; P203-Y218 HydrophobicContact CG-CD2 3.49Å; P203-Y218 VanDerWaalsContact CG-CD2 3.49Å; P203-Y218 HydrophobicContact CG-CE1 4.3Å; P203-Y218 HydrophobicContact CG-CE2 3.41Å; P203-Y218 VanDerWaalsContact CG-CE2 3.41Å; P203-Y218 HydrophobicContact CG-CG 3.99Å; P203-R230 WeakPolarHBondContact O-CD 3.43Å
204	C	88.3	Confident	82.6	Confident	18 Å²	18	69.1 Å²	69.1	12%	0.122	39%	0.389	C	S	.	.			trans	-91.9	129.1	-177.4	-54	0	0	0	0	111.1	S202 G208 C220	S202-C204 VanDerWaalsContact C-N 3.29Å; S202-C204 PolarHBondContact O-N 3.36Å; C204-G208 VanDerWaalsContact CB-O 3.31Å; C204-G208 WeakPolarHBondContact CB-O 3.5Å; C204-C220 WeakPolarHBondContact CA-SG 3.48Å; C204-C220 HydrophobicContact CB-CB 3.8Å; C204-C220 WeakPolarHBondContact CB-SG 3.19Å; C204-C220 WeakPolarHBondContact SG-CA 3.01Å; C204-C220 WeakPolarHBondContact SG-CB 3.35Å; C204-C220 CovalentContact SG-SG 2.03Å; C204-C220 PolarHBondContact SG-SG 2.82Å
205	F	83.8	Confident	81.4	Confident	101 Å²	101	71.1 Å²	71.1	44%	0.443	42%	0.415	S	S	.	.	S	Bend	trans	-81.9	163.9	177.3	-65.8	-72.1	0	0	0	112.2	D207 G208 R230 E232	F205-D207 PolarHBondContact O-N 2.93Å; F205-G208 PolarHBondContact O-N 2.85Å; F205-R230 WeakPolarHBondContact CB-O 3.49Å; F205-R230 HydrophobicContact CD2-CB 3.82Å; F205-R230 HydrophobicContact CE2-CB 4.17Å; F205-R230 PolarHBondContact N-O 3.42Å; F205-E232 HydrophobicContact CD2-CB 4.19Å
206	H	82.4	Confident	80.2	Confident	93 Å²	93	71.6 Å²	71.6	43%	0.431	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	48.2	173.6	-55.8	-54.9	0	0	0	114.3	G208 L223 Y226 C231	H206-G208 PolarHBondContact O-N 3.25Å; H206-G208 VanDerWaalsContact O-N 3.15Å; H206-L223 WeakPolarHBondContact O-CD1 2.98Å; H206-Y226 HydrophobicContact CB-CD1 3.9Å; H206-Y226 HydrophobicContact CB-CD2 4.19Å; H206-Y226 HydrophobicContact CB-CE1 3.82Å; H206-Y226 HydrophobicContact CB-CE2 4.14Å; H206-Y226 HydrophobicContact CB-CG 4.07Å; H206-Y226 AromaticContact CD2-CD1 3.21Å; H206-Y226 WeakPolarHBondContact CD2-CD1 3.46Å; H206-Y226 AromaticContact CD2-CE1 3.19Å; H206-Y226 WeakPolarHBondContact CD2-CE1 3.35Å; H206-Y226 AromaticContact CE1-CE1 3.97Å; H206-Y226 AromaticContact CG-CD1 3.65Å; H206-Y226 AromaticContact CG-CE1 3.35Å; H206-Y226 AromaticContact CG-CZ 3.83Å; H206-Y226 AromaticContact ND1-CE1 3.83Å; H206-Y226 AromaticContact NE2-CD1 3.97Å; H206-Y226 AromaticContact NE2-CE1 3.62Å; H206-C231 PolarHBondContact CD2-O 2.82Å; H206-C231 VanDerWaalsContact CD2-O 3.27Å
207	D	82.4	Confident	79.7	Confident	146 Å²	146	72.3 Å²	72.3	78%	0.781	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.1	-178.2	-62.1	-36.8	0	0	0	113.9	F205 L223	F205-D207 PolarHBondContact O-N 2.93Å; D207-L223 HydrophobicContact CB-CD1 3.72Å; D207-L223 WeakPolarHBondContact O-CD1 3.39Å
208	G	84	Confident	79.7	Confident	14 Å²	14	74.4 Å²	74.4	14%	0.144	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-63.2	141	172.1	0	0	0	0	0	111.9	C204 F205 H206 A221	C204-G208 VanDerWaalsContact CB-O 3.31Å; C204-G208 WeakPolarHBondContact CB-O 3.5Å; F205-G208 PolarHBondContact O-N 2.85Å; H206-G208 PolarHBondContact O-N 3.25Å; H206-G208 VanDerWaalsContact O-N 3.15Å; G208-A221 WeakPolarHBondContact CA-O 3.21Å
209	T	87.6	Confident	80.1	Confident	92 Å²	92	79.6 Å²	79.6	56%	0.564	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.4	-179.5	-54.4	0	0	0	0	110.6	C220 A221	T209-C220 WeakPolarHBondContact O-CA 3.12Å; T209-A221 PolarHBondContact N-O 2.99Å; T209-A221 PolarHBondContact O-N 2.84Å
210	C	86.2	Confident	80.4	Confident	37 Å²	37	79 Å²	79	25%	0.25	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.4	177	-166.4	0	0	0	0	111.3	C199	C199-C210 VanDerWaalsContact CA-SG 3.51Å; C199-C210 HydrophobicContact CB-CB 3.86Å; C199-C210 WeakPolarHBondContact CB-SG 3.08Å; C199-C210 WeakPolarHBondContact SG-CB 3.47Å; C199-C210 CovalentContact SG-SG 2.05Å; C199-C210 PolarHBondContact SG-SG 2.05Å
211	V	84.4	Confident	80.7	Confident	75 Å²	75	78.7 Å²	78.7	46%	0.455	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.8	-179.5	-173.7	0	0	0	0	109.1	Y218 K219	V211-Y218 CarbonylContact O-C 3.57Å; V211-Y218 WeakPolarHBondContact O-CA 3.31Å; V211-K219 PolarHBondContact N-O 2.97Å; V211-K219 PolarHBondContact O-N 3.15Å
212	L	79.9	Confident	81	Confident	79 Å²	79	76.5 Å²	76.5	41%	0.414	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134	177.9	-73.9	163.3	0	0	0	111.5	T197 A198 C199 S217	T197-L212 HydrophobicContact CG2-CD1 4.03Å; A198-L212 HydrophobicContact CB-CD2 4.26Å; C199-L212 HydrophobicContact CB-CD2 4.37Å; C199-L212 HydrophobicContact CB-CG 4.3Å; L212-S217 WeakPolarHBondContact CA-O 3.04Å
213	D	75.1	Confident	80.9	Confident	82 Å²	82	76.3 Å²	76.3	44%	0.439	43%	0.427	S	S	.	.			trans	-85.5	159	172.7	-75	-31.5	0	0	0	111.6	A215 G216 S217	D213-A215 PolarHBondContact O-N 2.03Å; D213-G216 PolarHBondContact O-N 3.04Å; D213-S217 PolarHBondContact N-O 3.27Å
214	K	66.9	Low	80.3	Confident	229 Å²	229	80.3 Å²	80.3	100%	0.996	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-15.9	179.1	-66.7	-177	179.3	179.3	0	114.6
215	A	66.6	Low	79.4	Confident	97 Å²	97	80.9 Å²	80.9	80%	0.802	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	3.9	178.8	0	0	0	0	0	114	D213	D213-A215 PolarHBondContact O-N 2.03Å
216	G	65.1	Low	79.2	Confident	28 Å²	28	79.6 Å²	79.6	29%	0.289	46%	0.464	S	S	.	.	S	Bend	trans	84.7	3.5	-177.4	0	0	0	0	0	115.3	D213	D213-G216 PolarHBondContact O-N 3.04Å
217	S	73.6	Confident	79	Confident	64 Å²	64	78.6 Å²	78.6	45%	0.448	46%	0.464	S	S	.	.			trans	-81.5	170.3	170.4	-170	0	0	0	0	111.8	L212 D213	L212-S217 WeakPolarHBondContact CA-O 3.04Å; D213-S217 PolarHBondContact N-O 3.27Å
218	Y	83.3	Confident	78.9	Confident	73 Å²	73	73 Å²	73	29%	0.286	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	154.6	175.8	78.6	-79.9	0	0	0	113.1	A198 P203 V211 R230	A198-Y218 HydrophobicContact CB-CD1 3.87Å; A198-Y218 HydrophobicContact CB-CG 4.38Å; P203-Y218 HydrophobicContact CB-CD2 4.21Å; P203-Y218 HydrophobicContact CB-CE1 4.34Å; P203-Y218 HydrophobicContact CB-CE2 3.59Å; P203-Y218 HydrophobicContact CG-CD1 4.37Å; P203-Y218 HydrophobicContact CG-CD2 3.49Å; P203-Y218 VanDerWaalsContact CG-CD2 3.49Å; P203-Y218 HydrophobicContact CG-CE1 4.3Å; P203-Y218 HydrophobicContact CG-CE2 3.41Å; P203-Y218 VanDerWaalsContact CG-CE2 3.41Å; P203-Y218 HydrophobicContact CG-CG 3.99Å; V211-Y218 CarbonylContact O-C 3.57Å; V211-Y218 WeakPolarHBondContact O-CA 3.31Å; Y218-R230 HydrophobicContact CE2-CG 4.49Å; Y218-R230 WeakPolarHBondContact OH-CD 3.44Å
219	K	85.6	Confident	78.7	Confident	144 Å²	144	80.6 Å²	80.6	63%	0.626	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	137.7	169.8	-176	177.2	179.3	-179.2	0	110.1	V211	V211-K219 PolarHBondContact N-O 2.97Å; V211-K219 PolarHBondContact O-N 3.15Å
220	C	87.2	Confident	78.5	Confident	13 Å²	13	81.7 Å²	81.7	9%	0.088	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	133.1	175.4	-63.7	0	0	0	0	111.8	C204 T209 Q229	C204-C220 WeakPolarHBondContact CA-SG 3.48Å; C204-C220 HydrophobicContact CB-CB 3.8Å; C204-C220 WeakPolarHBondContact CB-SG 3.19Å; C204-C220 WeakPolarHBondContact SG-CA 3.01Å; C204-C220 WeakPolarHBondContact SG-CB 3.35Å; C204-C220 CovalentContact SG-SG 2.03Å; C204-C220 PolarHBondContact SG-SG 2.82Å; T209-C220 WeakPolarHBondContact O-CA 3.12Å; C220-Q229 WeakPolarHBondContact CB-O 3.32Å
221	A	86.5	Confident	78.4	Confident	51 Å²	51	80 Å²	80	42%	0.421	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.7	166.9	0	0	0	0	0	109.4	G208 T209	G208-A221 WeakPolarHBondContact CA-O 3.21Å; T209-A221 PolarHBondContact N-O 2.99Å; T209-A221 PolarHBondContact O-N 2.84Å
222	C	84.7	Confident	78.2	Confident	49 Å²	49	80 Å²	80	33%	0.331	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-87.9	142.6	-172.6	-51.6	0	0	0	0	112.9	Y226 C231	C222-Y226 WeakPolarHBondContact CB-O 2.99Å; C222-C231 WeakPolarHBondContact CA-SG 3.48Å; C222-C231 HydrophobicContact CB-CB 3.72Å; C222-C231 WeakPolarHBondContact CB-SG 3.4Å; C222-C231 WeakPolarHBondContact SG-CA 3.24Å; C222-C231 WeakPolarHBondContact SG-CB 3.49Å; C222-C231 CovalentContact SG-SG 2.03Å; C222-C231 PolarHBondContact SG-SG 2.85Å
223	L	80.9	Confident	77.9	Confident	96 Å²	96	80 Å²	80	50%	0.503	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-67.2	154.3	169.1	-82.8	154.1	0	0	0	111.2	H206 D207 G225 Y226	H206-L223 WeakPolarHBondContact O-CD1 2.98Å; D207-L223 HydrophobicContact CB-CD1 3.72Å; D207-L223 WeakPolarHBondContact O-CD1 3.39Å; L223-G225 PolarHBondContact O-N 3.28Å; L223-Y226 PolarHBondContact O-N 3.09Å; L223-Y226 VanDerWaalsContact O-N 3.09Å
224	A	72.9	Confident	77.3	Confident	105 Å²	105	81.3 Å²	81.3	87%	0.868	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	126.9	-179.9	0	0	0	0	0	111
225	G	69.3	Low	77.2	Confident	30 Å²	30	75.5 Å²	75.5	31%	0.309	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.4	-7.2	-174.3	0	0	0	0	0	114.5	L223 L235	L223-G225 PolarHBondContact O-N 3.28Å; G225-L235 WeakPolarHBondContact O-CB 3.22Å; G225-L235 PolarHBondContact O-N 2.81Å
226	Y	78.8	Confident	76.8	Confident	75 Å²	75	78.6 Å²	78.6	29%	0.294	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.8	178.3	-62.3	-87.1	0	0	0	112.4	H206 C222 L223 N233 L234	H206-Y226 HydrophobicContact CB-CD1 3.9Å; H206-Y226 HydrophobicContact CB-CD2 4.19Å; H206-Y226 HydrophobicContact CB-CE1 3.82Å; H206-Y226 HydrophobicContact CB-CE2 4.14Å; H206-Y226 HydrophobicContact CB-CG 4.07Å; H206-Y226 AromaticContact CD2-CD1 3.21Å; H206-Y226 WeakPolarHBondContact CD2-CD1 3.46Å; H206-Y226 AromaticContact CD2-CE1 3.19Å; H206-Y226 WeakPolarHBondContact CD2-CE1 3.35Å; H206-Y226 AromaticContact CE1-CE1 3.97Å; H206-Y226 AromaticContact CG-CD1 3.65Å; H206-Y226 AromaticContact CG-CE1 3.35Å; H206-Y226 AromaticContact CG-CZ 3.83Å; H206-Y226 AromaticContact ND1-CE1 3.83Å; H206-Y226 AromaticContact NE2-CD1 3.97Å; H206-Y226 AromaticContact NE2-CE1 3.62Å; C222-Y226 WeakPolarHBondContact CB-O 2.99Å; L223-Y226 PolarHBondContact O-N 3.09Å; L223-Y226 VanDerWaalsContact O-N 3.09Å; Y226-N233 CarbonylContact C-O 3.56Å; Y226-N233 VanDerWaalsContact CA-O 3.24Å; Y226-N233 WeakPolarHBondContact CA-O 3.31Å; Y226-L234 HydrophobicContact CD1-CD1 3.91Å; Y226-L234 HydrophobicContact CE1-CD1 3.3Å; Y226-L234 HydrophobicContact CE2-CD1 4.32Å
227	T	79	Confident	76.6	Confident	72 Å²	72	84.6 Å²	84.6	44%	0.442	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	166.9	179.9	-169.3	0	0	0	0	111.1	C231 E232 N233 L235	T227-C231 CarbonylContact O-C 3.52Å; T227-E232 PolarHBondContact O-N 3.38Å; T227-N233 HydrophobicContact CG2-CB 3.8Å; T227-N233 PolarHBondContact N-O 2.03Å; T227-N233 WeakPolarHBondContact O-CA 3.43Å; T227-N233 VanDerWaalsContact O-CB 3.27Å; T227-N233 WeakPolarHBondContact O-CB 3.28Å; T227-N233 PolarHBondContact O-N 2.91Å; T227-N233 PolarHBondContact O-ND2 3.3Å; T227-L235 HydrophobicContact CG2-CD2 4.34Å; T227-L235 HydrophobicContact CG2-CG 4.37Å
228	G	78.4	Confident	76.3	Confident	28 Å²	28	89.2 Å²	89.2	29%	0.289	46%	0.462	S	S	.	.	S	Bend	trans	115	170.1	-175	0	0	0	0	0	113.4	R230 C231 E232	G228-R230 VanDerWaalsContact C-N 3.28Å; G228-R230 PolarHBondContact O-N 3.39Å; G228-C231 PolarHBondContact O-N 3.42Å; G228-E232 VanDerWaalsContact CA-OE1 3.28Å; G228-E232 WeakPolarHBondContact CA-OE1 3.44Å
229	Q	80.8	Confident	76	Confident	173 Å²	173	88 Å²	88	81%	0.808	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-28.2	-175.9	-73.3	-171.4	-8.4	0	0	112.8	C220 E232	C220-Q229 WeakPolarHBondContact CB-O 3.32Å; Q229-E232 PolarHBondContact N-OE1 3.37Å; Q229-E232 PolarHBondContact N-OE2 2.83Å
230	R	83.5	Confident	75.8	Confident	115 Å²	115	81.1 Å²	81.1	43%	0.434	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	19	174.9	-61.4	-174.6	-64.1	-162.5	1.5	111.8	P203 F205 Y218 G228 E232	P203-R230 WeakPolarHBondContact O-CD 3.43Å; F205-R230 WeakPolarHBondContact CB-O 3.49Å; F205-R230 HydrophobicContact CD2-CB 3.82Å; F205-R230 HydrophobicContact CE2-CB 4.17Å; F205-R230 PolarHBondContact N-O 3.42Å; Y218-R230 HydrophobicContact CE2-CG 4.49Å; Y218-R230 WeakPolarHBondContact OH-CD 3.44Å; G228-R230 VanDerWaalsContact C-N 3.28Å; G228-R230 PolarHBondContact O-N 3.39Å; R230-E232 VanDerWaalsContact C-OE2 3.31Å; R230-E232 VanDerWaalsContact CA-OE2 3.32Å; R230-E232 WeakPolarHBondContact CA-OE2 3.49Å; R230-E232 PolarHBondContact N-OE2 2.76Å; R230-E232 PolarHBondContact O-N 2.82Å
231	C	84	Confident	75.6	Confident	1 Å²	1	84.4 Å²	84.4	1%	0.007	45%	0.453	C	S	.	.	S	Bend	trans	61.9	28.3	-174.5	-47.5	0	0	0	0	114.1	H206 C222 T227 G228 N233	H206-C231 PolarHBondContact CD2-O 2.82Å; H206-C231 VanDerWaalsContact CD2-O 3.27Å; C222-C231 WeakPolarHBondContact CA-SG 3.48Å; C222-C231 HydrophobicContact CB-CB 3.72Å; C222-C231 WeakPolarHBondContact CB-SG 3.4Å; C222-C231 WeakPolarHBondContact SG-CA 3.24Å; C222-C231 WeakPolarHBondContact SG-CB 3.49Å; C222-C231 CovalentContact SG-SG 2.03Å; C222-C231 PolarHBondContact SG-SG 2.85Å; T227-C231 CarbonylContact O-C 3.52Å; G228-C231 PolarHBondContact O-N 3.42Å; C231-N233 VanDerWaalsContact C-N 3.35Å; C231-N233 PolarHBondContact O-N 2.71Å
232	E	79.9	Confident	75.4	Confident	77 Å²	77	85 Å²	85	36%	0.36	45%	0.45	S	S	.	.			trans	-74.8	-16.2	-172.7	67.6	-76.5	175.6	0	0	115.3	F205 T227 G228 Q229 R230	F205-E232 HydrophobicContact CD2-CB 4.19Å; T227-E232 PolarHBondContact O-N 3.38Å; G228-E232 VanDerWaalsContact CA-OE1 3.28Å; G228-E232 WeakPolarHBondContact CA-OE1 3.44Å; Q229-E232 PolarHBondContact N-OE1 3.37Å; Q229-E232 PolarHBondContact N-OE2 2.83Å; R230-E232 VanDerWaalsContact C-OE2 3.31Å; R230-E232 VanDerWaalsContact CA-OE2 3.32Å; R230-E232 WeakPolarHBondContact CA-OE2 3.49Å; R230-E232 PolarHBondContact N-OE2 2.76Å; R230-E232 PolarHBondContact O-N 2.82Å
233	N	73.9	Confident	75.4	Confident	79 Å²	79	84.1 Å²	84.1	42%	0.422	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.4	-174.6	-52.4	-65.3	0	0	0	111	Y226 T227 C231	Y226-N233 CarbonylContact C-O 3.56Å; Y226-N233 VanDerWaalsContact CA-O 3.24Å; Y226-N233 WeakPolarHBondContact CA-O 3.31Å; T227-N233 HydrophobicContact CG2-CB 3.8Å; T227-N233 PolarHBondContact N-O 2.03Å; T227-N233 WeakPolarHBondContact O-CA 3.43Å; T227-N233 VanDerWaalsContact O-CB 3.27Å; T227-N233 WeakPolarHBondContact O-CB 3.28Å; T227-N233 PolarHBondContact O-N 2.91Å; T227-N233 PolarHBondContact O-ND2 3.3Å; C231-N233 VanDerWaalsContact C-N 3.35Å; C231-N233 PolarHBondContact O-N 2.71Å
234	L	63.4	Low	75.6	Confident	108 Å²	108	80.8 Å²	80.8	57%	0.565	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.5	169.7	-167.9	75.7	0	0	0	109.6	Y226 E236	Y226-L234 HydrophobicContact CD1-CD1 3.91Å; Y226-L234 HydrophobicContact CE1-CD1 3.3Å; Y226-L234 HydrophobicContact CE2-CD1 4.32Å; L234-E236 PolarHBondContact O-N 3.12Å
235	L	63.5	Low	76.2	Confident	107 Å²	107	78 Å²	78	56%	0.56	41%	0.414	S	S	*	.			trans	-72	95.7	168.3	-76.9	162.7	0	0	0	108.4	G225 T227 E237	G225-L235 WeakPolarHBondContact O-CB 3.22Å; G225-L235 PolarHBondContact O-N 2.81Å; T227-L235 HydrophobicContact CG2-CD2 4.34Å; T227-L235 HydrophobicContact CG2-CG 4.37Å; L235-E237 PolarHBondContact O-N 3.23Å; L235-E237 VanDerWaalsContact O-N 3.15Å
236	E	59.5	Low	77.1	Confident	163 Å²	163	77.2 Å²	77.2	76%	0.762	40%	0.403	S	S	*	.			trans	-60.8	116.7	173.7	-70.6	-172	164.4	0	0	110.5	L234 R238	L234-E236 PolarHBondContact O-N 3.12Å; E236-R238 PolarHBondContact O-N 3.31Å
237	E	59	Low	77.5	Confident	154 Å²	154	79.4 Å²	79.4	72%	0.72	42%	0.424	S	S	*	.			trans	-65.1	101.3	167.7	-67.9	-172.2	171.9	0	0	109.3	L235 N239	L235-E237 PolarHBondContact O-N 3.23Å; L235-E237 VanDerWaalsContact O-N 3.15Å; E237-N239 PolarHBondContact O-N 3.22Å; E237-N239 PolarHBondContact O-ND2 3.21Å
238	R	67.6	Low	77.8	Confident	161 Å²	161	79.3 Å²	79.3	61%	0.608	42%	0.421	S	S	*	.			trans	-70.2	99.8	176.6	-64.6	-173.3	-177.3	-163.8	1.8	110	E236 I267	E236-R238 PolarHBondContact O-N 3.31Å; R238-I267 VanDerWaalsContact O-CD1 3.3Å; R238-I267 WeakPolarHBondContact O-CD1 3.41Å; R238-I267 VanDerWaalsContact O-CG1 3.23Å; R238-I267 WeakPolarHBondContact O-CG1 3.39Å
239	N	76.9	Confident	78.3	Confident	47 Å²	47	78.9 Å²	78.9	25%	0.251	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-98.3	145.7	174.1	-66.6	-58	0	0	0	110.3	E237 H264	E237-N239 PolarHBondContact O-N 3.22Å; E237-N239 PolarHBondContact O-ND2 3.21Å; N239-H264 HydrophobicContact CB-CB 4.05Å
240	C	81.1	Confident	78.7	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	139.3	175.9	-57.3	0	0	0	0	110.3	H264 A265 C289 G293 W295	C240-H264 CarbonylContact O-C 3.51Å; C240-H264 WeakPolarHBondContact O-CA 3.3Å; C240-A265 PolarHBondContact N-O 3.41Å; C240-A265 PolarHBondContact O-N 2.86Å; C240-C289 HydrophobicContact CB-CB 3.82Å; C240-C289 WeakPolarHBondContact CB-SG 3.45Å; C240-C289 WeakPolarHBondContact SG-CA 3.43Å; C240-C289 WeakPolarHBondContact SG-CB 3.03Å; C240-C289 CovalentContact SG-SG 2.03Å; C240-C289 PolarHBondContact SG-SG 3.34Å; C240-G293 PolarHBondContact SG-O 3.15Å; C240-G293 VanDerWaalsContact SG-O 3.37Å; C240-W295 HydrophobicContact CB-CD2 4.44Å; C240-W295 HydrophobicContact CB-CZ2 4.09Å
241	S	84.1	Confident	79.1	Confident	81 Å²	81	73.3 Å²	73.3	57%	0.566	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	151.3	170.3	-54.7	0	0	0	0	111.5	P243 W295	S241-P243 WeakPolarHBondContact O-CD 3.27Å; S241-W295 PolarHBondContact O-NE1 2.8Å
242	D	83.1	Confident	79.3	Confident	64 Å²	64	79.6 Å²	79.6	34%	0.342	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-57.3	119.5	174.3	-178.7	9.5	0	0	0	110.8	G244 Q251 L259 R263	D242-G244 PolarHBondContact O-N 3.05Å; D242-G244 PolarHBondContact OD1-N 3.29Å; D242-G244 VanDerWaalsContact OD1-N 3.12Å; D242-Q251 PolarHBondContact OD1-NE2 3.22Å; D242-L259 HydrophobicContact CB-CD2 4.47Å; D242-R263 PolarHBondContact N-O 2.95Å
243	P	83.4	Confident	79.7	Confident	30 Å²	30	79.1 Å²	79.1	20%	0.195	42%	0.418	C	S	.	.			trans	-69.7	-14.8	-177	26.7	-33.1	0	0	0	113.3	S241 F273 W295 Q299	S241-P243 WeakPolarHBondContact O-CD 3.27Å; P243-F273 HydrophobicContact CB-CZ 4.25Å; P243-F273 HydrophobicContact CG-CZ 4.04Å; P243-W295 VanDerWaalsContact CD-CZ2 3.44Å; P243-W295 HydrophobicContact CG-CD2 4.2Å; P243-W295 HydrophobicContact CG-CH2 4.4Å; P243-W295 HydrophobicContact CG-CZ2 3.82Å; P243-Q299 PolarHBondContact O-NE2 3.34Å
244	G	85.2	Confident	80.3	Confident	27 Å²	27	78.9 Å²	78.9	28%	0.278	42%	0.419	S	S	.	.			trans	70.2	154.4	179.8	0	0	0	0	0	114.1	D242 Q251 F273 Q299	D242-G244 PolarHBondContact O-N 3.05Å; D242-G244 PolarHBondContact OD1-N 3.29Å; D242-G244 VanDerWaalsContact OD1-N 3.12Å; G244-Q251 VanDerWaalsContact C-OE1 3.26Å; G244-Q251 PolarHBondContact O-OE1 3.12Å; G244-F273 WeakPolarHBondContact O-CE1 3.03Å; G244-Q299 PolarHBondContact O-NE2 2.88Å
245	G	85.4	Confident	81.2	Confident	47 Å²	47	75.1 Å²	75.1	49%	0.485	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-75.6	144.6	178.3	0	0	0	0	0	113.1
246	P	88.6	Confident	82.1	Confident	12 Å²	12	72.6 Å²	72.6	8%	0.078	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-65.1	147.4	173.4	25.9	-33.6	0	0	0	111.4	N248 G249 F273	P246-N248 PolarHBondContact O-N 2.71Å; P246-G249 CarbonylContact O-C 3.59Å; P246-G249 WeakPolarHBondContact O-CA 3.37Å; P246-G249 PolarHBondContact O-N 3.22Å; P246-F273 HydrophobicContact CG-CD1 4.39Å
247	V	86.4	Confident	83	Confident	121 Å²	121	68.7 Å²	68.7	73%	0.733	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	129.2	175.2	-175.7	0	0	0	0	109.8	G249 C302	V247-G249 VanDerWaalsContact C-N 3.3Å; V247-C302 WeakPolarHBondContact O-CB 3.23Å
248	N	86.2	Confident	83.9	Confident	70 Å²	70	62 Å²	62	37%	0.374	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	29.2	-169.8	-50.4	-65.1	0	0	0	114.3	P246 N276 Y279	P246-N248 PolarHBondContact O-N 2.71Å; N248-N276 VanDerWaalsContact O-CB 3.26Å; N248-N276 WeakPolarHBondContact O-CB 3.34Å; N248-N276 VanDerWaalsContact O-CG 3.32Å; N248-N276 PolarHBondContact O-N 2.89Å; N248-Y279 HydrophobicContact CB-CD1 4.04Å; N248-Y279 HydrophobicContact CB-CD2 4.15Å; N248-Y279 HydrophobicContact CB-CE1 3.77Å; N248-Y279 HydrophobicContact CB-CE2 3.94Å; N248-Y279 HydrophobicContact CB-CG 4.2Å; N248-Y279 WeakPolarHBondContact ND2-CE1 3.05Å; N248-Y279 PolarHBondContact ND2-OH 2.88Å
249	G	88.3	Confident	84.4	Confident	19 Å²	19	57.6 Å²	57.6	20%	0.196	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	-173.9	171.8	0	0	0	0	0	111.7	P246 V247 F274	P246-G249 CarbonylContact O-C 3.59Å; P246-G249 WeakPolarHBondContact O-CA 3.37Å; P246-G249 PolarHBondContact O-N 3.22Å; V247-G249 VanDerWaalsContact C-N 3.3Å; G249-F274 CarbonylContact C-O 3.47Å; G249-F274 WeakPolarHBondContact CA-O 3.38Å
250	Y	90.1	Very high	84.1	Confident	123 Å²	123	57.6 Å²	57.6	48%	0.482	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	161.9	178.8	63	-88	0	0	0	109.9	F274	Y250-F274 HydrophobicContact CD1-CB 4.08Å; Y250-F274 HydrophobicContact CD2-CB 4.08Å; Y250-F274 AromaticContact CD2-CD2 3.99Å; Y250-F274 HydrophobicContact CD2-CD2 3.99Å; Y250-F274 HydrophobicContact CD2-CG 4.4Å; Y250-F274 HydrophobicContact CE1-CB 3.64Å; Y250-F274 HydrophobicContact CE2-CB 3.64Å; Y250-F274 AromaticContact CE2-CD2 3.5Å; Y250-F274 HydrophobicContact CE2-CD2 3.5Å; Y250-F274 HydrophobicContact CE2-CE2 4.4Å; Y250-F274 AromaticContact CE2-CG 3.72Å; Y250-F274 HydrophobicContact CE2-CG 3.72Å; Y250-F274 HydrophobicContact CG-CB 4.28Å; Y250-F274 AromaticContact CZ-CG 3.78Å; Y250-F274 PolarHBondContact N-O 3.24Å; Y250-F274 PolarHBondContact O-N 3.12Å; Y250-F274 VanDerWaalsContact O-O 3.11Å
251	Q	90.8	Very high	83.4	Confident	49 Å²	49	65.1 Å²	65.1	23%	0.229	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	154.5	175.8	70.2	177.7	13.9	0	0	110.5	D242 G244 V271 S272 F273	D242-Q251 PolarHBondContact OD1-NE2 3.22Å; G244-Q251 VanDerWaalsContact C-OE1 3.26Å; G244-Q251 PolarHBondContact O-OE1 3.12Å; Q251-V271 HydrophobicContact CB-CG1 3.79Å; Q251-V271 HydrophobicContact CG-CG1 4.26Å; Q251-S272 CarbonylContact C-O 3.57Å; Q251-S272 WeakPolarHBondContact CA-O 3.01Å; Q251-F273 HydrophobicContact CB-CD1 3.68Å; Q251-F273 HydrophobicContact CB-CE1 3.77Å; Q251-F273 VanDerWaalsContact OE1-CE1 3.3Å
252	K	89.4	Confident	82.5	Confident	132 Å²	132	63.5 Å²	63.5	57%	0.574	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	136	174.7	-168	178	179.1	178.6	0	109.6	T254 S272 F274	K252-T254 PolarHBondContact O-N 3.01Å; K252-S272 PolarHBondContact N-O 2.99Å; K252-S272 PolarHBondContact O-N 3.33Å; K252-F274 HydrophobicContact CB-CD2 4.47Å; K252-F274 HydrophobicContact CB-CE2 3.94Å
253	I	87.1	Confident	82	Confident	68 Å²	68	69.5 Å²	69.5	35%	0.349	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	124.8	170.9	-59.2	169.7	0	0	0	107.9	L259 T269 V271	I253-L259 HydrophobicContact CD1-CB 4.49Å; I253-L259 HydrophobicContact CD1-CD1 3.59Å; I253-L259 HydrophobicContact CD1-CG 3.77Å; I253-T269 HydrophobicContact CG2-CG2 4.05Å; I253-V271 HydrophobicContact CG1-CG2 4.3Å
254	T	87.9	Confident	81.8	Confident	74 Å²	74	72.2 Å²	72.2	45%	0.454	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-8.3	-176.7	50.3	0	0	0	0	113.2	K252 V270 S272	K252-T254 PolarHBondContact O-N 3.01Å; T254-V270 PolarHBondContact N-O 3.01Å; T254-S272 VanDerWaalsContact CG2-OG 3.23Å; T254-S272 WeakPolarHBondContact CG2-OG 3.35Å; T254-S272 PolarHBondContact OG1-OG 2.72Å
255	G	81.1	Confident	81.7	Confident	28 Å²	28	71 Å²	71	29%	0.289	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	164.6	173.6	0	0	0	0	0	113.6	V270	G255-V270 PolarHBondContact N-O 3.17Å; G255-V270 PolarHBondContact O-N 3.02Å
256	G	82.4	Confident	81.5	Confident	54 Å²	54	73.2 Å²	73.2	56%	0.557	40%	0.402	S	S	*	.	S	Bend	trans	89.1	-175.5	176.1	0	0	0	0	0	115.2	G258	G256-G258 VanDerWaalsContact C-N 3.26Å; G256-G258 PolarHBondContact O-N 2.8Å
257	P	77.8	Confident	81.2	Confident	81 Å²	81	76 Å²	76	53%	0.526	42%	0.416	S	S	.	.	S	Bend	trans	-70.6	-9.3	-169	23.6	-32.1	0	0	0	116.2	K266 I267	P257-K266 HydrophobicContact CB-CB 3.94Å; P257-K266 HydrophobicContact CB-CD 3.91Å; P257-K266 HydrophobicContact CG-CB 3.53Å; P257-K266 HydrophobicContact CG-CD 4.41Å; P257-I267 VanDerWaalsContact CG-O 3.31Å; P257-I267 WeakPolarHBondContact CG-O 3.43Å
258	G	79	Confident	81.1	Confident	13 Å²	13	71.9 Å²	71.9	13%	0.134	40%	0.397	C	S	.	.			trans	89.2	-168	169.8	0	0	0	0	0	115.3	G256 K266 T269	G256-G258 VanDerWaalsContact C-N 3.26Å; G256-G258 PolarHBondContact O-N 2.8Å; G258-K266 PolarHBondContact O-N 3.04Å; G258-K266 VanDerWaalsContact O-N 3.12Å; G258-T269 PolarHBondContact N-OG1 2.8Å; G258-T269 PolarHBondContact O-OG1 2.8Å
259	L	77.8	Confident	81.1	Confident	69 Å²	69	68.5 Å²	68.5	36%	0.361	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140.4	179.8	-75.4	158.2	0	0	0	111.6	D242 I253 H264 A265	D242-L259 HydrophobicContact CB-CD2 4.47Å; I253-L259 HydrophobicContact CD1-CB 4.49Å; I253-L259 HydrophobicContact CD1-CD1 3.59Å; I253-L259 HydrophobicContact CD1-CG 3.77Å; L259-H264 CarbonylContact C-O 3.56Å; L259-H264 WeakPolarHBondContact CA-O 3.23Å; L259-A265 HydrophobicContact CD2-CB 4.27Å
260	I	71.8	Confident	81.2	Confident	48 Å²	48	69.2 Å²	69.2	25%	0.246	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	122.7	167.1	-50	173.3	0	0	0	108	G262 R263 H264 K266	I260-G262 PolarHBondContact O-N 2.75Å; I260-R263 PolarHBondContact O-N 2.87Å; I260-R263 VanDerWaalsContact O-N 3.12Å; I260-H264 PolarHBondContact N-O 3.4Å; I260-H264 PolarHBondContact O-N 3.45Å; I260-K266 HydrophobicContact CD1-CD 4.33Å; I260-K266 HydrophobicContact CD1-CG 3.59Å; I260-K266 HydrophobicContact CG1-CD 4.22Å; I260-K266 HydrophobicContact CG1-CG 3.68Å
261	N	66.1	Low	81.3	Confident	158 Å²	158	63.6 Å²	63.6	85%	0.845	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	23.2	177.7	-65.4	-11.7	0	0	0	114.8	R263	N261-R263 PolarHBondContact O-N 3.43Å
262	G	64.4	Low	81.3	Confident	46 Å²	46	61.3 Å²	61.3	47%	0.474	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	6	-178.3	0	0	0	0	0	116.3	I260	I260-G262 PolarHBondContact O-N 2.75Å
263	R	73.3	Confident	81.5	Confident	190 Å²	190	55.1 Å²	55.1	72%	0.717	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-26.5	-176	-69.9	-174.4	178.2	-178.5	-0.5	114.9	D242 I260 N261	D242-R263 PolarHBondContact N-O 2.95Å; I260-R263 PolarHBondContact O-N 2.87Å; I260-R263 VanDerWaalsContact O-N 3.12Å; N261-R263 PolarHBondContact O-N 3.43Å
264	H	79.6	Confident	81.6	Confident	87 Å²	87	55.1 Å²	55.1	40%	0.403	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.1	-177	-56.7	94.2	0	0	0	110.5	N239 C240 L259 I260	N239-H264 HydrophobicContact CB-CB 4.05Å; C240-H264 CarbonylContact O-C 3.51Å; C240-H264 WeakPolarHBondContact O-CA 3.3Å; L259-H264 CarbonylContact C-O 3.56Å; L259-H264 WeakPolarHBondContact CA-O 3.23Å; I260-H264 PolarHBondContact N-O 3.4Å; I260-H264 PolarHBondContact O-N 3.45Å
265	A	81.3	Confident	81.7	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	133.3	175.9	0	0	0	0	0	110.7	C240 L259 T269 W295	C240-A265 PolarHBondContact N-O 3.41Å; C240-A265 PolarHBondContact O-N 2.86Å; L259-A265 HydrophobicContact CD2-CB 4.27Å; A265-T269 HydrophobicContact CB-CG2 4.23Å; A265-W295 HydrophobicContact CB-CH2 3.8Å; A265-W295 HydrophobicContact CB-CZ2 3.52Å
266	K	82.2	Confident	81.9	Confident	94 Å²	94	55.1 Å²	55.1	41%	0.409	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-65.7	149.4	173	-79.3	-178.4	178.3	-170.2	0	110.8	P257 G258 I260 G268 T269	P257-K266 HydrophobicContact CB-CB 3.94Å; P257-K266 HydrophobicContact CB-CD 3.91Å; P257-K266 HydrophobicContact CG-CB 3.53Å; P257-K266 HydrophobicContact CG-CD 4.41Å; G258-K266 PolarHBondContact O-N 3.04Å; G258-K266 VanDerWaalsContact O-N 3.12Å; I260-K266 HydrophobicContact CD1-CD 4.33Å; I260-K266 HydrophobicContact CD1-CG 3.59Å; I260-K266 HydrophobicContact CG1-CD 4.22Å; I260-K266 HydrophobicContact CG1-CG 3.68Å; K266-G268 PolarHBondContact O-N 2.94Å; K266-T269 VanDerWaalsContact O-CB 3.23Å; K266-T269 WeakPolarHBondContact O-CB 3.23Å; K266-T269 PolarHBondContact O-N 2.03Å; K266-T269 PolarHBondContact O-OG1 2.77Å
267	I	82.8	Confident	81.5	Confident	72 Å²	72	60.1 Å²	60.1	37%	0.369	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	134.6	173.7	-62.3	169.6	0	0	0	109.9	R238 P257 Q291	R238-I267 VanDerWaalsContact O-CD1 3.3Å; R238-I267 WeakPolarHBondContact O-CD1 3.41Å; R238-I267 VanDerWaalsContact O-CG1 3.23Å; R238-I267 WeakPolarHBondContact O-CG1 3.39Å; P257-I267 VanDerWaalsContact CG-O 3.31Å; P257-I267 WeakPolarHBondContact CG-O 3.43Å; I267-Q291 HydrophobicContact CG2-CG 4.08Å
268	G	82.9	Confident	81.2	Confident	33 Å²	33	59 Å²	59	34%	0.34	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-2	-176.5	0	0	0	0	0	115.1	K266 C289	K266-G268 PolarHBondContact O-N 2.94Å; G268-C289 PolarHBondContact N-O 3.03Å
269	T	87.4	Confident	81.4	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.324	C	S	.	.			trans	-68.3	132.9	173.3	-58.2	0	0	0	0	110.9	I253 G258 A265 K266 V271 T288 C289 W295	I253-T269 HydrophobicContact CG2-CG2 4.05Å; G258-T269 PolarHBondContact N-OG1 2.8Å; G258-T269 PolarHBondContact O-OG1 2.8Å; A265-T269 HydrophobicContact CB-CG2 4.23Å; K266-T269 VanDerWaalsContact O-CB 3.23Å; K266-T269 WeakPolarHBondContact O-CB 3.23Å; K266-T269 PolarHBondContact O-N 2.03Å; K266-T269 PolarHBondContact O-OG1 2.77Å; T269-V271 HydrophobicContact CG2-CG2 4.48Å; T269-T288 WeakPolarHBondContact O-CA 3.42Å; T269-C289 PolarHBondContact O-N 3.37Å; T269-W295 HydrophobicContact CG2-CH2 4.46Å; T269-W295 WeakPolarHBondContact O-CZ3 3.42Å
270	V	90.9	Very high	81.8	Confident	33 Å²	33	58.5 Å²	58.5	20%	0.2	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.2	179.5	-174.7	0	0	0	0	109.8	T254 G255 K286 R287 T288	T254-V270 PolarHBondContact N-O 3.01Å; G255-V270 PolarHBondContact N-O 3.17Å; G255-V270 PolarHBondContact O-N 3.02Å; V270-K286 HydrophobicContact CG1-CB 4.46Å; V270-R287 WeakPolarHBondContact CA-O 3.35Å; V270-T288 HydrophobicContact CG2-CG2 3.97Å
271	V	90.7	Very high	82.6	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.03	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	133.3	178	179.2	0	0	0	0	109.2	Q251 I253 T269 F273 K286 R287 W295	Q251-V271 HydrophobicContact CB-CG1 3.79Å; Q251-V271 HydrophobicContact CG-CG1 4.26Å; I253-V271 HydrophobicContact CG1-CG2 4.3Å; T269-V271 HydrophobicContact CG2-CG2 4.48Å; V271-F273 HydrophobicContact CB-CE2 4.41Å; V271-F273 HydrophobicContact CB-CZ 4.45Å; V271-F273 HydrophobicContact CG1-CE1 4.14Å; V271-F273 HydrophobicContact CG1-CE2 4.01Å; V271-F273 HydrophobicContact CG1-CZ 3.79Å; V271-K286 CarbonylContact O-C 3.56Å; V271-K286 VanDerWaalsContact O-CA 3.27Å; V271-K286 WeakPolarHBondContact O-CA 3.4Å; V271-R287 PolarHBondContact N-O 2.75Å; V271-R287 PolarHBondContact O-N 3.44Å; V271-W295 HydrophobicContact CB-CH2 4.32Å; V271-W295 HydrophobicContact CB-CZ3 4.21Å; V271-W295 HydrophobicContact CG2-CH2 3.46Å; V271-W295 VanDerWaalsContact CG2-CH2 3.46Å; V271-W295 HydrophobicContact CG2-CZ2 4.35Å; V271-W295 HydrophobicContact CG2-CZ3 3.81Å
272	S	92.4	Very high	83.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.1	173.8	-57.6	0	0	0	0	110.9	Q251 K252 T254 E285 K286	Q251-S272 CarbonylContact C-O 3.57Å; Q251-S272 WeakPolarHBondContact CA-O 3.01Å; K252-S272 PolarHBondContact N-O 2.99Å; K252-S272 PolarHBondContact O-N 3.33Å; T254-S272 VanDerWaalsContact CG2-OG 3.23Å; T254-S272 WeakPolarHBondContact CG2-OG 3.35Å; T254-S272 PolarHBondContact OG1-OG 2.72Å; S272-E285 CarbonylContact C-O 3.48Å; S272-E285 WeakPolarHBondContact CA-O 3.39Å; S272-K286 WeakPolarHBondContact OG-CG 3.04Å
273	F	92.1	Very high	84.6	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.009	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	140.5	-175.2	-61.9	-85.8	0	0	0	111.5	P243 G244 P246 Q251 V271 L281 E285 R287 P300	P243-F273 HydrophobicContact CB-CZ 4.25Å; P243-F273 HydrophobicContact CG-CZ 4.04Å; G244-F273 WeakPolarHBondContact O-CE1 3.03Å; P246-F273 HydrophobicContact CG-CD1 4.39Å; Q251-F273 HydrophobicContact CB-CD1 3.68Å; Q251-F273 HydrophobicContact CB-CE1 3.77Å; Q251-F273 VanDerWaalsContact OE1-CE1 3.3Å; V271-F273 HydrophobicContact CB-CE2 4.41Å; V271-F273 HydrophobicContact CB-CZ 4.45Å; V271-F273 HydrophobicContact CG1-CE1 4.14Å; V271-F273 HydrophobicContact CG1-CE2 4.01Å; V271-F273 HydrophobicContact CG1-CZ 3.79Å; F273-L281 HydrophobicContact CB-CD1 4Å; F273-L281 HydrophobicContact CB-CD2 4.17Å; F273-E285 PolarHBondContact N-O 2.81Å; F273-R287 HydrophobicContact CD2-CG 4.45Å; F273-R287 HydrophobicContact CE2-CB 4.06Å; F273-R287 HydrophobicContact CE2-CG 3.72Å; F273-P300 HydrophobicContact CB-CG 3.61Å; F273-P300 HydrophobicContact CD1-CG 3.99Å; F273-P300 HydrophobicContact CD2-CG 3.5Å; F273-P300 HydrophobicContact CE2-CG 4.15Å; F273-P300 HydrophobicContact CG-CG 3.41Å; F273-P300 VanDerWaalsContact CG-CG 3.41Å
274	F	90.5	Very high	85.4	Confident	69 Å²	69	45 Å²	45	30%	0.303	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147	-178.1	-58.6	-85.5	0	0	0	109.7	G249 Y250 K252	G249-F274 CarbonylContact C-O 3.47Å; G249-F274 WeakPolarHBondContact CA-O 3.38Å; Y250-F274 HydrophobicContact CD1-CB 4.08Å; Y250-F274 HydrophobicContact CD2-CB 4.08Å; Y250-F274 AromaticContact CD2-CD2 3.99Å; Y250-F274 HydrophobicContact CD2-CD2 3.99Å; Y250-F274 HydrophobicContact CD2-CG 4.4Å; Y250-F274 HydrophobicContact CE1-CB 3.64Å; Y250-F274 HydrophobicContact CE2-CB 3.64Å; Y250-F274 AromaticContact CE2-CD2 3.5Å; Y250-F274 HydrophobicContact CE2-CD2 3.5Å; Y250-F274 HydrophobicContact CE2-CE2 4.4Å; Y250-F274 AromaticContact CE2-CG 3.72Å; Y250-F274 HydrophobicContact CE2-CG 3.72Å; Y250-F274 HydrophobicContact CG-CB 4.28Å; Y250-F274 AromaticContact CZ-CG 3.78Å; Y250-F274 PolarHBondContact N-O 3.24Å; Y250-F274 PolarHBondContact O-N 3.12Å; Y250-F274 VanDerWaalsContact O-O 3.11Å; K252-F274 HydrophobicContact CB-CD2 4.47Å; K252-F274 HydrophobicContact CB-CE2 3.94Å
275	C	89.8	Confident	85.9	Confident	27 Å²	27	46.1 Å²	46.1	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	150.9	174.1	-65.4	0	0	0	0	111.2	L281 C302	C275-L281 WeakPolarHBondContact SG-CD1 3.26Å; C275-C302 WeakPolarHBondContact CA-SG 3.4Å; C275-C302 HydrophobicContact CB-CB 3.87Å; C275-C302 WeakPolarHBondContact CB-SG 3.18Å; C275-C302 WeakPolarHBondContact SG-CA 3.46Å; C275-C302 WeakPolarHBondContact SG-CB 3.27Å; C275-C302 CovalentContact SG-SG 2.04Å; C275-C302 PolarHBondContact SG-SG 3.15Å
276	N	85.8	Confident	86.4	Confident	75 Å²	75	51.7 Å²	51.7	40%	0.401	28%	0.282	S	S	.	.			trans	-64.7	158.5	172.3	-68.4	-14.1	0	0	0	110.7	N248 S278 Y279	N248-N276 VanDerWaalsContact O-CB 3.26Å; N248-N276 WeakPolarHBondContact O-CB 3.34Å; N248-N276 VanDerWaalsContact O-CG 3.32Å; N248-N276 PolarHBondContact O-N 2.89Å; N276-S278 PolarHBondContact O-N 2.93Å; N276-Y279 PolarHBondContact O-N 3.34Å
277	N	72.8	Confident	86.8	Confident	158 Å²	158	48.6 Å²	48.6	85%	0.845	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	134.2	178.2	-71.2	-19.2	0	0	0	111
278	S	72.5	Confident	87.2	Confident	58 Å²	58	47.6 Å²	47.6	41%	0.406	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-3.4	-173.6	77.8	0	0	0	0	117.6	N276	N276-S278 PolarHBondContact O-N 2.93Å
279	Y	83.4	Confident	87.5	Confident	61 Å²	61	46.1 Å²	46.1	24%	0.239	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	151	173.7	-67.2	-105.8	0	0	0	110.8	N248 N276 C302 I303 K304	N248-Y279 HydrophobicContact CB-CD1 4.04Å; N248-Y279 HydrophobicContact CB-CD2 4.15Å; N248-Y279 HydrophobicContact CB-CE1 3.77Å; N248-Y279 HydrophobicContact CB-CE2 3.94Å; N248-Y279 HydrophobicContact CB-CG 4.2Å; N248-Y279 WeakPolarHBondContact ND2-CE1 3.05Å; N248-Y279 PolarHBondContact ND2-OH 2.88Å; N276-Y279 PolarHBondContact O-N 3.34Å; Y279-C302 HydrophobicContact CD1-CB 4.1Å; Y279-C302 WeakPolarHBondContact CD1-O 3.43Å; Y279-C302 HydrophobicContact CG-CB 4.38Å; Y279-I303 CarbonylContact C-O 3.58Å; Y279-I303 WeakPolarHBondContact CA-O 3.36Å; Y279-K304 HydrophobicContact CD1-CG 3.69Å; Y279-K304 HydrophobicContact CD2-CG 4.29Å; Y279-K304 HydrophobicContact CE1-CD 4.31Å; Y279-K304 HydrophobicContact CE1-CG 3.5Å; Y279-K304 VanDerWaalsContact CE1-CG 3.5Å; Y279-K304 HydrophobicContact CE2-CD 4.42Å; Y279-K304 VanDerWaalsContact CE2-CE 3.44Å; Y279-K304 HydrophobicContact CE2-CG 4.08Å; Y279-K304 HydrophobicContact CG-CG 4.11Å; Y279-K304 WeakPolarHBondContact OH-CE 3.31Å
280	V	86.1	Confident	87.5	Confident	11 Å²	11	50.3 Å²	50.3	7%	0.067	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.1	175.4	67.3	0	0	0	0	109.5	I303 A305 L359 P360 Y363	V280-I303 HydrophobicContact CG1-CD1 4.47Å; V280-I303 HydrophobicContact CG1-CG1 3.72Å; V280-I303 WeakPolarHBondContact CG1-O 3.44Å; V280-I303 PolarHBondContact N-O 2.9Å; V280-I303 PolarHBondContact O-N 2.99Å; V280-A305 HydrophobicContact CG1-CB 3.65Å; V280-L359 HydrophobicContact CG1-CD2 3.49Å; V280-L359 VanDerWaalsContact CG1-CD2 3.49Å; V280-P360 HydrophobicContact CG2-CG 3.46Å; V280-P360 VanDerWaalsContact CG2-CG 3.46Å; V280-Y363 HydrophobicContact CB-CD1 4Å; V280-Y363 HydrophobicContact CB-CE1 3.87Å; V280-Y363 HydrophobicContact CG1-CD1 4.1Å; V280-Y363 HydrophobicContact CG1-CE1 4.47Å; V280-Y363 HydrophobicContact CG1-CG 4.44Å; V280-Y363 HydrophobicContact CG2-CD1 3.95Å; V280-Y363 HydrophobicContact CG2-CD2 4.03Å; V280-Y363 HydrophobicContact CG2-CE1 3.76Å; V280-Y363 HydrophobicContact CG2-CE2 3.87Å; V280-Y363 HydrophobicContact CG2-CG 4.08Å
281	L	88.3	Confident	87.1	Confident	32 Å²	32	56.9 Å²	56.9	17%	0.168	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	128.5	179.6	-159.3	78.8	0	0	0	109.9	F273 C275 E285 P300	F273-L281 HydrophobicContact CB-CD1 4Å; F273-L281 HydrophobicContact CB-CD2 4.17Å; C275-L281 WeakPolarHBondContact SG-CD1 3.26Å; L281-E285 HydrophobicContact CD2-CB 3.99Å; L281-E285 HydrophobicContact CD2-CG 4.15Å; L281-P300 HydrophobicContact CD1-CB 3.68Å; L281-P300 HydrophobicContact CD1-CG 4.13Å; L281-P300 HydrophobicContact CD2-CB 4.03Å; L281-P300 HydrophobicContact CD2-CG 4.46Å; L281-P300 HydrophobicContact CG-CB 3.72Å; L281-P300 HydrophobicContact CG-CG 4.49Å
282	S	87.9	Confident	86.7	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.063	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.1	171.7	174.4	0	0	0	0	108.6	P300 I301 D358	S282-P300 CarbonylContact O-C 3.51Å; S282-P300 WeakPolarHBondContact O-CA 3.4Å; S282-I301 PolarHBondContact N-O 2.64Å; S282-I301 PolarHBondContact O-N 3.29Å; S282-D358 VanDerWaalsContact CB-O 3.31Å; S282-D358 WeakPolarHBondContact CB-O 3.41Å; S282-D358 PolarHBondContact OG-N 2.89Å; S282-D358 PolarHBondContact OG-O 2.81Å
283	G	85	Confident	86	Confident	47 Å²	47	61.1 Å²	61.1	49%	0.485	33%	0.326	S	S	.	.	S	Bend	trans	118.7	-160.2	-171.7	0	0	0	0	0	112.3
284	N	88.9	Confident	85.8	Confident	70 Å²	70	67.1 Å²	67.1	37%	0.374	35%	0.354	S	S	.	.			trans	-83.2	119.1	-177.7	-66.9	93.6	0	0	0	111.3	K286 R287 K298 P300	N284-K286 PolarHBondContact O-N 3.03Å; N284-R287 HydrophobicContact CB-CG 4.29Å; N284-K298 PolarHBondContact OD1-N 3.34Å; N284-K298 PolarHBondContact OD1-O 3.04Å; N284-P300 WeakPolarHBondContact O-CG 3.39Å
285	E	89.6	Confident	85.8	Confident	111 Å²	111	65.3 Å²	65.3	52%	0.519	35%	0.345	S	S	.	.	S	Bend	trans	-59.4	-34.8	176.9	-173.4	-172	160.1	0	0	113	S272 F273 L281	S272-E285 CarbonylContact C-O 3.48Å; S272-E285 WeakPolarHBondContact CA-O 3.39Å; F273-E285 PolarHBondContact N-O 2.81Å; L281-E285 HydrophobicContact CD2-CB 3.99Å; L281-E285 HydrophobicContact CD2-CG 4.15Å
286	K	91.6	Very high	85.9	Confident	118 Å²	118	65.3 Å²	65.3	51%	0.513	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.4	179.7	-54	-171.3	179.9	174	0	110	V270 V271 S272 N284	V270-K286 HydrophobicContact CG1-CB 4.46Å; V271-K286 CarbonylContact O-C 3.56Å; V271-K286 VanDerWaalsContact O-CA 3.27Å; V271-K286 WeakPolarHBondContact O-CA 3.4Å; S272-K286 WeakPolarHBondContact OG-CG 3.04Å; N284-K286 PolarHBondContact O-N 3.03Å
287	R	91.5	Very high	86	Confident	28 Å²	28	64.1 Å²	64.1	11%	0.106	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143.5	174.1	-58.5	-175.7	74.9	-159.6	2.2	109.5	V270 V271 F273 N284 W295 S296 G297	V270-R287 WeakPolarHBondContact CA-O 3.35Å; V271-R287 PolarHBondContact N-O 2.75Å; V271-R287 PolarHBondContact O-N 3.44Å; F273-R287 HydrophobicContact CD2-CG 4.45Å; F273-R287 HydrophobicContact CE2-CB 4.06Å; F273-R287 HydrophobicContact CE2-CG 3.72Å; N284-R287 HydrophobicContact CB-CG 4.29Å; R287-W295 HydrophobicContact CB-CE3 3.84Å; R287-W295 VanDerWaalsContact CZ-CB 3.41Å; R287-W295 PolarHBondContact NH2-O 2.92Å; R287-W295 VanDerWaalsContact NH2-O 3.11Å; R287-W295 WeakPolarHBondContact O-CZ3 3.06Å; R287-S296 WeakPolarHBondContact CG-O 3.47Å; R287-S296 PolarHBondContact NE-O 2.04Å; R287-G297 PolarHBondContact NH2-O 2.83Å
288	T	91.3	Very high	86.6	Confident	52 Å²	52	64.3 Å²	64.3	32%	0.319	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.3	-178.3	-50.3	0	0	0	0	109.7	T269 V270 Q290 W295 S296	T269-T288 WeakPolarHBondContact O-CA 3.42Å; V270-T288 HydrophobicContact CG2-CG2 3.97Å; T288-Q290 PolarHBondContact O-N 2.87Å; T288-W295 VanDerWaalsContact C-CE3 3.42Å; T288-S296 PolarHBondContact N-OG 2.83Å; T288-S296 PolarHBondContact O-N 2.85Å
289	C	89.8	Confident	87.3	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-72.2	113.4	173.4	177.5	0	0	0	0	109.5	C240 G268 T269 W295	C240-C289 HydrophobicContact CB-CB 3.82Å; C240-C289 WeakPolarHBondContact CB-SG 3.45Å; C240-C289 WeakPolarHBondContact SG-CA 3.43Å; C240-C289 WeakPolarHBondContact SG-CB 3.03Å; C240-C289 CovalentContact SG-SG 2.03Å; C240-C289 PolarHBondContact SG-SG 3.34Å; G268-C289 PolarHBondContact N-O 3.03Å; T269-C289 PolarHBondContact O-N 3.37Å; C289-W295 HydrophobicContact CB-CD2 4.5Å; C289-W295 HydrophobicContact CB-CE3 4.27Å; C289-W295 HydrophobicContact CB-CH2 4.07Å; C289-W295 HydrophobicContact CB-CZ2 4.32Å; C289-W295 HydrophobicContact CB-CZ3 4.06Å
290	Q	87.4	Confident	87.5	Confident	87 Å²	87	62 Å²	62	41%	0.407	33%	0.329	S	S	.	.			trans	-86.8	166.1	-175	-66.2	179.4	-39.5	0	0	111.6	T288 N292 G293 E294	T288-Q290 PolarHBondContact O-N 2.87Å; Q290-N292 WeakPolarHBondContact CB-OD1 3.17Å; Q290-N292 PolarHBondContact O-N 3.11Å; Q290-N292 VanDerWaalsContact O-N 3.15Å; Q290-G293 PolarHBondContact O-N 3.31Å; Q290-E294 WeakPolarHBondContact CB-O 3.49Å; Q290-E294 PolarHBondContact N-O 3.5Å
291	Q	82.2	Confident	87.7	Confident	172 Å²	172	65.3 Å²	65.3	80%	0.804	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.9	-179.3	-68	-179.5	-1.7	0	0	113.6	I267 G293	I267-Q291 HydrophobicContact CG2-CG 4.08Å; Q291-G293 PolarHBondContact O-N 2.93Å
292	N	81.7	Confident	87.6	Confident	73 Å²	73	64.5 Å²	64.5	39%	0.39	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.4	176.2	65.2	-11.3	0	0	0	113.5	Q290 E294	Q290-N292 WeakPolarHBondContact CB-OD1 3.17Å; Q290-N292 PolarHBondContact O-N 3.11Å; Q290-N292 VanDerWaalsContact O-N 3.15Å; N292-E294 PolarHBondContact ND2-OE2 2.83Å; N292-E294 PolarHBondContact OD1-N 3.47Å
293	G	78.8	Confident	87.5	Confident	22 Å²	22	65 Å²	65	23%	0.227	34%	0.344	C	S	.	.	S	Bend	trans	85	8.9	-174.8	0	0	0	0	0	114.3	C240 Q290 Q291	C240-G293 PolarHBondContact SG-O 3.15Å; C240-G293 VanDerWaalsContact SG-O 3.37Å; Q290-G293 PolarHBondContact O-N 3.31Å; Q291-G293 PolarHBondContact O-N 2.93Å
294	E	87.5	Confident	87.5	Confident	128 Å²	128	66.4 Å²	66.4	60%	0.598	34%	0.337	S	S	*	.			trans	-109.7	155.4	177.1	-62.6	-174.2	157.6	0	0	112.3	Q290 N292	Q290-E294 WeakPolarHBondContact CB-O 3.49Å; Q290-E294 PolarHBondContact N-O 3.5Å; N292-E294 PolarHBondContact ND2-OE2 2.83Å; N292-E294 PolarHBondContact OD1-N 3.47Å
295	W	89.4	Confident	87.4	Confident	30 Å²	30	63.3 Å²	63.3	11%	0.114	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-85	133	175.1	-73.9	99.4	0	0	0	111.7	C240 S241 P243 A265 T269 V271 R287 T288 C289	C240-W295 HydrophobicContact CB-CD2 4.44Å; C240-W295 HydrophobicContact CB-CZ2 4.09Å; S241-W295 PolarHBondContact O-NE1 2.8Å; P243-W295 VanDerWaalsContact CD-CZ2 3.44Å; P243-W295 HydrophobicContact CG-CD2 4.2Å; P243-W295 HydrophobicContact CG-CH2 4.4Å; P243-W295 HydrophobicContact CG-CZ2 3.82Å; A265-W295 HydrophobicContact CB-CH2 3.8Å; A265-W295 HydrophobicContact CB-CZ2 3.52Å; T269-W295 HydrophobicContact CG2-CH2 4.46Å; T269-W295 WeakPolarHBondContact O-CZ3 3.42Å; V271-W295 HydrophobicContact CB-CH2 4.32Å; V271-W295 HydrophobicContact CB-CZ3 4.21Å; V271-W295 HydrophobicContact CG2-CH2 3.46Å; V271-W295 VanDerWaalsContact CG2-CH2 3.46Å; V271-W295 HydrophobicContact CG2-CZ2 4.35Å; V271-W295 HydrophobicContact CG2-CZ3 3.81Å; R287-W295 HydrophobicContact CB-CE3 3.84Å; R287-W295 VanDerWaalsContact CZ-CB 3.41Å; R287-W295 PolarHBondContact NH2-O 2.92Å; R287-W295 VanDerWaalsContact NH2-O 3.11Å; R287-W295 WeakPolarHBondContact O-CZ3 3.06Å; T288-W295 VanDerWaalsContact C-CE3 3.42Å; C289-W295 HydrophobicContact CB-CD2 4.5Å; C289-W295 HydrophobicContact CB-CE3 4.27Å; C289-W295 HydrophobicContact CB-CH2 4.07Å; C289-W295 HydrophobicContact CB-CZ2 4.32Å; C289-W295 HydrophobicContact CB-CZ3 4.06Å
296	S	91.8	Very high	87.2	Confident	28 Å²	28	58 Å²	58	20%	0.196	30%	0.297	C	S	.	.	S	Bend	trans	-58.6	140.2	175.4	69.2	0	0	0	0	112.7	R287 T288	R287-S296 WeakPolarHBondContact CG-O 3.47Å; R287-S296 PolarHBondContact NE-O 2.04Å; T288-S296 PolarHBondContact N-OG 2.83Å; T288-S296 PolarHBondContact O-N 2.85Å
297	G	87.7	Confident	87.1	Confident	50 Å²	50	60.5 Å²	60.5	52%	0.515	30%	0.303	S	S	.	.	S	Bend	trans	70.6	-168.3	171	0	0	0	0	0	114.9	R287	R287-G297 PolarHBondContact NH2-O 2.83Å
298	K	87.3	Confident	86.9	Confident	161 Å²	161	61.4 Å²	61.4	70%	0.7	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-93.8	139.6	-178.5	-63.8	-177.5	-178.6	179.1	0	111.1	N284	N284-K298 PolarHBondContact OD1-N 3.34Å; N284-K298 PolarHBondContact OD1-O 3.04Å
299	Q	85.1	Confident	86.6	Confident	69 Å²	69	59.9 Å²	59.9	32%	0.322	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-59.6	124.3	173.4	-178.4	66.5	10.6	0	0	109.7	P243 G244	P243-Q299 PolarHBondContact O-NE2 3.34Å; G244-Q299 PolarHBondContact O-NE2 2.88Å
300	P	89.1	Confident	86.4	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.013	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-75.6	152.4	-178.3	30.8	-35.5	0	0	0	112.3	F273 L281 S282 N284	F273-P300 HydrophobicContact CB-CG 3.61Å; F273-P300 HydrophobicContact CD1-CG 3.99Å; F273-P300 HydrophobicContact CD2-CG 3.5Å; F273-P300 HydrophobicContact CE2-CG 4.15Å; F273-P300 HydrophobicContact CG-CG 3.41Å; F273-P300 VanDerWaalsContact CG-CG 3.41Å; L281-P300 HydrophobicContact CD1-CB 3.68Å; L281-P300 HydrophobicContact CD1-CG 4.13Å; L281-P300 HydrophobicContact CD2-CB 4.03Å; L281-P300 HydrophobicContact CD2-CG 4.46Å; L281-P300 HydrophobicContact CG-CB 3.72Å; L281-P300 HydrophobicContact CG-CG 4.49Å; S282-P300 CarbonylContact O-C 3.51Å; S282-P300 WeakPolarHBondContact O-CA 3.4Å; N284-P300 WeakPolarHBondContact O-CG 3.39Å
301	I	89	Confident	86.2	Confident	80 Å²	80	67.6 Å²	67.6	41%	0.41	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.7	174.1	60.8	170.5	0	0	0	110.6	S282 I303	S282-I301 PolarHBondContact N-O 2.64Å; S282-I301 PolarHBondContact O-N 3.29Å; I301-I303 HydrophobicContact CD1-CG2 3.84Å; I301-I303 HydrophobicContact CG1-CG2 4.08Å
302	C	88.1	Confident	86.3	Confident	16 Å²	16	62.3 Å²	62.3	11%	0.108	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	113.3	175.7	-68.9	0	0	0	0	110.4	V247 C275 Y279	V247-C302 WeakPolarHBondContact O-CB 3.23Å; C275-C302 WeakPolarHBondContact CA-SG 3.4Å; C275-C302 HydrophobicContact CB-CB 3.87Å; C275-C302 WeakPolarHBondContact CB-SG 3.18Å; C275-C302 WeakPolarHBondContact SG-CA 3.46Å; C275-C302 WeakPolarHBondContact SG-CB 3.27Å; C275-C302 CovalentContact SG-SG 2.04Å; C275-C302 PolarHBondContact SG-SG 3.15Å; Y279-C302 HydrophobicContact CD1-CB 4.1Å; Y279-C302 WeakPolarHBondContact CD1-O 3.43Å; Y279-C302 HydrophobicContact CG-CB 4.38Å
303	I	85.4	Confident	86.4	Confident	19 Å²	19	66 Å²	66	10%	0.097	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.2	-179.7	57.5	-179.3	0	0	0	111	Y279 V280 I301 A305 G357 L359	Y279-I303 CarbonylContact C-O 3.58Å; Y279-I303 WeakPolarHBondContact CA-O 3.36Å; V280-I303 HydrophobicContact CG1-CD1 4.47Å; V280-I303 HydrophobicContact CG1-CG1 3.72Å; V280-I303 WeakPolarHBondContact CG1-O 3.44Å; V280-I303 PolarHBondContact N-O 2.9Å; V280-I303 PolarHBondContact O-N 2.99Å; I301-I303 HydrophobicContact CD1-CG2 3.84Å; I301-I303 HydrophobicContact CG1-CG2 4.08Å; I303-A305 PolarHBondContact O-N 3.49Å; I303-G357 WeakPolarHBondContact CD1-O 3.01Å; I303-L359 HydrophobicContact CD1-CD2 3.27Å; I303-L359 HydrophobicContact CD1-CG 3.83Å; I303-L359 HydrophobicContact CG1-CD2 3.8Å
304	K	84.2	Confident	86.7	Confident	76 Å²	76	67 Å²	67	33%	0.33	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126.8	172.9	-74.5	-166.4	-178.9	177.1	0	109.9	Y279 L366 R391	Y279-K304 HydrophobicContact CD1-CG 3.69Å; Y279-K304 HydrophobicContact CD2-CG 4.29Å; Y279-K304 HydrophobicContact CE1-CD 4.31Å; Y279-K304 HydrophobicContact CE1-CG 3.5Å; Y279-K304 VanDerWaalsContact CE1-CG 3.5Å; Y279-K304 HydrophobicContact CE2-CD 4.42Å; Y279-K304 VanDerWaalsContact CE2-CE 3.44Å; Y279-K304 HydrophobicContact CE2-CG 4.08Å; Y279-K304 HydrophobicContact CG-CG 4.11Å; Y279-K304 WeakPolarHBondContact OH-CE 3.31Å; K304-L366 HydrophobicContact CB-CD1 4.02Å; K304-L366 HydrophobicContact CB-CD2 4.22Å; K304-L366 HydrophobicContact CB-CG 4.36Å; K304-R391 WeakPolarHBondContact CD-O 3.35Å
305	A	86.2	Confident	86.6	Confident	6 Å²	6	61.2 Å²	61.2	5%	0.05	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161.8	178.1	0	0	0	0	0	110.6	V280 I303 L359 Y363 Q364	V280-A305 HydrophobicContact CG1-CB 3.65Å; I303-A305 PolarHBondContact O-N 3.49Å; A305-L359 HydrophobicContact CB-CD1 4.15Å; A305-L359 HydrophobicContact CB-CD2 3.48Å; A305-L359 VanDerWaalsContact CB-CD2 3.48Å; A305-Y363 HydrophobicContact CB-CD1 4.08Å; A305-Q364 WeakPolarHBondContact CB-O 3.23Å
306	C	86.8	Confident	86.6	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	128.8	171.8	-59.1	0	0	0	0	110	E308 Y363 Q364 C389 W395	C306-E308 PolarHBondContact O-N 2.86Å; C306-Y363 WeakPolarHBondContact O-CA 3.43Å; C306-Q364 PolarHBondContact N-O 3.49Å; C306-Q364 PolarHBondContact O-N 3.48Å; C306-C389 HydrophobicContact CB-CB 3.73Å; C306-C389 WeakPolarHBondContact CB-SG 3.36Å; C306-C389 PolarHBondContact N-SG 3.12Å; C306-C389 VanDerWaalsContact N-SG 3.4Å; C306-C389 WeakPolarHBondContact SG-CA 3.43Å; C306-C389 WeakPolarHBondContact SG-CB 3.24Å; C306-C389 CovalentContact SG-SG 2.02Å; C306-C389 PolarHBondContact SG-SG 2.78Å; C306-W395 HydrophobicContact CB-CD2 4.24Å; C306-W395 HydrophobicContact CB-CG 4.48Å; C306-W395 HydrophobicContact CB-CZ2 3.8Å
307	R	88.6	Confident	86.5	Confident	169 Å²	169	69.6 Å²	69.6	64%	0.638	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	135.1	169	-171.6	177.2	-173	174.3	5.4	109.5	Y363 W395	R307-Y363 HydrophobicContact CB-CD1 4.26Å; R307-Y363 HydrophobicContact CB-CE1 3.88Å; R307-Y363 HydrophobicContact CG-CE1 4.37Å; R307-W395 PolarHBondContact O-NE1 3.49Å
308	E	86.9	Confident	86.5	Confident	48 Å²	48	74.1 Å²	74.1	22%	0.224	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-55.6	129.6	177.2	-77.1	-172.1	180	0	0	111.1	C306 K310 R317 G362 Q364	C306-E308 PolarHBondContact O-N 2.86Å; E308-K310 PolarHBondContact O-N 3.37Å; E308-R317 IonicContact OE2-CZ 3.77Å; E308-R317 IonicContact OE2-NH1 2.66Å; E308-R317 PolarHBondContact OE2-NH1 2.82Å; E308-R317 IonicContact OE2-NH2 2.69Å; E308-R317 PolarHBondContact OE2-NH2 2.99Å; E308-G362 WeakPolarHBondContact CB-O 3.46Å; E308-G362 WeakPolarHBondContact CG-O 3.3Å; E308-G362 PolarHBondContact N-O 3.15Å; E308-Q364 HydrophobicContact CG-CG 3.86Å; E308-Q364 PolarHBondContact OE1-NE2 2.93Å
309	P	84.9	Confident	86.4	Confident	19 Å²	19	70.2 Å²	70.2	12%	0.123	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-65	135.5	178.7	-19.9	33.9	0	0	0	110.1	I311 L370 W395	P309-I311 PolarHBondContact O-N 2.9Å; P309-L370 HydrophobicContact CG-CD1 4.26Å; P309-W395 HydrophobicContact CG-CD2 4.05Å; P309-W395 HydrophobicContact CG-CG 3.93Å
310	K	85.8	Confident	86.2	Confident	200 Å²	200	68.6 Å²	68.6	87%	0.87	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-64.6	126.1	163.7	-65.5	-172.3	177.8	-173.3	0	108.1	E308	E308-K310 PolarHBondContact O-N 3.37Å
311	I	84.6	Confident	85.1	Confident	51 Å²	51	73.6 Å²	73.6	26%	0.262	35%	0.352	S	S	.	.			trans	-119.1	153.3	177.4	57.7	171.6	0	0	0	109.5	P309 V315 R317 Y372	P309-I311 PolarHBondContact O-N 2.9Å; I311-V315 HydrophobicContact CB-CB 4.29Å; I311-V315 HydrophobicContact CB-CG1 4.5Å; I311-V315 WeakPolarHBondContact CD1-O 3.38Å; I311-R317 HydrophobicContact CD1-CB 3.93Å; I311-R317 HydrophobicContact CD1-CG 3.75Å; I311-Y372 HydrophobicContact CG2-CD1 4.35Å; I311-Y372 HydrophobicContact CG2-CE1 3.82Å
312	S	83.4	Confident	83.8	Confident	61 Å²	61	74 Å²	74	43%	0.427	35%	0.354	S	S	.	.			trans	-69.2	151	170.6	171.2	0	0	0	0	110.1	L314 V315	S312-L314 PolarHBondContact O-N 2.96Å; S312-L314 PolarHBondContact OG-N 3.43Å; S312-V315 WeakPolarHBondContact O-CB 3.16Å; S312-V315 PolarHBondContact O-N 3.09Å
313	D	83.6	Confident	82.4	Confident	151 Å²	151	79 Å²	79	81%	0.807	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.1	175.7	-58.9	-34.8	0	0	0	113	V315 I375	D313-V315 VanDerWaalsContact C-N 3.3Å; D313-I375 WeakPolarHBondContact O-CD1 3.37Å
314	L	84.3	Confident	81	Confident	43 Å²	43	84.8 Å²	84.8	23%	0.225	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-8.7	176.3	-62.8	175.2	0	0	0	113.9	S312 C374 I375 Y379 C402	S312-L314 PolarHBondContact O-N 2.96Å; S312-L314 PolarHBondContact OG-N 3.43Å; L314-C374 WeakPolarHBondContact O-CA 3.34Å; L314-I375 PolarHBondContact O-N 2.91Å; L314-Y379 HydrophobicContact CD1-CD1 4.03Å; L314-Y379 HydrophobicContact CD1-CE1 3.56Å; L314-Y379 HydrophobicContact CD2-CE1 4.25Å; L314-Y379 HydrophobicContact CD2-CE2 4.15Å; L314-Y379 HydrophobicContact CG-CE1 4.49Å; L314-C402 HydrophobicContact CB-CB 3.91Å
315	V	87.1	Confident	79.6	Confident	7 Å²	7	85.8 Å²	85.8	4%	0.042	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	123.5	-176.5	-177.7	0	0	0	0	108.9	I311 S312 D313 Y372 P400 C402	I311-V315 HydrophobicContact CB-CB 4.29Å; I311-V315 HydrophobicContact CB-CG1 4.5Å; I311-V315 WeakPolarHBondContact CD1-O 3.38Å; S312-V315 WeakPolarHBondContact O-CB 3.16Å; S312-V315 PolarHBondContact O-N 3.09Å; D313-V315 VanDerWaalsContact C-N 3.3Å; V315-Y372 HydrophobicContact CG1-CD1 3.79Å; V315-Y372 HydrophobicContact CG1-CG 4.43Å; V315-P400 HydrophobicContact CG1-CG 4.43Å; V315-C402 HydrophobicContact CG2-CB 4.36Å
316	R	88.4	Confident	78	Confident	129 Å²	129	90.1 Å²	90.1	49%	0.487	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133	168.1	-174.9	176.4	-74.4	171.9	-0.1	109.3	Y372 E373 I375	R316-Y372 WeakPolarHBondContact O-CA 3.43Å; R316-E373 HydrophobicContact CB-CG 3.79Å; R316-E373 WeakPolarHBondContact CD-OE1 3.31Å; R316-E373 HydrophobicContact CG-CG 4.26Å; R316-E373 PolarHBondContact N-O 3.07Å; R316-E373 PolarHBondContact O-N 3.2Å; R316-I375 HydrophobicContact CB-CG1 3.95Å
317	R	89.6	Confident	76.5	Confident	104 Å²	104	99 Å²	99	39%	0.392	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.7	175.4	66.6	176.8	178.8	176.4	13.8	111.2	E308 I311 Q371 Y372	E308-R317 IonicContact OE2-CZ 3.77Å; E308-R317 IonicContact OE2-NH1 2.66Å; E308-R317 PolarHBondContact OE2-NH1 2.82Å; E308-R317 IonicContact OE2-NH2 2.69Å; E308-R317 PolarHBondContact OE2-NH2 2.99Å; I311-R317 HydrophobicContact CD1-CB 3.93Å; I311-R317 HydrophobicContact CD1-CG 3.75Å; R317-Q371 CarbonylContact C-O 3.45Å; R317-Q371 WeakPolarHBondContact CA-O 2.81Å; R317-Y372 HydrophobicContact CB-CD1 4.07Å; R317-Y372 HydrophobicContact CB-CE1 4.05Å
318	R	88.1	Confident	74.9	Confident	145 Å²	145	97 Å²	97	55%	0.547	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	130.1	170.7	-172.1	-178.7	-64.2	-177.9	2.7	109.5	L320 L370 Q371	R318-L320 HydrophobicContact CG-CD2 4.49Å; R318-L370 WeakPolarHBondContact O-CA 3.37Å; R318-Q371 PolarHBondContact N-O 3.19Å; R318-Q371 PolarHBondContact O-N 3.15Å
319	V	84.8	Confident	73.6	Confident	79 Å²	79	97.6 Å²	97.6	48%	0.479	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	123.6	172	-172.8	0	0	0	0	108	T368 L370	V319-T368 HydrophobicContact CG1-CG2 3.69Å; V319-L370 HydrophobicContact CB-CD2 4.17Å; V319-L370 HydrophobicContact CG1-CD2 4.26Å; V319-L370 HydrophobicContact CG2-CD2 3.7Å
320	L	80.4	Confident	72.8	Confident	36 Å²	36	101.9 Å²	101.9	19%	0.188	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	143.1	173.9	-63.4	179.2	0	0	0	109.3	R318 Q369 Q371	R318-L320 HydrophobicContact CG-CD2 4.49Å; L320-Q369 HydrophobicContact CB-CB 4.15Å; L320-Q369 PolarHBondContact N-O 3.42Å; L320-Q371 HydrophobicContact CD1-CB 3.88Å; L320-Q371 HydrophobicContact CG-CB 4.17Å
321	P	65.9	Low	71.9	Confident	107 Å²	107	97.3 Å²	97.3	70%	0.695	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-60.5	155.2	175.9	26.8	-33.9	0	0	0	110.6	Q323	P321-Q323 PolarHBondContact O-N 3.05Å
322	M	62	Low	70.8	Confident	89 Å²	89	100.4 Å²	100.4	44%	0.438	51%	0.511	S	S	.	.			trans	-57.7	111.9	176.4	-67.4	-171.7	-174.8	0	0	109.8	H365 L366 H367	M322-H365 HydrophobicContact CE-CB 3.59Å; M322-L366 WeakPolarHBondContact CE-O 3.47Å; M322-H367 HydrophobicContact SD-CB 4.42Å
323	Q	60.2	Low	69.9	Low	121 Å²	121	102.1 Å²	102.1	57%	0.565	51%	0.512	S	S	*	.			trans	-107.9	118.1	174.1	-129.6	178.5	-4.1	0	0	107.8	P321 Q325	P321-Q323 PolarHBondContact O-N 3.05Å; Q323-Q325 PolarHBondContact O-N 3.19Å
324	V	55.4	Low	68.9	Low	140 Å²	140	100.5 Å²	100.5	85%	0.848	50%	0.503	S	S	*	.			trans	-63.2	109.3	169.4	-178.6	0	0	0	0	106.3	S326	V324-S326 PolarHBondContact O-N 3.26Å; V324-S326 VanDerWaalsContact O-N 3.08Å
325	Q	54.4	Low	67.9	Low	96 Å²	96	104.6 Å²	104.6	45%	0.449	52%	0.516	S	S	.	.			trans	-72.5	102.9	173.5	-68.4	-166.6	-19.3	0	0	107.4	Q323 R327	Q323-Q325 PolarHBondContact O-N 3.19Å; Q325-R327 PolarHBondContact O-N 3.13Å
326	S	53.4	Low	66.7	Low	98 Å²	98	107.9 Å²	107.9	69%	0.685	54%	0.54	S	S	*	.			trans	-68.4	91.3	163.6	51.2	0	0	0	0	107.5	V324 E328	V324-S326 PolarHBondContact O-N 3.26Å; V324-S326 VanDerWaalsContact O-N 3.08Å; S326-E328 PolarHBondContact O-N 2.85Å; S326-E328 VanDerWaalsContact O-N 3.15Å
327	R	54.5	Low	65.5	Low	186 Å²	186	105.6 Å²	105.6	70%	0.702	55%	0.549	S	S	*	.			trans	-80.9	89.4	161.6	-67.8	-175.1	-177.5	-165.7	-1.7	105.4	Q325 T329	Q325-R327 PolarHBondContact O-N 3.13Å; R327-T329 PolarHBondContact O-N 2.61Å
328	E	54.8	Low	64.1	Low	126 Å²	126	104.2 Å²	104.2	59%	0.589	56%	0.56	S	S	*	*			trans	-63.3	85.2	168.2	-75.7	-174.8	-164.4	0	0	108.1	S326 Q333	S326-E328 PolarHBondContact O-N 2.85Å; S326-E328 VanDerWaalsContact O-N 3.15Å; E328-Q333 HydrophobicContact CB-CG 3.78Å; E328-Q333 HydrophobicContact CG-CG 4.32Å; E328-Q333 PolarHBondContact OE2-NE2 3.12Å
329	T	60.8	Low	62.6	Low	61 Å²	61	104.6 Å²	104.6	37%	0.374	57%	0.565	S	S	.	*			trans	-64.5	151.1	166	58.1	0	0	0	0	108.1	R327 L331 H332 Q333	R327-T329 PolarHBondContact O-N 2.61Å; T329-L331 PolarHBondContact O-N 3.21Å; T329-H332 WeakPolarHBondContact O-CA 3.36Å; T329-H332 WeakPolarHBondContact O-CB 3.43Å; T329-H332 PolarHBondContact O-N 3.15Å; T329-H332 WeakPolarHBondContact OG1-CB 3.49Å; T329-H332 PolarHBondContact OG1-N 3.14Å; T329-H332 VanDerWaalsContact OG1-N 3.09Å; T329-H332 PolarHBondContact OG1-ND1 3Å; T329-Q333 PolarHBondContact O-N 3.16Å
330	P	68.1	Low	61	Low	110 Å²	110	105.7 Å²	105.7	71%	0.714	58%	0.576	S	S	*	*	H	α-helix	trans	-50.2	-35.3	175.3	-27.9	34.6	0	0	0	112.5	Q333 L334	P330-Q333 PolarHBondContact O-N 3.45Å; P330-L334 WeakPolarHBondContact O-CB 3.49Å; P330-L334 PolarHBondContact O-N 2.75Å
331	L	65.7	Low	59.4	Low	103 Å²	103	113.9 Å²	113.9	54%	0.539	61%	0.611	S	S	.	*	H	α-helix	trans	-66.6	-43.1	174.1	-165.6	71.5	0	0	0	113.1	T329 L334 Y335	T329-L331 PolarHBondContact O-N 3.21Å; L331-L334 WeakPolarHBondContact O-CB 3.43Å; L331-L334 PolarHBondContact O-N 3.34Å; L331-Y335 HydrophobicContact CD1-CD2 4.22Å; L331-Y335 HydrophobicContact CD1-CE2 3.66Å; L331-Y335 HydrophobicContact CD2-CE2 4.06Å; L331-Y335 HydrophobicContact CG-CD2 3.83Å; L331-Y335 HydrophobicContact CG-CE2 3.56Å; L331-Y335 WeakPolarHBondContact O-CD2 3.25Å; L331-Y335 PolarHBondContact O-N 2.84Å
332	H	62.1	Low	58.4	Low	116 Å²	116	117 Å²	117	54%	0.537	62%	0.616	S	S	.	*	H	α-helix	trans	-61.3	-43.3	172.7	-104.9	102.3	0	0	0	111.4	T329 L334 Y335 S336	T329-H332 WeakPolarHBondContact O-CA 3.36Å; T329-H332 WeakPolarHBondContact O-CB 3.43Å; T329-H332 PolarHBondContact O-N 3.15Å; T329-H332 WeakPolarHBondContact OG1-CB 3.49Å; T329-H332 PolarHBondContact OG1-N 3.14Å; T329-H332 VanDerWaalsContact OG1-N 3.09Å; T329-H332 PolarHBondContact OG1-ND1 3Å; H332-L334 VanDerWaalsContact C-N 3.33Å; H332-L334 PolarHBondContact O-N 3.48Å; H332-Y335 PolarHBondContact O-N 3.47Å; H332-S336 VanDerWaalsContact O-CB 3.29Å; H332-S336 WeakPolarHBondContact O-CB 3.44Å; H332-S336 PolarHBondContact O-N 3.34Å; H332-S336 PolarHBondContact O-OG 3.39Å
333	Q	63.6	Low	57.4	Low	97 Å²	97	122 Å²	122	45%	0.453	64%	0.635	S	S	.	*	H	α-helix	trans	-63.8	-40.1	176.8	-68.5	-178.5	-25.1	0	0	111.5	E328 T329 P330 S336 A337	E328-Q333 HydrophobicContact CB-CG 3.78Å; E328-Q333 HydrophobicContact CG-CG 4.32Å; E328-Q333 PolarHBondContact OE2-NE2 3.12Å; T329-Q333 PolarHBondContact O-N 3.16Å; P330-Q333 PolarHBondContact O-N 3.45Å; Q333-S336 PolarHBondContact O-N 2.8Å; Q333-A337 VanDerWaalsContact O-CB 3.28Å; Q333-A337 WeakPolarHBondContact O-CB 3.44Å; Q333-A337 PolarHBondContact O-N 3.5Å
334	L	64.3	Low	56.3	Low	117 Å²	117	123 Å²	123	61%	0.613	64%	0.644	S	S	*	*	H	α-helix	trans	-62.2	-47.5	176	-163.8	86.1	0	0	0	112	P330 L331 H332 A337 A338	P330-L334 WeakPolarHBondContact O-CB 3.49Å; P330-L334 PolarHBondContact O-N 2.75Å; L331-L334 WeakPolarHBondContact O-CB 3.43Å; L331-L334 PolarHBondContact O-N 3.34Å; H332-L334 VanDerWaalsContact C-N 3.33Å; H332-L334 PolarHBondContact O-N 3.48Å; L334-A337 PolarHBondContact O-N 2.88Å; L334-A338 VanDerWaalsContact O-CB 3.32Å; L334-A338 WeakPolarHBondContact O-CB 3.47Å; L334-A338 PolarHBondContact O-N 2.02Å
335	Y	62.3	Low	55.5	Low	129 Å²	129	125 Å²	125	51%	0.506	64%	0.644	S	S	.	*	H	α-helix	trans	-68.8	-40.2	177.7	-78	-64.6	0	0	0	112.4	L331 H332 A337 A338 F339	L331-Y335 HydrophobicContact CD1-CD2 4.22Å; L331-Y335 HydrophobicContact CD1-CE2 3.66Å; L331-Y335 HydrophobicContact CD2-CE2 4.06Å; L331-Y335 HydrophobicContact CG-CD2 3.83Å; L331-Y335 HydrophobicContact CG-CE2 3.56Å; L331-Y335 WeakPolarHBondContact O-CD2 3.25Å; L331-Y335 PolarHBondContact O-N 2.84Å; H332-Y335 PolarHBondContact O-N 3.47Å; Y335-A337 VanDerWaalsContact C-N 3.3Å; Y335-A337 PolarHBondContact O-N 3.18Å; Y335-A338 PolarHBondContact O-N 3.4Å; Y335-F339 HydrophobicContact CD1-CD2 4.14Å; Y335-F339 AromaticContact CD1-CE2 3.77Å; Y335-F339 HydrophobicContact CD1-CE2 3.77Å; Y335-F339 HydrophobicContact CE1-CE2 4.32Å; Y335-F339 WeakPolarHBondContact O-CB 3.29Å; Y335-F339 WeakPolarHBondContact O-CD2 3.33Å; Y335-F339 PolarHBondContact O-N 3.31Å
336	S	62.1	Low	54.5	Low	77 Å²	77	124.6 Å²	124.6	54%	0.538	65%	0.651	S	S	.	*	H	α-helix	trans	-63.6	-35.9	175	-65.8	0	0	0	0	112.1	H332 Q333 S340	H332-S336 VanDerWaalsContact O-CB 3.29Å; H332-S336 WeakPolarHBondContact O-CB 3.44Å; H332-S336 PolarHBondContact O-N 3.34Å; H332-S336 PolarHBondContact O-OG 3.39Å; Q333-S336 PolarHBondContact O-N 2.8Å; S336-S340 WeakPolarHBondContact O-CB 3.43Å
337	A	62.3	Low	53.5	Low	81 Å²	81	123.6 Å²	123.6	67%	0.669	65%	0.649	S	S	*	*	H	α-helix	trans	-72	-38.1	174.1	0	0	0	0	0	112.8	Q333 L334 Y335	Q333-A337 VanDerWaalsContact O-CB 3.28Å; Q333-A337 WeakPolarHBondContact O-CB 3.44Å; Q333-A337 PolarHBondContact O-N 3.5Å; L334-A337 PolarHBondContact O-N 2.88Å; Y335-A337 VanDerWaalsContact C-N 3.3Å; Y335-A337 PolarHBondContact O-N 3.18Å
338	A	60.5	Low	52.4	Low	75 Å²	75	120.6 Å²	120.6	62%	0.62	65%	0.654	S	S	*	*	H	α-helix	trans	-73.9	-30.1	-178.2	0	0	0	0	0	113.9	L334 Y335	L334-A338 VanDerWaalsContact O-CB 3.32Å; L334-A338 WeakPolarHBondContact O-CB 3.47Å; L334-A338 PolarHBondContact O-N 2.02Å; Y335-A338 PolarHBondContact O-N 3.4Å
339	F	56.8	Low	51.4	Low	152 Å²	152	120.9 Å²	120.9	67%	0.667	66%	0.664	S	S	*	*	S	Bend	trans	-103.8	4.4	-173.9	-74.7	-88.6	0	0	0	114.7	Y335 K341	Y335-F339 HydrophobicContact CD1-CD2 4.14Å; Y335-F339 AromaticContact CD1-CE2 3.77Å; Y335-F339 HydrophobicContact CD1-CE2 3.77Å; Y335-F339 HydrophobicContact CE1-CE2 4.32Å; Y335-F339 WeakPolarHBondContact O-CB 3.29Å; Y335-F339 WeakPolarHBondContact O-CD2 3.33Å; Y335-F339 PolarHBondContact O-N 3.31Å; F339-K341 PolarHBondContact O-N 2.95Å
340	S	51.7	Low	50.2	Low	102 Å²	102	127.3 Å²	127.3	71%	0.713	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	17.3	-175.4	-163.8	0	0	0	0	116.1	S336	S336-S340 WeakPolarHBondContact O-CB 3.43Å
341	K	47.5	Very low	48.5	Very low	209 Å²	209	131 Å²	131	91%	0.909	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	6.4	173.8	-86.7	-168.4	179.7	-179.2	0	115.9	F339	F339-K341 PolarHBondContact O-N 2.95Å
342	Q	44.1	Very low	46.9	Very low	172 Å²	172	130.9 Å²	130.9	80%	0.804	70%	0.697	S	S	*	*	S	Bend	trans	-115.2	98.4	161.7	-80.9	-177.8	-13.9	0	0	109.4	L344	Q342-L344 PolarHBondContact O-N 3.31Å
343	K	41.8	Very low	45.9	Very low	193 Å²	193	130.2 Å²	130.2	84%	0.839	71%	0.712	S	S	*	*			trans	-60.5	86.2	170.3	-166.8	179.8	-170.9	178.9	0	108.2	Q345	K343-Q345 PolarHBondContact O-N 2.74Å
344	L	36	Very low	45.1	Very low	144 Å²	144	129.8 Å²	129.8	75%	0.754	71%	0.712	S	S	*	*			trans	-68.1	100.6	165.2	-143.9	88.6	0	0	0	106.1	Q342 S346	Q342-L344 PolarHBondContact O-N 3.31Å; L344-S346 PolarHBondContact O-N 2.91Å
345	Q	38	Very low	44	Very low	182 Å²	182	129.8 Å²	129.8	85%	0.85	72%	0.719	S	S	*	*			trans	-62.1	81.7	162.2	-80.4	177.5	-22.2	0	0	107.6	K343	K343-Q345 PolarHBondContact O-N 2.74Å
346	S	34.4	Very low	43.7	Very low	86 Å²	86	127 Å²	127	60%	0.601	71%	0.71	S	S	*	*			trans	-106.2	120.4	160.6	60.1	0	0	0	0	106.3	L344	L344-S346 PolarHBondContact O-N 2.91Å
347	A	31.2	Very low	43.5	Very low	77 Å²	77	124.4 Å²	124.4	64%	0.636	70%	0.695	S	S	*	*			trans	-41.4	152.4	168.4	0	0	0	0	0	110.5	T349	A347-T349 PolarHBondContact O-N 2.92Å
348	P	33.2	Very low	43.9	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	70%	0.699	S	S	*	*			trans	-52.2	113.6	169.1	23.6	-30.5	0	0	0	105.6	K350	P348-K350 PolarHBondContact O-N 3.46Å
349	T	33.8	Very low	44.7	Very low	132 Å²	132	125.2 Å²	125.2	81%	0.81	68%	0.677	S	S	*	*			trans	-57	103.7	174.1	23.5	0	0	0	0	103.8	A347 K351	A347-T349 PolarHBondContact O-N 2.92Å; T349-K351 PolarHBondContact O-N 3.28Å
350	K	35.3	Very low	45.8	Very low	195 Å²	195	120.2 Å²	120.2	85%	0.848	66%	0.66	S	S	*	*			trans	-40.7	124.4	164.9	-87.9	-179.9	174.5	177.2	0	104	P348	P348-K350 PolarHBondContact O-N 3.46Å
351	K	32.2	Very low	47.2	Very low	189 Å²	189	124.5 Å²	124.5	82%	0.822	67%	0.671	S	S	*	*			trans	-27.4	120.6	172.2	-74.2	173.9	176.3	174.4	0	106.7	T349 A353	T349-K351 PolarHBondContact O-N 3.28Å; K351-A353 PolarHBondContact O-N 2.78Å
352	P	32.1	Very low	49	Very low	100 Å²	100	116 Å²	116	65%	0.649	64%	0.643	S	S	*	*			trans	-52.3	115.3	178.9	20.6	-29.9	0	0	0	105.1	L354	P352-L354 HydrophobicContact CB-CG 4.21Å; P352-L354 HydrophobicContact CG-CD1 4.16Å; P352-L354 HydrophobicContact CG-CG 4.39Å; P352-L354 PolarHBondContact O-N 2.79Å
353	A	40.8	Very low	51	Low	101 Å²	101	111.3 Å²	111.3	84%	0.835	62%	0.618	S	S	*	*			trans	-68.8	74.6	170	0	0	0	0	0	103.8	K351 P355	K351-A353 PolarHBondContact O-N 2.78Å; A353-P355 WeakPolarHBondContact O-CD 2.95Å
354	L	46.5	Very low	53.1	Low	88 Å²	88	103.7 Å²	103.7	46%	0.461	59%	0.586	S	S	.	*			trans	-58.9	122.9	174.4	-79.3	148.8	0	0	0	104	P352 F356	P352-L354 HydrophobicContact CB-CG 4.21Å; P352-L354 HydrophobicContact CG-CD1 4.16Å; P352-L354 HydrophobicContact CG-CG 4.39Å; P352-L354 PolarHBondContact O-N 2.79Å; L354-F356 HydrophobicContact CB-CD1 4.42Å; L354-F356 HydrophobicContact CB-CD2 3.45Å; L354-F356 VanDerWaalsContact CB-CD2 3.45Å; L354-F356 HydrophobicContact CB-CE1 4.14Å; L354-F356 HydrophobicContact CB-CE2 3.11Å; L354-F356 HydrophobicContact CB-CG 4.12Å; L354-F356 HydrophobicContact CB-CZ 3.5Å; L354-F356 HydrophobicContact CD1-CE2 3.47Å; L354-F356 VanDerWaalsContact CD1-CE2 3.47Å; L354-F356 HydrophobicContact CD1-CZ 3.58Å; L354-F356 HydrophobicContact CD2-CE1 4.41Å; L354-F356 HydrophobicContact CD2-CE2 4.35Å; L354-F356 HydrophobicContact CD2-CZ 3.9Å; L354-F356 HydrophobicContact CG-CE2 3.77Å; L354-F356 HydrophobicContact CG-CZ 3.83Å; L354-F356 PolarHBondContact O-N 2.92Å
355	P	42.1	Very low	55.3	Low	118 Å²	118	99.1 Å²	99.1	77%	0.766	56%	0.56	S	S	*	*			trans	-75.9	72.2	-179.3	32.4	-32.2	0	0	0	106.3	A353 G357	A353-P355 WeakPolarHBondContact O-CD 2.95Å; P355-G357 PolarHBondContact O-N 3.33Å
356	F	55.3	Low	57.5	Low	71 Å²	71	91.6 Å²	91.6	31%	0.311	53%	0.526	S	S	.	.			trans	-83.1	107.4	172.7	-61.8	-60.1	0	0	0	106	L354 H365	L354-F356 HydrophobicContact CB-CD1 4.42Å; L354-F356 HydrophobicContact CB-CD2 3.45Å; L354-F356 VanDerWaalsContact CB-CD2 3.45Å; L354-F356 HydrophobicContact CB-CE1 4.14Å; L354-F356 HydrophobicContact CB-CE2 3.11Å; L354-F356 HydrophobicContact CB-CG 4.12Å; L354-F356 HydrophobicContact CB-CZ 3.5Å; L354-F356 HydrophobicContact CD1-CE2 3.47Å; L354-F356 VanDerWaalsContact CD1-CE2 3.47Å; L354-F356 HydrophobicContact CD1-CZ 3.58Å; L354-F356 HydrophobicContact CD2-CE1 4.41Å; L354-F356 HydrophobicContact CD2-CE2 4.35Å; L354-F356 HydrophobicContact CD2-CZ 3.9Å; L354-F356 HydrophobicContact CG-CE2 3.77Å; L354-F356 HydrophobicContact CG-CZ 3.83Å; L354-F356 PolarHBondContact O-N 2.92Å; F356-H365 WeakPolarHBondContact CB-CE1 3.37Å; F356-H365 AromaticContact CD1-ND1 3.87Å; F356-H365 AromaticContact CD2-ND1 3.76Å; F356-H365 AromaticContact CG-CE1 3.74Å; F356-H365 AromaticContact CG-ND1 3.48Å; F356-H365 WeakPolarHBondContact CG-ND1 3.47Å
357	G	57.7	Low	59.7	Low	22 Å²	22	91.4 Å²	91.4	23%	0.227	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-48.6	149.7	161.1	0	0	0	0	0	109.9	I303 P355 L359	I303-G357 WeakPolarHBondContact CD1-O 3.01Å; P355-G357 PolarHBondContact O-N 3.33Å; G357-L359 PolarHBondContact O-N 3.27Å
358	D	70.7	Confident	62.3	Low	139 Å²	139	88.2 Å²	88.2	74%	0.743	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-54.4	123	-175.8	-61.3	-47.7	0	0	0	110.3	S282	S282-D358 VanDerWaalsContact CB-O 3.31Å; S282-D358 WeakPolarHBondContact CB-O 3.41Å; S282-D358 PolarHBondContact OG-N 2.89Å; S282-D358 PolarHBondContact OG-O 2.81Å
359	L	76.9	Confident	64.8	Low	33 Å²	33	82.5 Å²	82.5	17%	0.173	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-72.8	140.5	175.1	-82.1	173.7	0	0	0	109.7	V280 I303 A305 G357 H365	V280-L359 HydrophobicContact CG1-CD2 3.49Å; V280-L359 VanDerWaalsContact CG1-CD2 3.49Å; I303-L359 HydrophobicContact CD1-CD2 3.27Å; I303-L359 HydrophobicContact CD1-CG 3.83Å; I303-L359 HydrophobicContact CG1-CD2 3.8Å; A305-L359 HydrophobicContact CB-CD1 4.15Å; A305-L359 HydrophobicContact CB-CD2 3.48Å; A305-L359 VanDerWaalsContact CB-CD2 3.48Å; G357-L359 PolarHBondContact O-N 3.27Å; L359-H365 HydrophobicContact CD1-CB 4.28Å; L359-H365 WeakPolarHBondContact CD1-CE1 3.29Å; L359-H365 VanDerWaalsContact CD1-CG 3.5Å; L359-H365 VanDerWaalsContact CD1-ND1 3.33Å; L359-H365 WeakPolarHBondContact CD1-ND1 3.41Å; L359-H365 WeakPolarHBondContact CD1-NE2 3.48Å; L359-H365 VanDerWaalsContact CG-CE1 3.44Å; L359-H365 WeakPolarHBondContact CG-CE1 3.31Å
360	P	81	Confident	67.4	Low	48 Å²	48	76.4 Å²	76.4	31%	0.312	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-64.8	157.6	169.7	27.8	-32.4	0	0	0	110.7	V280 G362 Y363	V280-P360 HydrophobicContact CG2-CG 3.46Å; V280-P360 VanDerWaalsContact CG2-CG 3.46Å; P360-G362 PolarHBondContact O-N 2.91Å; P360-Y363 HydrophobicContact CG-CD2 3.88Å; P360-Y363 HydrophobicContact CG-CE2 4.35Å; P360-Y363 HydrophobicContact CG-CG 4.47Å; P360-Y363 PolarHBondContact O-N 3.4Å
361	M	80.8	Confident	70.1	Confident	191 Å²	191	70.8 Å²	70.8	94%	0.941	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	140	179.3	-66.8	-141.2	-66	0	0	111.9
362	G	84.6	Confident	72.9	Confident	30 Å²	30	61.8 Å²	61.8	31%	0.309	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	13.8	-179.3	0	0	0	0	0	114.8	E308 P360	E308-G362 WeakPolarHBondContact CB-O 3.46Å; E308-G362 WeakPolarHBondContact CG-O 3.3Å; E308-G362 PolarHBondContact N-O 3.15Å; P360-G362 PolarHBondContact O-N 2.91Å
363	Y	86.4	Confident	75.7	Confident	74 Å²	74	60.4 Å²	60.4	29%	0.29	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	150.6	171.3	-73.5	-98.7	0	0	0	111.7	V280 A305 C306 R307 P360	V280-Y363 HydrophobicContact CB-CD1 4Å; V280-Y363 HydrophobicContact CB-CE1 3.87Å; V280-Y363 HydrophobicContact CG1-CD1 4.1Å; V280-Y363 HydrophobicContact CG1-CE1 4.47Å; V280-Y363 HydrophobicContact CG1-CG 4.44Å; V280-Y363 HydrophobicContact CG2-CD1 3.95Å; V280-Y363 HydrophobicContact CG2-CD2 4.03Å; V280-Y363 HydrophobicContact CG2-CE1 3.76Å; V280-Y363 HydrophobicContact CG2-CE2 3.87Å; V280-Y363 HydrophobicContact CG2-CG 4.08Å; A305-Y363 HydrophobicContact CB-CD1 4.08Å; C306-Y363 WeakPolarHBondContact O-CA 3.43Å; R307-Y363 HydrophobicContact CB-CD1 4.26Å; R307-Y363 HydrophobicContact CB-CE1 3.88Å; R307-Y363 HydrophobicContact CG-CE1 4.37Å; P360-Y363 HydrophobicContact CG-CD2 3.88Å; P360-Y363 HydrophobicContact CG-CE2 4.35Å; P360-Y363 HydrophobicContact CG-CG 4.47Å; P360-Y363 PolarHBondContact O-N 3.4Å
364	Q	85.3	Confident	78.1	Confident	34 Å²	34	56.8 Å²	56.8	16%	0.159	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.4	179.2	-65.6	-65.3	-22.6	0	0	110.4	A305 C306 E308 T368 W395	A305-Q364 WeakPolarHBondContact CB-O 3.23Å; C306-Q364 PolarHBondContact N-O 3.49Å; C306-Q364 PolarHBondContact O-N 3.48Å; E308-Q364 HydrophobicContact CG-CG 3.86Å; E308-Q364 PolarHBondContact OE1-NE2 2.93Å; Q364-T368 HydrophobicContact CB-CG2 4.19Å; Q364-T368 HydrophobicContact CG-CG2 4.49Å; Q364-W395 HydrophobicContact CB-CH2 4.07Å; Q364-W395 HydrophobicContact CB-CZ2 3.97Å; Q364-W395 HydrophobicContact CG-CH2 4.36Å; Q364-W395 HydrophobicContact CG-CZ2 4.19Å
365	H	82.9	Confident	80.1	Confident	47 Å²	47	56.7 Å²	56.7	22%	0.218	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	158.6	177.9	-64.7	-75.6	0	0	0	112.2	M322 F356 L359 T368 C389	M322-H365 HydrophobicContact CE-CB 3.59Å; F356-H365 WeakPolarHBondContact CB-CE1 3.37Å; F356-H365 AromaticContact CD1-ND1 3.87Å; F356-H365 AromaticContact CD2-ND1 3.76Å; F356-H365 AromaticContact CG-CE1 3.74Å; F356-H365 AromaticContact CG-ND1 3.48Å; F356-H365 WeakPolarHBondContact CG-ND1 3.47Å; L359-H365 HydrophobicContact CD1-CB 4.28Å; L359-H365 WeakPolarHBondContact CD1-CE1 3.29Å; L359-H365 VanDerWaalsContact CD1-CG 3.5Å; L359-H365 VanDerWaalsContact CD1-ND1 3.33Å; L359-H365 WeakPolarHBondContact CD1-ND1 3.41Å; L359-H365 WeakPolarHBondContact CD1-NE2 3.48Å; L359-H365 VanDerWaalsContact CG-CE1 3.44Å; L359-H365 WeakPolarHBondContact CG-CE1 3.31Å; H365-T368 VanDerWaalsContact O-CB 3.24Å; H365-T368 WeakPolarHBondContact O-CB 3.43Å; H365-T368 PolarHBondContact O-N 3.2Å; H365-T368 PolarHBondContact O-OG1 2.94Å; H365-C389 WeakPolarHBondContact O-CB 3.35Å
366	L	83.6	Confident	82.2	Confident	24 Å²	24	52.5 Å²	52.5	13%	0.126	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	141.5	174.1	-61	-176.7	0	0	0	111.2	K304 M322 T368 L390	K304-L366 HydrophobicContact CB-CD1 4.02Å; K304-L366 HydrophobicContact CB-CD2 4.22Å; K304-L366 HydrophobicContact CB-CG 4.36Å; M322-L366 WeakPolarHBondContact CE-O 3.47Å; L366-T368 PolarHBondContact O-N 2.94Å; L366-L390 VanDerWaalsContact CD2-O 3.23Å; L366-L390 WeakPolarHBondContact CD2-O 3.41Å
367	H	82.1	Confident	83.6	Confident	83 Å²	83	54 Å²	54	38%	0.384	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-0.1	-177.5	-38.2	92.3	0	0	0	115.3	M322 Q369 C389	M322-H367 HydrophobicContact SD-CB 4.42Å; H367-Q369 PolarHBondContact O-N 3.36Å; H367-C389 WeakPolarHBondContact CA-O 3.5Å; H367-C389 PolarHBondContact N-O 2.77Å
368	T	84.1	Confident	85	Confident	10 Å²	10	54.5 Å²	54.5	6%	0.061	29%	0.289	C	S	.	.			trans	-57.6	137.9	165.3	-63.3	0	0	0	0	109.7	V319 Q364 H365 L366 T388 C389 W395	V319-T368 HydrophobicContact CG1-CG2 3.69Å; Q364-T368 HydrophobicContact CB-CG2 4.19Å; Q364-T368 HydrophobicContact CG-CG2 4.49Å; H365-T368 VanDerWaalsContact O-CB 3.24Å; H365-T368 WeakPolarHBondContact O-CB 3.43Å; H365-T368 PolarHBondContact O-N 3.2Å; H365-T368 PolarHBondContact O-OG1 2.94Å; L366-T368 PolarHBondContact O-N 2.94Å; T368-T388 WeakPolarHBondContact O-CA 3.45Å; T368-C389 PolarHBondContact O-N 2.96Å; T368-W395 WeakPolarHBondContact O-CZ3 3.49Å
369	Q	86.9	Confident	85.9	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.019	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136	-179.5	-75.9	160.4	-20.3	0	0	110	L320 H367 R386 R387 T388	L320-Q369 HydrophobicContact CB-CB 4.15Å; L320-Q369 PolarHBondContact N-O 3.42Å; H367-Q369 PolarHBondContact O-N 3.36Å; Q369-R386 HydrophobicContact CB-CG 4.43Å; Q369-R386 VanDerWaalsContact CD-NH2 3.32Å; Q369-R386 VanDerWaalsContact OE1-CZ 3.26Å; Q369-R387 CarbonylContact C-O 3.52Å; Q369-R387 WeakPolarHBondContact CA-O 3.4Å; Q369-T388 HydrophobicContact CG-CG2 3.89Å; Q369-T388 WeakPolarHBondContact CG-OG1 3.08Å
370	L	88.9	Confident	86.4	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.1	174.6	-60.8	-179.6	0	0	0	108.6	P309 R318 V319 Y372 R386 R387 W395	P309-L370 HydrophobicContact CG-CD1 4.26Å; R318-L370 WeakPolarHBondContact O-CA 3.37Å; V319-L370 HydrophobicContact CB-CD2 4.17Å; V319-L370 HydrophobicContact CG1-CD2 4.26Å; V319-L370 HydrophobicContact CG2-CD2 3.7Å; L370-Y372 HydrophobicContact CB-CE1 4.48Å; L370-Y372 HydrophobicContact CB-CE2 3.65Å; L370-Y372 WeakPolarHBondContact CB-OH 3.31Å; L370-Y372 WeakPolarHBondContact CD1-OH 3.34Å; L370-R386 CarbonylContact O-C 3.51Å; L370-R386 WeakPolarHBondContact O-CA 3.4Å; L370-R387 PolarHBondContact N-O 2.87Å; L370-R387 PolarHBondContact O-N 3.28Å; L370-W395 HydrophobicContact CB-CZ3 4.25Å; L370-W395 HydrophobicContact CD1-CD2 4.46Å; L370-W395 HydrophobicContact CD1-CE3 4.21Å; L370-W395 HydrophobicContact CD1-CH2 3.26Å; L370-W395 HydrophobicContact CD1-CZ2 3.51Å; L370-W395 HydrophobicContact CD1-CZ3 3.63Å; L370-W395 HydrophobicContact CD2-CH2 4.25Å; L370-W395 HydrophobicContact CG-CE3 4.44Å; L370-W395 HydrophobicContact CG-CH2 3.41Å; L370-W395 VanDerWaalsContact CG-CH2 3.41Å; L370-W395 HydrophobicContact CG-CZ2 4.18Å; L370-W395 HydrophobicContact CG-CZ3 3.55Å
371	Q	90.9	Very high	86.9	Confident	77 Å²	77	56.5 Å²	56.5	36%	0.36	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.1	171.2	-177	173.6	10.1	0	0	109.6	R317 R318 L320 S385	R317-Q371 CarbonylContact C-O 3.45Å; R317-Q371 WeakPolarHBondContact CA-O 2.81Å; R318-Q371 PolarHBondContact N-O 3.19Å; R318-Q371 PolarHBondContact O-N 3.15Å; L320-Q371 HydrophobicContact CD1-CB 3.88Å; L320-Q371 HydrophobicContact CG-CB 4.17Å; Q371-S385 WeakPolarHBondContact CA-O 3.33Å
372	Y	91.3	Very high	87.3	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.5	-176	-57.5	-88	0	0	0	111.5	I311 V315 R316 R317 L370 R381 S385 R387 P400	I311-Y372 HydrophobicContact CG2-CD1 4.35Å; I311-Y372 HydrophobicContact CG2-CE1 3.82Å; V315-Y372 HydrophobicContact CG1-CD1 3.79Å; V315-Y372 HydrophobicContact CG1-CG 4.43Å; R316-Y372 WeakPolarHBondContact O-CA 3.43Å; R317-Y372 HydrophobicContact CB-CD1 4.07Å; R317-Y372 HydrophobicContact CB-CE1 4.05Å; L370-Y372 HydrophobicContact CB-CE1 4.48Å; L370-Y372 HydrophobicContact CB-CE2 3.65Å; L370-Y372 WeakPolarHBondContact CB-OH 3.31Å; L370-Y372 WeakPolarHBondContact CD1-OH 3.34Å; Y372-R381 PolarHBondContact O-NH1 3.31Å; Y372-S385 PolarHBondContact N-O 3.46Å; Y372-R387 HydrophobicContact CD2-CG 4.3Å; Y372-R387 HydrophobicContact CE2-CB 3.88Å; Y372-R387 HydrophobicContact CE2-CG 3.65Å; Y372-P400 HydrophobicContact CD1-CB 4.45Å; Y372-P400 HydrophobicContact CD1-CG 3.52Å; Y372-P400 HydrophobicContact CD2-CG 3.88Å; Y372-P400 HydrophobicContact CE1-CG 3.86Å; Y372-P400 HydrophobicContact CE2-CG 4.23Å; Y372-P400 HydrophobicContact CG-CB 4.09Å; Y372-P400 HydrophobicContact CG-CG 3.5Å
373	E	91.8	Very high	87.5	Confident	70 Å²	70	51.6 Å²	51.6	33%	0.327	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	157	175.1	64.5	-168.4	177.8	0	0	109.9	R316	R316-E373 HydrophobicContact CB-CG 3.79Å; R316-E373 WeakPolarHBondContact CD-OE1 3.31Å; R316-E373 HydrophobicContact CG-CG 4.26Å; R316-E373 PolarHBondContact N-O 3.07Å; R316-E373 PolarHBondContact O-N 3.2Å
374	C	91.1	Very high	87.7	Confident	25 Å²	25	49.7 Å²	49.7	17%	0.169	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	143.8	172.8	-61.1	0	0	0	0	109.5	L314 S376 R380 R381 C402	L314-C374 WeakPolarHBondContact O-CA 3.34Å; C374-S376 PolarHBondContact O-N 2.89Å; C374-R380 VanDerWaalsContact SG-C 3.6Å; C374-R381 PolarHBondContact SG-N 3.37Å; C374-C402 WeakPolarHBondContact CA-SG 3.42Å; C374-C402 HydrophobicContact CB-CB 3.96Å; C374-C402 WeakPolarHBondContact CB-SG 3.17Å; C374-C402 WeakPolarHBondContact SG-CB 3.31Å; C374-C402 CovalentContact SG-SG 2.04Å; C374-C402 PolarHBondContact SG-SG 3.4Å
375	I	87.6	Confident	87.9	Confident	86 Å²	86	50.9 Å²	50.9	44%	0.441	27%	0.267	S	S	.	.	S	Bend	trans	-65.2	-30.8	-176.8	-70.5	-177.5	0	0	0	112.3	D313 L314 R316	D313-I375 WeakPolarHBondContact O-CD1 3.37Å; L314-I375 PolarHBondContact O-N 2.91Å; R316-I375 HydrophobicContact CB-CG1 3.95Å
376	S	85.3	Confident	88.2	Confident	30 Å²	30	52.3 Å²	52.3	21%	0.21	27%	0.271	C	S	.	.	S	Bend	trans	-125.8	145.9	-174.5	163.6	0	0	0	0	111.3	C374 F378 Y379	C374-S376 PolarHBondContact O-N 2.89Å; S376-F378 PolarHBondContact O-N 2.81Å; S376-F378 WeakPolarHBondContact OG-CD2 3.05Å; S376-F378 PolarHBondContact OG-N 2.78Å; S376-Y379 PolarHBondContact O-N 3.45Å
377	P	85.7	Confident	88.6	Confident	102 Å²	102	52.6 Å²	52.6	66%	0.662	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.9	177.6	29.4	-37.3	0	0	0	113.5	Y379 I405	P377-Y379 PolarHBondContact O-N 2.82Å; P377-I405 VanDerWaalsContact O-CD1 3.28Å; P377-I405 WeakPolarHBondContact O-CD1 3.24Å
378	F	86.8	Confident	88.9	Confident	33 Å²	33	49.8 Å²	49.8	15%	0.145	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-4	175.5	-53.8	-57.5	0	0	0	113.3	S376 P404 I405 E410 I532 T534	S376-F378 PolarHBondContact O-N 2.81Å; S376-F378 WeakPolarHBondContact OG-CD2 3.05Å; S376-F378 PolarHBondContact OG-N 2.78Å; F378-P404 WeakPolarHBondContact O-CA 3.48Å; F378-I405 WeakPolarHBondContact O-CG1 3.49Å; F378-I405 PolarHBondContact O-N 2.75Å; F378-E410 WeakPolarHBondContact CE1-OE1 3.5Å; F378-I532 HydrophobicContact CB-CG2 3.7Å; F378-I532 HydrophobicContact CG-CG2 4.33Å; F378-T534 HydrophobicContact CE1-CG2 4.19Å; F378-T534 HydrophobicContact CE2-CG2 4.32Å; F378-T534 HydrophobicContact CZ-CG2 3.5Å
379	Y	89.6	Confident	89	Confident	26 Å²	26	49.3 Å²	49.3	10%	0.102	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.2	179.9	-63.4	-94.9	0	0	0	111.2	L314 S376 P377 C402 I403 P404 E456 I532	L314-Y379 HydrophobicContact CD1-CD1 4.03Å; L314-Y379 HydrophobicContact CD1-CE1 3.56Å; L314-Y379 HydrophobicContact CD2-CE1 4.25Å; L314-Y379 HydrophobicContact CD2-CE2 4.15Å; L314-Y379 HydrophobicContact CG-CE1 4.49Å; S376-Y379 PolarHBondContact O-N 3.45Å; P377-Y379 PolarHBondContact O-N 2.82Å; Y379-C402 HydrophobicContact CD1-CB 4.41Å; Y379-I403 CarbonylContact C-O 3.49Å; Y379-I403 VanDerWaalsContact CA-O 3.27Å; Y379-I403 WeakPolarHBondContact CA-O 3.47Å; Y379-P404 HydrophobicContact CD1-CB 4.38Å; Y379-P404 HydrophobicContact CE1-CB 4.28Å; Y379-E456 VanDerWaalsContact CE1-OE1 3.3Å; Y379-E456 WeakPolarHBondContact CE1-OE1 3.35Å; Y379-E456 PolarHBondContact OH-OE1 2.01Å; Y379-I532 HydrophobicContact CE1-CG1 4.24Å; Y379-I532 HydrophobicContact CE2-CB 4.12Å; Y379-I532 HydrophobicContact CE2-CG2 4.49Å; Y379-I532 WeakPolarHBondContact OH-CB 3.28Å; Y379-I532 VanDerWaalsContact OH-CG1 3.32Å; Y379-I532 WeakPolarHBondContact OH-CG1 3.17Å
380	R	88.3	Confident	89	Confident	130 Å²	130	52.5 Å²	52.5	49%	0.491	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143	169.6	64.4	177.7	-177.3	170.5	0.7	110.7	C374 C402 I403 I405	C374-R380 VanDerWaalsContact SG-C 3.6Å; R380-C402 WeakPolarHBondContact O-CA 3.33Å; R380-I403 HydrophobicContact CG-CD1 4.18Å; R380-I403 HydrophobicContact CG-CG1 3.71Å; R380-I403 PolarHBondContact N-O 2.89Å; R380-I403 PolarHBondContact O-N 3.36Å; R380-I405 HydrophobicContact CB-CD1 4.29Å; R380-I405 HydrophobicContact CB-CG1 3.94Å; R380-I405 HydrophobicContact CG-CG1 4.14Å
381	R	90.9	Very high	88.7	Confident	106 Å²	106	61.1 Å²	61.1	40%	0.4	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	129.3	177.8	-175.5	-172.7	62.2	-132.9	-16.3	110.5	Y372 C374 S385 P400 S401	Y372-R381 PolarHBondContact O-NH1 3.31Å; C374-R381 PolarHBondContact SG-N 3.37Å; R381-S385 VanDerWaalsContact CZ-CA 3.48Å; R381-S385 VanDerWaalsContact NH1-CB 3.3Å; R381-P400 HydrophobicContact CG-CB 4.43Å; R381-S401 CarbonylContact C-O 3.55Å; R381-S401 WeakPolarHBondContact CA-O 3.49Å
382	L	89.8	Confident	88.3	Confident	78 Å²	78	61.4 Å²	61.4	41%	0.408	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.4	161.2	-66.8	-179.5	0	0	0	110	P400 S401 I403	L382-P400 CarbonylContact O-C 3.56Å; L382-P400 VanDerWaalsContact O-CA 3.26Å; L382-P400 WeakPolarHBondContact O-CA 3.26Å; L382-S401 PolarHBondContact N-O 3.34Å; L382-S401 PolarHBondContact O-N 3.06Å; L382-I403 HydrophobicContact CD1-CD1 3.6Å; L382-I403 HydrophobicContact CD1-CG1 3.96Å; L382-I403 HydrophobicContact CD1-CG2 3.91Å; L382-I403 HydrophobicContact CD2-CD1 4.31Å; L382-I403 HydrophobicContact CG-CD1 3.92Å; L382-I403 HydrophobicContact CG-CG1 4Å
383	G	88.7	Confident	87.9	Confident	41 Å²	41	62.1 Å²	62.1	42%	0.423	32%	0.32	S	S	.	.	S	Bend	trans	90.9	-164.9	-178.2	0	0	0	0	0	113.6
384	S	90.3	Very high	87.8	Confident	33 Å²	33	66.1 Å²	66.1	23%	0.231	34%	0.336	C	S	.	.			trans	-78.1	132.6	-171.2	-63.1	0	0	0	0	112.3	R386 G397 R398	S384-R386 VanDerWaalsContact C-N 3.31Å; S384-G397 WeakPolarHBondContact OG-CA 3.3Å; S384-R398 WeakPolarHBondContact CB-O 3.14Å; S384-R398 PolarHBondContact N-O 2.77Å; S384-R398 PolarHBondContact OG-N 2.84Å
385	S	89.4	Confident	87.7	Confident	59 Å²	59	66.4 Å²	66.4	41%	0.413	33%	0.334	S	S	.	.	S	Bend	trans	-67.8	-30.7	175	59.9	0	0	0	0	113.5	Q371 Y372 R381	Q371-S385 WeakPolarHBondContact CA-O 3.33Å; Y372-S385 PolarHBondContact N-O 3.46Å; R381-S385 VanDerWaalsContact CZ-CA 3.48Å; R381-S385 VanDerWaalsContact NH1-CB 3.3Å
386	R	90.2	Very high	87.9	Confident	77 Å²	77	63.8 Å²	63.8	29%	0.291	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	138.2	179.6	-167.2	179.4	-174.1	169	7.1	109	Q369 L370 S384	Q369-R386 HydrophobicContact CB-CG 4.43Å; Q369-R386 VanDerWaalsContact CD-NH2 3.32Å; Q369-R386 VanDerWaalsContact OE1-CZ 3.26Å; L370-R386 CarbonylContact O-C 3.51Å; L370-R386 WeakPolarHBondContact O-CA 3.4Å; S384-R386 VanDerWaalsContact C-N 3.31Å
387	R	90.2	Very high	88	Confident	30 Å²	30	64.8 Å²	64.8	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	139.9	174.1	-57.3	-177.2	70.4	-171.2	7.5	109.4	Q369 L370 Y372 W395 S396 G397	Q369-R387 CarbonylContact C-O 3.52Å; Q369-R387 WeakPolarHBondContact CA-O 3.4Å; L370-R387 PolarHBondContact N-O 2.87Å; L370-R387 PolarHBondContact O-N 3.28Å; Y372-R387 HydrophobicContact CD2-CG 4.3Å; Y372-R387 HydrophobicContact CE2-CB 3.88Å; Y372-R387 HydrophobicContact CE2-CG 3.65Å; R387-W395 HydrophobicContact CB-CE3 3.97Å; R387-W395 PolarHBondContact NH2-O 2.84Å; R387-S396 WeakPolarHBondContact CB-O 3.35Å; R387-S396 VanDerWaalsContact CG-O 3.31Å; R387-S396 WeakPolarHBondContact CG-O 3.49Å; R387-S396 PolarHBondContact NE-O 2.78Å; R387-G397 PolarHBondContact NH2-O 3Å
388	T	88.6	Confident	88.2	Confident	24 Å²	24	69.5 Å²	69.5	15%	0.147	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.3	-177.7	-51.4	0	0	0	0	109.1	T368 Q369 L390 W395 S396	T368-T388 WeakPolarHBondContact O-CA 3.45Å; Q369-T388 HydrophobicContact CG-CG2 3.89Å; Q369-T388 WeakPolarHBondContact CG-OG1 3.08Å; T388-L390 PolarHBondContact O-N 2.79Å; T388-W395 VanDerWaalsContact C-CE3 3.48Å; T388-S396 PolarHBondContact N-OG 3.35Å; T388-S396 PolarHBondContact O-N 3.3Å; T388-S396 PolarHBondContact O-OG 2.81Å
389	C	87.8	Confident	88.4	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-70.8	114.3	170.8	177.7	0	0	0	0	109.5	C306 H365 H367 T368 W395	C306-C389 HydrophobicContact CB-CB 3.73Å; C306-C389 WeakPolarHBondContact CB-SG 3.36Å; C306-C389 PolarHBondContact N-SG 3.12Å; C306-C389 VanDerWaalsContact N-SG 3.4Å; C306-C389 WeakPolarHBondContact SG-CA 3.43Å; C306-C389 WeakPolarHBondContact SG-CB 3.24Å; C306-C389 CovalentContact SG-SG 2.02Å; C306-C389 PolarHBondContact SG-SG 2.78Å; H365-C389 WeakPolarHBondContact O-CB 3.35Å; H367-C389 WeakPolarHBondContact CA-O 3.5Å; H367-C389 PolarHBondContact N-O 2.77Å; T368-C389 PolarHBondContact O-N 2.96Å; C389-W395 HydrophobicContact CB-CE3 4.24Å; C389-W395 HydrophobicContact CB-CH2 3.94Å; C389-W395 HydrophobicContact CB-CZ2 4.35Å; C389-W395 HydrophobicContact CB-CZ3 3.9Å; C389-W395 VanDerWaalsContact N-CZ3 3.34Å
390	L	85.6	Confident	88.4	Confident	72 Å²	72	70.6 Å²	70.6	38%	0.377	36%	0.362	S	S	.	.			trans	-86.9	159.5	-176.8	-58.9	176.3	0	0	0	111	L366 T388 T392 G393 K394	L366-L390 VanDerWaalsContact CD2-O 3.23Å; L366-L390 WeakPolarHBondContact CD2-O 3.41Å; T388-L390 PolarHBondContact O-N 2.79Å; L390-T392 PolarHBondContact O-N 3.26Å; L390-G393 PolarHBondContact O-N 2.61Å; L390-K394 VanDerWaalsContact CB-O 3.3Å; L390-K394 WeakPolarHBondContact CB-O 3.34Å; L390-K394 WeakPolarHBondContact CG-O 3.43Å; L390-K394 PolarHBondContact N-O 2.9Å
391	R	83.3	Confident	88.5	Confident	183 Å²	183	66.8 Å²	66.8	69%	0.691	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-15.9	173.6	-68.2	-173.8	178.7	-176.8	-3.3	114.5	K304 G393	K304-R391 WeakPolarHBondContact CD-O 3.35Å; R391-G393 VanDerWaalsContact C-N 3.25Å; R391-G393 PolarHBondContact O-N 2.93Å
392	T	82.9	Confident	88.5	Confident	83 Å²	83	62.3 Å²	62.3	51%	0.509	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.1	173.4	57.4	0	0	0	0	113.7	L390 K394	L390-T392 PolarHBondContact O-N 3.26Å; T392-K394 PolarHBondContact O-N 3.19Å; T392-K394 PolarHBondContact OG1-N 3.38Å
393	G	83	Confident	88.5	Confident	17 Å²	17	61 Å²	61	18%	0.175	33%	0.333	C	S	.	.	S	Bend	trans	76.1	10.2	-171.8	0	0	0	0	0	113.6	L390 R391	L390-G393 PolarHBondContact O-N 2.61Å; R391-G393 VanDerWaalsContact C-N 3.25Å; R391-G393 PolarHBondContact O-N 2.93Å
394	K	88.5	Confident	88.6	Confident	154 Å²	154	60.1 Å²	60.1	67%	0.67	32%	0.32	S	S	*	.	S	Bend	trans	-112.7	150.7	178.4	-64.6	-176	179.2	179	0	111.4	L390 T392	L390-K394 VanDerWaalsContact CB-O 3.3Å; L390-K394 WeakPolarHBondContact CB-O 3.34Å; L390-K394 WeakPolarHBondContact CG-O 3.43Å; L390-K394 PolarHBondContact N-O 2.9Å; T392-K394 PolarHBondContact O-N 3.19Å; T392-K394 PolarHBondContact OG1-N 3.38Å
395	W	89.8	Confident	88.5	Confident	31 Å²	31	59.8 Å²	59.8	12%	0.117	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-79.4	132.9	174	-70.1	97.4	0	0	0	111.7	C306 R307 P309 Q364 T368 L370 R387 T388 C389	C306-W395 HydrophobicContact CB-CD2 4.24Å; C306-W395 HydrophobicContact CB-CG 4.48Å; C306-W395 HydrophobicContact CB-CZ2 3.8Å; R307-W395 PolarHBondContact O-NE1 3.49Å; P309-W395 HydrophobicContact CG-CD2 4.05Å; P309-W395 HydrophobicContact CG-CG 3.93Å; Q364-W395 HydrophobicContact CB-CH2 4.07Å; Q364-W395 HydrophobicContact CB-CZ2 3.97Å; Q364-W395 HydrophobicContact CG-CH2 4.36Å; Q364-W395 HydrophobicContact CG-CZ2 4.19Å; T368-W395 WeakPolarHBondContact O-CZ3 3.49Å; L370-W395 HydrophobicContact CB-CZ3 4.25Å; L370-W395 HydrophobicContact CD1-CD2 4.46Å; L370-W395 HydrophobicContact CD1-CE3 4.21Å; L370-W395 HydrophobicContact CD1-CH2 3.26Å; L370-W395 HydrophobicContact CD1-CZ2 3.51Å; L370-W395 HydrophobicContact CD1-CZ3 3.63Å; L370-W395 HydrophobicContact CD2-CH2 4.25Å; L370-W395 HydrophobicContact CG-CE3 4.44Å; L370-W395 HydrophobicContact CG-CH2 3.41Å; L370-W395 VanDerWaalsContact CG-CH2 3.41Å; L370-W395 HydrophobicContact CG-CZ2 4.18Å; L370-W395 HydrophobicContact CG-CZ3 3.55Å; R387-W395 HydrophobicContact CB-CE3 3.97Å; R387-W395 PolarHBondContact NH2-O 2.84Å; T388-W395 VanDerWaalsContact C-CE3 3.48Å; C389-W395 HydrophobicContact CB-CE3 4.24Å; C389-W395 HydrophobicContact CB-CH2 3.94Å; C389-W395 HydrophobicContact CB-CZ2 4.35Å; C389-W395 HydrophobicContact CB-CZ3 3.9Å; C389-W395 VanDerWaalsContact N-CZ3 3.34Å
396	S	90.6	Very high	88.6	Confident	31 Å²	31	58.6 Å²	58.6	22%	0.217	31%	0.306	C	S	.	.			trans	-66.4	162.1	172.7	70.9	0	0	0	0	112.6	R387 T388	R387-S396 WeakPolarHBondContact CB-O 3.35Å; R387-S396 VanDerWaalsContact CG-O 3.31Å; R387-S396 WeakPolarHBondContact CG-O 3.49Å; R387-S396 PolarHBondContact NE-O 2.78Å; T388-S396 PolarHBondContact N-OG 3.35Å; T388-S396 PolarHBondContact O-N 3.3Å; T388-S396 PolarHBondContact O-OG 2.81Å
397	G	88.4	Confident	88.4	Confident	50 Å²	50	54.9 Å²	54.9	52%	0.515	29%	0.293	S	S	.	.	S	Bend	trans	69.7	-177.8	173.8	0	0	0	0	0	114.7	S384 R387	S384-G397 WeakPolarHBondContact OG-CA 3.3Å; R387-G397 PolarHBondContact NH2-O 3Å
398	R	90.6	Very high	88.1	Confident	201 Å²	201	56.8 Å²	56.8	76%	0.758	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-89	145.6	-180	-56.9	-174.5	-152.5	174.1	6.8	110.2	S384	S384-R398 WeakPolarHBondContact CB-O 3.14Å; S384-R398 PolarHBondContact N-O 2.77Å; S384-R398 PolarHBondContact OG-N 2.84Å
399	A	89.1	Confident	87.5	Confident	68 Å²	68	57.3 Å²	57.3	56%	0.562	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-59.3	131.6	176.7	0	0	0	0	0	110.6
400	P	90.3	Very high	86.4	Confident	14 Å²	14	62.5 Å²	62.5	9%	0.091	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-76.9	140.1	-179.5	31.2	-33.4	0	0	0	110.7	V315 Y372 R381 L382	V315-P400 HydrophobicContact CG1-CG 4.43Å; Y372-P400 HydrophobicContact CD1-CB 4.45Å; Y372-P400 HydrophobicContact CD1-CG 3.52Å; Y372-P400 HydrophobicContact CD2-CG 3.88Å; Y372-P400 HydrophobicContact CE1-CG 3.86Å; Y372-P400 HydrophobicContact CE2-CG 4.23Å; Y372-P400 HydrophobicContact CG-CB 4.09Å; Y372-P400 HydrophobicContact CG-CG 3.5Å; R381-P400 HydrophobicContact CG-CB 4.43Å; L382-P400 CarbonylContact O-C 3.56Å; L382-P400 VanDerWaalsContact O-CA 3.26Å; L382-P400 WeakPolarHBondContact O-CA 3.26Å
401	S	91.4	Very high	84.8	Confident	51 Å²	51	66 Å²	66	36%	0.357	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	152.6	170	55.3	0	0	0	0	109.7	R381 L382	R381-S401 CarbonylContact C-O 3.55Å; R381-S401 WeakPolarHBondContact CA-O 3.49Å; L382-S401 PolarHBondContact N-O 3.34Å; L382-S401 PolarHBondContact O-N 3.06Å
402	C	90.6	Very high	83.3	Confident	12 Å²	12	62 Å²	62	8%	0.081	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.3	177.7	-72.3	0	0	0	0	108.5	L314 V315 C374 Y379 R380	L314-C402 HydrophobicContact CB-CB 3.91Å; V315-C402 HydrophobicContact CG2-CB 4.36Å; C374-C402 WeakPolarHBondContact CA-SG 3.42Å; C374-C402 HydrophobicContact CB-CB 3.96Å; C374-C402 WeakPolarHBondContact CB-SG 3.17Å; C374-C402 WeakPolarHBondContact SG-CB 3.31Å; C374-C402 CovalentContact SG-SG 2.04Å; C374-C402 PolarHBondContact SG-SG 3.4Å; Y379-C402 HydrophobicContact CD1-CB 4.41Å; R380-C402 WeakPolarHBondContact O-CA 3.33Å
403	I	89.1	Confident	81.3	Confident	50 Å²	50	64.1 Å²	64.1	26%	0.256	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.6	177.7	59.5	161.9	0	0	0	109.5	Y379 R380 L382	Y379-I403 CarbonylContact C-O 3.49Å; Y379-I403 VanDerWaalsContact CA-O 3.27Å; Y379-I403 WeakPolarHBondContact CA-O 3.47Å; R380-I403 HydrophobicContact CG-CD1 4.18Å; R380-I403 HydrophobicContact CG-CG1 3.71Å; R380-I403 PolarHBondContact N-O 2.89Å; R380-I403 PolarHBondContact O-N 3.36Å; L382-I403 HydrophobicContact CD1-CD1 3.6Å; L382-I403 HydrophobicContact CD1-CG1 3.96Å; L382-I403 HydrophobicContact CD1-CG2 3.91Å; L382-I403 HydrophobicContact CD2-CD1 4.31Å; L382-I403 HydrophobicContact CG-CD1 3.92Å; L382-I403 HydrophobicContact CG-CG1 4Å
404	P	89.9	Confident	79	Confident	23 Å²	23	66.7 Å²	66.7	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	143.8	179.2	27.7	-36.6	0	0	0	111	F378 Y379 E456 I532 P538	F378-P404 WeakPolarHBondContact O-CA 3.48Å; Y379-P404 HydrophobicContact CD1-CB 4.38Å; Y379-P404 HydrophobicContact CE1-CB 4.28Å; P404-E456 HydrophobicContact CG-CG 3.87Å; P404-I532 HydrophobicContact CB-CD1 4.38Å; P404-I532 HydrophobicContact CB-CG1 4.11Å; P404-P538 HydrophobicContact CB-CG 3.86Å; P404-P538 HydrophobicContact CG-CG 4.02Å
405	I	89.5	Confident	76.7	Confident	26 Å²	26	65.1 Å²	65.1	13%	0.133	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-80.4	125	171.6	-58.3	176.2	0	0	0	107	P377 F378 R380 K408 R642	P377-I405 VanDerWaalsContact O-CD1 3.28Å; P377-I405 WeakPolarHBondContact O-CD1 3.24Å; F378-I405 WeakPolarHBondContact O-CG1 3.49Å; F378-I405 PolarHBondContact O-N 2.75Å; R380-I405 HydrophobicContact CB-CD1 4.29Å; R380-I405 HydrophobicContact CB-CG1 3.94Å; R380-I405 HydrophobicContact CG-CG1 4.14Å; I405-K408 HydrophobicContact CG2-CB 4.36Å; I405-R642 VanDerWaalsContact CG2-NH1 3.25Å
406	C	90.2	Very high	74.3	Confident	33 Å²	33	72 Å²	72	22%	0.223	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-89.2	154.1	177.4	66.9	0	0	0	0	112.3	K408 P538 C540 R642	C406-K408 VanDerWaalsContact C-N 3.28Å; C406-K408 PolarHBondContact O-N 3.03Å; C406-P538 CarbonylContact C-O 3.59Å; C406-P538 WeakPolarHBondContact CA-O 3.47Å; C406-P538 HydrophobicContact CB-CB 4.45Å; C406-P538 HydrophobicContact CB-CG 4.18Å; C406-C540 HydrophobicContact CB-CB 3.99Å; C406-C540 WeakPolarHBondContact CB-SG 3.27Å; C406-C540 PolarHBondContact O-SG 2.86Å; C406-C540 WeakPolarHBondContact SG-CA 3.07Å; C406-C540 WeakPolarHBondContact SG-CB 3.11Å; C406-C540 CovalentContact SG-SG 2.04Å; C406-C540 PolarHBondContact SG-SG 3.23Å; C406-R642 PolarHBondContact O-NH1 3.27Å
407	G	86.5	Confident	72	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	43%	0.425	C	S	.	.	S	Bend	trans	68.5	15.5	164.3	0	0	0	0	0	115.8	P538 R642 W643	G407-P538 PolarHBondContact N-O 2.04Å; G407-R642 WeakPolarHBondContact O-CA 3.45Å; G407-W643 WeakPolarHBondContact CA-O 3.49Å; G407-W643 PolarHBondContact O-N 2.94Å
408	K	84.3	Confident	69.9	Low	69 Å²	69	81.8 Å²	81.8	30%	0.3	44%	0.442	S	S	.	.			trans	-98.6	132	179	-172.8	165.4	179.6	155.3	0	110	I405 C406 Q537 E640	I405-K408 HydrophobicContact CG2-CB 4.36Å; C406-K408 VanDerWaalsContact C-N 3.28Å; C406-K408 PolarHBondContact O-N 3.03Å; K408-Q537 PolarHBondContact O-OE1 2.83Å; K408-E640 WeakPolarHBondContact CE-OE2 3.35Å; K408-E640 VanDerWaalsContact NZ-CD 3.32Å; K408-E640 IonicContact NZ-OE1 3.49Å; K408-E640 PolarHBondContact NZ-OE1 3.28Å; K408-E640 VanDerWaalsContact NZ-OE1 3.15Å; K408-E640 IonicContact NZ-OE2 2.74Å; K408-E640 PolarHBondContact NZ-OE2 2.87Å
409	I	76.9	Confident	68.3	Low	36 Å²	36	74.3 Å²	74.3	19%	0.185	43%	0.428	C	S	.	.			trans	-116.3	131.5	168.9	-62.7	-178.2	0	0	0	107.1	I412 W422 W424	I409-I412 HydrophobicContact CG2-CG1 4.47Å; I409-W422 HydrophobicContact CD1-CE3 4.17Å; I409-W422 HydrophobicContact CD1-CZ3 4.07Å; I409-W424 HydrophobicContact CD1-CH2 3.56Å; I409-W424 HydrophobicContact CD1-CZ2 4.17Å; I409-W424 HydrophobicContact CD1-CZ3 4.3Å; I409-W424 HydrophobicContact CG1-CH2 3.65Å; I409-W424 HydrophobicContact CG1-CZ3 3.93Å
410	E	64.6	Low	67.3	Low	108 Å²	108	74.3 Å²	74.3	51%	0.505	42%	0.418	S	S	.	.	S	Bend	trans	-76.4	129	175.7	-72.8	-176.6	164	0	0	110.6	F378	F378-E410 WeakPolarHBondContact CE1-OE1 3.5Å
411	N	52.2	Low	66.9	Low	147 Å²	147	77.1 Å²	77.1	79%	0.786	43%	0.427	S	S	*	.			trans	52.4	85.3	172.4	-70.6	-10.1	0	0	0	117.3
412	I	51.3	Low	66.7	Low	98 Å²	98	75.5 Å²	75.5	50%	0.503	41%	0.413	S	S	.	.			trans	-95.9	73	151.6	-53	173.5	0	0	0	107.5	I409	I409-I412 HydrophobicContact CG2-CG1 4.47Å
413	T	40	Very low	66.7	Low	127 Å²	127	75.2 Å²	75.2	78%	0.779	41%	0.411	S	S	*	.			trans	-95.4	105.3	156	31.6	0	0	0	0	107
414	A	35.3	Very low	66.9	Low	71 Å²	71	72.9 Å²	72.9	59%	0.587	40%	0.399	S	S	*	.	S	Bend	trans	86.2	136	178.8	0	0	0	0	0	117.3	K416	A414-K416 VanDerWaalsContact C-N 3.34Å; A414-K416 PolarHBondContact O-N 3.11Å
415	P	40.5	Very low	67.1	Low	121 Å²	121	71.9 Å²	71.9	79%	0.786	39%	0.392	S	S	*	.			trans	-77.3	84.9	172.9	33	-30.8	0	0	0	108.8
416	K	38.2	Very low	67.3	Low	177 Å²	177	70.6 Å²	70.6	77%	0.77	39%	0.386	S	S	*	.			trans	-91.3	100.1	157.8	-77.2	-172.2	177.4	-177.4	0	107.1	A414 Q418	A414-K416 VanDerWaalsContact C-N 3.34Å; A414-K416 PolarHBondContact O-N 3.11Å; K416-Q418 PolarHBondContact O-N 2.91Å; K416-Q418 VanDerWaalsContact O-N 3.13Å
417	T	42.9	Very low	67.4	Low	99 Å²	99	69 Å²	69	61%	0.607	38%	0.375	S	S	*	.			trans	-64.7	-6	-178	35.6	0	0	0	0	114.5	P617	T417-P617 HydrophobicContact CG2-CB 4.15Å; T417-P617 HydrophobicContact CG2-CG 3.84Å
418	Q	44.4	Very low	67.7	Low	186 Å²	186	69 Å²	69	87%	0.869	38%	0.375	S	S	*	.	S	Bend	trans	-100.6	103.2	174	-78.9	179.2	-17.9	0	0	111.5	K416	K416-Q418 PolarHBondContact O-N 2.91Å; K416-Q418 VanDerWaalsContact O-N 3.13Å
419	G	56.4	Low	68	Low	44 Å²	44	66 Å²	66	45%	0.454	36%	0.362	S	S	.	.			trans	108.7	23.7	164	0	0	0	0	0	116.8	R421	G419-R421 PolarHBondContact O-N 2.83Å
420	L	69.4	Low	68.5	Low	68 Å²	68	67.3 Å²	67.3	36%	0.356	36%	0.364	S	S	.	.			trans	-67.5	118.6	173.4	-149.3	75.5	0	0	0	109.7	W422	L420-W422 HydrophobicContact CD2-CH2 4.07Å; L420-W422 HydrophobicContact CD2-CZ2 3.86Å
421	R	80.1	Confident	69.6	Low	73 Å²	73	67.4 Å²	67.4	28%	0.275	36%	0.36	S	S	.	.			trans	-90.9	138.6	177.9	-66.9	-172.1	175.1	-124.5	2.4	109.4	G419 P423 F487 E495	G419-R421 PolarHBondContact O-N 2.83Å; R421-P423 WeakPolarHBondContact O-CD 3.39Å; R421-F487 HydrophobicContact CG-CD2 3.77Å; R421-F487 HydrophobicContact CG-CE2 4.28Å; R421-F487 HydrophobicContact CG-CG 4.26Å; R421-F487 VanDerWaalsContact CZ-CB 3.48Å; R421-F487 VanDerWaalsContact NH1-CB 3.28Å; R421-E495 IonicContact CZ-OE1 3.83Å; R421-E495 IonicContact CZ-OE2 2.72Å; R421-E495 IonicContact NH1-OE1 2.94Å; R421-E495 IonicContact NH1-OE2 3Å; R421-E495 PolarHBondContact NH1-OE2 3.42Å; R421-E495 IonicContact NH2-OE1 3.72Å; R421-E495 PolarHBondContact NH2-OE1 2.86Å; R421-E495 VanDerWaalsContact NH2-OE1 3.12Å; R421-E495 IonicContact NH2-OE2 3.65Å
422	W	88.4	Confident	70.6	Confident	17 Å²	17	61.5 Å²	61.5	6%	0.064	33%	0.33	C	S	.	.			trans	-105.7	100.4	179.6	-62.7	101.1	0	0	0	109.7	I409 L420 W424 Q425 T557 A559 L577 W643	I409-W422 HydrophobicContact CD1-CE3 4.17Å; I409-W422 HydrophobicContact CD1-CZ3 4.07Å; L420-W422 HydrophobicContact CD2-CH2 4.07Å; L420-W422 HydrophobicContact CD2-CZ2 3.86Å; W422-W424 AromaticContact CE3-CE2 3.98Å; W422-W424 HydrophobicContact CE3-CH2 4.38Å; W422-W424 AromaticContact CE3-CZ2 3.51Å; W422-W424 HydrophobicContact CE3-CZ2 3.51Å; W422-W424 AromaticContact CZ3-CZ2 3.82Å; W422-W424 HydrophobicContact CZ3-CZ2 3.82Å; W422-W424 PolarHBondContact O-N 2.79Å; W422-Q425 HydrophobicContact CB-CB 4.09Å; W422-Q425 VanDerWaalsContact O-CB 3.26Å; W422-Q425 WeakPolarHBondContact O-CB 3.5Å; W422-Q425 PolarHBondContact O-N 3.21Å; W422-T557 HydrophobicContact CH2-CG2 3.62Å; W422-T557 HydrophobicContact CZ2-CG2 3.56Å; W422-A559 HydrophobicContact CD2-CB 4.29Å; W422-A559 HydrophobicContact CG-CB 3.99Å; W422-L577 HydrophobicContact CB-CD2 4Å; W422-L577 HydrophobicContact CG-CD2 4.14Å; W422-W643 AromaticContact CH2-CH2 3.56Å; W422-W643 HydrophobicContact CH2-CH2 3.56Å; W422-W643 AromaticContact CH2-CZ2 3.87Å; W422-W643 HydrophobicContact CH2-CZ2 3.87Å; W422-W643 AromaticContact CH2-CZ3 3.93Å; W422-W643 HydrophobicContact CH2-CZ3 3.93Å; W422-W643 HydrophobicContact CZ3-CD2 4.1Å; W422-W643 HydrophobicContact CZ3-CE3 4.02Å; W422-W643 AromaticContact CZ3-CH2 3.78Å; W422-W643 HydrophobicContact CZ3-CH2 3.78Å; W422-W643 AromaticContact CZ3-CZ2 3.85Å; W422-W643 HydrophobicContact CZ3-CZ2 3.85Å; W422-W643 AromaticContact CZ3-CZ3 3.87Å; W422-W643 HydrophobicContact CZ3-CZ3 3.87Å
423	P	91	Very high	71.2	Confident	6 Å²	6	60 Å²	60	4%	0.039	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.4	-166.7	-23.5	35.5	0	0	0	115.3	R421 R535 V536 Q537	R421-P423 WeakPolarHBondContact O-CD 3.39Å; P423-R535 WeakPolarHBondContact CA-O 3.49Å; P423-V536 VanDerWaalsContact O-CA 3.3Å; P423-V536 WeakPolarHBondContact O-CA 2.91Å; P423-Q537 CarbonylContact C-O 3.56Å; P423-Q537 HydrophobicContact CB-CB 3.88Å; P423-Q537 HydrophobicContact CB-CG 4.03Å; P423-Q537 PolarHBondContact O-N 3.23Å
424	W	93.8	Very high	71.9	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-5.5	177.6	43.3	74.4	0	0	0	113	I409 W422 A426 A452 L453 Q537 I539 W643	I409-W424 HydrophobicContact CD1-CH2 3.56Å; I409-W424 HydrophobicContact CD1-CZ2 4.17Å; I409-W424 HydrophobicContact CD1-CZ3 4.3Å; I409-W424 HydrophobicContact CG1-CH2 3.65Å; I409-W424 HydrophobicContact CG1-CZ3 3.93Å; W422-W424 AromaticContact CE3-CE2 3.98Å; W422-W424 HydrophobicContact CE3-CH2 4.38Å; W422-W424 AromaticContact CE3-CZ2 3.51Å; W422-W424 HydrophobicContact CE3-CZ2 3.51Å; W422-W424 AromaticContact CZ3-CZ2 3.82Å; W422-W424 HydrophobicContact CZ3-CZ2 3.82Å; W422-W424 PolarHBondContact O-N 2.79Å; W424-A426 PolarHBondContact O-N 2.97Å; W424-A452 CarbonylContact O-C 3.32Å; W424-A452 WeakPolarHBondContact O-CA 3.4Å; W424-L453 HydrophobicContact CB-CB 4.48Å; W424-L453 PolarHBondContact O-N 2.77Å; W424-Q537 WeakPolarHBondContact CA-O 3.4Å; W424-Q537 WeakPolarHBondContact CB-O 3.49Å; W424-Q537 PolarHBondContact N-O 3.03Å; W424-I539 HydrophobicContact CB-CB 3.79Å; W424-I539 HydrophobicContact CB-CG2 4.3Å; W424-I539 HydrophobicContact CD2-CB 3.75Å; W424-I539 HydrophobicContact CD2-CD1 4.11Å; W424-I539 HydrophobicContact CD2-CG1 4.02Å; W424-I539 HydrophobicContact CE3-CB 4.11Å; W424-I539 HydrophobicContact CE3-CG1 4.37Å; W424-I539 HydrophobicContact CG-CB 3.61Å; W424-I539 HydrophobicContact CG-CD1 4.21Å; W424-I539 HydrophobicContact CG-CG1 4.25Å; W424-I539 HydrophobicContact CG-CG2 4.4Å; W424-I539 HydrophobicContact CZ2-CD1 4.27Å; W424-W643 HydrophobicContact CH2-CB 3.25Å; W424-W643 AromaticContact CH2-CD1 3.53Å; W424-W643 HydrophobicContact CH2-CD2 4.03Å; W424-W643 AromaticContact CH2-CG 3.29Å; W424-W643 HydrophobicContact CH2-CG 3.29Å; W424-W643 HydrophobicContact CZ2-CB 3.58Å; W424-W643 HydrophobicContact CZ2-CD2 4.01Å; W424-W643 HydrophobicContact CZ2-CE3 4.4Å; W424-W643 AromaticContact CZ2-CG 3.67Å; W424-W643 HydrophobicContact CZ2-CG 3.67Å; W424-W643 HydrophobicContact CZ3-CB 4Å; W424-W643 HydrophobicContact CZ3-CG 4.34Å
425	Q	93.1	Very high	72.4	Confident	2 Å²	2	59 Å²	59	1%	0.009	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	126.3	-178.7	-164	76.1	2.3	0	0	110.4	W422 S450 A559 W561 L577 I628	W422-Q425 HydrophobicContact CB-CB 4.09Å; W422-Q425 VanDerWaalsContact O-CB 3.26Å; W422-Q425 WeakPolarHBondContact O-CB 3.5Å; W422-Q425 PolarHBondContact O-N 3.21Å; Q425-S450 PolarHBondContact NE2-OG 2.98Å; Q425-A559 PolarHBondContact NE2-O 2.68Å; Q425-W561 HydrophobicContact CB-CH2 4.02Å; Q425-W561 HydrophobicContact CB-CZ3 4.47Å; Q425-W561 HydrophobicContact CG-CE3 4.25Å; Q425-W561 HydrophobicContact CG-CH2 3.24Å; Q425-W561 HydrophobicContact CG-CZ2 4.15Å; Q425-W561 HydrophobicContact CG-CZ3 3.31Å; Q425-L577 HydrophobicContact CB-CD2 4.38Å; Q425-L577 HydrophobicContact CG-CD1 3.92Å; Q425-L577 HydrophobicContact CG-CD2 4.23Å; Q425-I628 VanDerWaalsContact OE1-CG1 3.27Å
426	A	94.4	Very high	72.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.8	177.5	0	0	0	0	0	110.1	W424 I428 S450 G451 V459 V482 L484	W424-A426 PolarHBondContact O-N 2.97Å; A426-I428 HydrophobicContact CB-CD1 4.42Å; A426-S450 CarbonylContact O-C 3.55Å; A426-S450 VanDerWaalsContact O-CA 3.27Å; A426-S450 WeakPolarHBondContact O-CA 3.36Å; A426-G451 WeakPolarHBondContact CB-O 3.13Å; A426-G451 PolarHBondContact N-O 2.88Å; A426-G451 PolarHBondContact O-N 3.06Å; A426-V459 HydrophobicContact CB-CG1 3.69Å; A426-V459 HydrophobicContact CB-CG2 4.31Å; A426-V482 HydrophobicContact CB-CG1 3.98Å; A426-L484 HydrophobicContact CB-CD2 3.55Å
427	A	91.9	Very high	72.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.3	174.7	0	0	0	0	0	109.6	Y429 L447 V482 V483 K486 W561	A427-Y429 HydrophobicContact CB-CD2 4.41Å; A427-Y429 HydrophobicContact CB-CE2 3.86Å; A427-L447 HydrophobicContact CB-CD1 3.56Å; A427-V482 WeakPolarHBondContact O-CA 3.04Å; A427-V483 HydrophobicContact CB-CB 4.17Å; A427-V483 PolarHBondContact N-O 2.89Å; A427-V483 PolarHBondContact O-N 3.25Å; A427-K486 HydrophobicContact CB-CD 4.27Å; A427-W561 HydrophobicContact CB-CE3 4.17Å; A427-W561 HydrophobicContact CB-CH2 3.93Å; A427-W561 HydrophobicContact CB-CZ3 3.63Å
428	I	92.3	Very high	73.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.2	-176.8	-48.1	-57.7	0	0	0	109.2	A426 V448 C449 V459 V461 V482 L524	A426-I428 HydrophobicContact CB-CD1 4.42Å; I428-V448 PolarHBondContact O-N 2.86Å; I428-C449 HydrophobicContact CB-CB 4.27Å; I428-C449 WeakPolarHBondContact CB-O 2.94Å; I428-C449 HydrophobicContact CG1-CB 4.46Å; I428-C449 PolarHBondContact N-O 3.46Å; I428-C449 PolarHBondContact O-N 3.03Å; I428-V459 HydrophobicContact CD1-CG1 4.35Å; I428-V461 HydrophobicContact CG1-CG2 4.1Å; I428-V482 HydrophobicContact CD1-CB 4.41Å; I428-V482 HydrophobicContact CD1-CG1 4.16Å; I428-V482 HydrophobicContact CD1-CG2 3.82Å; I428-L524 HydrophobicContact CD1-CD1 3.74Å; I428-L524 HydrophobicContact CG2-CD1 4.49Å
429	Y	89.9	Confident	73.5	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.4	-179.4	-76.4	-104.6	0	0	0	111.3	A427 W445 F446 L447 L480 K481 V483 K486 D491	A427-Y429 HydrophobicContact CB-CD2 4.41Å; A427-Y429 HydrophobicContact CB-CE2 3.86Å; Y429-W445 HydrophobicContact CD1-CB 4.07Å; Y429-F446 CarbonylContact C-O 3.58Å; Y429-F446 VanDerWaalsContact CA-O 3.25Å; Y429-F446 WeakPolarHBondContact CA-O 3.5Å; Y429-F446 WeakPolarHBondContact CD1-O 2.94Å; Y429-L447 HydrophobicContact CD1-CB 4.33Å; Y429-L447 HydrophobicContact CD2-CD1 4.02Å; Y429-L447 HydrophobicContact CE1-CB 3.95Å; Y429-L447 HydrophobicContact CE2-CB 4.39Å; Y429-L447 HydrophobicContact CE2-CD1 3.72Å; Y429-L480 VanDerWaalsContact O-CA 3.29Å; Y429-L480 WeakPolarHBondContact O-CA 3.02Å; Y429-L480 WeakPolarHBondContact O-CD2 3.33Å; Y429-K481 VanDerWaalsContact CB-CE 3.48Å; Y429-K481 HydrophobicContact CG-CG 4.36Å; Y429-K481 PolarHBondContact N-O 2.88Å; Y429-K481 PolarHBondContact O-N 3.01Å; Y429-V483 HydrophobicContact CD2-CG2 3.84Å; Y429-V483 HydrophobicContact CE2-CB 4.27Å; Y429-V483 HydrophobicContact CE2-CG2 3.9Å; Y429-K486 VanDerWaalsContact OH-CE 3.22Å; Y429-K486 WeakPolarHBondContact OH-CE 3.24Å; Y429-K486 PolarHBondContact OH-NZ 2.69Å; Y429-D491 WeakPolarHBondContact CE1-OD2 3.46Å; Y429-D491 VanDerWaalsContact OH-CG 3.3Å; Y429-D491 PolarHBondContact OH-OD1 2.93Å; Y429-D491 PolarHBondContact OH-OD2 3.08Å
430	R	88.9	Confident	73.5	Confident	65 Å²	65	54.3 Å²	54.3	25%	0.245	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.3	171.3	-180	179.6	-176.6	166.1	8.1	110.6	W445 F446 V448 D468 D479 L480	R430-W445 WeakPolarHBondContact O-CA 3.29Å; R430-F446 HydrophobicContact CB-CE1 4.19Å; R430-F446 HydrophobicContact CB-CE2 4.45Å; R430-F446 HydrophobicContact CB-CZ 3.99Å; R430-F446 HydrophobicContact CG-CE1 4.3Å; R430-F446 HydrophobicContact CG-CZ 4.12Å; R430-F446 PolarHBondContact N-O 2.77Å; R430-F446 VanDerWaalsContact O-CD1 3.24Å; R430-F446 WeakPolarHBondContact O-CD1 3.36Å; R430-F446 WeakPolarHBondContact O-CE1 3.29Å; R430-F446 PolarHBondContact O-N 3.47Å; R430-V448 HydrophobicContact CB-CG2 3.29Å; R430-D468 IonicContact NH2-OD1 3.12Å; R430-D468 PolarHBondContact NH2-OD1 3.41Å; R430-D479 CarbonylContact C-O 3.44Å; R430-D479 VanDerWaalsContact CA-O 3.28Å; R430-D479 WeakPolarHBondContact CA-O 3.28Å; R430-L480 HydrophobicContact CB-CD2 3.95Å; R430-L480 HydrophobicContact CG-CD2 4.33Å
431	R	86.6	Confident	73	Confident	109 Å²	109	59 Å²	59	41%	0.411	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	138.7	173.1	-163.9	177.4	-174.6	-168.3	-1.7	110.5	S433 W445 D479	R431-S433 VanDerWaalsContact C-N 3.28Å; R431-S433 PolarHBondContact O-N 3.03Å; R431-W445 HydrophobicContact CB-CD2 4.24Å; R431-W445 HydrophobicContact CB-CE3 3.98Å; R431-W445 HydrophobicContact CB-CH2 4Å; R431-W445 HydrophobicContact CB-CZ2 4.23Å; R431-W445 HydrophobicContact CB-CZ3 3.87Å; R431-W445 HydrophobicContact CG-CZ2 4.42Å; R431-D479 HydrophobicContact CB-CB 4.21Å; R431-D479 PolarHBondContact N-O 3.09Å
432	T	74.8	Confident	71.9	Confident	24 Å²	24	64.4 Å²	64.4	15%	0.147	36%	0.36	C	S	.	.			trans	-72.9	78.7	170.7	47.7	0	0	0	0	111.2	L440 H441 G443 A444 F446	T432-L440 HydrophobicContact CG2-CD2 3.62Å; T432-H441 PolarHBondContact OG1-O 2.81Å; T432-G443 PolarHBondContact O-N 3.47Å; T432-G443 PolarHBondContact OG1-N 3.24Å; T432-G443 VanDerWaalsContact OG1-N 3.12Å; T432-A444 PolarHBondContact N-O 3.1Å; T432-A444 VanDerWaalsContact N-O 3.1Å; T432-A444 PolarHBondContact OG1-N 2.84Å; T432-A444 VanDerWaalsContact OG1-N 3.13Å; T432-A444 PolarHBondContact OG1-O 3.13Å; T432-A444 VanDerWaalsContact OG1-O 3.09Å; T432-F446 HydrophobicContact CG2-CD1 3.82Å; T432-F446 HydrophobicContact CG2-CE1 3.58Å
433	S	62.1	Low	70.8	Confident	66 Å²	66	64.6 Å²	64.6	46%	0.462	37%	0.368	S	S	.	.			trans	-92.4	107.6	170.7	47.4	0	0	0	0	109.9	R431 D479	R431-S433 VanDerWaalsContact C-N 3.28Å; R431-S433 PolarHBondContact O-N 3.03Å; S433-D479 PolarHBondContact OG-OD2 3.33Å
434	G	54.8	Low	70.1	Confident	70 Å²	70	66.1 Å²	66.1	72%	0.722	38%	0.381	S	S	*	.	S	Bend	trans	94.4	12.7	163	0	0	0	0	0	119.2
435	V	46.2	Very low	69.6	Low	108 Å²	108	70.3 Å²	70.3	66%	0.655	40%	0.396	S	S	*	.			trans	-91.5	115.8	174.4	-174	0	0	0	0	110.5	D437	V435-D437 HydrophobicContact CG1-CB 3.78Å; V435-D437 PolarHBondContact O-N 2.96Å; V435-D437 VanDerWaalsContact O-N 3.16Å
436	H	45.1	Very low	69.1	Low	187 Å²	187	73.7 Å²	73.7	87%	0.866	41%	0.411	S	S	*	.			trans	-81	64.6	167.1	-78.5	-80.3	0	0	0	109.9
437	D	42.8	Very low	68.6	Low	115 Å²	115	73.9 Å²	73.9	62%	0.615	41%	0.412	S	S	*	.			trans	-125	126.9	168.8	-168.2	18.2	0	0	0	109.1	V435 S439	V435-D437 HydrophobicContact CG1-CB 3.78Å; V435-D437 PolarHBondContact O-N 2.96Å; V435-D437 VanDerWaalsContact O-N 3.16Å; D437-S439 PolarHBondContact O-N 3.16Å
438	G	47.9	Very low	68.3	Low	91 Å²	91	75.4 Å²	75.4	94%	0.938	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	19.2	-164	0	0	0	0	0	115.4
439	S	53.8	Low	68.2	Low	46 Å²	46	75.8 Å²	75.8	32%	0.322	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-15.7	-166.7	179.7	0	0	0	0	114.7	D437 R568	D437-S439 PolarHBondContact O-N 3.16Å; S439-R568 PolarHBondContact OG-NH1 2.78Å; S439-R568 PolarHBondContact OG-NH2 2.72Å
440	L	55.5	Low	68.2	Low	89 Å²	89	75.8 Å²	75.8	47%	0.466	43%	0.425	S	S	.	.	S	Bend	trans	-125.7	134.5	-179.8	-107.6	83	0	0	0	111.7	T432 K442	T432-L440 HydrophobicContact CG2-CD2 3.62Å; L440-K442 PolarHBondContact O-N 3.12Å
441	H	58.8	Low	68.4	Low	167 Å²	167	72.7 Å²	72.7	77%	0.773	41%	0.413	S	S	*	.			trans	-57.9	124.2	175.1	-67.1	-65.7	0	0	0	110.8	T432 G443 A444	T432-H441 PolarHBondContact OG1-O 2.81Å; H441-G443 PolarHBondContact O-N 3.09Å; H441-G443 VanDerWaalsContact O-N 3.14Å; H441-A444 HydrophobicContact CB-CB 4.42Å; H441-A444 WeakPolarHBondContact O-CB 3.5Å; H441-A444 PolarHBondContact O-N 3.14Å
442	K	57.5	Low	68.8	Low	185 Å²	185	67.5 Å²	67.5	80%	0.804	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	118.1	179.4	-127.1	177.3	-175.6	177.2	0	110.3	L440	L440-K442 PolarHBondContact O-N 3.12Å
443	G	65.5	Low	69.9	Low	22 Å²	22	66.4 Å²	66.4	23%	0.227	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	8.6	177.1	0	0	0	0	0	115.9	T432 H441	T432-G443 PolarHBondContact O-N 3.47Å; T432-G443 PolarHBondContact OG1-N 3.24Å; T432-G443 VanDerWaalsContact OG1-N 3.12Å; H441-G443 PolarHBondContact O-N 3.09Å; H441-G443 VanDerWaalsContact O-N 3.14Å
444	A	77.4	Confident	71.5	Confident	38 Å²	38	63.7 Å²	63.7	31%	0.314	37%	0.368	S	S	.	.			trans	-66.9	146.9	171	0	0	0	0	0	112.1	T432 H441	T432-A444 PolarHBondContact N-O 3.1Å; T432-A444 VanDerWaalsContact N-O 3.1Å; T432-A444 PolarHBondContact OG1-N 2.84Å; T432-A444 VanDerWaalsContact OG1-N 3.13Å; T432-A444 PolarHBondContact OG1-O 3.13Å; T432-A444 VanDerWaalsContact OG1-O 3.09Å; H441-A444 HydrophobicContact CB-CB 4.42Å; H441-A444 WeakPolarHBondContact O-CB 3.5Å; H441-A444 PolarHBondContact O-N 3.14Å
445	W	82.9	Confident	73.3	Confident	88 Å²	88	62 Å²	62	33%	0.333	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.9	173.6	-68	94.5	0	0	0	109.9	Y429 R430 R431 D479 K481	Y429-W445 HydrophobicContact CD1-CB 4.07Å; R430-W445 WeakPolarHBondContact O-CA 3.29Å; R431-W445 HydrophobicContact CB-CD2 4.24Å; R431-W445 HydrophobicContact CB-CE3 3.98Å; R431-W445 HydrophobicContact CB-CH2 4Å; R431-W445 HydrophobicContact CB-CZ2 4.23Å; R431-W445 HydrophobicContact CB-CZ3 3.87Å; R431-W445 HydrophobicContact CG-CZ2 4.42Å; W445-D479 WeakPolarHBondContact CZ3-O 3.49Å; W445-K481 HydrophobicContact CD2-CD 3.91Å; W445-K481 HydrophobicContact CD2-CG 4.39Å; W445-K481 HydrophobicContact CE3-CD 3.9Å; W445-K481 HydrophobicContact CE3-CG 3.86Å; W445-K481 HydrophobicContact CG-CD 4.44Å; W445-K481 HydrophobicContact CH2-CB 4.32Å; W445-K481 HydrophobicContact CH2-CD 4.4Å; W445-K481 HydrophobicContact CH2-CG 4.27Å; W445-K481 HydrophobicContact CZ2-CD 4.43Å; W445-K481 HydrophobicContact CZ3-CB 4.17Å; W445-K481 HydrophobicContact CZ3-CD 4.13Å; W445-K481 HydrophobicContact CZ3-CG 3.78Å
446	F	81.5	Confident	75.5	Confident	73 Å²	73	57.9 Å²	57.9	32%	0.32	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.7	173.6	63.4	-81.8	0	0	0	110.3	Y429 R430 T432 V448	Y429-F446 CarbonylContact C-O 3.58Å; Y429-F446 VanDerWaalsContact CA-O 3.25Å; Y429-F446 WeakPolarHBondContact CA-O 3.5Å; Y429-F446 WeakPolarHBondContact CD1-O 2.94Å; R430-F446 HydrophobicContact CB-CE1 4.19Å; R430-F446 HydrophobicContact CB-CE2 4.45Å; R430-F446 HydrophobicContact CB-CZ 3.99Å; R430-F446 HydrophobicContact CG-CE1 4.3Å; R430-F446 HydrophobicContact CG-CZ 4.12Å; R430-F446 PolarHBondContact N-O 2.77Å; R430-F446 VanDerWaalsContact O-CD1 3.24Å; R430-F446 WeakPolarHBondContact O-CD1 3.36Å; R430-F446 WeakPolarHBondContact O-CE1 3.29Å; R430-F446 PolarHBondContact O-N 3.47Å; T432-F446 HydrophobicContact CG2-CD1 3.82Å; T432-F446 HydrophobicContact CG2-CE1 3.58Å; F446-V448 HydrophobicContact CD2-CG2 4.09Å; F446-V448 HydrophobicContact CE2-CG1 4.26Å; F446-V448 HydrophobicContact CE2-CG2 3.85Å; F446-V448 HydrophobicContact CZ-CG2 4.49Å; F446-V448 WeakPolarHBondContact O-CG2 3.47Å
447	L	85.1	Confident	77.8	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.026	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	127.2	177.7	-179.8	71.4	0	0	0	109.2	A427 Y429 R489 W561	A427-L447 HydrophobicContact CB-CD1 3.56Å; Y429-L447 HydrophobicContact CD1-CB 4.33Å; Y429-L447 HydrophobicContact CD2-CD1 4.02Å; Y429-L447 HydrophobicContact CE1-CB 3.95Å; Y429-L447 HydrophobicContact CE2-CB 4.39Å; Y429-L447 HydrophobicContact CE2-CD1 3.72Å; L447-R489 VanDerWaalsContact CD2-NH1 3.28Å; L447-W561 HydrophobicContact CD2-CB 3.53Å; L447-W561 HydrophobicContact CD2-CD2 4.34Å; L447-W561 HydrophobicContact CD2-CE3 4.32Å; L447-W561 HydrophobicContact CD2-CG 4.07Å
448	V	85.6	Confident	80.4	Confident	31 Å²	31	48.3 Å²	48.3	19%	0.188	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-36.5	-175.9	-149.3	0	0	0	0	112	I428 R430 F446 V563	I428-V448 PolarHBondContact O-N 2.86Å; R430-V448 HydrophobicContact CB-CG2 3.29Å; F446-V448 HydrophobicContact CD2-CG2 4.09Å; F446-V448 HydrophobicContact CE2-CG1 4.26Å; F446-V448 HydrophobicContact CE2-CG2 3.85Å; F446-V448 HydrophobicContact CZ-CG2 4.49Å; F446-V448 WeakPolarHBondContact O-CG2 3.47Å; V448-V563 WeakPolarHBondContact O-CG1 3.22Å
449	C	88.9	Confident	82.7	Confident	8 Å²	8	44 Å²	44	5%	0.054	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	164.2	-175.9	-76.2	0	0	0	0	112.3	I428 V461 C465	I428-C449 HydrophobicContact CB-CB 4.27Å; I428-C449 WeakPolarHBondContact CB-O 2.94Å; I428-C449 HydrophobicContact CG1-CB 4.46Å; I428-C449 PolarHBondContact N-O 3.46Å; I428-C449 PolarHBondContact O-N 3.03Å; C449-V461 HydrophobicContact CB-CG2 4.34Å; C449-C465 HydrophobicContact CB-CB 3.59Å; C449-C465 WeakPolarHBondContact CB-SG 3.3Å; C449-C465 WeakPolarHBondContact SG-CB 3.33Å; C449-C465 CovalentContact SG-SG 2.01Å; C449-C465 PolarHBondContact SG-SG 3.03Å
450	S	90.5	Very high	84.8	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.035	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	154.1	161.1	-50.6	0	0	0	0	111.7	Q425 A426 G626	Q425-S450 PolarHBondContact NE2-OG 2.98Å; A426-S450 CarbonylContact O-C 3.55Å; A426-S450 VanDerWaalsContact O-CA 3.27Å; A426-S450 WeakPolarHBondContact O-CA 3.36Å; S450-G626 WeakPolarHBondContact CB-O 3.06Å; S450-G626 PolarHBondContact N-O 2.95Å; S450-G626 PolarHBondContact OG-O 3.08Å
451	G	93.6	Very high	86.7	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	179.5	171	0	0	0	0	0	111.2	A426 V460	A426-G451 WeakPolarHBondContact CB-O 3.13Å; A426-G451 PolarHBondContact N-O 2.88Å; A426-G451 PolarHBondContact O-N 3.06Å; G451-V460 CarbonylContact C-O 3.55Å; G451-V460 WeakPolarHBondContact CA-O 3.47Å
452	A	95.8	Very high	88.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.8	-178.9	0	0	0	0	0	111.4	W424 V454 V459 V460 I539 I628 L645	W424-A452 CarbonylContact O-C 3.32Å; W424-A452 WeakPolarHBondContact O-CA 3.4Å; A452-V454 PolarHBondContact O-N 2.97Å; A452-V459 CarbonylContact O-C 3.48Å; A452-V459 VanDerWaalsContact O-CA 3.31Å; A452-V459 WeakPolarHBondContact O-CA 3.26Å; A452-V460 PolarHBondContact N-O 3.47Å; A452-V460 PolarHBondContact O-N 2.79Å; A452-I539 HydrophobicContact CB-CG2 3.95Å; A452-I628 HydrophobicContact CB-CD1 3.87Å; A452-I628 HydrophobicContact CB-CG2 4.11Å; A452-L645 HydrophobicContact CB-CD1 3.88Å; A452-L645 HydrophobicContact CB-CD2 3.89Å; A452-L645 HydrophobicContact CB-CG 4.48Å
453	L	96.4	Very high	90.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	121	169.3	-171.3	73.3	0	0	0	109.3	W424 N455 V459 L484 L526 A530 V536 P538 I539	W424-L453 HydrophobicContact CB-CB 4.48Å; W424-L453 PolarHBondContact O-N 2.77Å; L453-N455 WeakPolarHBondContact CD1-O 3.4Å; L453-N455 VanDerWaalsContact CG-O 3.27Å; L453-N455 WeakPolarHBondContact CG-O 3.17Å; L453-V459 HydrophobicContact CB-CG2 4.49Å; L453-V459 HydrophobicContact CD1-CG2 3.67Å; L453-L484 HydrophobicContact CB-CD2 4.26Å; L453-L484 HydrophobicContact CD1-CD1 3.94Å; L453-L484 HydrophobicContact CD1-CD2 4.39Å; L453-L484 HydrophobicContact CD2-CD1 4.12Å; L453-L526 HydrophobicContact CD1-CD1 4.12Å; L453-A530 HydrophobicContact CD1-CB 4.44Å; L453-A530 HydrophobicContact CD2-CB 4.29Å; L453-V536 HydrophobicContact CD2-CG1 3.8Å; L453-P538 CarbonylContact O-C 3.4Å; L453-P538 WeakPolarHBondContact O-CA 3.47Å; L453-I539 PolarHBondContact O-N 3.2Å
454	V	95.3	Very high	91.3	Very high	10 Å²	10	22.6 Å²	22.6	6%	0.061	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-19.5	-177.8	-67.7	0	0	0	0	112.6	A452 T458 V460 P538 I539 L541 L645 M679	A452-V454 PolarHBondContact O-N 2.97Å; V454-T458 HydrophobicContact CG2-CG2 3.81Å; V454-T458 VanDerWaalsContact CG2-O 3.26Å; V454-T458 WeakPolarHBondContact CG2-O 3.31Å; V454-T458 PolarHBondContact N-O 2.74Å; V454-V460 HydrophobicContact CB-CG2 4.42Å; V454-V460 HydrophobicContact CG1-CB 4.33Å; V454-V460 HydrophobicContact CG1-CG2 3.74Å; V454-V460 HydrophobicContact CG2-CG2 3.78Å; V454-P538 VanDerWaalsContact C-CB 3.5Å; V454-P538 WeakPolarHBondContact O-CB 3.08Å; V454-I539 HydrophobicContact CG1-CG2 4.07Å; V454-L541 HydrophobicContact CG1-CD2 4.08Å; V454-L645 HydrophobicContact CG1-CD2 4.27Å; V454-M679 HydrophobicContact CB-CE 3.32Å; V454-M679 HydrophobicContact CG2-CE 3.22Å; V454-M679 WeakPolarHBondContact O-CE 3.46Å
455	N	92.5	Very high	92	Very high	33 Å²	33	21.2 Å²	21.2	18%	0.176	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	-174.2	165.5	70	26.8	0	0	0	110.2	L453 R457 T458 M679	L453-N455 WeakPolarHBondContact CD1-O 3.4Å; L453-N455 VanDerWaalsContact CG-O 3.27Å; L453-N455 WeakPolarHBondContact CG-O 3.17Å; N455-R457 PolarHBondContact O-N 3.33Å; N455-R457 WeakPolarHBondContact OD1-CA 3.49Å; N455-R457 PolarHBondContact OD1-N 3.49Å; N455-T458 VanDerWaalsContact CG-OG1 3.3Å; N455-T458 PolarHBondContact ND2-OG1 3.3Å; N455-T458 VanDerWaalsContact ND2-OG1 3.12Å; N455-T458 WeakPolarHBondContact OD1-CA 3.47Å; N455-T458 WeakPolarHBondContact OD1-CB 3.22Å; N455-T458 PolarHBondContact OD1-N 3.31Å; N455-T458 PolarHBondContact OD1-OG1 2.86Å; N455-M679 HydrophobicContact CB-CE 4.06Å; N455-M679 WeakPolarHBondContact ND2-CG 3.34Å
456	E	92.6	Very high	92.4	Very high	23 Å²	23	17 Å²	17	11%	0.107	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.6	-178.1	-52.6	-177.3	134.5	0	0	115.1	Y379 P404 K529 A530 I532	Y379-E456 VanDerWaalsContact CE1-OE1 3.3Å; Y379-E456 WeakPolarHBondContact CE1-OE1 3.35Å; Y379-E456 PolarHBondContact OH-OE1 2.01Å; P404-E456 HydrophobicContact CG-CG 3.87Å; E456-K529 HydrophobicContact CB-CB 4.41Å; E456-K529 HydrophobicContact CB-CG 4.5Å; E456-K529 CarbonylContact O-C 3.59Å; E456-K529 WeakPolarHBondContact O-CA 3.32Å; E456-K529 WeakPolarHBondContact OE2-CE 3.4Å; E456-K529 IonicContact OE2-NZ 3.06Å; E456-K529 PolarHBondContact OE2-NZ 2.81Å; E456-A530 PolarHBondContact O-N 2.83Å; E456-I532 HydrophobicContact CG-CD1 4.29Å; E456-I532 HydrophobicContact CG-CG1 4.26Å
457	R	94.9	Very high	93	Very high	100 Å²	100	13.7 Å²	13.7	38%	0.377	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.5	1.8	-172	-70.4	-173.7	169.6	-81.3	3.8	114.4	N455 K525 L526 L527 K529	N455-R457 PolarHBondContact O-N 3.33Å; N455-R457 WeakPolarHBondContact OD1-CA 3.49Å; N455-R457 PolarHBondContact OD1-N 3.49Å; R457-K525 WeakPolarHBondContact O-CA 3.41Å; R457-L526 PolarHBondContact NH1-O 2.85Å; R457-L526 PolarHBondContact O-N 2.97Å; R457-L527 PolarHBondContact NH1-O 3.11Å; R457-K529 HydrophobicContact CG-CG 3.85Å
458	T	96.5	Very high	93.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.7	-166.3	-47.6	0	0	0	0	109.2	V454 N455 I523 L524 M679	V454-T458 HydrophobicContact CG2-CG2 3.81Å; V454-T458 VanDerWaalsContact CG2-O 3.26Å; V454-T458 WeakPolarHBondContact CG2-O 3.31Å; V454-T458 PolarHBondContact N-O 2.74Å; N455-T458 VanDerWaalsContact CG-OG1 3.3Å; N455-T458 PolarHBondContact ND2-OG1 3.3Å; N455-T458 VanDerWaalsContact ND2-OG1 3.12Å; N455-T458 WeakPolarHBondContact OD1-CA 3.47Å; N455-T458 WeakPolarHBondContact OD1-CB 3.22Å; N455-T458 PolarHBondContact OD1-N 3.31Å; N455-T458 PolarHBondContact OD1-OG1 2.86Å; T458-I523 HydrophobicContact CG2-CG2 3.42Å; T458-I523 VanDerWaalsContact CG2-CG2 3.42Å; T458-L524 WeakPolarHBondContact CA-O 3.43Å; T458-M679 HydrophobicContact CG2-CG 4.3Å
459	V	96.8	Very high	92.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.7	173.8	175.1	0	0	0	0	108.4	A426 I428 A452 L453 V482 L524 L526	A426-V459 HydrophobicContact CB-CG1 3.69Å; A426-V459 HydrophobicContact CB-CG2 4.31Å; I428-V459 HydrophobicContact CD1-CG1 4.35Å; A452-V459 CarbonylContact O-C 3.48Å; A452-V459 VanDerWaalsContact O-CA 3.31Å; A452-V459 WeakPolarHBondContact O-CA 3.26Å; L453-V459 HydrophobicContact CB-CG2 4.49Å; L453-V459 HydrophobicContact CD1-CG2 3.67Å; V459-V482 HydrophobicContact CG2-CG1 4.11Å; V459-L524 HydrophobicContact CB-CB 4.35Å; V459-L524 PolarHBondContact N-O 3.06Å; V459-L524 PolarHBondContact O-N 3.43Å; V459-L526 HydrophobicContact CG2-CD1 4.2Å; V459-L526 HydrophobicContact CG2-CD2 4.4Å
460	V	96.6	Very high	92.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.4	174.4	177.4	0	0	0	0	108.3	G451 A452 V454 I521 L645 L648 I675	G451-V460 CarbonylContact C-O 3.55Å; G451-V460 WeakPolarHBondContact CA-O 3.47Å; A452-V460 PolarHBondContact N-O 3.47Å; A452-V460 PolarHBondContact O-N 2.79Å; V454-V460 HydrophobicContact CB-CG2 4.42Å; V454-V460 HydrophobicContact CG1-CB 4.33Å; V454-V460 HydrophobicContact CG1-CG2 3.74Å; V454-V460 HydrophobicContact CG2-CG2 3.78Å; V460-I521 HydrophobicContact CG1-CD1 3.83Å; V460-I521 HydrophobicContact CG1-CG1 3.87Å; V460-L645 HydrophobicContact CB-CD2 4.28Å; V460-L645 HydrophobicContact CG1-CD2 4.28Å; V460-L648 HydrophobicContact CG1-CD1 3.76Å; V460-L648 HydrophobicContact CG1-CD2 4.4Å; V460-I675 HydrophobicContact CG2-CD1 4.3Å; V460-I675 HydrophobicContact CG2-CG1 4.46Å; V460-I675 HydrophobicContact CG2-CG2 3.9Å
461	V	95.4	Very high	92.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161	-177.5	66.4	0	0	0	0	109.2	I428 C449 C465 V466 A522 L524	I428-V461 HydrophobicContact CG1-CG2 4.1Å; C449-V461 HydrophobicContact CB-CG2 4.34Å; V461-C465 HydrophobicContact CG2-CB 3.7Å; V461-V466 HydrophobicContact CG1-CG1 3.92Å; V461-A522 HydrophobicContact CG1-CB 4.11Å; V461-A522 PolarHBondContact N-O 2.83Å; V461-A522 PolarHBondContact O-N 3.39Å; V461-A522 VanDerWaalsContact O-O 3.08Å; V461-L524 HydrophobicContact CB-CD1 4.45Å; V461-L524 HydrophobicContact CG1-CD1 3.9Å; V461-L524 HydrophobicContact CG1-CD2 4.29Å; V461-L524 HydrophobicContact CG1-CG 3.85Å
462	A	94	Very high	92.4	Very high	3 Å²	3	34.5 Å²	34.5	3%	0.025	18%	0.184	C	C	.	.			trans	-64.3	145.1	167.9	0	0	0	0	0	110.6	H464 C465 D520	A462-H464 VanDerWaalsContact CB-CE1 3.47Å; A462-H464 WeakPolarHBondContact CB-CE1 3.48Å; A462-C465 VanDerWaalsContact O-CB 3.29Å; A462-C465 WeakPolarHBondContact O-CB 3.43Å; A462-C465 PolarHBondContact O-N 2.81Å; A462-D520 WeakPolarHBondContact CA-O 3.18Å
463	A	94.8	Very high	92.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-68.2	-35.9	-177.1	0	0	0	0	0	112.8	C465 V466 T467 L508 Y512 D520 A522	A463-C465 PolarHBondContact O-N 3.27Å; A463-C465 VanDerWaalsContact O-N 3.15Å; A463-V466 VanDerWaalsContact O-CG2 3.31Å; A463-V466 WeakPolarHBondContact O-CG2 3.27Å; A463-V466 PolarHBondContact O-N 2.62Å; A463-T467 PolarHBondContact O-N 2.78Å; A463-T467 PolarHBondContact O-OG1 3.28Å; A463-L508 HydrophobicContact CB-CD1 3.3Å; A463-Y512 HydrophobicContact CB-CD1 3.89Å; A463-Y512 HydrophobicContact CB-CD2 3.53Å; A463-Y512 HydrophobicContact CB-CE1 3.86Å; A463-Y512 HydrophobicContact CB-CE2 3.53Å; A463-Y512 HydrophobicContact CB-CG 3.69Å; A463-D520 WeakPolarHBondContact CA-OD1 3.05Å; A463-D520 WeakPolarHBondContact CB-OD1 3.48Å; A463-D520 PolarHBondContact N-OD1 3.24Å; A463-A522 HydrophobicContact CB-CB 4.26Å
464	H	90.9	Very high	91.9	Very high	58 Å²	58	42.6 Å²	42.6	27%	0.269	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-61.2	-23.8	177.1	74.7	-101.3	0	0	0	112.5	A462 V466 T467 Y512 L517 D520 S650	A462-H464 VanDerWaalsContact CB-CE1 3.47Å; A462-H464 WeakPolarHBondContact CB-CE1 3.48Å; H464-V466 PolarHBondContact O-N 2.83Å; H464-T467 WeakPolarHBondContact CA-OG1 3.43Å; H464-Y512 WeakPolarHBondContact CA-OH 3.28Å; H464-Y512 WeakPolarHBondContact CB-OH 3.36Å; H464-Y512 PolarHBondContact N-OH 2.83Å; H464-L517 HydrophobicContact CB-CD2 4.09Å; H464-D520 IonicContact CE1-OD2 2.67Å; H464-D520 PolarHBondContact CE1-OD2 2.86Å; H464-D520 IonicContact CG-OD1 2.84Å; H464-D520 IonicContact CG-OD2 2.78Å; H464-D520 PolarHBondContact N-OD1 2.74Å; H464-D520 IonicContact ND1-OD1 3.33Å; H464-D520 PolarHBondContact ND1-OD1 2.9Å; H464-D520 IonicContact ND1-OD2 2.76Å; H464-D520 PolarHBondContact ND1-OD2 2.85Å; H464-S650 PolarHBondContact CE1-O 2.98Å; H464-S650 VanDerWaalsContact CE1-O 3.31Å
465	C	90.6	Very high	91.7	Very high	8 Å²	8	42.7 Å²	42.7	5%	0.054	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-69.8	-21.4	177.4	-64.4	0	0	0	0	113.9	C449 V461 A462 A463	C449-C465 HydrophobicContact CB-CB 3.59Å; C449-C465 WeakPolarHBondContact CB-SG 3.3Å; C449-C465 WeakPolarHBondContact SG-CB 3.33Å; C449-C465 CovalentContact SG-SG 2.01Å; C449-C465 PolarHBondContact SG-SG 3.03Å; V461-C465 HydrophobicContact CG2-CB 3.7Å; A462-C465 VanDerWaalsContact O-CB 3.29Å; A462-C465 WeakPolarHBondContact O-CB 3.43Å; A462-C465 PolarHBondContact O-N 2.81Å; A463-C465 PolarHBondContact O-N 3.27Å; A463-C465 VanDerWaalsContact O-N 3.15Å
466	V	93	Very high	91.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-122.5	7	-171.2	-60.4	0	0	0	0	112.8	V461 A463 H464 I475 L480 I506 A522 L524	V461-V466 HydrophobicContact CG1-CG1 3.92Å; A463-V466 VanDerWaalsContact O-CG2 3.31Å; A463-V466 WeakPolarHBondContact O-CG2 3.27Å; A463-V466 PolarHBondContact O-N 2.62Å; H464-V466 PolarHBondContact O-N 2.83Å; V466-I475 PolarHBondContact O-N 3.1Å; V466-L480 HydrophobicContact CB-CD1 4.22Å; V466-L480 HydrophobicContact CG1-CD1 4.04Å; V466-I506 HydrophobicContact CB-CG2 4.16Å; V466-I506 HydrophobicContact CG2-CG2 3.84Å; V466-A522 HydrophobicContact CG2-CB 3.67Å; V466-L524 HydrophobicContact CG1-CD1 4.44Å; V466-L524 HydrophobicContact CG1-CD2 3.82Å
467	T	93	Very high	91.7	Very high	4 Å²	4	50 Å²	50	3%	0.025	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-119.3	162.6	177.2	50.6	0	0	0	0	110.7	A463 H464 K471 T473 L508 Y512	A463-T467 PolarHBondContact O-N 2.78Å; A463-T467 PolarHBondContact O-OG1 3.28Å; H464-T467 WeakPolarHBondContact CA-OG1 3.43Å; T467-K471 WeakPolarHBondContact CB-O 3.49Å; T467-T473 CarbonylContact C-O 3.52Å; T467-T473 VanDerWaalsContact CA-O 3.24Å; T467-T473 WeakPolarHBondContact CA-O 3.25Å; T467-L508 HydrophobicContact CG2-CD1 4.18Å; T467-L508 HydrophobicContact CG2-CD2 4.3Å; T467-Y512 HydrophobicContact CG2-CE1 4.19Å
468	D	87.4	Confident	91.6	Very high	57 Å²	57	48.9 Å²	48.9	31%	0.305	27%	0.274	S	S	.	.			trans	-71.6	145.1	168	-64.3	-51.5	0	0	0	110.2	R430 G470 K471 T473	R430-D468 IonicContact NH2-OD1 3.12Å; R430-D468 PolarHBondContact NH2-OD1 3.41Å; D468-G470 PolarHBondContact O-N 3.03Å; D468-K471 HydrophobicContact CB-CB 4.31Å; D468-K471 HydrophobicContact CB-CD 4.33Å; D468-K471 PolarHBondContact O-N 2.78Å; D468-T473 PolarHBondContact N-O 2.93Å; D468-T473 PolarHBondContact OD2-OG1 2.92Å
469	L	82.2	Confident	91.3	Very high	167 Å²	167	49.9 Å²	49.9	87%	0.874	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	123.5	-178.1	-69.6	167.4	0	0	0	111.7	K471	L469-K471 VanDerWaalsContact C-N 3.26Å; L469-K471 PolarHBondContact O-N 3.38Å
470	G	82.4	Confident	91.2	Very high	52 Å²	52	50.1 Å²	50.1	54%	0.536	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	14.7	179.1	0	0	0	0	0	115	D468	D468-G470 PolarHBondContact O-N 3.03Å
471	K	88.6	Confident	91	Very high	125 Å²	125	52 Å²	52	54%	0.543	29%	0.289	S	S	.	.	S	Bend	trans	-131.9	158.4	-177.8	-61.7	-178.5	-176.8	177.6	0	111.9	T467 D468 L469 T473	T467-K471 WeakPolarHBondContact CB-O 3.49Å; D468-K471 HydrophobicContact CB-CB 4.31Å; D468-K471 HydrophobicContact CB-CD 4.33Å; D468-K471 PolarHBondContact O-N 2.78Å; L469-K471 VanDerWaalsContact C-N 3.26Å; L469-K471 PolarHBondContact O-N 3.38Å; K471-T473 VanDerWaalsContact C-N 3.28Å; K471-T473 WeakPolarHBondContact CB-OG1 2.89Å
472	V	90.1	Very high	91	Very high	84 Å²	84	52 Å²	52	51%	0.509	29%	0.289	S	S	.	.			trans	-87.7	4.3	170.2	-61.6	0	0	0	0	112.8	M474 L508 Y512 P514	V472-M474 PolarHBondContact O-N 3.28Å; V472-L508 HydrophobicContact CB-CD2 4.27Å; V472-Y512 HydrophobicContact CG1-CD1 4.35Å; V472-P514 HydrophobicContact CG1-CG 4Å
473	T	91.1	Very high	90.9	Very high	68 Å²	68	52.1 Å²	52.1	42%	0.417	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-74	119.2	179.4	50.5	0	0	0	0	110.1	T467 D468 K471	T467-T473 CarbonylContact C-O 3.52Å; T467-T473 VanDerWaalsContact CA-O 3.24Å; T467-T473 WeakPolarHBondContact CA-O 3.25Å; D468-T473 PolarHBondContact N-O 2.93Å; D468-T473 PolarHBondContact OD2-OG1 2.92Å; K471-T473 VanDerWaalsContact C-N 3.28Å; K471-T473 WeakPolarHBondContact CB-OG1 2.89Å
474	M	91.6	Very high	90.9	Very high	103 Å²	103	52.1 Å²	52.1	51%	0.507	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-76.4	140.4	-178.6	-64.2	174.2	-73.4	0	0	111.6	V472 I506 L508	V472-M474 PolarHBondContact O-N 3.28Å; M474-I506 HydrophobicContact CG-CG2 4.48Å; M474-I506 HydrophobicContact SD-CB 4.24Å; M474-I506 HydrophobicContact SD-CG2 4.14Å; M474-L508 HydrophobicContact SD-CB 4.46Å
475	I	91.8	Very high	90.8	Very high	11 Å²	11	49.6 Å²	49.6	6%	0.056	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-66.3	144.3	170.3	-58.9	167.7	0	0	0	108.8	V466 T477 D479 L480 I506	V466-I475 PolarHBondContact O-N 3.1Å; I475-T477 PolarHBondContact O-N 2.92Å; I475-D479 HydrophobicContact CG2-CB 4.06Å; I475-L480 HydrophobicContact CB-CD1 4.06Å; I475-L480 HydrophobicContact CB-CG 4.29Å; I475-L480 HydrophobicContact CD1-CD2 4.42Å; I475-L480 HydrophobicContact CG2-CD1 4.18Å; I475-L480 HydrophobicContact CG2-CD2 4.2Å; I475-L480 HydrophobicContact CG2-CG 3.86Å; I475-I506 WeakPolarHBondContact O-CD1 3.28Å
476	K	92.1	Very high	90.6	Very high	155 Å²	155	49.7 Å²	49.7	67%	0.674	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-59.9	136	177.4	-65.7	179.2	-178	175.9	0	110.4	A478 D479	K476-A478 PolarHBondContact O-N 3.01Å; K476-A478 VanDerWaalsContact O-N 3.15Å; K476-D479 HydrophobicContact CB-CB 4.49Å; K476-D479 PolarHBondContact O-N 2.04Å
477	T	92.8	Very high	90.2	Very high	56 Å²	56	50.6 Å²	50.6	34%	0.344	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.6	-31.8	177.2	50.3	0	0	0	0	113.1	I475 D479 L480 I503 I506	I475-T477 PolarHBondContact O-N 2.92Å; T477-D479 VanDerWaalsContact C-N 3.26Å; T477-D479 PolarHBondContact O-N 2.77Å; T477-L480 PolarHBondContact O-N 2.9Å; T477-I503 HydrophobicContact CG2-CG2 4.06Å; T477-I506 HydrophobicContact CG2-CD1 4.03Å; T477-I506 HydrophobicContact CG2-CG1 3.97Å
478	A	91.3	Very high	89.7	Confident	75 Å²	75	53.7 Å²	53.7	62%	0.62	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-68.8	-21.5	176.2	0	0	0	0	0	114	K476	K476-A478 PolarHBondContact O-N 3.01Å; K476-A478 VanDerWaalsContact O-N 3.15Å
479	D	91.9	Very high	89.3	Confident	22 Å²	22	51.6 Å²	51.6	12%	0.118	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-95.4	4.8	178.1	-69.5	-25.2	0	0	0	112	R430 R431 S433 W445 I475 K476 T477	R430-D479 CarbonylContact C-O 3.44Å; R430-D479 VanDerWaalsContact CA-O 3.28Å; R430-D479 WeakPolarHBondContact CA-O 3.28Å; R431-D479 HydrophobicContact CB-CB 4.21Å; R431-D479 PolarHBondContact N-O 3.09Å; S433-D479 PolarHBondContact OG-OD2 3.33Å; W445-D479 WeakPolarHBondContact CZ3-O 3.49Å; I475-D479 HydrophobicContact CG2-CB 4.06Å; K476-D479 HydrophobicContact CB-CB 4.49Å; K476-D479 PolarHBondContact O-N 2.04Å; T477-D479 VanDerWaalsContact C-N 3.26Å; T477-D479 PolarHBondContact O-N 2.77Å
480	L	93.1	Very high	89	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.9	176.4	-67.9	177.4	0	0	0	111.3	Y429 R430 V466 I475 T477 I503 I506	Y429-L480 VanDerWaalsContact O-CA 3.29Å; Y429-L480 WeakPolarHBondContact O-CA 3.02Å; Y429-L480 WeakPolarHBondContact O-CD2 3.33Å; R430-L480 HydrophobicContact CB-CD2 3.95Å; R430-L480 HydrophobicContact CG-CD2 4.33Å; V466-L480 HydrophobicContact CB-CD1 4.22Å; V466-L480 HydrophobicContact CG1-CD1 4.04Å; I475-L480 HydrophobicContact CB-CD1 4.06Å; I475-L480 HydrophobicContact CB-CG 4.29Å; I475-L480 HydrophobicContact CD1-CD2 4.42Å; I475-L480 HydrophobicContact CG2-CD1 4.18Å; I475-L480 HydrophobicContact CG2-CD2 4.2Å; I475-L480 HydrophobicContact CG2-CG 3.86Å; T477-L480 PolarHBondContact O-N 2.9Å; L480-I503 HydrophobicContact CB-CD1 3.54Å; L480-I503 HydrophobicContact CD1-CD1 4.39Å; L480-I506 HydrophobicContact CD1-CD1 3.72Å
481	K	93	Very high	88.3	Confident	39 Å²	39	45.7 Å²	45.7	17%	0.17	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152	170.4	67.4	178.5	-176.6	-179.1	0	110.7	Y429 W445	Y429-K481 VanDerWaalsContact CB-CE 3.48Å; Y429-K481 HydrophobicContact CG-CG 4.36Å; Y429-K481 PolarHBondContact N-O 2.88Å; Y429-K481 PolarHBondContact O-N 3.01Å; W445-K481 HydrophobicContact CD2-CD 3.91Å; W445-K481 HydrophobicContact CD2-CG 4.39Å; W445-K481 HydrophobicContact CE3-CD 3.9Å; W445-K481 HydrophobicContact CE3-CG 3.86Å; W445-K481 HydrophobicContact CG-CD 4.44Å; W445-K481 HydrophobicContact CH2-CB 4.32Å; W445-K481 HydrophobicContact CH2-CD 4.4Å; W445-K481 HydrophobicContact CH2-CG 4.27Å; W445-K481 HydrophobicContact CZ2-CD 4.43Å; W445-K481 HydrophobicContact CZ3-CB 4.17Å; W445-K481 HydrophobicContact CZ3-CD 4.13Å; W445-K481 HydrophobicContact CZ3-CG 3.78Å
482	V	95.1	Very high	87.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.4	177.4	-179.1	0	0	0	0	109.2	A426 A427 I428 V459 L484 L501 I503 L524 L526	A426-V482 HydrophobicContact CB-CG1 3.98Å; A427-V482 WeakPolarHBondContact O-CA 3.04Å; I428-V482 HydrophobicContact CD1-CB 4.41Å; I428-V482 HydrophobicContact CD1-CG1 4.16Å; I428-V482 HydrophobicContact CD1-CG2 3.82Å; V459-V482 HydrophobicContact CG2-CG1 4.11Å; V482-L484 HydrophobicContact CG1-CD2 4.22Å; V482-L484 HydrophobicContact CG1-CG 4.31Å; V482-L501 PolarHBondContact N-O 3.44Å; V482-L501 PolarHBondContact O-N 2.94Å; V482-I503 HydrophobicContact CG2-CD1 3.88Å; V482-I503 HydrophobicContact CG2-CG1 3.84Å; V482-L524 HydrophobicContact CG2-CD1 3.99Å; V482-L526 HydrophobicContact CB-CD2 3.9Å; V482-L526 HydrophobicContact CG1-CD2 4.24Å; V482-L526 HydrophobicContact CG2-CD2 3.86Å
483	V	93.1	Very high	86.3	Confident	6 Å²	6	46 Å²	46	4%	0.036	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.8	178.4	-174.7	0	0	0	0	109.5	A427 Y429 K486 I498 Q499	A427-V483 HydrophobicContact CB-CB 4.17Å; A427-V483 PolarHBondContact N-O 2.89Å; A427-V483 PolarHBondContact O-N 3.25Å; Y429-V483 HydrophobicContact CD2-CG2 3.84Å; Y429-V483 HydrophobicContact CE2-CB 4.27Å; Y429-V483 HydrophobicContact CE2-CG2 3.9Å; V483-K486 HydrophobicContact CG1-CB 4.39Å; V483-K486 HydrophobicContact CG1-CD 4.25Å; V483-I498 HydrophobicContact CG1-CG2 3.34Å; V483-Q499 WeakPolarHBondContact CA-O 3.41Å
484	L	93.2	Very high	84.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	155	-178.9	-59.4	171.8	0	0	0	111.5	A426 L453 V482 K486 I498 Q499 L501 A530 V536	A426-L484 HydrophobicContact CB-CD2 3.55Å; L453-L484 HydrophobicContact CB-CD2 4.26Å; L453-L484 HydrophobicContact CD1-CD1 3.94Å; L453-L484 HydrophobicContact CD1-CD2 4.39Å; L453-L484 HydrophobicContact CD2-CD1 4.12Å; V482-L484 HydrophobicContact CG1-CD2 4.22Å; V482-L484 HydrophobicContact CG1-CG 4.31Å; L484-K486 PolarHBondContact O-N 2.88Å; L484-I498 WeakPolarHBondContact O-CA 3.21Å; L484-Q499 HydrophobicContact CB-CB 4.38Å; L484-Q499 PolarHBondContact N-O 3.5Å; L484-Q499 PolarHBondContact O-N 2.92Å; L484-L501 HydrophobicContact CD1-CD1 3.63Å; L484-L501 HydrophobicContact CG-CD1 4.44Å; L484-A530 HydrophobicContact CD1-CB 3.6Å; L484-V536 HydrophobicContact CB-CG1 4.1Å; L484-V536 HydrophobicContact CB-CG2 4Å; L484-V536 HydrophobicContact CD1-CG1 3.96Å
485	G	89	Confident	83.7	Confident	6 Å²	6	47.5 Å²	47.5	6%	0.062	25%	0.245	C	C	.	.	S	Bend	trans	75.1	11.4	176.4	0	0	0	0	0	114.4
486	K	87.1	Confident	82.7	Confident	10 Å²	10	57.3 Å²	57.3	4%	0.043	29%	0.287	C	S	.	.			trans	-78.3	145	177.9	-171.6	172.4	173.1	80.9	0	110.2	A427 Y429 V483 L484 Y488 R489 D490 D491 I498 W561	A427-K486 HydrophobicContact CB-CD 4.27Å; Y429-K486 VanDerWaalsContact OH-CE 3.22Å; Y429-K486 WeakPolarHBondContact OH-CE 3.24Å; Y429-K486 PolarHBondContact OH-NZ 2.69Å; V483-K486 HydrophobicContact CG1-CB 4.39Å; V483-K486 HydrophobicContact CG1-CD 4.25Å; L484-K486 PolarHBondContact O-N 2.88Å; K486-Y488 WeakPolarHBondContact CE-O 3.4Å; K486-Y488 WeakPolarHBondContact CG-O 3.38Å; K486-Y488 PolarHBondContact NZ-O 2.87Å; K486-R489 WeakPolarHBondContact CE-O 2.93Å; K486-R489 VanDerWaalsContact NZ-C 3.3Å; K486-R489 PolarHBondContact NZ-O 2.8Å; K486-D490 PolarHBondContact NZ-O 3.04Å; K486-D491 IonicContact NZ-OD1 3.6Å; K486-D491 PolarHBondContact NZ-OD1 3.15Å; K486-I498 HydrophobicContact CG-CD1 4.4Å; K486-W561 HydrophobicContact CB-CH2 4.42Å; K486-W561 HydrophobicContact CB-CZ2 3.99Å; K486-W561 HydrophobicContact CG-CZ2 4.15Å; K486-W561 WeakPolarHBondContact O-CZ2 3.48Å
487	F	84.1	Confident	82	Confident	19 Å²	19	52.4 Å²	52.4	8%	0.083	27%	0.27	C	S	.	.			trans	-126.2	-50.5	173	176.9	-106.9	0	0	0	110.8	R421 W561 T576 L577	R421-F487 HydrophobicContact CG-CD2 3.77Å; R421-F487 HydrophobicContact CG-CE2 4.28Å; R421-F487 HydrophobicContact CG-CG 4.26Å; R421-F487 VanDerWaalsContact CZ-CB 3.48Å; R421-F487 VanDerWaalsContact NH1-CB 3.28Å; F487-W561 PolarHBondContact O-NE1 3.48Å; F487-W561 VanDerWaalsContact O-NE1 3.09Å; F487-T576 HydrophobicContact CD1-CG2 4.11Å; F487-T576 HydrophobicContact CE1-CG2 3.49Å; F487-T576 VanDerWaalsContact CE1-CG2 3.49Å; F487-T576 HydrophobicContact CZ-CG2 3.93Å; F487-L577 HydrophobicContact CD2-CB 4.16Å; F487-L577 HydrophobicContact CE2-CB 4.42Å; F487-L577 PolarHBondContact O-N 3.31Å
488	Y	83.2	Confident	81.7	Confident	68 Å²	68	52.2 Å²	52.2	27%	0.267	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-76.8	140.3	170.5	-62.2	-79.6	0	0	0	111.1	K486 D490 E495 D575 T576	K486-Y488 WeakPolarHBondContact CE-O 3.4Å; K486-Y488 WeakPolarHBondContact CG-O 3.38Å; K486-Y488 PolarHBondContact NZ-O 2.87Å; Y488-D490 VanDerWaalsContact C-N 3.27Å; Y488-D490 PolarHBondContact O-N 2.97Å; Y488-E495 WeakPolarHBondContact CD2-OE1 3.41Å; Y488-E495 WeakPolarHBondContact CE2-OE1 3.49Å; Y488-D575 WeakPolarHBondContact CA-O 3.41Å; Y488-T576 HydrophobicContact CD1-CG2 3.59Å; Y488-T576 HydrophobicContact CE1-CG2 3.53Å
489	R	78.6	Confident	81.8	Confident	14 Å²	14	50 Å²	50	5%	0.053	24%	0.243	C	C	.	.	S	Bend	trans	-65.9	-31.7	172.8	-179.6	170.4	158.7	92.1	-1.1	112	L447 K486 D491 N562 F572 D575	L447-R489 VanDerWaalsContact CD2-NH1 3.28Å; K486-R489 WeakPolarHBondContact CE-O 2.93Å; K486-R489 VanDerWaalsContact NZ-C 3.3Å; K486-R489 PolarHBondContact NZ-O 2.8Å; R489-D491 PolarHBondContact O-N 3.03Å; R489-N562 WeakPolarHBondContact CD-O 3.43Å; R489-N562 PolarHBondContact NE-O 3.02Å; R489-N562 PolarHBondContact NH1-O 3.35Å; R489-F572 HydrophobicContact CG-CE1 4.33Å; R489-F572 HydrophobicContact CG-CZ 4.09Å; R489-F572 VanDerWaalsContact NH2-CE2 3.3Å; R489-D575 HydrophobicContact CB-CB 4.31Å; R489-D575 PolarHBondContact N-O 2.82Å
490	D	76	Confident	81.8	Confident	17 Å²	17	52.7 Å²	52.7	9%	0.091	26%	0.264	C	S	.	.			trans	-57.4	130.7	177.3	-169	1.6	0	0	0	112.4	K486 Y488 D492 R493	K486-D490 PolarHBondContact NZ-O 3.04Å; Y488-D490 VanDerWaalsContact C-N 3.27Å; Y488-D490 PolarHBondContact O-N 2.97Å; D490-D492 PolarHBondContact OD1-N 2.81Å; D490-D492 VanDerWaalsContact OD1-N 3.08Å; D490-R493 HydrophobicContact CB-CG 4.27Å; D490-R493 IonicContact OD2-NE 3.15Å
491	D	68.1	Low	81.8	Confident	77 Å²	77	53.2 Å²	53.2	41%	0.412	27%	0.266	S	S	.	.	S	Bend	trans	-91.5	-21.1	-179.1	-75.8	-26.1	0	0	0	112.9	Y429 K486 R489 R493	Y429-D491 WeakPolarHBondContact CE1-OD2 3.46Å; Y429-D491 VanDerWaalsContact OH-CG 3.3Å; Y429-D491 PolarHBondContact OH-OD1 2.93Å; Y429-D491 PolarHBondContact OH-OD2 3.08Å; K486-D491 IonicContact NZ-OD1 3.6Å; K486-D491 PolarHBondContact NZ-OD1 3.15Å; R489-D491 PolarHBondContact O-N 3.03Å; D491-R493 PolarHBondContact O-N 2.72Å
492	D	66.1	Low	81.9	Confident	137 Å²	137	57.5 Å²	57.5	73%	0.733	29%	0.287	S	S	*	.	S	Bend	trans	-78.9	-6.7	-179	-66.1	-30	0	0	0	112.3	D490 D494	D490-D492 PolarHBondContact OD1-N 2.81Å; D490-D492 VanDerWaalsContact OD1-N 3.08Å; D492-D494 PolarHBondContact O-N 2.76Å
493	R	69.7	Low	82	Confident	80 Å²	80	58 Å²	58	30%	0.302	29%	0.29	S	S	.	.	S	Bend	trans	-81	105.8	173	-70.4	-173.9	-170.5	-140.5	-8.3	110.2	D490 D491 E495 K573 N574	D490-R493 HydrophobicContact CB-CG 4.27Å; D490-R493 IonicContact OD2-NE 3.15Å; D491-R493 PolarHBondContact O-N 2.72Å; R493-E495 PolarHBondContact O-N 3.43Å; R493-K573 PolarHBondContact NE-O 2.75Å; R493-K573 PolarHBondContact NH2-O 3.26Å; R493-N574 PolarHBondContact NH2-OD1 2.77Å
494	D	58.6	Low	82.1	Confident	166 Å²	166	60.7 Å²	60.7	89%	0.888	31%	0.308	S	S	*	.			trans	-67	78	170.6	-89.2	-28.5	0	0	0	112	D492 K496	D492-D494 PolarHBondContact O-N 2.76Å; D494-K496 PolarHBondContact O-N 2.94Å
495	E	70	Confident	82.3	Confident	36 Å²	36	62.4 Å²	62.4	17%	0.168	32%	0.323	C	S	.	.			trans	-80.5	108.1	160.1	-75	-162.2	-175.2	0	0	108.5	R421 Y488 R493 T497 I498 R535	R421-E495 IonicContact CZ-OE1 3.83Å; R421-E495 IonicContact CZ-OE2 2.72Å; R421-E495 IonicContact NH1-OE1 2.94Å; R421-E495 IonicContact NH1-OE2 3Å; R421-E495 PolarHBondContact NH1-OE2 3.42Å; R421-E495 IonicContact NH2-OE1 3.72Å; R421-E495 PolarHBondContact NH2-OE1 2.86Å; R421-E495 VanDerWaalsContact NH2-OE1 3.12Å; R421-E495 IonicContact NH2-OE2 3.65Å; Y488-E495 WeakPolarHBondContact CD2-OE1 3.41Å; Y488-E495 WeakPolarHBondContact CE2-OE1 3.49Å; R493-E495 PolarHBondContact O-N 3.43Å; E495-T497 PolarHBondContact O-N 3Å; E495-I498 HydrophobicContact CB-CD1 3.75Å; E495-I498 HydrophobicContact CB-CG1 3.84Å; E495-I498 PolarHBondContact O-N 2.92Å; E495-R535 IonicContact OE2-NH1 3.15Å; E495-R535 PolarHBondContact OE2-NH1 3.5Å; E495-R535 VanDerWaalsContact OE2-NH1 3.15Å
496	K	71	Confident	82.6	Confident	217 Å²	217	63.2 Å²	63.2	94%	0.943	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-11.4	175.8	-68.7	-177.7	177.9	178.6	0	115	D494	D494-K496 PolarHBondContact O-N 2.94Å
497	T	76.3	Confident	83.1	Confident	51 Å²	51	65 Å²	65	31%	0.313	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-8	-178.9	55.1	0	0	0	0	114.4	E495 R535	E495-T497 PolarHBondContact O-N 3Å; T497-R535 WeakPolarHBondContact OG1-CD 3.17Å; T497-R535 PolarHBondContact OG1-NH1 2.95Å
498	I	88.1	Confident	83.7	Confident	52 Å²	52	65.8 Å²	65.8	27%	0.267	34%	0.34	S	S	.	.			trans	-73.4	138.5	178.7	-68.4	173.8	0	0	0	109.9	V483 L484 K486 E495	V483-I498 HydrophobicContact CG1-CG2 3.34Å; L484-I498 WeakPolarHBondContact O-CA 3.21Å; K486-I498 HydrophobicContact CG-CD1 4.4Å; E495-I498 HydrophobicContact CB-CD1 3.75Å; E495-I498 HydrophobicContact CB-CG1 3.84Å; E495-I498 PolarHBondContact O-N 2.92Å
499	Q	92.1	Very high	84.3	Confident	28 Å²	28	63.5 Å²	63.5	13%	0.131	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	108.2	177.6	-61.8	178.8	54.3	0	0	109.5	V483 L484 L501 R531	V483-Q499 WeakPolarHBondContact CA-O 3.41Å; L484-Q499 HydrophobicContact CB-CB 4.38Å; L484-Q499 PolarHBondContact N-O 3.5Å; L484-Q499 PolarHBondContact O-N 2.92Å; Q499-L501 HydrophobicContact CB-CG 4.47Å; Q499-R531 PolarHBondContact NE2-O 3.3Å
500	S	92.2	Very high	85.1	Confident	80 Å²	80	67.8 Å²	67.8	56%	0.559	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	115.7	171.6	-174.8	0	0	0	0	109.1
501	L	94.4	Very high	86	Confident	14 Å²	14	72.3 Å²	72.3	7%	0.073	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.7	-173.4	-60.8	178	0	0	0	110.7	V482 L484 Q499 L526 D528 A530	V482-L501 PolarHBondContact N-O 3.44Å; V482-L501 PolarHBondContact O-N 2.94Å; L484-L501 HydrophobicContact CD1-CD1 3.63Å; L484-L501 HydrophobicContact CG-CD1 4.44Å; Q499-L501 HydrophobicContact CB-CG 4.47Å; L501-L526 HydrophobicContact CB-CD2 4.07Å; L501-L526 HydrophobicContact CD1-CD1 3.58Å; L501-L526 HydrophobicContact CD1-CD2 4.37Å; L501-L526 HydrophobicContact CD1-CG 4.4Å; L501-D528 HydrophobicContact CD2-CB 4.39Å; L501-A530 HydrophobicContact CD1-CB 3.97Å
502	Q	94.6	Very high	87.3	Confident	130 Å²	130	69.4 Å²	69.4	61%	0.607	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	152.2	173.9	-66.8	-176.6	-10	0	0	111.3	L527	Q502-L527 HydrophobicContact CB-CB 4.31Å; Q502-L527 HydrophobicContact CB-CD2 4.41Å; Q502-L527 PolarHBondContact O-N 3.04Å
503	I	96.1	Very high	88.6	Confident	11 Å²	11	65.4 Å²	65.4	6%	0.056	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.1	179.4	-56.4	176.9	0	0	0	108.7	T477 L480 V482 A505 I506 L524 K525	T477-I503 HydrophobicContact CG2-CG2 4.06Å; L480-I503 HydrophobicContact CB-CD1 3.54Å; L480-I503 HydrophobicContact CD1-CD1 4.39Å; V482-I503 HydrophobicContact CG2-CD1 3.88Å; V482-I503 HydrophobicContact CG2-CG1 3.84Å; I503-A505 WeakPolarHBondContact CG2-O 3.39Å; I503-I506 HydrophobicContact CG2-CG1 4.05Å; I503-L524 HydrophobicContact CD1-CB 4.49Å; I503-L524 HydrophobicContact CD1-CD1 4Å; I503-L524 HydrophobicContact CD1-CD2 4.19Å; I503-L524 HydrophobicContact CD1-CG 4.44Å; I503-L524 HydrophobicContact CG2-CB 4.43Å; I503-L524 HydrophobicContact CG2-CD2 4.45Å; I503-K525 CarbonylContact C-O 3.47Å; I503-K525 WeakPolarHBondContact CA-O 3.47Å; I503-K525 WeakPolarHBondContact CG2-O 3.14Å
504	S	96	Very high	89.6	Confident	61 Å²	61	62.8 Å²	62.8	43%	0.427	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-36.9	174.5	58.6	0	0	0	0	112.3	K525	S504-K525 PolarHBondContact N-O 3.33Å; S504-K525 WeakPolarHBondContact OG-CB 3.39Å; S504-K525 PolarHBondContact OG-O 3.42Å; S504-K525 VanDerWaalsContact OG-O 3.09Å
505	A	96.3	Very high	90.9	Very high	37 Å²	37	62 Å²	62	31%	0.306	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	150.7	179.1	0	0	0	0	0	111.9	I503 K525	I503-A505 WeakPolarHBondContact CG2-O 3.39Å; A505-K525 HydrophobicContact CB-CB 4.17Å; A505-K525 HydrophobicContact CB-CG 4.45Å; A505-K525 PolarHBondContact O-N 2.98Å
506	I	96.7	Very high	91.7	Very high	22 Å²	22	64.4 Å²	64.4	11%	0.113	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.6	171.2	-56	166	0	0	0	106.4	V466 M474 I475 T477 L480 I503 L524	V466-I506 HydrophobicContact CB-CG2 4.16Å; V466-I506 HydrophobicContact CG2-CG2 3.84Å; M474-I506 HydrophobicContact CG-CG2 4.48Å; M474-I506 HydrophobicContact SD-CB 4.24Å; M474-I506 HydrophobicContact SD-CG2 4.14Å; I475-I506 WeakPolarHBondContact O-CD1 3.28Å; T477-I506 HydrophobicContact CG2-CD1 4.03Å; T477-I506 HydrophobicContact CG2-CG1 3.97Å; L480-I506 HydrophobicContact CD1-CD1 3.72Å; I503-I506 HydrophobicContact CG2-CG1 4.05Å; I506-L524 HydrophobicContact CB-CD2 4.27Å; I506-L524 HydrophobicContact CG1-CD2 3.78Å; I506-L524 HydrophobicContact CG2-CD2 3.99Å
507	I	96.8	Very high	92.6	Very high	48 Å²	48	55.7 Å²	55.7	25%	0.246	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	107.9	178.9	-52.2	172.8	0	0	0	107.4	A522 I523 K525 W674 N678	I507-A522 CarbonylContact O-C 3.58Å; I507-A522 WeakPolarHBondContact O-CA 3.46Å; I507-I523 HydrophobicContact CB-CB 4.24Å; I507-I523 PolarHBondContact N-O 3.45Å; I507-I523 PolarHBondContact O-N 3.3Å; I507-K525 HydrophobicContact CD1-CG 4.26Å; I507-W674 HydrophobicContact CG2-CZ2 4.01Å; I507-N678 HydrophobicContact CD1-CB 4.32Å
508	L	96.4	Very high	93.3	Very high	36 Å²	36	54.8 Å²	54.8	19%	0.188	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	143	176.7	-175.1	65.4	0	0	0	110.2	A463 T467 V472 M474 Y512 A522	A463-L508 HydrophobicContact CB-CD1 3.3Å; T467-L508 HydrophobicContact CG2-CD1 4.18Å; T467-L508 HydrophobicContact CG2-CD2 4.3Å; V472-L508 HydrophobicContact CB-CD2 4.27Å; M474-L508 HydrophobicContact SD-CB 4.46Å; L508-Y512 HydrophobicContact CD1-CD1 3.49Å; L508-Y512 VanDerWaalsContact CD1-CD1 3.49Å; L508-Y512 HydrophobicContact CD1-CE1 4.17Å; L508-Y512 HydrophobicContact CD1-CG 3.8Å; L508-Y512 HydrophobicContact CD2-CD1 3.89Å; L508-Y512 HydrophobicContact CG-CD1 4.06Å; L508-Y512 HydrophobicContact CG-CG 4.39Å; L508-A522 HydrophobicContact CD1-CB 4.43Å
509	H	96.3	Very high	93.6	Very high	20 Å²	20	52.4 Å²	52.4	9%	0.093	29%	0.293	C	S	.	.			trans	-64.7	134.7	172.6	-169.1	-91.2	0	0	0	110.1	N511 Y512 I521 F671 W674	H509-N511 PolarHBondContact ND1-N 2.85Å; H509-N511 PolarHBondContact O-N 3.4Å; H509-Y512 VanDerWaalsContact O-CB 3.31Å; H509-Y512 WeakPolarHBondContact O-CB 3.37Å; H509-Y512 PolarHBondContact O-N 2.86Å; H509-I521 HydrophobicContact CB-CG2 3.75Å; H509-I521 WeakPolarHBondContact CB-O 3.42Å; H509-I521 PolarHBondContact N-O 3.07Å; H509-F671 AromaticContact CD2-CD1 3.67Å; H509-F671 AromaticContact CD2-CE1 3.91Å; H509-F671 AromaticContact CE1-CE1 3.74Å; H509-F671 AromaticContact NE2-CD1 3.56Å; H509-F671 AromaticContact NE2-CE1 3.64Å; H509-W674 HydrophobicContact CB-CH2 4.12Å; H509-W674 HydrophobicContact CB-CZ2 4.06Å; H509-W674 AromaticContact CD2-CD2 3.61Å; H509-W674 AromaticContact CD2-CE2 3.68Å; H509-W674 AromaticContact CD2-CE3 3.97Å; H509-W674 AromaticContact CD2-CG 3.88Å; H509-W674 AromaticContact CD2-NE1 3.92Å
510	P	95.3	Very high	93.7	Very high	103 Å²	103	51 Å²	51	67%	0.669	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.1	-174.4	23.7	-35.4	0	0	0	114
511	N	95.3	Very high	93.9	Very high	113 Å²	113	47.2 Å²	47.2	60%	0.604	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	13.6	179	-57.1	-6.5	0	0	0	112.8	H509 D513 A519	H509-N511 PolarHBondContact ND1-N 2.85Å; H509-N511 PolarHBondContact O-N 3.4Å; N511-D513 PolarHBondContact O-N 2.9Å; N511-A519 HydrophobicContact CB-CB 4.32Å
512	Y	95.4	Very high	94	Very high	15 Å²	15	46.6 Å²	46.6	6%	0.059	26%	0.257	C	S	.	.			trans	-63.3	119.4	178.2	172.6	-120.9	0	0	0	110.6	A463 H464 T467 V472 L508 H509 P514 L517 D518 D520	A463-Y512 HydrophobicContact CB-CD1 3.89Å; A463-Y512 HydrophobicContact CB-CD2 3.53Å; A463-Y512 HydrophobicContact CB-CE1 3.86Å; A463-Y512 HydrophobicContact CB-CE2 3.53Å; A463-Y512 HydrophobicContact CB-CG 3.69Å; H464-Y512 WeakPolarHBondContact CA-OH 3.28Å; H464-Y512 WeakPolarHBondContact CB-OH 3.36Å; H464-Y512 PolarHBondContact N-OH 2.83Å; T467-Y512 HydrophobicContact CG2-CE1 4.19Å; V472-Y512 HydrophobicContact CG1-CD1 4.35Å; L508-Y512 HydrophobicContact CD1-CD1 3.49Å; L508-Y512 VanDerWaalsContact CD1-CD1 3.49Å; L508-Y512 HydrophobicContact CD1-CE1 4.17Å; L508-Y512 HydrophobicContact CD1-CG 3.8Å; L508-Y512 HydrophobicContact CD2-CD1 3.89Å; L508-Y512 HydrophobicContact CG-CD1 4.06Å; L508-Y512 HydrophobicContact CG-CG 4.39Å; H509-Y512 VanDerWaalsContact O-CB 3.31Å; H509-Y512 WeakPolarHBondContact O-CB 3.37Å; H509-Y512 PolarHBondContact O-N 2.86Å; Y512-P514 HydrophobicContact CE1-CB 3.87Å; Y512-L517 HydrophobicContact CE2-CD2 4.25Å; Y512-D518 WeakPolarHBondContact CA-O 3.29Å; Y512-D520 HydrophobicContact CD2-CB 4.22Å; Y512-D520 HydrophobicContact CE2-CB 3.9Å
513	D	93.1	Very high	94.1	Very high	54 Å²	54	40.4 Å²	40.4	29%	0.289	23%	0.228	S	C	.	.			trans	-103.9	111.4	173.9	-172.3	-30.6	0	0	0	109.3	N511 I515 L516 L517 D518	N511-D513 PolarHBondContact O-N 2.9Å; D513-I515 PolarHBondContact O-N 3.32Å; D513-I515 WeakPolarHBondContact OD1-CA 3.32Å; D513-I515 WeakPolarHBondContact OD1-CB 3.5Å; D513-I515 PolarHBondContact OD1-N 2.87Å; D513-L516 HydrophobicContact CB-CB 4.38Å; D513-L516 PolarHBondContact OD1-N 2.84Å; D513-L517 CarbonylContact O-C 3.18Å; D513-L517 WeakPolarHBondContact O-CA 3.47Å; D513-L517 PolarHBondContact O-N 3.17Å; D513-D518 HydrophobicContact CB-CB 4.26Å; D513-D518 PolarHBondContact N-O 2.79Å; D513-D518 PolarHBondContact O-N 3.04Å
514	P	90.1	Very high	94.2	Very high	25 Å²	25	39.9 Å²	39.9	16%	0.162	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-7.4	-178.1	33.1	-37.2	0	0	0	114.2	V472 Y512	V472-P514 HydrophobicContact CG1-CG 4Å; Y512-P514 HydrophobicContact CE1-CB 3.87Å
515	I	86.4	Confident	94.2	Very high	148 Å²	148	38.3 Å²	38.3	76%	0.759	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-52.3	177.9	-58.1	174.5	0	0	0	109.5	D513 L517	D513-I515 PolarHBondContact O-N 3.32Å; D513-I515 WeakPolarHBondContact OD1-CA 3.32Å; D513-I515 WeakPolarHBondContact OD1-CB 3.5Å; D513-I515 PolarHBondContact OD1-N 2.87Å; I515-L517 VanDerWaalsContact C-N 3.34Å
516	L	87.6	Confident	94.2	Very high	88 Å²	88	36.7 Å²	36.7	46%	0.461	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.3	177.8	-65.8	177.3	0	0	0	113.1	D513 D518 M607	D513-L516 HydrophobicContact CB-CB 4.38Å; D513-L516 PolarHBondContact OD1-N 2.84Å; L516-D518 HydrophobicContact CB-CB 4.44Å; L516-D518 PolarHBondContact O-N 2.84Å; L516-M607 WeakPolarHBondContact O-CE 3.32Å
517	L	88.6	Confident	94.1	Very high	34 Å²	34	39.7 Å²	39.7	18%	0.178	21%	0.213	C	C	.	.			trans	57.5	24.5	-167.9	-61.8	172.7	0	0	0	113	H464 Y512 D513 I515 D520 M607 W651	H464-L517 HydrophobicContact CB-CD2 4.09Å; Y512-L517 HydrophobicContact CE2-CD2 4.25Å; D513-L517 CarbonylContact O-C 3.18Å; D513-L517 WeakPolarHBondContact O-CA 3.47Å; D513-L517 PolarHBondContact O-N 3.17Å; I515-L517 VanDerWaalsContact C-N 3.34Å; L517-D520 HydrophobicContact CB-CB 4.38Å; L517-D520 WeakPolarHBondContact O-CB 3.48Å; L517-M607 WeakPolarHBondContact O-CE 3.25Å; L517-W651 HydrophobicContact CD1-CB 3.78Å; L517-W651 VanDerWaalsContact CD1-CD1 3.49Å; L517-W651 HydrophobicContact CD1-CG 3.9Å
518	D	92.4	Very high	93.9	Very high	32 Å²	32	42 Å²	42	17%	0.171	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	143.1	172.3	-170.8	46.1	0	0	0	110.9	Y512 D513 L516 D520 T604 N606 M607	Y512-D518 WeakPolarHBondContact CA-O 3.29Å; D513-D518 HydrophobicContact CB-CB 4.26Å; D513-D518 PolarHBondContact N-O 2.79Å; D513-D518 PolarHBondContact O-N 3.04Å; L516-D518 HydrophobicContact CB-CB 4.44Å; L516-D518 PolarHBondContact O-N 2.84Å; D518-D520 PolarHBondContact O-N 3.37Å; D518-T604 HydrophobicContact CB-CG2 4.15Å; D518-T604 WeakPolarHBondContact OD1-CB 3.48Å; D518-T604 PolarHBondContact OD1-OG1 3.45Å; D518-N606 WeakPolarHBondContact OD1-CB 3.09Å; D518-N606 PolarHBondContact OD1-ND2 3.38Å; D518-N606 PolarHBondContact OD2-ND2 3.06Å; D518-M607 HydrophobicContact CB-CE 4.23Å
519	A	93.7	Very high	93.7	Very high	1 Å²	1	45 Å²	45	1%	0.008	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	41.2	-173.3	0	0	0	0	0	113.5	N511 I521 F671	N511-A519 HydrophobicContact CB-CB 4.32Å; A519-I521 PolarHBondContact O-N 2.98Å; A519-F671 HydrophobicContact CB-CE1 3.86Å; A519-F671 HydrophobicContact CB-CZ 3.71Å
520	D	94.8	Very high	93.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.			trans	-70.3	70.4	178.3	179.7	31.7	0	0	0	112.1	A462 A463 H464 Y512 L517 D518 S650 T666	A462-D520 WeakPolarHBondContact CA-O 3.18Å; A463-D520 WeakPolarHBondContact CA-OD1 3.05Å; A463-D520 WeakPolarHBondContact CB-OD1 3.48Å; A463-D520 PolarHBondContact N-OD1 3.24Å; H464-D520 IonicContact CE1-OD2 2.67Å; H464-D520 PolarHBondContact CE1-OD2 2.86Å; H464-D520 IonicContact CG-OD1 2.84Å; H464-D520 IonicContact CG-OD2 2.78Å; H464-D520 PolarHBondContact N-OD1 2.74Å; H464-D520 IonicContact ND1-OD1 3.33Å; H464-D520 PolarHBondContact ND1-OD1 2.9Å; H464-D520 IonicContact ND1-OD2 2.76Å; H464-D520 PolarHBondContact ND1-OD2 2.85Å; Y512-D520 HydrophobicContact CD2-CB 4.22Å; Y512-D520 HydrophobicContact CE2-CB 3.9Å; L517-D520 HydrophobicContact CB-CB 4.38Å; L517-D520 WeakPolarHBondContact O-CB 3.48Å; D518-D520 PolarHBondContact O-N 3.37Å; D520-S650 WeakPolarHBondContact OD2-CB 3.27Å; D520-S650 PolarHBondContact OD2-OG 3.23Å; D520-T666 WeakPolarHBondContact O-CG2 3.36Å; D520-T666 PolarHBondContact O-OG1 2.96Å
521	I	95.6	Very high	93.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.238	C	C	.	.			trans	-143.5	136.8	-179.2	-166.5	169.2	0	0	0	111.3	V460 H509 A519 L648 T666 V668 F671 W674 I675	V460-I521 HydrophobicContact CG1-CD1 3.83Å; V460-I521 HydrophobicContact CG1-CG1 3.87Å; H509-I521 HydrophobicContact CB-CG2 3.75Å; H509-I521 WeakPolarHBondContact CB-O 3.42Å; H509-I521 PolarHBondContact N-O 3.07Å; A519-I521 PolarHBondContact O-N 2.98Å; I521-L648 HydrophobicContact CB-CD1 4.45Å; I521-L648 HydrophobicContact CD1-CD1 4.14Å; I521-L648 HydrophobicContact CG1-CD1 3.84Å; I521-T666 HydrophobicContact CB-CG2 4.27Å; I521-V668 HydrophobicContact CD1-CG2 4.49Å; I521-F671 HydrophobicContact CD1-CB 3.94Å; I521-F671 HydrophobicContact CD1-CD2 4.18Å; I521-F671 HydrophobicContact CD1-CG 4.2Å; I521-F671 HydrophobicContact CG2-CD1 4.02Å; I521-F671 HydrophobicContact CG2-CD2 4.13Å; I521-F671 HydrophobicContact CG2-CE1 4.26Å; I521-F671 HydrophobicContact CG2-CE2 4.38Å; I521-F671 HydrophobicContact CG2-CG 3.96Å; I521-F671 HydrophobicContact CG2-CZ 4.45Å; I521-W674 HydrophobicContact CD1-CZ3 4.47Å; I521-W674 HydrophobicContact CG1-CZ3 4.23Å; I521-W674 HydrophobicContact CG2-CZ3 4.04Å; I521-I675 HydrophobicContact CD1-CD1 3.91Å; I521-I675 HydrophobicContact CD1-CG1 4.35Å
522	A	96.6	Very high	93.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.6	175.4	0	0	0	0	0	111.1	V461 A463 V466 I507 L508	V461-A522 HydrophobicContact CG1-CB 4.11Å; V461-A522 PolarHBondContact N-O 2.83Å; V461-A522 PolarHBondContact O-N 3.39Å; V461-A522 VanDerWaalsContact O-O 3.08Å; A463-A522 HydrophobicContact CB-CB 4.26Å; V466-A522 HydrophobicContact CG2-CB 3.67Å; I507-A522 CarbonylContact O-C 3.58Å; I507-A522 WeakPolarHBondContact O-CA 3.46Å; L508-A522 HydrophobicContact CD1-CB 4.43Å
523	I	97.1	Very high	92.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.9	177.2	-67.3	168.2	0	0	0	109.3	T458 I507 W674 I675 N678	T458-I523 HydrophobicContact CG2-CG2 3.42Å; T458-I523 VanDerWaalsContact CG2-CG2 3.42Å; I507-I523 HydrophobicContact CB-CB 4.24Å; I507-I523 PolarHBondContact N-O 3.45Å; I507-I523 PolarHBondContact O-N 3.3Å; I523-W674 HydrophobicContact CB-CH2 4.47Å; I523-W674 HydrophobicContact CD1-CD2 4.44Å; I523-W674 HydrophobicContact CD1-CE3 3.89Å; I523-W674 HydrophobicContact CD1-CH2 3.66Å; I523-W674 HydrophobicContact CD1-CZ2 4.23Å; I523-W674 HydrophobicContact CD1-CZ3 3.47Å; I523-W674 VanDerWaalsContact CD1-CZ3 3.47Å; I523-W674 HydrophobicContact CG1-CH2 3.76Å; I523-W674 HydrophobicContact CG1-CZ3 3.67Å; I523-I675 HydrophobicContact CD1-CB 4.42Å; I523-I675 HydrophobicContact CD1-CG1 4.38Å; I523-I675 HydrophobicContact CD1-CG2 4.35Å; I523-N678 HydrophobicContact CD1-CB 3.52Å
524	L	97	Very high	92.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.8	170.9	-52.8	176.1	0	0	0	109.4	I428 T458 V459 V461 V466 V482 I503 I506	I428-L524 HydrophobicContact CD1-CD1 3.74Å; I428-L524 HydrophobicContact CG2-CD1 4.49Å; T458-L524 WeakPolarHBondContact CA-O 3.43Å; V459-L524 HydrophobicContact CB-CB 4.35Å; V459-L524 PolarHBondContact N-O 3.06Å; V459-L524 PolarHBondContact O-N 3.43Å; V461-L524 HydrophobicContact CB-CD1 4.45Å; V461-L524 HydrophobicContact CG1-CD1 3.9Å; V461-L524 HydrophobicContact CG1-CD2 4.29Å; V461-L524 HydrophobicContact CG1-CG 3.85Å; V466-L524 HydrophobicContact CG1-CD1 4.44Å; V466-L524 HydrophobicContact CG1-CD2 3.82Å; V482-L524 HydrophobicContact CG2-CD1 3.99Å; I503-L524 HydrophobicContact CD1-CB 4.49Å; I503-L524 HydrophobicContact CD1-CD1 4Å; I503-L524 HydrophobicContact CD1-CD2 4.19Å; I503-L524 HydrophobicContact CD1-CG 4.44Å; I503-L524 HydrophobicContact CG2-CB 4.43Å; I503-L524 HydrophobicContact CG2-CD2 4.45Å; I506-L524 HydrophobicContact CB-CD2 4.27Å; I506-L524 HydrophobicContact CG1-CD2 3.78Å; I506-L524 HydrophobicContact CG2-CD2 3.99Å
525	K	96.8	Very high	92.3	Very high	29 Å²	29	48.9 Å²	48.9	13%	0.126	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.8	171.6	-70.6	-68.3	-166.4	163.5	0	109.3	R457 I503 S504 A505 I507 N678 M679 K680	R457-K525 WeakPolarHBondContact O-CA 3.41Å; I503-K525 CarbonylContact C-O 3.47Å; I503-K525 WeakPolarHBondContact CA-O 3.47Å; I503-K525 WeakPolarHBondContact CG2-O 3.14Å; S504-K525 PolarHBondContact N-O 3.33Å; S504-K525 WeakPolarHBondContact OG-CB 3.39Å; S504-K525 PolarHBondContact OG-O 3.42Å; S504-K525 VanDerWaalsContact OG-O 3.09Å; A505-K525 HydrophobicContact CB-CB 4.17Å; A505-K525 HydrophobicContact CB-CG 4.45Å; A505-K525 PolarHBondContact O-N 2.98Å; I507-K525 HydrophobicContact CD1-CG 4.26Å; K525-N678 WeakPolarHBondContact CE-O 3.32Å; K525-N678 PolarHBondContact NZ-O 3.17Å; K525-M679 VanDerWaalsContact NZ-C 3.34Å; K525-M679 PolarHBondContact NZ-O 2.98Å; K525-M679 VanDerWaalsContact NZ-O 3.13Å; K525-K680 PolarHBondContact NZ-OXT 2.03Å; K525-K680 VanDerWaalsContact NZ-OXT 3.12Å
526	L	96.1	Very high	92.5	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	136.9	178	-54.3	172.6	0	0	0	109.9	L453 R457 V459 V482 L501 D528	L453-L526 HydrophobicContact CD1-CD1 4.12Å; R457-L526 PolarHBondContact NH1-O 2.85Å; R457-L526 PolarHBondContact O-N 2.97Å; V459-L526 HydrophobicContact CG2-CD1 4.2Å; V459-L526 HydrophobicContact CG2-CD2 4.4Å; V482-L526 HydrophobicContact CB-CD2 3.9Å; V482-L526 HydrophobicContact CG1-CD2 4.24Å; V482-L526 HydrophobicContact CG2-CD2 3.86Å; L501-L526 HydrophobicContact CB-CD2 4.07Å; L501-L526 HydrophobicContact CD1-CD1 3.58Å; L501-L526 HydrophobicContact CD1-CD2 4.37Å; L501-L526 HydrophobicContact CD1-CG 4.4Å; L526-D528 WeakPolarHBondContact CB-O 3.34Å
527	L	94.6	Very high	92.7	Very high	84 Å²	84	37.9 Å²	37.9	44%	0.44	18%	0.181	S	C	.	.	S	Bend	trans	-64	-48	176.6	-175.5	65.3	0	0	0	110.9	R457 Q502	R457-L527 PolarHBondContact NH1-O 3.11Å; Q502-L527 HydrophobicContact CB-CB 4.31Å; Q502-L527 HydrophobicContact CB-CD2 4.41Å; Q502-L527 PolarHBondContact O-N 3.04Å
528	D	93.4	Very high	93	Very high	97 Å²	97	36.3 Å²	36.3	52%	0.519	17%	0.172	S	C	.	.	S	Bend	trans	-103.8	155	176.1	-67.2	-52.5	0	0	0	111.9	L501 L526	L501-D528 HydrophobicContact CD2-CB 4.39Å; L526-D528 WeakPolarHBondContact CB-O 3.34Å
529	K	91.6	Very high	93.1	Very high	99 Å²	99	34.9 Å²	34.9	43%	0.43	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-72	132.5	174.3	-68.4	-173.5	166.8	-148.8	0	110.6	E456 R457 R531	E456-K529 HydrophobicContact CB-CB 4.41Å; E456-K529 HydrophobicContact CB-CG 4.5Å; E456-K529 CarbonylContact O-C 3.59Å; E456-K529 WeakPolarHBondContact O-CA 3.32Å; E456-K529 WeakPolarHBondContact OE2-CE 3.4Å; E456-K529 IonicContact OE2-NZ 3.06Å; E456-K529 PolarHBondContact OE2-NZ 2.81Å; R457-K529 HydrophobicContact CG-CG 3.85Å; K529-R531 PolarHBondContact O-N 3.35Å
530	A	92.7	Very high	93	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-61.8	131	166.1	0	0	0	0	0	110.4	L453 E456 L484 L501 I532 V536	L453-A530 HydrophobicContact CD1-CB 4.44Å; L453-A530 HydrophobicContact CD2-CB 4.29Å; E456-A530 PolarHBondContact O-N 2.83Å; L484-A530 HydrophobicContact CD1-CB 3.6Å; L501-A530 HydrophobicContact CD1-CB 3.97Å; A530-I532 PolarHBondContact O-N 2.82Å; A530-V536 HydrophobicContact CB-CG1 4.27Å
531	R	91.8	Very high	92.9	Very high	200 Å²	200	36.2 Å²	36.2	76%	0.755	17%	0.172	S	C	*	.			trans	-79.4	105.9	176.6	-60	179.2	-179.1	179.4	0.4	109.1	Q499 K529 S533	Q499-R531 PolarHBondContact NE2-O 3.3Å; K529-R531 PolarHBondContact O-N 3.35Å; R531-S533 PolarHBondContact O-N 3.01Å
532	I	91.3	Very high	92.3	Very high	18 Å²	18	36.4 Å²	36.4	9%	0.092	17%	0.174	C	C	.	.			trans	-66.5	130.8	-179.1	-51.7	-57.4	0	0	0	110.4	F378 Y379 P404 E456 A530 V536 Q537	F378-I532 HydrophobicContact CB-CG2 3.7Å; F378-I532 HydrophobicContact CG-CG2 4.33Å; Y379-I532 HydrophobicContact CE1-CG1 4.24Å; Y379-I532 HydrophobicContact CE2-CB 4.12Å; Y379-I532 HydrophobicContact CE2-CG2 4.49Å; Y379-I532 WeakPolarHBondContact OH-CB 3.28Å; Y379-I532 VanDerWaalsContact OH-CG1 3.32Å; Y379-I532 WeakPolarHBondContact OH-CG1 3.17Å; P404-I532 HydrophobicContact CB-CD1 4.38Å; P404-I532 HydrophobicContact CB-CG1 4.11Å; E456-I532 HydrophobicContact CG-CD1 4.29Å; E456-I532 HydrophobicContact CG-CG1 4.26Å; A530-I532 PolarHBondContact O-N 2.82Å; I532-V536 WeakPolarHBondContact CA-O 3Å; I532-V536 WeakPolarHBondContact CG2-O 3.15Å; I532-Q537 HydrophobicContact CG2-CG 4.31Å
533	S	88	Confident	91.3	Very high	33 Å²	33	37.1 Å²	37.1	23%	0.231	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-151.1	-176.4	-177.3	66.5	0	0	0	0	110.4	R531 R535 V536 Q537	R531-S533 PolarHBondContact O-N 3.01Å; S533-R535 PolarHBondContact O-N 2.84Å; S533-R535 PolarHBondContact OG-N 2.94Å; S533-V536 PolarHBondContact N-O 3.44Å; S533-V536 CarbonylContact O-C 3.48Å; S533-V536 PolarHBondContact O-N 3.4Å; S533-V536 VanDerWaalsContact O-O 3.06Å; S533-V536 PolarHBondContact OG-N 3.23Å; S533-Q537 WeakPolarHBondContact O-CG 3.12Å; S533-Q537 PolarHBondContact O-NE2 2.82Å; S533-Q537 VanDerWaalsContact O-NE2 3.12Å
534	T	84.8	Confident	90	Very high	78 Å²	78	41.6 Å²	41.6	48%	0.479	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.7	171.9	51.5	0	0	0	0	113.2	F378	F378-T534 HydrophobicContact CE1-CG2 4.19Å; F378-T534 HydrophobicContact CE2-CG2 4.32Å; F378-T534 HydrophobicContact CZ-CG2 3.5Å
535	R	86.6	Confident	88.6	Confident	80 Å²	80	51.5 Å²	51.5	30%	0.302	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-11.1	-177.3	-60.6	-175.3	-173.7	-147.4	-6	114.5	P423 E495 T497 S533	P423-R535 WeakPolarHBondContact CA-O 3.49Å; E495-R535 IonicContact OE2-NH1 3.15Å; E495-R535 PolarHBondContact OE2-NH1 3.5Å; E495-R535 VanDerWaalsContact OE2-NH1 3.15Å; T497-R535 WeakPolarHBondContact OG1-CD 3.17Å; T497-R535 PolarHBondContact OG1-NH1 2.95Å; S533-R535 PolarHBondContact O-N 2.84Å; S533-R535 PolarHBondContact OG-N 2.94Å
536	V	91.3	Very high	87.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-133.8	105.5	-179.8	-179.1	0	0	0	0	108.4	P423 L453 L484 A530 I532 S533	P423-V536 VanDerWaalsContact O-CA 3.3Å; P423-V536 WeakPolarHBondContact O-CA 2.91Å; L453-V536 HydrophobicContact CD2-CG1 3.8Å; L484-V536 HydrophobicContact CB-CG1 4.1Å; L484-V536 HydrophobicContact CB-CG2 4Å; L484-V536 HydrophobicContact CD1-CG1 3.96Å; A530-V536 HydrophobicContact CB-CG1 4.27Å; I532-V536 WeakPolarHBondContact CA-O 3Å; I532-V536 WeakPolarHBondContact CG2-O 3.15Å; S533-V536 PolarHBondContact N-O 3.44Å; S533-V536 CarbonylContact O-C 3.48Å; S533-V536 PolarHBondContact O-N 3.4Å; S533-V536 VanDerWaalsContact O-O 3.06Å; S533-V536 PolarHBondContact OG-N 3.23Å
537	Q	92.4	Very high	85.7	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.028	27%	0.265	C	S	.	.			trans	-144.1	150.3	178.8	-55.3	-173.6	22.4	0	0	109.5	K408 P423 W424 I532 S533	K408-Q537 PolarHBondContact O-OE1 2.83Å; P423-Q537 CarbonylContact C-O 3.56Å; P423-Q537 HydrophobicContact CB-CB 3.88Å; P423-Q537 HydrophobicContact CB-CG 4.03Å; P423-Q537 PolarHBondContact O-N 3.23Å; W424-Q537 WeakPolarHBondContact CA-O 3.4Å; W424-Q537 WeakPolarHBondContact CB-O 3.49Å; W424-Q537 PolarHBondContact N-O 3.03Å; I532-Q537 HydrophobicContact CG2-CG 4.31Å; S533-Q537 WeakPolarHBondContact O-CG 3.12Å; S533-Q537 PolarHBondContact O-NE2 2.82Å; S533-Q537 VanDerWaalsContact O-NE2 3.12Å
538	P	95.1	Very high	83.9	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.006	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-76.5	150	177.8	29.3	-31.5	0	0	0	111.9	P404 C406 G407 L453 V454	P404-P538 HydrophobicContact CB-CG 3.86Å; P404-P538 HydrophobicContact CG-CG 4.02Å; C406-P538 CarbonylContact C-O 3.59Å; C406-P538 WeakPolarHBondContact CA-O 3.47Å; C406-P538 HydrophobicContact CB-CB 4.45Å; C406-P538 HydrophobicContact CB-CG 4.18Å; G407-P538 PolarHBondContact N-O 2.04Å; L453-P538 CarbonylContact O-C 3.4Å; L453-P538 WeakPolarHBondContact O-CA 3.47Å; V454-P538 VanDerWaalsContact C-CB 3.5Å; V454-P538 WeakPolarHBondContact O-CB 3.08Å
539	I	94.2	Very high	82.3	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-85.2	150.8	166.6	-164	168.3	0	0	0	110.2	W424 A452 L453 V454 A630 W643 L645	W424-I539 HydrophobicContact CB-CB 3.79Å; W424-I539 HydrophobicContact CB-CG2 4.3Å; W424-I539 HydrophobicContact CD2-CB 3.75Å; W424-I539 HydrophobicContact CD2-CD1 4.11Å; W424-I539 HydrophobicContact CD2-CG1 4.02Å; W424-I539 HydrophobicContact CE3-CB 4.11Å; W424-I539 HydrophobicContact CE3-CG1 4.37Å; W424-I539 HydrophobicContact CG-CB 3.61Å; W424-I539 HydrophobicContact CG-CD1 4.21Å; W424-I539 HydrophobicContact CG-CG1 4.25Å; W424-I539 HydrophobicContact CG-CG2 4.4Å; W424-I539 HydrophobicContact CZ2-CD1 4.27Å; A452-I539 HydrophobicContact CB-CG2 3.95Å; L453-I539 PolarHBondContact O-N 3.2Å; V454-I539 HydrophobicContact CG1-CG2 4.07Å; I539-A630 HydrophobicContact CD1-CB 3.65Å; I539-W643 HydrophobicContact CG1-CB 4.39Å; I539-W643 WeakPolarHBondContact CG1-O 3.25Å; I539-L645 HydrophobicContact CD1-CB 3.99Å; I539-L645 HydrophobicContact CG1-CB 4.35Å; I539-L645 HydrophobicContact CG2-CB 3.82Å; I539-L645 HydrophobicContact CG2-CD2 4.49Å
540	C	92.2	Very high	80.9	Confident	7 Å²	7	52.2 Å²	52.2	5%	0.047	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	156.4	174.8	-60.4	0	0	0	0	111.2	C406 W643 H644 L645	C406-C540 HydrophobicContact CB-CB 3.99Å; C406-C540 WeakPolarHBondContact CB-SG 3.27Å; C406-C540 PolarHBondContact O-SG 2.86Å; C406-C540 WeakPolarHBondContact SG-CA 3.07Å; C406-C540 WeakPolarHBondContact SG-CB 3.11Å; C406-C540 CovalentContact SG-SG 2.04Å; C406-C540 PolarHBondContact SG-SG 3.23Å; C540-W643 WeakPolarHBondContact CB-O 3.38Å; C540-W643 PolarHBondContact N-O 3.15Å; C540-W643 VanDerWaalsContact N-O 3.15Å; C540-H644 WeakPolarHBondContact CB-CD2 3.47Å; C540-H644 WeakPolarHBondContact CB-NE2 3.29Å; C540-H644 CarbonylContact O-C 3.53Å; C540-H644 VanDerWaalsContact O-CA 3.25Å; C540-H644 WeakPolarHBondContact O-CA 3.45Å; C540-L645 PolarHBondContact O-N 2.86Å
541	L	91.3	Very high	79.7	Confident	22 Å²	22	54 Å²	54	12%	0.115	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.8	169	-65.9	173	0	0	0	109	V454 L645 V668 K672 I675 E676 M679	V454-L541 HydrophobicContact CG1-CD2 4.08Å; L541-L645 HydrophobicContact CD2-CD2 4.38Å; L541-V668 HydrophobicContact CD2-CG1 4.2Å; L541-K672 HydrophobicContact CB-CG 4.34Å; L541-I675 HydrophobicContact CD1-CB 4.16Å; L541-I675 HydrophobicContact CD1-CG2 3.8Å; L541-I675 HydrophobicContact CD2-CD1 4.09Å; L541-E676 HydrophobicContact CD1-CG 4.01Å; L541-M679 HydrophobicContact CD1-CE 4.23Å
542	A	83.1	Confident	78.3	Confident	4 Å²	4	50.6 Å²	50.6	3%	0.033	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-65.4	146.4	178.3	0	0	0	0	0	111.2	H644 M646 L669 K672	A542-H644 HydrophobicContact CB-CB 4Å; A542-M646 HydrophobicContact CB-SD 4.44Å; A542-L669 HydrophobicContact CB-CD1 4.09Å; A542-L669 WeakPolarHBondContact O-CD1 3.38Å; A542-K672 WeakPolarHBondContact O-CD 3.46Å
543	A	76.7	Confident	77	Confident	15 Å²	15	56.3 Å²	56.3	12%	0.124	30%	0.3	C	S	.	.			trans	-112.3	152.8	166	0	0	0	0	0	110.4	R545 D546 K672	A543-R545 PolarHBondContact O-N 2.77Å; A543-D546 WeakPolarHBondContact CB-OD2 3.15Å; A543-D546 PolarHBondContact N-OD2 3.21Å; A543-D546 WeakPolarHBondContact O-CB 3.33Å; A543-D546 PolarHBondContact O-N 3.48Å; A543-K672 VanDerWaalsContact CB-NZ 3.27Å
544	S	70.2	Confident	76	Confident	93 Å²	93	55.3 Å²	55.3	65%	0.65	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-23	177.4	-43.2	0	0	0	0	113
545	R	67.1	Low	75.6	Confident	209 Å²	209	57.6 Å²	57.6	79%	0.789	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-17.2	177.1	-58.7	-179.7	-176.9	-170.3	-0.3	113.5	A543 R636	A543-R545 PolarHBondContact O-N 2.77Å; R545-R636 PolarHBondContact O-NH2 3.37Å
546	D	65	Low	75.6	Confident	51 Å²	51	53.8 Å²	53.8	27%	0.273	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-12.8	-174.9	-61.9	-38.7	0	0	0	112.5	A543 S548 F633	A543-D546 WeakPolarHBondContact CB-OD2 3.15Å; A543-D546 PolarHBondContact N-OD2 3.21Å; A543-D546 WeakPolarHBondContact O-CB 3.33Å; A543-D546 PolarHBondContact O-N 3.48Å; D546-S548 PolarHBondContact O-N 2.78Å; D546-F633 HydrophobicContact CB-CE2 3.64Å; D546-F633 HydrophobicContact CB-CZ 3.58Å
547	L	67	Low	75.4	Confident	42 Å²	42	54.8 Å²	54.8	22%	0.22	29%	0.29	C	S	.	.			trans	-81.2	99.9	174.4	-68.3	154.1	0	0	0	109.3	M646 L669	L547-M646 HydrophobicContact CD1-CE 4.46Å; L547-M646 HydrophobicContact CD2-CE 4.32Å; L547-L669 HydrophobicContact CD1-CD2 3.82Å
548	S	56.2	Low	75.2	Confident	107 Å²	107	54.5 Å²	54.5	75%	0.748	29%	0.288	S	S	*	.			trans	-85.6	-20.2	174.6	54.7	0	0	0	0	113.6	D546	D546-S548 PolarHBondContact O-N 2.78Å
549	T	59.9	Low	74.9	Confident	73 Å²	73	54.7 Å²	54.7	45%	0.448	29%	0.29	S	S	.	.	S	Bend	trans	-107.2	155.2	176.1	46.5	0	0	0	0	109.5	F551	T549-F551 PolarHBondContact O-N 2.9Å
550	S	62.3	Low	74.6	Confident	53 Å²	53	54.6 Å²	54.6	37%	0.371	29%	0.289	S	S	.	.			trans	-56.4	141.6	173.2	-179.5	0	0	0	0	109.5	Q552 E553 S554	S550-Q552 PolarHBondContact O-N 2.81Å; S550-Q552 VanDerWaalsContact O-N 3.11Å; S550-Q552 PolarHBondContact OG-N 3.01Å; S550-E553 PolarHBondContact O-N 2.88Å; S550-S554 PolarHBondContact O-OG 3.3Å
551	F	66.7	Low	74.3	Confident	41 Å²	41	54.2 Å²	54.2	18%	0.18	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-53.3	-32.9	175.8	174	-122.2	0	0	0	111.8	T549 E553 S554 I556 V584 F608 M646	T549-F551 PolarHBondContact O-N 2.9Å; F551-E553 VanDerWaalsContact C-N 3.3Å; F551-E553 PolarHBondContact O-N 2.71Å; F551-S554 PolarHBondContact O-N 2.82Å; F551-I556 HydrophobicContact CE2-CD1 4.23Å; F551-V584 HydrophobicContact CD1-CG1 4.4Å; F551-V584 HydrophobicContact CE1-CG1 3.97Å; F551-V584 HydrophobicContact CE1-CG2 4.25Å; F551-V584 HydrophobicContact CE2-CG2 4.26Å; F551-V584 HydrophobicContact CZ-CG1 4.48Å; F551-V584 HydrophobicContact CZ-CG2 4.05Å; F551-F608 HydrophobicContact CE1-CB 3.86Å; F551-F608 HydrophobicContact CE1-CD2 4.44Å; F551-F608 HydrophobicContact CE1-CG 4.09Å; F551-F608 HydrophobicContact CZ-CB 3.91Å; F551-F608 AromaticContact CZ-CD1 3.9Å; F551-F608 HydrophobicContact CZ-CD1 3.9Å; F551-F608 AromaticContact CZ-CD2 3.82Å; F551-F608 HydrophobicContact CZ-CD2 3.82Å; F551-F608 HydrophobicContact CZ-CE1 4.35Å; F551-F608 HydrophobicContact CZ-CE2 4.29Å; F551-F608 AromaticContact CZ-CG 3.61Å; F551-F608 HydrophobicContact CZ-CG 3.61Å; F551-M646 HydrophobicContact CD2-CE 3.13Å; F551-M646 HydrophobicContact CE2-CE 3.05Å; F551-M646 HydrophobicContact CE2-CG 3.95Å; F551-M646 HydrophobicContact CE2-SD 4.33Å; F551-M646 HydrophobicContact CG-CE 4.24Å; F551-M646 HydrophobicContact CZ-CE 4.12Å
552	Q	62.8	Low	73.7	Confident	128 Å²	128	53.9 Å²	53.9	60%	0.598	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-71.4	-20.3	178.8	-68.9	168.7	-30.6	0	0	113.7	S550	S550-Q552 PolarHBondContact O-N 2.81Å; S550-Q552 VanDerWaalsContact O-N 3.11Å; S550-Q552 PolarHBondContact OG-N 3.01Å
553	E	63.3	Low	73.2	Confident	137 Å²	137	55.4 Å²	55.4	64%	0.64	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-98.4	5.4	-178.6	-64.9	174.3	165	0	0	112.8	S550 F551	S550-E553 PolarHBondContact O-N 2.88Å; F551-E553 VanDerWaalsContact C-N 3.3Å; F551-E553 PolarHBondContact O-N 2.71Å
554	S	68.8	Low	72.6	Confident	12 Å²	12	61 Å²	61	8%	0.084	32%	0.321	C	S	.	.			trans	-90.5	123.6	-174.3	-60.9	0	0	0	0	111.1	S550 F551 I556	S550-S554 PolarHBondContact O-OG 3.3Å; F551-S554 PolarHBondContact O-N 2.82Å; S554-I556 PolarHBondContact O-N 3.41Å
555	H	74.8	Confident	72	Confident	126 Å²	126	57.9 Å²	57.9	58%	0.583	30%	0.301	S	S	*	.			trans	-71.3	110.9	170	-65.2	-67.9	0	0	0	110.3	V581	H555-V581 HydrophobicContact CB-CG1 4.02Å
556	I	86.8	Confident	71.5	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.5	-178.5	-62.8	175.2	0	0	0	108.5	F551 S554 V558 V581 V582 V584 F608 A629	F551-I556 HydrophobicContact CE2-CD1 4.23Å; S554-I556 PolarHBondContact O-N 3.41Å; I556-V558 HydrophobicContact CG2-CG2 4.45Å; I556-V581 CarbonylContact O-C 3.57Å; I556-V581 WeakPolarHBondContact O-CA 3.46Å; I556-V582 HydrophobicContact CB-CG2 3.82Å; I556-V582 HydrophobicContact CG2-CG2 3.9Å; I556-V582 PolarHBondContact N-O 3.49Å; I556-V582 VanDerWaalsContact N-O 3.16Å; I556-V582 PolarHBondContact O-N 2.76Å; I556-V584 HydrophobicContact CD1-CG2 3.55Å; I556-F608 HydrophobicContact CD1-CD2 4.48Å; I556-F608 HydrophobicContact CD1-CE2 3.67Å; I556-F608 HydrophobicContact CD1-CZ 4.09Å; I556-A629 HydrophobicContact CG2-CB 3.6Å
557	T	87.8	Confident	71	Confident	22 Å²	22	54.4 Å²	54.4	14%	0.135	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.4	172.7	-53	0	0	0	0	109.9	W422 G580 A630	W422-T557 HydrophobicContact CH2-CG2 3.62Å; W422-T557 HydrophobicContact CZ2-CG2 3.56Å; T557-G580 WeakPolarHBondContact CA-O 3.09Å; T557-A630 PolarHBondContact N-O 3.5Å; T557-A630 PolarHBondContact O-N 3.46Å
558	V	88.3	Confident	70.4	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.5	175.2	-170.4	0	0	0	0	109.2	I556 S579 G580 V582 I620 T622 I628 A629 V649 F665	I556-V558 HydrophobicContact CG2-CG2 4.45Å; V558-S579 CarbonylContact O-C 3.5Å; V558-S579 WeakPolarHBondContact O-CA 3.36Å; V558-S579 WeakPolarHBondContact O-CB 3.48Å; V558-G580 PolarHBondContact N-O 2.95Å; V558-G580 PolarHBondContact O-N 3.18Å; V558-V582 HydrophobicContact CG2-CB 4.39Å; V558-V582 HydrophobicContact CG2-CG1 3.89Å; V558-V582 HydrophobicContact CG2-CG2 3.56Å; V558-I620 HydrophobicContact CB-CD1 4.05Å; V558-I620 HydrophobicContact CG1-CD1 3.74Å; V558-I620 WeakPolarHBondContact O-CD1 3.42Å; V558-T622 HydrophobicContact CB-CG2 4.49Å; V558-T622 HydrophobicContact CG1-CG2 4.22Å; V558-I628 VanDerWaalsContact CA-O 3.29Å; V558-I628 WeakPolarHBondContact CA-O 3.21Å; V558-A629 HydrophobicContact CG2-CB 4.21Å; V558-V649 HydrophobicContact CG1-CG2 4.25Å; V558-F665 HydrophobicContact CG1-CE1 4.06Å; V558-F665 HydrophobicContact CG1-CZ 4.48Å; V558-F665 HydrophobicContact CG2-CE1 3.85Å; V558-F665 HydrophobicContact CG2-CZ 3.86Å
559	A	88.8	Confident	70.3	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.033	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	138	175.9	0	0	0	0	0	112	W422 Q425 R578 G627 I628	W422-A559 HydrophobicContact CD2-CB 4.29Å; W422-A559 HydrophobicContact CG-CB 3.99Å; Q425-A559 PolarHBondContact NE2-O 2.68Å; A559-R578 VanDerWaalsContact CA-O 3.29Å; A559-R578 WeakPolarHBondContact CA-O 2.92Å; A559-G627 WeakPolarHBondContact O-CA 3.17Å; A559-I628 PolarHBondContact N-O 2.7Å; A559-I628 PolarHBondContact O-N 3.47Å
560	G	87.5	Confident	69.7	Low	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	167.3	-176.3	0	0	0	0	0	114	R578	G560-R578 PolarHBondContact N-O 3Å; G560-R578 PolarHBondContact O-N 3.1Å
561	W	85.6	Confident	69.3	Low	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.337	C	S	.	.			trans	-107.5	145.6	174	-66.5	-83.1	0	0	0	109.6	Q425 A427 L447 K486 F487 V563 L577 T625	Q425-W561 HydrophobicContact CB-CH2 4.02Å; Q425-W561 HydrophobicContact CB-CZ3 4.47Å; Q425-W561 HydrophobicContact CG-CE3 4.25Å; Q425-W561 HydrophobicContact CG-CH2 3.24Å; Q425-W561 HydrophobicContact CG-CZ2 4.15Å; Q425-W561 HydrophobicContact CG-CZ3 3.31Å; A427-W561 HydrophobicContact CB-CE3 4.17Å; A427-W561 HydrophobicContact CB-CH2 3.93Å; A427-W561 HydrophobicContact CB-CZ3 3.63Å; L447-W561 HydrophobicContact CD2-CB 3.53Å; L447-W561 HydrophobicContact CD2-CD2 4.34Å; L447-W561 HydrophobicContact CD2-CE3 4.32Å; L447-W561 HydrophobicContact CD2-CG 4.07Å; K486-W561 HydrophobicContact CB-CH2 4.42Å; K486-W561 HydrophobicContact CB-CZ2 3.99Å; K486-W561 HydrophobicContact CG-CZ2 4.15Å; K486-W561 WeakPolarHBondContact O-CZ2 3.48Å; F487-W561 PolarHBondContact O-NE1 3.48Å; F487-W561 VanDerWaalsContact O-NE1 3.09Å; W561-V563 PolarHBondContact O-N 2.81Å; W561-V563 VanDerWaalsContact O-N 3.11Å; W561-L577 HydrophobicContact CD2-CD1 3.71Å; W561-L577 HydrophobicContact CE3-CD1 4.05Å; W561-L577 HydrophobicContact CG-CD1 4.18Å; W561-L577 HydrophobicContact CH2-CD1 4.2Å; W561-L577 HydrophobicContact CZ2-CB 4.41Å; W561-L577 HydrophobicContact CZ2-CD1 3.84Å; W561-L577 HydrophobicContact CZ2-CD2 4.39Å; W561-L577 HydrophobicContact CZ2-CG 4.47Å; W561-L577 HydrophobicContact CZ3-CD1 4.29Å; W561-T625 PolarHBondContact N-O 3.06Å; W561-T625 CarbonylContact O-C 3.59Å; W561-T625 VanDerWaalsContact O-C 3.32Å; W561-T625 WeakPolarHBondContact O-CA 3.37Å
562	N	78.7	Confident	69.1	Low	15 Å²	15	61.6 Å²	61.6	8%	0.08	34%	0.338	C	S	.	.			trans	-61.6	119.6	178.6	-170.4	-24.9	0	0	0	109.5	R489 L564 A565 E624 T625	R489-N562 WeakPolarHBondContact CD-O 3.43Å; R489-N562 PolarHBondContact NE-O 3.02Å; R489-N562 PolarHBondContact NH1-O 3.35Å; N562-L564 PolarHBondContact OD1-N 3.01Å; N562-A565 PolarHBondContact OD1-N 2.6Å; N562-E624 PolarHBondContact ND2-OE2 3.08Å; N562-T625 HydrophobicContact CB-CG2 4.25Å
563	V	72.8	Confident	69	Low	35 Å²	35	61.6 Å²	61.6	21%	0.212	34%	0.336	C	S	.	.	S	Bend	trans	-82.4	-33.9	-177.4	178.9	0	0	0	0	111.2	V448 W561 E624	V448-V563 WeakPolarHBondContact O-CG1 3.22Å; W561-V563 PolarHBondContact O-N 2.81Å; W561-V563 VanDerWaalsContact O-N 3.11Å; V563-E624 WeakPolarHBondContact CB-O 3.35Å; V563-E624 PolarHBondContact N-O 3.4Å
564	L	63.4	Low	69.2	Low	132 Å²	132	60.7 Å²	60.7	69%	0.691	34%	0.336	S	S	*	.	S	Bend	trans	-94.4	8.1	-168.5	-65.9	174.2	0	0	0	114.9	N562 D566	N562-L564 PolarHBondContact OD1-N 3.01Å; L564-D566 PolarHBondContact O-N 3.11Å
565	A	58.4	Low	69.7	Low	28 Å²	28	61.2 Å²	61.2	23%	0.231	34%	0.337	C	S	.	.			trans	-67	127.9	-177.7	0	0	0	0	0	112.9	N562 V567 F572	N562-A565 PolarHBondContact OD1-N 2.6Å; A565-V567 PolarHBondContact O-N 3.03Å; A565-F572 HydrophobicContact CB-CD2 3.79Å; A565-F572 HydrophobicContact CB-CE2 3.81Å
566	D	56.4	Low	70	Confident	85 Å²	85	57.4 Å²	57.4	46%	0.455	32%	0.323	S	S	.	.			trans	-57.5	117.9	177.6	-179.3	7.8	0	0	0	111.2	L564 R568 S569	L564-D566 PolarHBondContact O-N 3.11Å; D566-R568 PolarHBondContact O-N 2.95Å; D566-R568 PolarHBondContact OD1-N 2.96Å; D566-R568 IonicContact OD1-NE 2.77Å; D566-S569 WeakPolarHBondContact O-CB 3.46Å; D566-S569 PolarHBondContact O-N 3.4Å; D566-S569 VanDerWaalsContact O-N 3.08Å
567	V	54.5	Low	69.8	Low	103 Å²	103	58 Å²	58	62%	0.624	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.7	-178.4	-175.8	0	0	0	0	112	A565	A565-V567 PolarHBondContact O-N 3.03Å
568	R	53.8	Low	69.6	Low	176 Å²	176	60.5 Å²	60.5	66%	0.664	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-5.5	-179.3	-70.1	179.9	-91.5	-125.3	-2.9	114.6	S439 D566	S439-R568 PolarHBondContact OG-NH1 2.78Å; S439-R568 PolarHBondContact OG-NH2 2.72Å; D566-R568 PolarHBondContact O-N 2.95Å; D566-R568 PolarHBondContact OD1-N 2.96Å; D566-R568 IonicContact OD1-NE 2.77Å
569	S	54.2	Low	69.5	Low	57 Å²	57	62.3 Å²	62.3	40%	0.399	35%	0.346	S	S	.	.			trans	-86.5	129.3	-174.4	-71	0	0	0	0	113.5	D566 G571 F572	D566-S569 WeakPolarHBondContact O-CB 3.46Å; D566-S569 PolarHBondContact O-N 3.4Å; D566-S569 VanDerWaalsContact O-N 3.08Å; S569-G571 VanDerWaalsContact C-N 3.27Å; S569-G571 PolarHBondContact O-N 3.16Å; S569-F572 VanDerWaalsContact O-CB 3.25Å; S569-F572 WeakPolarHBondContact O-CB 3.5Å; S569-F572 PolarHBondContact O-N 3.12Å
570	P	48.4	Very low	69.3	Low	124 Å²	124	62.3 Å²	62.3	81%	0.805	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-62.5	-25.1	-178.4	-22.8	32.4	0	0	0	115.4	F572	P570-F572 PolarHBondContact O-N 3Å
571	G	54.2	Low	69.2	Low	65 Å²	65	63.7 Å²	63.7	67%	0.67	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-69.1	-11.8	179.1	0	0	0	0	0	114.8	S569 K573	S569-G571 VanDerWaalsContact C-N 3.27Å; S569-G571 PolarHBondContact O-N 3.16Å; G571-K573 PolarHBondContact O-N 2.94Å
572	F	61.6	Low	69.2	Low	44 Å²	44	63.9 Å²	63.9	19%	0.193	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-67.8	-30.1	-176	-170.4	-89.6	0	0	0	114.2	R489 A565 S569 P570 N574 D575	R489-F572 HydrophobicContact CG-CE1 4.33Å; R489-F572 HydrophobicContact CG-CZ 4.09Å; R489-F572 VanDerWaalsContact NH2-CE2 3.3Å; A565-F572 HydrophobicContact CB-CD2 3.79Å; A565-F572 HydrophobicContact CB-CE2 3.81Å; S569-F572 VanDerWaalsContact O-CB 3.25Å; S569-F572 WeakPolarHBondContact O-CB 3.5Å; S569-F572 PolarHBondContact O-N 3.12Å; P570-F572 PolarHBondContact O-N 3Å; F572-N574 PolarHBondContact O-N 3.44Å; F572-N574 VanDerWaalsContact O-N 3.16Å; F572-D575 PolarHBondContact O-N 3.37Å
573	K	60.5	Low	69.5	Low	129 Å²	129	64.5 Å²	64.5	56%	0.561	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-68	-15.2	-174.3	-70	-170.4	173.2	-171.1	0	114.4	R493 G571	R493-K573 PolarHBondContact NE-O 2.75Å; R493-K573 PolarHBondContact NH2-O 3.26Å; G571-K573 PolarHBondContact O-N 2.94Å
574	N	68.8	Low	70.3	Confident	117 Å²	117	64.2 Å²	64.2	63%	0.626	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-113.9	3.6	179.7	-78.7	-24.1	0	0	0	113.4	R493 F572 T576	R493-N574 PolarHBondContact NH2-OD1 2.77Å; F572-N574 PolarHBondContact O-N 3.44Å; F572-N574 VanDerWaalsContact O-N 3.16Å; N574-T576 PolarHBondContact O-N 2.89Å
575	D	77.8	Confident	71.4	Confident	23 Å²	23	59.3 Å²	59.3	12%	0.123	34%	0.335	C	S	.	.			trans	-68.5	131.5	-178	-166.5	40.5	0	0	0	110.5	Y488 R489 F572 R578	Y488-D575 WeakPolarHBondContact CA-O 3.41Å; R489-D575 HydrophobicContact CB-CB 4.31Å; R489-D575 PolarHBondContact N-O 2.82Å; F572-D575 PolarHBondContact O-N 3.37Å; D575-R578 IonicContact OD1-CZ 3.3Å; D575-R578 IonicContact OD1-NE 3.35Å; D575-R578 PolarHBondContact OD1-NE 3.38Å; D575-R578 IonicContact OD1-NH2 3.87Å; D575-R578 PolarHBondContact OD1-NH2 3.32Å
576	T	81.5	Confident	72.9	Confident	47 Å²	47	61.6 Å²	61.6	29%	0.288	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-112.6	162.1	-175.9	53.8	0	0	0	0	110.8	F487 Y488 N574 R578	F487-T576 HydrophobicContact CD1-CG2 4.11Å; F487-T576 HydrophobicContact CE1-CG2 3.49Å; F487-T576 VanDerWaalsContact CE1-CG2 3.49Å; F487-T576 HydrophobicContact CZ-CG2 3.93Å; Y488-T576 HydrophobicContact CD1-CG2 3.59Å; Y488-T576 HydrophobicContact CE1-CG2 3.53Å; N574-T576 PolarHBondContact O-N 2.89Å; T576-R578 PolarHBondContact O-N 3.15Å
577	L	83.1	Confident	74.4	Confident	12 Å²	12	60.3 Å²	60.3	6%	0.063	34%	0.341	C	S	.	.			trans	-52.7	124.7	168.1	-175.8	65.4	0	0	0	109.8	W422 Q425 F487 W561	W422-L577 HydrophobicContact CB-CD2 4Å; W422-L577 HydrophobicContact CG-CD2 4.14Å; Q425-L577 HydrophobicContact CB-CD2 4.38Å; Q425-L577 HydrophobicContact CG-CD1 3.92Å; Q425-L577 HydrophobicContact CG-CD2 4.23Å; F487-L577 HydrophobicContact CD2-CB 4.16Å; F487-L577 HydrophobicContact CE2-CB 4.42Å; F487-L577 PolarHBondContact O-N 3.31Å; W561-L577 HydrophobicContact CD2-CD1 3.71Å; W561-L577 HydrophobicContact CE3-CD1 4.05Å; W561-L577 HydrophobicContact CG-CD1 4.18Å; W561-L577 HydrophobicContact CH2-CD1 4.2Å; W561-L577 HydrophobicContact CZ2-CB 4.41Å; W561-L577 HydrophobicContact CZ2-CD1 3.84Å; W561-L577 HydrophobicContact CZ2-CD2 4.39Å; W561-L577 HydrophobicContact CZ2-CG 4.47Å; W561-L577 HydrophobicContact CZ3-CD1 4.29Å
578	R	83.7	Confident	76	Confident	75 Å²	75	59.9 Å²	59.9	28%	0.283	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	150.8	179.5	-67.6	163.8	-175.4	-144	9.3	109.5	A559 G560 D575 T576 D619 I620	A559-R578 VanDerWaalsContact CA-O 3.29Å; A559-R578 WeakPolarHBondContact CA-O 2.92Å; G560-R578 PolarHBondContact N-O 3Å; G560-R578 PolarHBondContact O-N 3.1Å; D575-R578 IonicContact OD1-CZ 3.3Å; D575-R578 IonicContact OD1-NE 3.35Å; D575-R578 PolarHBondContact OD1-NE 3.38Å; D575-R578 IonicContact OD1-NH2 3.87Å; D575-R578 PolarHBondContact OD1-NH2 3.32Å; T576-R578 PolarHBondContact O-N 3.15Å; R578-D619 VanDerWaalsContact CD-O 3.23Å; R578-D619 WeakPolarHBondContact CD-O 3.16Å; R578-D619 WeakPolarHBondContact CG-O 3.32Å; R578-I620 HydrophobicContact CB-CB 4.1Å; R578-I620 HydrophobicContact CB-CG1 4.17Å
579	S	85.9	Confident	77.7	Confident	38 Å²	38	56.2 Å²	56.2	27%	0.266	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	153.4	172.3	56.7	0	0	0	0	111.7	V558 D619	V558-S579 CarbonylContact O-C 3.5Å; V558-S579 WeakPolarHBondContact O-CA 3.36Å; V558-S579 WeakPolarHBondContact O-CB 3.48Å; S579-D619 PolarHBondContact O-N 3.25Å
580	G	84.3	Confident	79.3	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	162.2	174.5	0	0	0	0	0	111.4	T557 V558	T557-G580 WeakPolarHBondContact CA-O 3.09Å; V558-G580 PolarHBondContact N-O 2.95Å; V558-G580 PolarHBondContact O-N 3.18Å
581	V	85.3	Confident	81.2	Confident	30 Å²	30	49.9 Å²	49.9	18%	0.182	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	135.2	177	-176.7	0	0	0	0	109.1	H555 I556 E613 A616	H555-V581 HydrophobicContact CB-CG1 4.02Å; I556-V581 CarbonylContact O-C 3.57Å; I556-V581 WeakPolarHBondContact O-CA 3.46Å; V581-E613 HydrophobicContact CG1-CB 4.39Å; V581-E613 PolarHBondContact O-N 3.11Å; V581-A616 HydrophobicContact CB-CB 3.68Å; V581-A616 HydrophobicContact CG1-CB 4.29Å; V581-A616 HydrophobicContact CG2-CB 4.06Å
582	V	85.8	Confident	82.8	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	150.9	177.3	-57.1	0	0	0	0	109.8	I556 V558 A610 S611 T622	I556-V582 HydrophobicContact CB-CG2 3.82Å; I556-V582 HydrophobicContact CG2-CG2 3.9Å; I556-V582 PolarHBondContact N-O 3.49Å; I556-V582 VanDerWaalsContact N-O 3.16Å; I556-V582 PolarHBondContact O-N 2.76Å; V558-V582 HydrophobicContact CG2-CB 4.39Å; V558-V582 HydrophobicContact CG2-CG1 3.89Å; V558-V582 HydrophobicContact CG2-CG2 3.56Å; V582-A610 HydrophobicContact CB-CB 3.91Å; V582-A610 HydrophobicContact CG2-CB 3.64Å; V582-S611 CarbonylContact C-O 3.46Å; V582-S611 VanDerWaalsContact CA-O 3.27Å; V582-S611 WeakPolarHBondContact CA-O 2.98Å; V582-S611 WeakPolarHBondContact CB-O 3.35Å; V582-T622 HydrophobicContact CG1-CG2 4.47Å
583	S	86.3	Confident	83.9	Confident	27 Å²	27	51.4 Å²	51.4	19%	0.189	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	140.2	178	-69.9	0	0	0	0	109.8	V585 A610 S611 E613	S583-V585 PolarHBondContact O-N 3.36Å; S583-A610 CarbonylContact O-C 3.56Å; S583-A610 WeakPolarHBondContact O-CA 3.06Å; S583-A610 VanDerWaalsContact O-CB 3.32Å; S583-A610 WeakPolarHBondContact O-CB 3.24Å; S583-S611 PolarHBondContact N-O 3.22Å; S583-S611 PolarHBondContact O-N 2.88Å; S583-E613 WeakPolarHBondContact CB-OE2 3.14Å; S583-E613 PolarHBondContact OG-OE2 3.41Å
584	V	88.4	Confident	84.9	Confident	29 Å²	29	45.5 Å²	45.5	18%	0.176	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	132.4	-177.2	-179.4	0	0	0	0	109.3	F551 I556 F608 C609	F551-V584 HydrophobicContact CD1-CG1 4.4Å; F551-V584 HydrophobicContact CE1-CG1 3.97Å; F551-V584 HydrophobicContact CE1-CG2 4.25Å; F551-V584 HydrophobicContact CE2-CG2 4.26Å; F551-V584 HydrophobicContact CZ-CG1 4.48Å; F551-V584 HydrophobicContact CZ-CG2 4.05Å; I556-V584 HydrophobicContact CD1-CG2 3.55Å; V584-F608 HydrophobicContact CG2-CD2 4.34Å; V584-C609 WeakPolarHBondContact CA-O 3.32Å
585	V	87.7	Confident	85.7	Confident	30 Å²	30	45.5 Å²	45.5	18%	0.182	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	147.2	177.4	-177.5	0	0	0	0	108.7	S583 L589 C609 S611	S583-V585 PolarHBondContact O-N 3.36Å; V585-L589 HydrophobicContact CG1-CB 4.13Å; V585-C609 HydrophobicContact CB-CB 4.33Å; V585-C609 PolarHBondContact N-O 2.83Å; V585-S611 VanDerWaalsContact CG2-OG 3.25Å; V585-S611 WeakPolarHBondContact CG2-OG 3.33Å
586	D	88.1	Confident	85.9	Confident	75 Å²	75	51.1 Å²	51.1	40%	0.401	27%	0.272	S	S	.	.			trans	-59.5	141.2	173.5	-170	-91.4	0	0	0	111.2	L588 L589 C590	D586-L588 VanDerWaalsContact C-N 3.31Å; D586-L588 PolarHBondContact O-N 2.75Å; D586-L588 WeakPolarHBondContact OD1-CB 3.44Å; D586-L588 PolarHBondContact OD1-N 3.03Å; D586-L589 HydrophobicContact CB-CB 4.36Å; D586-L589 HydrophobicContact CB-CD1 4.08Å; D586-L589 HydrophobicContact CB-CG 4.19Å; D586-L589 PolarHBondContact O-N 2.93Å; D586-C590 PolarHBondContact O-N 3.07Å
587	S	88.4	Confident	85.6	Confident	58 Å²	58	53.1 Å²	53.1	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-62.3	-38.6	-176.5	48.6	0	0	0	0	112.2	C590 E591	S587-C590 WeakPolarHBondContact O-CB 3.2Å; S587-C590 PolarHBondContact O-N 3.44Å; S587-E591 WeakPolarHBondContact O-CG 2.98Å; S587-E591 PolarHBondContact O-N 3.27Å
588	L	88.4	Confident	85.1	Confident	95 Å²	95	55.5 Å²	55.5	50%	0.497	31%	0.306	S	S	.	.	H	α-helix	trans	-66.4	-45.6	-179.5	-178.7	65.5	0	0	0	110.9	D586 C590 E591 E592	D586-L588 VanDerWaalsContact C-N 3.31Å; D586-L588 PolarHBondContact O-N 2.75Å; D586-L588 WeakPolarHBondContact OD1-CB 3.44Å; D586-L588 PolarHBondContact OD1-N 3.03Å; L588-C590 PolarHBondContact O-N 3.18Å; L588-E591 PolarHBondContact O-N 3.05Å; L588-E592 WeakPolarHBondContact O-CG 3.47Å; L588-E592 PolarHBondContact O-N 3.27Å
589	L	88.9	Confident	84.6	Confident	99 Å²	99	55.4 Å²	55.4	52%	0.518	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-33.2	176	-66.3	177.9	0	0	0	112	V585 D586 Q593	V585-L589 HydrophobicContact CG1-CB 4.13Å; D586-L589 HydrophobicContact CB-CB 4.36Å; D586-L589 HydrophobicContact CB-CD1 4.08Å; D586-L589 HydrophobicContact CB-CG 4.19Å; D586-L589 PolarHBondContact O-N 2.93Å; L589-Q593 VanDerWaalsContact O-CB 3.24Å; L589-Q593 WeakPolarHBondContact O-CB 3.18Å; L589-Q593 PolarHBondContact O-N 3.12Å; L589-Q593 VanDerWaalsContact O-N 3.11Å
590	C	88.3	Confident	84.2	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.6	-45.8	174.5	-170.6	0	0	0	0	111.5	D586 S587 L588 Q593 H594 V603 C609	D586-C590 PolarHBondContact O-N 3.07Å; S587-C590 WeakPolarHBondContact O-CB 3.2Å; S587-C590 PolarHBondContact O-N 3.44Å; L588-C590 PolarHBondContact O-N 3.18Å; C590-Q593 PolarHBondContact O-N 3.3Å; C590-H594 PolarHBondContact O-N 3.49Å; C590-H594 PolarHBondContact O-ND1 3.11Å; C590-V603 HydrophobicContact CB-CG2 4.46Å; C590-C609 HydrophobicContact CB-CB 3.47Å; C590-C609 VanDerWaalsContact CB-CB 3.47Å; C590-C609 WeakPolarHBondContact CB-SG 3.49Å; C590-C609 WeakPolarHBondContact SG-CB 3.3Å; C590-C609 CovalentContact SG-SG 2.03Å; C590-C609 PolarHBondContact SG-SG 2.79Å
591	E	88.4	Confident	84.1	Confident	48 Å²	48	59.4 Å²	59.4	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-62.8	-50.5	178.2	-69.6	175.1	160.6	0	0	111.6	S587 L588 Q593 H594 E595 V601 S602 V603	S587-E591 WeakPolarHBondContact O-CG 2.98Å; S587-E591 PolarHBondContact O-N 3.27Å; L588-E591 PolarHBondContact O-N 3.05Å; E591-Q593 VanDerWaalsContact C-N 3.31Å; E591-Q593 PolarHBondContact O-N 2.93Å; E591-H594 PolarHBondContact O-N 3.38Å; E591-E595 PolarHBondContact O-N 2.95Å; E591-V601 HydrophobicContact CG-CG2 4.38Å; E591-S602 WeakPolarHBondContact OE1-CA 3.26Å; E591-V603 HydrophobicContact CG-CB 4.32Å; E591-V603 HydrophobicContact CG-CG2 3.79Å; E591-V603 PolarHBondContact OE1-N 3.4Å
592	E	87.9	Confident	84.1	Confident	95 Å²	95	61.4 Å²	61.4	44%	0.444	35%	0.349	S	S	.	.	H	α-helix	trans	-55.1	-45.6	177.1	-72.1	178.1	171.7	0	0	111.5	L588 H594 E595 D596	L588-E592 WeakPolarHBondContact O-CG 3.47Å; L588-E592 PolarHBondContact O-N 3.27Å; E592-H594 VanDerWaalsContact C-N 3.28Å; E592-H594 PolarHBondContact O-N 3.18Å; E592-E595 PolarHBondContact O-N 2.91Å; E592-D596 PolarHBondContact O-N 2.95Å
593	Q	85.4	Confident	84.2	Confident	46 Å²	46	62.3 Å²	62.3	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-36	178.9	178.9	174.2	63.3	0	0	112.7	L589 C590 E591 H597 R660 L661 S662	L589-Q593 VanDerWaalsContact O-CB 3.24Å; L589-Q593 WeakPolarHBondContact O-CB 3.18Å; L589-Q593 PolarHBondContact O-N 3.12Å; L589-Q593 VanDerWaalsContact O-N 3.11Å; C590-Q593 PolarHBondContact O-N 3.3Å; E591-Q593 VanDerWaalsContact C-N 3.31Å; E591-Q593 PolarHBondContact O-N 2.93Å; Q593-H597 PolarHBondContact O-ND1 3.31Å; Q593-R660 PolarHBondContact NE2-O 2.72Å; Q593-L661 HydrophobicContact CG-CD2 4.12Å; Q593-S662 VanDerWaalsContact OE1-CB 3.29Å; Q593-S662 PolarHBondContact OE1-OG 3.23Å
594	H	81.6	Confident	84.5	Confident	5 Å²	5	62.8 Å²	62.8	2%	0.023	36%	0.357	C	S	.	.	H	α-helix	trans	-78.8	-36.9	179.8	-75.5	79.1	0	0	0	111.9	C590 E591 E592 H597 G598 I599 V601 W651 S662	C590-H594 PolarHBondContact O-N 3.49Å; C590-H594 PolarHBondContact O-ND1 3.11Å; E591-H594 PolarHBondContact O-N 3.38Å; E592-H594 VanDerWaalsContact C-N 3.28Å; E592-H594 PolarHBondContact O-N 3.18Å; H594-H597 CarbonylContact O-C 3.57Å; H594-H597 PolarHBondContact O-N 2.83Å; H594-H597 VanDerWaalsContact O-N 3.15Å; H594-G598 PolarHBondContact O-N 3.24Å; H594-I599 CarbonylContact C-O 3.24Å; H594-I599 PolarHBondContact O-N 3.34Å; H594-I599 VanDerWaalsContact O-O 3.08Å; H594-V601 HydrophobicContact CB-CB 4.42Å; H594-V601 HydrophobicContact CB-CG1 4.07Å; H594-V601 HydrophobicContact CB-CG2 3.47Å; H594-V601 VanDerWaalsContact CB-CG2 3.47Å; H594-W651 AromaticContact CD2-CZ3 3.68Å; H594-W651 AromaticContact CE1-CZ3 3.99Å; H594-W651 AromaticContact NE2-CZ3 3.51Å; H594-S662 PolarHBondContact CE1-O 2.85Å; H594-S662 PolarHBondContact NE2-O 3.16Å
595	E	84.2	Confident	84.5	Confident	116 Å²	116	68.6 Å²	68.6	54%	0.542	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-44.2	173.4	-75.5	-172.2	173.2	0	0	111.9	E591 E592 H597 G598 I599	E591-E595 PolarHBondContact O-N 2.95Å; E592-E595 PolarHBondContact O-N 2.91Å; E595-H597 PolarHBondContact O-N 2.83Å; E595-H597 VanDerWaalsContact O-N 3.1Å; E595-G598 PolarHBondContact O-N 3.3Å; E595-I599 PolarHBondContact N-O 3.32Å
596	D	82.5	Confident	84.7	Confident	142 Å²	142	69 Å²	69	76%	0.759	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.8	175.6	-83	-13.6	0	0	0	112.9	E592	E592-D596 PolarHBondContact O-N 2.95Å
597	H	76	Confident	84.9	Confident	88 Å²	88	65.8 Å²	65.8	41%	0.407	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7.1	179	-69.8	79.9	0	0	0	113.5	Q593 H594 E595 Y653	Q593-H597 PolarHBondContact O-ND1 3.31Å; H594-H597 CarbonylContact O-C 3.57Å; H594-H597 PolarHBondContact O-N 2.83Å; H594-H597 VanDerWaalsContact O-N 3.15Å; E595-H597 PolarHBondContact O-N 2.83Å; E595-H597 VanDerWaalsContact O-N 3.1Å; H597-Y653 HydrophobicContact CB-CD1 3.74Å; H597-Y653 HydrophobicContact CB-CE1 3.44Å; H597-Y653 VanDerWaalsContact CB-CE1 3.44Å; H597-Y653 PolarHBondContact O-OH 2.99Å
598	G	71.8	Confident	85.1	Confident	63 Å²	63	63.4 Å²	63.4	65%	0.649	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	14.6	169.5	0	0	0	0	0	115.6	H594 E595	H594-G598 PolarHBondContact O-N 3.24Å; E595-G598 PolarHBondContact O-N 3.3Å
599	I	72.9	Confident	85.1	Confident	73 Å²	73	59 Å²	59	37%	0.374	33%	0.33	S	S	.	.			trans	-125.7	112.6	172.2	-57.8	-161.1	0	0	0	110.3	H594 E595 V601 Y653	H594-I599 CarbonylContact C-O 3.24Å; H594-I599 PolarHBondContact O-N 3.34Å; H594-I599 VanDerWaalsContact O-O 3.08Å; E595-I599 PolarHBondContact N-O 3.32Å; I599-V601 HydrophobicContact CG2-CG1 3.82Å; I599-V601 PolarHBondContact O-N 3.02Å; I599-Y653 HydrophobicContact CB-CD2 4.45Å; I599-Y653 HydrophobicContact CD1-CD2 3.36Å; I599-Y653 HydrophobicContact CD1-CE2 3.34Å; I599-Y653 HydrophobicContact CG1-CD2 3.76Å; I599-Y653 HydrophobicContact CG1-CE2 3.5Å; I599-Y653 VanDerWaalsContact CG1-CE2 3.5Å
600	P	77.6	Confident	85.1	Confident	104 Å²	104	54.3 Å²	54.3	68%	0.675	31%	0.306	S	S	*	.			trans	-68.8	125.7	169.1	29.3	-32.2	0	0	0	109.5
601	V	82.1	Confident	84.9	Confident	20 Å²	20	55.9 Å²	55.9	12%	0.121	32%	0.316	C	S	.	.			trans	-125.9	155.1	177.8	-59.9	0	0	0	0	109.4	E591 H594 I599 W651	E591-V601 HydrophobicContact CG-CG2 4.38Å; H594-V601 HydrophobicContact CB-CB 4.42Å; H594-V601 HydrophobicContact CB-CG1 4.07Å; H594-V601 HydrophobicContact CB-CG2 3.47Å; H594-V601 VanDerWaalsContact CB-CG2 3.47Å; I599-V601 HydrophobicContact CG2-CG1 3.82Å; I599-V601 PolarHBondContact O-N 3.02Å; V601-W651 HydrophobicContact CB-CH2 3.54Å; V601-W651 HydrophobicContact CB-CZ2 4.2Å; V601-W651 HydrophobicContact CB-CZ3 3.98Å; V601-W651 HydrophobicContact CG1-CE3 4.44Å; V601-W651 HydrophobicContact CG1-CH2 3.83Å; V601-W651 HydrophobicContact CG1-CZ3 3.72Å; V601-W651 HydrophobicContact CG2-CH2 3.6Å; V601-W651 HydrophobicContact CG2-CZ3 4.09Å
602	S	85.8	Confident	84.5	Confident	73 Å²	73	57.3 Å²	57.3	51%	0.51	32%	0.32	S	S	.	.			trans	-126.9	120.3	175.5	-56.8	0	0	0	0	109.6	E591	E591-S602 WeakPolarHBondContact OE1-CA 3.26Å
603	V	88.4	Confident	84.1	Confident	22 Å²	22	54.7 Å²	54.7	13%	0.133	31%	0.308	C	S	.	.			trans	-92.9	109.7	-179.3	-178.6	0	0	0	0	108.7	C590 E591 M607 W651	C590-V603 HydrophobicContact CB-CG2 4.46Å; E591-V603 HydrophobicContact CG-CB 4.32Å; E591-V603 HydrophobicContact CG-CG2 3.79Å; E591-V603 PolarHBondContact OE1-N 3.4Å; V603-M607 HydrophobicContact CG1-CB 3.99Å; V603-W651 HydrophobicContact CG2-CH2 4.43Å; V603-W651 HydrophobicContact CG2-CZ2 4.46Å
604	T	90.9	Very high	83.5	Confident	38 Å²	38	56.8 Å²	56.8	23%	0.233	33%	0.325	C	S	.	.			trans	-83.2	169.1	179.1	75	0	0	0	0	112.2	D518 N606 M607	D518-T604 HydrophobicContact CB-CG2 4.15Å; D518-T604 WeakPolarHBondContact OD1-CB 3.48Å; D518-T604 PolarHBondContact OD1-OG1 3.45Å; T604-N606 PolarHBondContact O-N 2.88Å; T604-N606 VanDerWaalsContact O-N 3.1Å; T604-N606 PolarHBondContact OG1-N 3.49Å; T604-M607 HydrophobicContact CG2-CE 4.3Å; T604-M607 PolarHBondContact O-N 2.91Å
605	D	89.1	Confident	83	Confident	150 Å²	150	62.4 Å²	62.4	80%	0.802	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.9	173.1	-73.3	-30	0	0	0	114.1	M607	D605-M607 VanDerWaalsContact C-N 3.27Å
606	N	92.1	Very high	82.4	Confident	38 Å²	38	57.7 Å²	57.7	20%	0.203	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	0.9	176.3	-60.3	-44.8	0	0	0	112.6	D518 T604 K667 F671	D518-N606 WeakPolarHBondContact OD1-CB 3.09Å; D518-N606 PolarHBondContact OD1-ND2 3.38Å; D518-N606 PolarHBondContact OD2-ND2 3.06Å; T604-N606 PolarHBondContact O-N 2.88Å; T604-N606 VanDerWaalsContact O-N 3.1Å; T604-N606 PolarHBondContact OG1-N 3.49Å; N606-K667 VanDerWaalsContact O-CB 3.25Å; N606-K667 WeakPolarHBondContact O-CB 3.08Å; N606-K667 PolarHBondContact O-N 3.44Å; N606-F671 HydrophobicContact CB-CE2 4.06Å; N606-F671 HydrophobicContact CB-CZ 3.84Å
607	M	92.6	Very high	81.7	Confident	9 Å²	9	55.2 Å²	55.2	4%	0.044	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	163.9	-179.9	-59.2	-174.3	-164.8	0	0	111.3	L516 L517 D518 V603 T604 D605 W651 F665	L516-M607 WeakPolarHBondContact O-CE 3.32Å; L517-M607 WeakPolarHBondContact O-CE 3.25Å; D518-M607 HydrophobicContact CB-CE 4.23Å; V603-M607 HydrophobicContact CG1-CB 3.99Å; T604-M607 HydrophobicContact CG2-CE 4.3Å; T604-M607 PolarHBondContact O-N 2.91Å; D605-M607 VanDerWaalsContact C-N 3.27Å; M607-W651 HydrophobicContact SD-CZ2 4.28Å; M607-F665 CarbonylContact C-O 3.26Å; M607-F665 VanDerWaalsContact CA-O 3.28Å; M607-F665 WeakPolarHBondContact CA-O 3.44Å
608	F	91.5	Very high	81.3	Confident	8 Å²	8	52 Å²	52	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	149	161.3	69	-84.1	0	0	0	109.4	F551 I556 V584 A610 A629 F665 K667	F551-F608 HydrophobicContact CE1-CB 3.86Å; F551-F608 HydrophobicContact CE1-CD2 4.44Å; F551-F608 HydrophobicContact CE1-CG 4.09Å; F551-F608 HydrophobicContact CZ-CB 3.91Å; F551-F608 AromaticContact CZ-CD1 3.9Å; F551-F608 HydrophobicContact CZ-CD1 3.9Å; F551-F608 AromaticContact CZ-CD2 3.82Å; F551-F608 HydrophobicContact CZ-CD2 3.82Å; F551-F608 HydrophobicContact CZ-CE1 4.35Å; F551-F608 HydrophobicContact CZ-CE2 4.29Å; F551-F608 AromaticContact CZ-CG 3.61Å; F551-F608 HydrophobicContact CZ-CG 3.61Å; I556-F608 HydrophobicContact CD1-CD2 4.48Å; I556-F608 HydrophobicContact CD1-CE2 3.67Å; I556-F608 HydrophobicContact CD1-CZ 4.09Å; V584-F608 HydrophobicContact CG2-CD2 4.34Å; F608-A610 HydrophobicContact CD2-CB 4.46Å; F608-A610 HydrophobicContact CE2-CB 4.26Å; F608-A629 HydrophobicContact CZ-CB 4.39Å; F608-F665 HydrophobicContact CD1-CB 3.95Å; F608-F665 HydrophobicContact CD2-CB 4.38Å; F608-F665 HydrophobicContact CD2-CD2 4.46Å; F608-F665 HydrophobicContact CE1-CB 3.47Å; F608-F665 VanDerWaalsContact CE1-CB 3.47Å; F608-F665 HydrophobicContact CE1-CG 4.35Å; F608-F665 HydrophobicContact CE2-CB 3.95Å; F608-F665 AromaticContact CE2-CD2 3.98Å; F608-F665 HydrophobicContact CE2-CD2 3.98Å; F608-F665 HydrophobicContact CE2-CG 4.05Å; F608-F665 HydrophobicContact CG-CB 4.39Å; F608-F665 HydrophobicContact CZ-CB 3.47Å; F608-F665 VanDerWaalsContact CZ-CB 3.47Å; F608-F665 HydrophobicContact CZ-CD1 4.44Å; F608-F665 HydrophobicContact CZ-CD2 4.26Å; F608-F665 AromaticContact CZ-CG 3.84Å; F608-F665 HydrophobicContact CZ-CG 3.84Å; F608-F665 PolarHBondContact N-O 2.99Å; F608-F665 PolarHBondContact O-N 3.41Å; F608-K667 HydrophobicContact CD1-CB 3.97Å; F608-K667 HydrophobicContact CD1-CG 4.14Å
609	C	89.9	Confident	81.3	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.007	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	146.5	172.7	-66.7	0	0	0	0	110.7	V584 V585 C590 T663	V584-C609 WeakPolarHBondContact CA-O 3.32Å; V585-C609 HydrophobicContact CB-CB 4.33Å; V585-C609 PolarHBondContact N-O 2.83Å; C590-C609 HydrophobicContact CB-CB 3.47Å; C590-C609 VanDerWaalsContact CB-CB 3.47Å; C590-C609 WeakPolarHBondContact CB-SG 3.49Å; C590-C609 WeakPolarHBondContact SG-CB 3.3Å; C590-C609 CovalentContact SG-SG 2.03Å; C590-C609 PolarHBondContact SG-SG 2.79Å; C609-T663 WeakPolarHBondContact CA-O 3.36Å
610	A	88.4	Confident	81.4	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.017	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	143.8	170.4	0	0	0	0	0	110.8	V582 S583 F608 T663 F665	V582-A610 HydrophobicContact CB-CB 3.91Å; V582-A610 HydrophobicContact CG2-CB 3.64Å; S583-A610 CarbonylContact O-C 3.56Å; S583-A610 WeakPolarHBondContact O-CA 3.06Å; S583-A610 VanDerWaalsContact O-CB 3.32Å; S583-A610 WeakPolarHBondContact O-CB 3.24Å; F608-A610 HydrophobicContact CD2-CB 4.46Å; F608-A610 HydrophobicContact CE2-CB 4.26Å; A610-T663 PolarHBondContact N-O 3.15Å; A610-T663 PolarHBondContact O-N 3.23Å; A610-F665 HydrophobicContact CB-CD2 4.23Å; A610-F665 HydrophobicContact CB-CE2 3.84Å
611	S	84.9	Confident	81.2	Confident	32 Å²	32	46.8 Å²	46.8	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	163	175.7	65	0	0	0	0	110.4	V582 S583 V585 E613	V582-S611 CarbonylContact C-O 3.46Å; V582-S611 VanDerWaalsContact CA-O 3.27Å; V582-S611 WeakPolarHBondContact CA-O 2.98Å; V582-S611 WeakPolarHBondContact CB-O 3.35Å; S583-S611 PolarHBondContact N-O 3.22Å; S583-S611 PolarHBondContact O-N 2.88Å; V585-S611 VanDerWaalsContact CG2-OG 3.25Å; V585-S611 WeakPolarHBondContact CG2-OG 3.33Å; S611-E613 PolarHBondContact O-N 2.99Å
612	W	79.8	Confident	80.6	Confident	79 Å²	79	47 Å²	47	30%	0.299	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	136.7	177.7	177.7	63.1	0	0	0	111.5	P614 A616 S618 H659	W612-P614 HydrophobicContact CE3-CB 4.34Å; W612-P614 HydrophobicContact CE3-CG 4.36Å; W612-P614 VanDerWaalsContact CH2-CA 3.46Å; W612-P614 HydrophobicContact CH2-CB 4.25Å; W612-P614 WeakPolarHBondContact CH2-O 3.34Å; W612-P614 HydrophobicContact CZ3-CB 3.86Å; W612-P614 HydrophobicContact CZ3-CG 4.32Å; W612-P614 WeakPolarHBondContact O-CD 3.26Å; W612-A616 PolarHBondContact NE1-O 3.5Å; W612-S618 VanDerWaalsContact CD1-CB 3.42Å; W612-H659 HydrophobicContact CB-CB 4.28Å; W612-H659 HydrophobicContact CD2-CB 4.13Å; W612-H659 AromaticContact CD2-ND1 3.65Å; W612-H659 HydrophobicContact CE3-CB 3.74Å; W612-H659 HydrophobicContact CG-CB 4.37Å; W612-H659 AromaticContact CG-ND1 3.63Å; W612-H659 HydrophobicContact CZ3-CB 4.41Å
613	E	79.4	Confident	79.7	Confident	39 Å²	39	44.9 Å²	44.9	18%	0.182	26%	0.261	C	S	.	.			trans	-85.8	112.9	176.4	178	55.6	-127.2	0	0	110	V581 S583 S611 T615 A616	V581-E613 HydrophobicContact CG1-CB 4.39Å; V581-E613 PolarHBondContact O-N 3.11Å; S583-E613 WeakPolarHBondContact CB-OE2 3.14Å; S583-E613 PolarHBondContact OG-OE2 3.41Å; S611-E613 PolarHBondContact O-N 2.99Å; E613-T615 PolarHBondContact O-N 3.28Å; E613-T615 VanDerWaalsContact O-N 3.09Å; E613-T615 PolarHBondContact OE1-OG1 3.44Å; E613-A616 HydrophobicContact CB-CB 4.1Å; E613-A616 HydrophobicContact CG-CB 3.94Å; E613-A616 PolarHBondContact O-N 3.49Å; E613-A616 VanDerWaalsContact O-N 3.07Å
614	P	72.3	Confident	78.7	Confident	91 Å²	91	46.2 Å²	46.2	59%	0.591	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-24.2	-170	-23.5	34.2	0	0	0	115.5	W612	W612-P614 HydrophobicContact CE3-CB 4.34Å; W612-P614 HydrophobicContact CE3-CG 4.36Å; W612-P614 VanDerWaalsContact CH2-CA 3.46Å; W612-P614 HydrophobicContact CH2-CB 4.25Å; W612-P614 WeakPolarHBondContact CH2-O 3.34Å; W612-P614 HydrophobicContact CZ3-CB 3.86Å; W612-P614 HydrophobicContact CZ3-CG 4.32Å; W612-P614 WeakPolarHBondContact O-CD 3.26Å
615	T	71.3	Confident	77.5	Confident	122 Å²	122	44.4 Å²	44.4	75%	0.748	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-9.5	-177.2	60.1	0	0	0	0	113	E613	E613-T615 PolarHBondContact O-N 3.28Å; E613-T615 VanDerWaalsContact O-N 3.09Å; E613-T615 PolarHBondContact OE1-OG1 3.44Å
616	A	72.1	Confident	76.5	Confident	17 Å²	17	38.2 Å²	38.2	14%	0.14	23%	0.226	C	C	.	.	S	Bend	trans	-109.6	139.1	-173.4	0	0	0	0	0	112.4	V581 W612 E613 S618	V581-A616 HydrophobicContact CB-CB 3.68Å; V581-A616 HydrophobicContact CG1-CB 4.29Å; V581-A616 HydrophobicContact CG2-CB 4.06Å; W612-A616 PolarHBondContact NE1-O 3.5Å; E613-A616 HydrophobicContact CB-CB 4.1Å; E613-A616 HydrophobicContact CG-CB 3.94Å; E613-A616 PolarHBondContact O-N 3.49Å; E613-A616 VanDerWaalsContact O-N 3.07Å; A616-S618 PolarHBondContact O-N 2.95Å
617	P	66.1	Low	76.1	Confident	91 Å²	91	36.5 Å²	36.5	59%	0.591	22%	0.217	S	C	*	.			trans	-62.9	133.2	175.6	25	-31.6	0	0	0	110.6	T417	T417-P617 HydrophobicContact CG2-CB 4.15Å; T417-P617 HydrophobicContact CG2-CG 3.84Å
618	S	69.2	Low	76	Confident	20 Å²	20	36.1 Å²	36.1	14%	0.14	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-148.6	125.6	179.8	179.7	0	0	0	0	111	W612 A616 I620	W612-S618 VanDerWaalsContact CD1-CB 3.42Å; A616-S618 PolarHBondContact O-N 2.95Å; S618-I620 WeakPolarHBondContact OG-CG2 3.29Å; S618-I620 PolarHBondContact OG-N 3.47Å
619	D	70.2	Confident	76	Confident	118 Å²	118	35.8 Å²	35.8	63%	0.631	21%	0.214	S	C	*	.			trans	-109.6	9.1	169.7	-61.8	-33.6	0	0	0	111.2	R578 S579	R578-D619 VanDerWaalsContact CD-O 3.23Å; R578-D619 WeakPolarHBondContact CD-O 3.16Å; R578-D619 WeakPolarHBondContact CG-O 3.32Å; S579-D619 PolarHBondContact O-N 3.25Å
620	I	74.8	Confident	76.1	Confident	9 Å²	9	35.9 Å²	35.9	5%	0.046	22%	0.215	C	C	.	.			trans	-94.8	139.5	-175.4	-162	169.9	0	0	0	112.4	V558 R578 S618 T622 T625	V558-I620 HydrophobicContact CB-CD1 4.05Å; V558-I620 HydrophobicContact CG1-CD1 3.74Å; V558-I620 WeakPolarHBondContact O-CD1 3.42Å; R578-I620 HydrophobicContact CB-CB 4.1Å; R578-I620 HydrophobicContact CB-CG1 4.17Å; S618-I620 WeakPolarHBondContact OG-CG2 3.29Å; S618-I620 PolarHBondContact OG-N 3.47Å; I620-T622 HydrophobicContact CG2-CG2 4.39Å; I620-T625 HydrophobicContact CG1-CG2 4.15Å; I620-T625 WeakPolarHBondContact CG1-OG1 3.28Å
621	C	74.6	Confident	76	Confident	4 Å²	4	36.2 Å²	36.2	3%	0.027	22%	0.217	C	C	.	.			trans	-110.4	94.9	169.2	-163.5	0	0	0	0	109.5	A623 E624 T625 C657	C621-A623 PolarHBondContact O-N 3.25Å; C621-A623 VanDerWaalsContact O-N 3.16Å; C621-E624 HydrophobicContact CB-CB 4.15Å; C621-E624 HydrophobicContact CB-CG 4.36Å; C621-E624 PolarHBondContact O-N 3.45Å; C621-T625 VanDerWaalsContact C-OG1 3.27Å; C621-T625 WeakPolarHBondContact O-CB 3.36Å; C621-T625 PolarHBondContact O-N 3.04Å; C621-T625 PolarHBondContact O-OG1 3.31Å; C621-C657 WeakPolarHBondContact CA-SG 3.22Å; C621-C657 HydrophobicContact CB-CB 4.19Å; C621-C657 WeakPolarHBondContact CB-SG 3.14Å; C621-C657 WeakPolarHBondContact SG-CA 3.41Å; C621-C657 WeakPolarHBondContact SG-CB 3.42Å; C621-C657 CovalentContact SG-SG 2.02Å; C621-C657 PolarHBondContact SG-SG 3.31Å
622	T	69.1	Low	76	Confident	24 Å²	24	37 Å²	37	15%	0.147	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-30.4	-170.2	47.5	0	0	0	0	113.3	V558 V582 I620 T663 F665	V558-T622 HydrophobicContact CB-CG2 4.49Å; V558-T622 HydrophobicContact CG1-CG2 4.22Å; V582-T622 HydrophobicContact CG1-CG2 4.47Å; I620-T622 HydrophobicContact CG2-CG2 4.39Å; T622-T663 PolarHBondContact OG1-OG1 2.72Å; T622-F665 HydrophobicContact CG2-CZ 4.26Å
623	A	66.3	Low	76	Confident	28 Å²	28	34.5 Å²	34.5	23%	0.231	21%	0.213	C	C	.	.	H	α-helix	trans	-69.1	-29.8	175.8	0	0	0	0	0	114.1	C621 S652 D654	C621-A623 PolarHBondContact O-N 3.25Å; C621-A623 VanDerWaalsContact O-N 3.16Å; A623-S652 WeakPolarHBondContact CB-OG 3.46Å; A623-D654 HydrophobicContact CB-CB 3.85Å; A623-D654 WeakPolarHBondContact CB-O 3.25Å
624	E	69.3	Low	75.6	Confident	51 Å²	51	37 Å²	37	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-100.9	-22.7	-177.6	-63.1	-173.5	170.4	0	0	113.5	N562 V563 C621	N562-E624 PolarHBondContact ND2-OE2 3.08Å; V563-E624 WeakPolarHBondContact CB-O 3.35Å; V563-E624 PolarHBondContact N-O 3.4Å; C621-E624 HydrophobicContact CB-CB 4.15Å; C621-E624 HydrophobicContact CB-CG 4.36Å; C621-E624 PolarHBondContact O-N 3.45Å
625	T	64.4	Low	75.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-98.8	-4.9	-165.1	45.4	0	0	0	0	115.7	W561 N562 I620 C621 G627	W561-T625 PolarHBondContact N-O 3.06Å; W561-T625 CarbonylContact O-C 3.59Å; W561-T625 VanDerWaalsContact O-C 3.32Å; W561-T625 WeakPolarHBondContact O-CA 3.37Å; N562-T625 HydrophobicContact CB-CG2 4.25Å; I620-T625 HydrophobicContact CG1-CG2 4.15Å; I620-T625 WeakPolarHBondContact CG1-OG1 3.28Å; C621-T625 VanDerWaalsContact C-OG1 3.27Å; C621-T625 WeakPolarHBondContact O-CB 3.36Å; C621-T625 PolarHBondContact O-N 3.04Å; C621-T625 PolarHBondContact O-OG1 3.31Å; T625-G627 PolarHBondContact O-N 3.21Å
626	G	69.2	Low	74.5	Confident	19 Å²	19	37.8 Å²	37.8	20%	0.196	22%	0.216	C	C	.	.			trans	35.4	80.9	176.3	0	0	0	0	0	112.6	S450	S450-G626 WeakPolarHBondContact CB-O 3.06Å; S450-G626 PolarHBondContact N-O 2.95Å; S450-G626 PolarHBondContact OG-O 3.08Å
627	G	82.6	Confident	73.6	Confident	2 Å²	2	42.1 Å²	42.1	2%	0.021	25%	0.252	C	S	.	.			trans	-117.9	-175	-163.2	0	0	0	0	0	115.5	A559 T625 V649	A559-G627 WeakPolarHBondContact O-CA 3.17Å; T625-G627 PolarHBondContact O-N 3.21Å; G627-V649 VanDerWaalsContact N-CG2 3.27Å; G627-V649 WeakPolarHBondContact O-CG2 3.06Å; G627-V649 PolarHBondContact O-N 2.57Å
628	I	91.4	Very high	73.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	144.8	169	70	176.1	0	0	0	109.5	Q425 A452 V558 A559 L645 L648	Q425-I628 VanDerWaalsContact OE1-CG1 3.27Å; A452-I628 HydrophobicContact CB-CD1 3.87Å; A452-I628 HydrophobicContact CB-CG2 4.11Å; V558-I628 VanDerWaalsContact CA-O 3.29Å; V558-I628 WeakPolarHBondContact CA-O 3.21Å; A559-I628 PolarHBondContact N-O 2.7Å; A559-I628 PolarHBondContact O-N 3.47Å; I628-L645 HydrophobicContact CB-CD1 4.07Å; I628-L648 HydrophobicContact CG2-CD2 4Å
629	A	90.8	Very high	72.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.2	176.3	0	0	0	0	0	109.5	I556 V558 F608 M646 G647 F665	I556-A629 HydrophobicContact CG2-CB 3.6Å; V558-A629 HydrophobicContact CG2-CB 4.21Å; F608-A629 HydrophobicContact CZ-CB 4.39Å; A629-M646 PolarHBondContact O-N 3.31Å; A629-G647 PolarHBondContact N-O 2.02Å; A629-G647 PolarHBondContact O-N 3.17Å; A629-F665 HydrophobicContact CB-CD1 3.9Å; A629-F665 HydrophobicContact CB-CE1 4.03Å
630	A	91.2	Very high	72.9	Confident	3 Å²	3	42.9 Å²	42.9	3%	0.025	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148	-176.7	0	0	0	0	0	111.8	I539 T557 W643 H644	I539-A630 HydrophobicContact CD1-CB 3.65Å; T557-A630 PolarHBondContact N-O 3.5Å; T557-A630 PolarHBondContact O-N 3.46Å; A630-W643 HydrophobicContact CB-CE3 3.9Å; A630-W643 HydrophobicContact CB-CZ3 4.38Å; A630-H644 CarbonylContact C-O 3.46Å; A630-H644 VanDerWaalsContact CA-O 3.25Å; A630-H644 WeakPolarHBondContact CA-O 3.49Å
631	V	88.1	Confident	73	Confident	10 Å²	10	46.2 Å²	46.2	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.7	177.1	66.3	0	0	0	0	109.9	F633 W643 H644 M646	V631-F633 HydrophobicContact CG1-CD1 4.14Å; V631-F633 HydrophobicContact CG1-CE1 4.14Å; V631-W643 CarbonylContact O-C 3.59Å; V631-W643 WeakPolarHBondContact O-CA 3.42Å; V631-H644 HydrophobicContact CG1-CB 4.3Å; V631-H644 PolarHBondContact N-O 2.77Å; V631-H644 PolarHBondContact O-N 3.18Å; V631-M646 HydrophobicContact CG1-CB 4.37Å
632	S	84.9	Confident	73.5	Confident	47 Å²	47	48.5 Å²	48.5	33%	0.329	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.9	176.9	175.4	0	0	0	0	110.3	R642	S632-R642 WeakPolarHBondContact CA-O 3.14Å
633	F	78.5	Confident	74.5	Confident	27 Å²	27	48.7 Å²	48.7	12%	0.118	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	151	173.4	50.6	-99.1	0	0	0	111.4	D546 V631 P641 R642 H644	D546-F633 HydrophobicContact CB-CE2 3.64Å; D546-F633 HydrophobicContact CB-CZ 3.58Å; V631-F633 HydrophobicContact CG1-CD1 4.14Å; V631-F633 HydrophobicContact CG1-CE1 4.14Å; F633-P641 WeakPolarHBondContact O-CA 3.45Å; F633-R642 PolarHBondContact N-O 3.15Å; F633-R642 PolarHBondContact O-N 2.85Å; F633-H644 AromaticContact CD1-ND1 3.87Å; F633-H644 AromaticContact CD2-CE1 3.97Å; F633-H644 HydrophobicContact CE1-CB 3.83Å; F633-H644 AromaticContact CE1-CE1 3.72Å; F633-H644 AromaticContact CE1-CG 3.43Å; F633-H644 VanDerWaalsContact CE1-CG 3.43Å; F633-H644 AromaticContact CE1-ND1 3.21Å; F633-H644 WeakPolarHBondContact CE1-ND1 3.35Å; F633-H644 AromaticContact CE2-CE1 3.17Å; F633-H644 WeakPolarHBondContact CE2-CE1 3.47Å; F633-H644 AromaticContact CE2-ND1 3.58Å; F633-H644 AromaticContact CE2-NE2 3.67Å; F633-H644 HydrophobicContact CZ-CB 4.17Å; F633-H644 AromaticContact CZ-CD2 3.48Å; F633-H644 VanDerWaalsContact CZ-CD2 3.48Å; F633-H644 WeakPolarHBondContact CZ-CD2 3.47Å; F633-H644 AromaticContact CZ-CE1 3.06Å; F633-H644 WeakPolarHBondContact CZ-CE1 2.9Å; F633-H644 AromaticContact CZ-CG 3.32Å; F633-H644 AromaticContact CZ-ND1 3.06Å; F633-H644 WeakPolarHBondContact CZ-ND1 2.99Å; F633-H644 AromaticContact CZ-NE2 3.36Å; F633-H644 WeakPolarHBondContact CZ-NE2 2.81Å
634	P	71.1	Confident	75.6	Confident	92 Å²	92	48 Å²	48	60%	0.597	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	133.8	175.7	25.5	-32.4	0	0	0	110.7
635	G	62	Low	76.8	Confident	20 Å²	20	45.6 Å²	45.6	21%	0.206	27%	0.266	C	S	.	.			trans	-71.3	140.6	180	0	0	0	0	0	112.8	A637 S638 E640	G635-A637 PolarHBondContact O-N 2.9Å; G635-S638 CarbonylContact C-O 3.6Å; G635-S638 WeakPolarHBondContact CA-O 3.47Å; G635-S638 PolarHBondContact N-O 2.79Å; G635-S638 CarbonylContact O-C 3.42Å; G635-S638 PolarHBondContact O-N 3.43Å; G635-E640 PolarHBondContact N-O 3.12Å
636	R	57.7	Low	78	Confident	209 Å²	209	45.8 Å²	45.8	79%	0.789	27%	0.266	S	S	*	.	S	Bend	trans	-61	-28.4	174.2	-69.8	-174.8	-176.7	-138.7	2	114	R545	R545-R636 PolarHBondContact O-NH2 3.37Å
637	A	54.3	Low	79.1	Confident	108 Å²	108	44.9 Å²	44.9	89%	0.893	26%	0.257	S	S	*	.	S	Bend	trans	-102.3	-11.7	-176.1	0	0	0	0	0	114.2	G635	G635-A637 PolarHBondContact O-N 2.9Å
638	S	57.6	Low	79.6	Confident	32 Å²	32	44.9 Å²	44.9	22%	0.224	26%	0.257	C	S	.	.	S	Bend	trans	-150.2	132.9	177.5	62.6	0	0	0	0	108.7	G635 E640	G635-S638 CarbonylContact C-O 3.6Å; G635-S638 WeakPolarHBondContact CA-O 3.47Å; G635-S638 PolarHBondContact N-O 2.79Å; G635-S638 CarbonylContact O-C 3.42Å; G635-S638 PolarHBondContact O-N 3.43Å; S638-E640 PolarHBondContact O-N 2.85Å
639	P	62.5	Low	79.6	Confident	126 Å²	126	45.4 Å²	45.4	82%	0.818	26%	0.26	S	S	*	.	S	Bend	trans	-63.9	-9.5	179.8	26.1	-33.9	0	0	0	113.7
640	E	70.9	Confident	79.3	Confident	88 Å²	88	45.9 Å²	45.9	41%	0.411	26%	0.263	S	S	.	.	S	Bend	trans	-67.5	129.1	174.5	-63.2	-174.2	166.1	0	0	111.6	K408 G635 S638	K408-E640 WeakPolarHBondContact CE-OE2 3.35Å; K408-E640 VanDerWaalsContact NZ-CD 3.32Å; K408-E640 IonicContact NZ-OE1 3.49Å; K408-E640 PolarHBondContact NZ-OE1 3.28Å; K408-E640 VanDerWaalsContact NZ-OE1 3.15Å; K408-E640 IonicContact NZ-OE2 2.74Å; K408-E640 PolarHBondContact NZ-OE2 2.87Å; G635-E640 PolarHBondContact N-O 3.12Å; S638-E640 PolarHBondContact O-N 2.85Å
641	P	77.1	Confident	78.8	Confident	79 Å²	79	47.7 Å²	47.7	51%	0.513	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	143.1	175.4	28	-33.7	0	0	0	111.7	F633	F633-P641 WeakPolarHBondContact O-CA 3.45Å
642	R	85.3	Confident	78.1	Confident	52 Å²	52	49 Å²	49	20%	0.196	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138	177.1	-71	179.8	-176.5	-92.5	-6.6	111.2	I405 C406 G407 S632 F633 H644	I405-R642 VanDerWaalsContact CG2-NH1 3.25Å; C406-R642 PolarHBondContact O-NH1 3.27Å; G407-R642 WeakPolarHBondContact O-CA 3.45Å; S632-R642 WeakPolarHBondContact CA-O 3.14Å; F633-R642 PolarHBondContact N-O 3.15Å; F633-R642 PolarHBondContact O-N 2.85Å; R642-H644 PolarHBondContact O-CE1 2.89Å; R642-H644 PolarHBondContact O-ND1 2.89Å
643	W	88.6	Confident	77.1	Confident	27 Å²	27	50.4 Å²	50.4	10%	0.102	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.9	176.2	-69	86.1	0	0	0	112.1	G407 W422 W424 I539 C540 A630 V631	G407-W643 WeakPolarHBondContact CA-O 3.49Å; G407-W643 PolarHBondContact O-N 2.94Å; W422-W643 AromaticContact CH2-CH2 3.56Å; W422-W643 HydrophobicContact CH2-CH2 3.56Å; W422-W643 AromaticContact CH2-CZ2 3.87Å; W422-W643 HydrophobicContact CH2-CZ2 3.87Å; W422-W643 AromaticContact CH2-CZ3 3.93Å; W422-W643 HydrophobicContact CH2-CZ3 3.93Å; W422-W643 HydrophobicContact CZ3-CD2 4.1Å; W422-W643 HydrophobicContact CZ3-CE3 4.02Å; W422-W643 AromaticContact CZ3-CH2 3.78Å; W422-W643 HydrophobicContact CZ3-CH2 3.78Å; W422-W643 AromaticContact CZ3-CZ2 3.85Å; W422-W643 HydrophobicContact CZ3-CZ2 3.85Å; W422-W643 AromaticContact CZ3-CZ3 3.87Å; W422-W643 HydrophobicContact CZ3-CZ3 3.87Å; W424-W643 HydrophobicContact CH2-CB 3.25Å; W424-W643 AromaticContact CH2-CD1 3.53Å; W424-W643 HydrophobicContact CH2-CD2 4.03Å; W424-W643 AromaticContact CH2-CG 3.29Å; W424-W643 HydrophobicContact CH2-CG 3.29Å; W424-W643 HydrophobicContact CZ2-CB 3.58Å; W424-W643 HydrophobicContact CZ2-CD2 4.01Å; W424-W643 HydrophobicContact CZ2-CE3 4.4Å; W424-W643 AromaticContact CZ2-CG 3.67Å; W424-W643 HydrophobicContact CZ2-CG 3.67Å; W424-W643 HydrophobicContact CZ3-CB 4Å; W424-W643 HydrophobicContact CZ3-CG 4.34Å; I539-W643 HydrophobicContact CG1-CB 4.39Å; I539-W643 WeakPolarHBondContact CG1-O 3.25Å; C540-W643 WeakPolarHBondContact CB-O 3.38Å; C540-W643 PolarHBondContact N-O 3.15Å; C540-W643 VanDerWaalsContact N-O 3.15Å; A630-W643 HydrophobicContact CB-CE3 3.9Å; A630-W643 HydrophobicContact CB-CZ3 4.38Å; V631-W643 CarbonylContact O-C 3.59Å; V631-W643 WeakPolarHBondContact O-CA 3.42Å
644	H	91.1	Very high	76.3	Confident	14 Å²	14	49.9 Å²	49.9	7%	0.065	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.3	-178.8	-63	74.8	0	0	0	110.4	C540 A542 A630 V631 F633 R642 M646	C540-H644 WeakPolarHBondContact CB-CD2 3.47Å; C540-H644 WeakPolarHBondContact CB-NE2 3.29Å; C540-H644 CarbonylContact O-C 3.53Å; C540-H644 VanDerWaalsContact O-CA 3.25Å; C540-H644 WeakPolarHBondContact O-CA 3.45Å; A542-H644 HydrophobicContact CB-CB 4Å; A630-H644 CarbonylContact C-O 3.46Å; A630-H644 VanDerWaalsContact CA-O 3.25Å; A630-H644 WeakPolarHBondContact CA-O 3.49Å; V631-H644 HydrophobicContact CG1-CB 4.3Å; V631-H644 PolarHBondContact N-O 2.77Å; V631-H644 PolarHBondContact O-N 3.18Å; F633-H644 AromaticContact CD1-ND1 3.87Å; F633-H644 AromaticContact CD2-CE1 3.97Å; F633-H644 HydrophobicContact CE1-CB 3.83Å; F633-H644 AromaticContact CE1-CE1 3.72Å; F633-H644 AromaticContact CE1-CG 3.43Å; F633-H644 VanDerWaalsContact CE1-CG 3.43Å; F633-H644 AromaticContact CE1-ND1 3.21Å; F633-H644 WeakPolarHBondContact CE1-ND1 3.35Å; F633-H644 AromaticContact CE2-CE1 3.17Å; F633-H644 WeakPolarHBondContact CE2-CE1 3.47Å; F633-H644 AromaticContact CE2-ND1 3.58Å; F633-H644 AromaticContact CE2-NE2 3.67Å; F633-H644 HydrophobicContact CZ-CB 4.17Å; F633-H644 AromaticContact CZ-CD2 3.48Å; F633-H644 VanDerWaalsContact CZ-CD2 3.48Å; F633-H644 WeakPolarHBondContact CZ-CD2 3.47Å; F633-H644 AromaticContact CZ-CE1 3.06Å; F633-H644 WeakPolarHBondContact CZ-CE1 2.9Å; F633-H644 AromaticContact CZ-CG 3.32Å; F633-H644 AromaticContact CZ-ND1 3.06Å; F633-H644 WeakPolarHBondContact CZ-ND1 2.99Å; F633-H644 AromaticContact CZ-NE2 3.36Å; F633-H644 WeakPolarHBondContact CZ-NE2 2.81Å; R642-H644 PolarHBondContact O-CE1 2.89Å; R642-H644 PolarHBondContact O-ND1 2.89Å; H644-M646 PolarHBondContact O-N 2.67Å
645	L	93.1	Very high	75.8	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.6	175.2	-176.3	63.8	0	0	0	109.1	A452 V454 V460 I539 C540 L541 I628 L648 V668	A452-L645 HydrophobicContact CB-CD1 3.88Å; A452-L645 HydrophobicContact CB-CD2 3.89Å; A452-L645 HydrophobicContact CB-CG 4.48Å; V454-L645 HydrophobicContact CG1-CD2 4.27Å; V460-L645 HydrophobicContact CB-CD2 4.28Å; V460-L645 HydrophobicContact CG1-CD2 4.28Å; I539-L645 HydrophobicContact CD1-CB 3.99Å; I539-L645 HydrophobicContact CG1-CB 4.35Å; I539-L645 HydrophobicContact CG2-CB 3.82Å; I539-L645 HydrophobicContact CG2-CD2 4.49Å; C540-L645 PolarHBondContact O-N 2.86Å; L541-L645 HydrophobicContact CD2-CD2 4.38Å; I628-L645 HydrophobicContact CB-CD1 4.07Å; L645-L648 HydrophobicContact CD1-CD2 4.32Å; L645-V668 HydrophobicContact CD2-CG1 4.05Å; L645-V668 HydrophobicContact CD2-CG2 4.18Å; L645-V668 HydrophobicContact CG-CB 4.41Å; L645-V668 HydrophobicContact CG-CG1 4.18Å; L645-V668 HydrophobicContact CG-CG2 4.06Å
646	M	90.8	Very high	75.7	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.015	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-38	-177	-161.6	58.9	176.8	0	0	112.6	A542 L547 F551 A629 V631 H644 V668	A542-M646 HydrophobicContact CB-SD 4.44Å; L547-M646 HydrophobicContact CD1-CE 4.46Å; L547-M646 HydrophobicContact CD2-CE 4.32Å; F551-M646 HydrophobicContact CD2-CE 3.13Å; F551-M646 HydrophobicContact CE2-CE 3.05Å; F551-M646 HydrophobicContact CE2-CG 3.95Å; F551-M646 HydrophobicContact CE2-SD 4.33Å; F551-M646 HydrophobicContact CG-CE 4.24Å; F551-M646 HydrophobicContact CZ-CE 4.12Å; A629-M646 PolarHBondContact O-N 3.31Å; V631-M646 HydrophobicContact CG1-CB 4.37Å; H644-M646 PolarHBondContact O-N 2.67Å; M646-V668 PolarHBondContact O-N 3.16Å
647	G	92	Very high	76.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	165.6	-178.7	0	0	0	0	0	114.6	A629 T666	A629-G647 PolarHBondContact N-O 2.02Å; A629-G647 PolarHBondContact O-N 3.17Å; G647-T666 CarbonylContact C-O 3.52Å; G647-T666 WeakPolarHBondContact CA-O 3.15Å
648	L	93.1	Very high	76.7	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.5	171.5	-56.1	166.1	0	0	0	106.9	V460 I521 I628 L645 S650 F665 T666 V668	V460-L648 HydrophobicContact CG1-CD1 3.76Å; V460-L648 HydrophobicContact CG1-CD2 4.4Å; I521-L648 HydrophobicContact CB-CD1 4.45Å; I521-L648 HydrophobicContact CD1-CD1 4.14Å; I521-L648 HydrophobicContact CG1-CD1 3.84Å; I628-L648 HydrophobicContact CG2-CD2 4Å; L645-L648 HydrophobicContact CD1-CD2 4.32Å; L648-S650 PolarHBondContact O-N 2.97Å; L648-F665 CarbonylContact O-C 3.57Å; L648-F665 WeakPolarHBondContact O-CA 3.5Å; L648-T666 PolarHBondContact N-O 3.26Å; L648-T666 VanDerWaalsContact N-O 3.11Å; L648-T666 PolarHBondContact O-N 3.2Å; L648-V668 HydrophobicContact CD1-CG2 4.23Å; L648-V668 HydrophobicContact CG-CG2 3.96Å
649	V	90.3	Very high	77.1	Confident	14 Å²	14	50.9 Å²	50.9	9%	0.085	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	125.5	175.7	174	0	0	0	0	108.6	V558 G627 T663 F665	V558-V649 HydrophobicContact CG1-CG2 4.25Å; G627-V649 VanDerWaalsContact N-CG2 3.27Å; G627-V649 WeakPolarHBondContact O-CG2 3.06Å; G627-V649 PolarHBondContact O-N 2.57Å; V649-T663 HydrophobicContact CG1-CG2 4.24Å; V649-F665 HydrophobicContact CB-CD1 4.45Å; V649-F665 HydrophobicContact CB-CE1 4.39Å; V649-F665 HydrophobicContact CG2-CD1 3.83Å; V649-F665 HydrophobicContact CG2-CE1 3.35Å; V649-F665 HydrophobicContact CG2-CZ 4.14Å
650	S	85.4	Confident	77.2	Confident	10 Å²	10	54.9 Å²	54.9	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-64	-179.4	-172.8	0	0	0	0	110.7	H464 D520 L648 A664	H464-S650 PolarHBondContact CE1-O 2.98Å; H464-S650 VanDerWaalsContact CE1-O 3.31Å; D520-S650 WeakPolarHBondContact OD2-CB 3.27Å; D520-S650 PolarHBondContact OD2-OG 3.23Å; L648-S650 PolarHBondContact O-N 2.97Å; S650-A664 PolarHBondContact N-O 2.94Å
651	W	80.6	Confident	77.4	Confident	41 Å²	41	51.7 Å²	51.7	16%	0.155	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	154.9	-177.8	54.1	-93.2	0	0	0	112.9	L517 H594 V601 V603 M607 A664	L517-W651 HydrophobicContact CD1-CB 3.78Å; L517-W651 VanDerWaalsContact CD1-CD1 3.49Å; L517-W651 HydrophobicContact CD1-CG 3.9Å; H594-W651 AromaticContact CD2-CZ3 3.68Å; H594-W651 AromaticContact CE1-CZ3 3.99Å; H594-W651 AromaticContact NE2-CZ3 3.51Å; V601-W651 HydrophobicContact CB-CH2 3.54Å; V601-W651 HydrophobicContact CB-CZ2 4.2Å; V601-W651 HydrophobicContact CB-CZ3 3.98Å; V601-W651 HydrophobicContact CG1-CE3 4.44Å; V601-W651 HydrophobicContact CG1-CH2 3.83Å; V601-W651 HydrophobicContact CG1-CZ3 3.72Å; V601-W651 HydrophobicContact CG2-CH2 3.6Å; V601-W651 HydrophobicContact CG2-CZ3 4.09Å; V603-W651 HydrophobicContact CG2-CH2 4.43Å; V603-W651 HydrophobicContact CG2-CZ2 4.46Å; M607-W651 HydrophobicContact SD-CZ2 4.28Å; W651-A664 HydrophobicContact CD2-CB 3.47Å; W651-A664 VanDerWaalsContact CD2-CB 3.47Å; W651-A664 HydrophobicContact CE3-CB 3.84Å; W651-A664 HydrophobicContact CG-CB 4.05Å; W651-A664 HydrophobicContact CH2-CB 3.73Å; W651-A664 HydrophobicContact CZ2-CB 3.38Å; W651-A664 HydrophobicContact CZ3-CB 3.95Å; W651-A664 PolarHBondContact N-O 2.98Å; W651-A664 PolarHBondContact O-N 2.87Å
652	S	73.4	Confident	77.7	Confident	37 Å²	37	48.1 Å²	48.1	26%	0.259	23%	0.23	S	C	.	.			trans	-152.8	148.5	175.7	-174.8	0	0	0	0	109.4	A623 D654 T663	A623-S652 WeakPolarHBondContact CB-OG 3.46Å; S652-D654 PolarHBondContact OG-N 3.13Å; S652-T663 PolarHBondContact OG-OG1 3.09Å
653	Y	63.1	Low	77.8	Confident	76 Å²	76	45.7 Å²	45.7	30%	0.298	22%	0.221	S	C	.	.			trans	-84.5	-17	175.1	-176.5	-109.7	0	0	0	113.7	H597 I599 K655	H597-Y653 HydrophobicContact CB-CD1 3.74Å; H597-Y653 HydrophobicContact CB-CE1 3.44Å; H597-Y653 VanDerWaalsContact CB-CE1 3.44Å; H597-Y653 PolarHBondContact O-OH 2.99Å; I599-Y653 HydrophobicContact CB-CD2 4.45Å; I599-Y653 HydrophobicContact CD1-CD2 3.36Å; I599-Y653 HydrophobicContact CD1-CE2 3.34Å; I599-Y653 HydrophobicContact CG1-CD2 3.76Å; I599-Y653 HydrophobicContact CG1-CE2 3.5Å; I599-Y653 VanDerWaalsContact CG1-CE2 3.5Å; Y653-K655 PolarHBondContact O-N 3.4Å; Y653-K655 VanDerWaalsContact O-N 3.12Å
654	D	63.3	Low	77.8	Confident	16 Å²	16	44.4 Å²	44.4	9%	0.086	22%	0.216	C	C	.	.			trans	-74.9	107.2	-165.3	-176	14.5	0	0	0	113.1	A623 S652 T656 C657 S658 L661	A623-D654 HydrophobicContact CB-CB 3.85Å; A623-D654 WeakPolarHBondContact CB-O 3.25Å; S652-D654 PolarHBondContact OG-N 3.13Å; D654-T656 VanDerWaalsContact C-N 3.34Å; D654-T656 WeakPolarHBondContact OD1-CA 3.18Å; D654-T656 PolarHBondContact OD1-N 3.02Å; D654-T656 PolarHBondContact OD1-OG1 3.04Å; D654-C657 VanDerWaalsContact CG-N 3.28Å; D654-C657 PolarHBondContact OD1-N 2.82Å; D654-C657 WeakPolarHBondContact OD2-CA 3.47Å; D654-C657 PolarHBondContact OD2-N 2.79Å; D654-S658 VanDerWaalsContact CG-N 3.28Å; D654-S658 PolarHBondContact OD1-N 2.8Å; D654-S658 PolarHBondContact OD2-N 3.07Å; D654-L661 HydrophobicContact CB-CB 4.15Å; D654-L661 HydrophobicContact CB-CD1 3.6Å
655	K	59.1	Low	77.9	Confident	184 Å²	184	43.8 Å²	43.8	80%	0.8	21%	0.213	S	C	*	.	S	Bend	trans	-87.6	-3.4	173.5	-64.3	-178.6	-177.7	173.6	0	113.4	Y653	Y653-K655 PolarHBondContact O-N 3.4Å; Y653-K655 VanDerWaalsContact O-N 3.12Å
656	T	60.7	Low	77.9	Confident	115 Å²	115	43.8 Å²	43.8	71%	0.706	21%	0.213	S	C	*	.	S	Bend	trans	-124.1	-0.8	-167.3	51.5	0	0	0	0	114.2	D654 S658	D654-T656 VanDerWaalsContact C-N 3.34Å; D654-T656 WeakPolarHBondContact OD1-CA 3.18Å; D654-T656 PolarHBondContact OD1-N 3.02Å; D654-T656 PolarHBondContact OD1-OG1 3.04Å; T656-S658 VanDerWaalsContact C-N 3.3Å; T656-S658 PolarHBondContact O-N 2.93Å
657	C	67.8	Low	78	Confident	41 Å²	41	46.1 Å²	46.1	28%	0.277	22%	0.223	S	C	.	.			trans	57.4	38.4	-173.3	-149.8	0	0	0	0	114.4	C621 D654 H659	C621-C657 WeakPolarHBondContact CA-SG 3.22Å; C621-C657 HydrophobicContact CB-CB 4.19Å; C621-C657 WeakPolarHBondContact CB-SG 3.14Å; C621-C657 WeakPolarHBondContact SG-CA 3.41Å; C621-C657 WeakPolarHBondContact SG-CB 3.42Å; C621-C657 CovalentContact SG-SG 2.02Å; C621-C657 PolarHBondContact SG-SG 3.31Å; D654-C657 VanDerWaalsContact CG-N 3.28Å; D654-C657 PolarHBondContact OD1-N 2.82Å; D654-C657 WeakPolarHBondContact OD2-CA 3.47Å; D654-C657 PolarHBondContact OD2-N 2.79Å; C657-H659 PolarHBondContact O-N 3.48Å
658	S	65.6	Low	78.1	Confident	47 Å²	47	46.2 Å²	46.2	33%	0.329	22%	0.224	S	C	.	.			trans	-69.6	113.6	171.1	-178.1	0	0	0	0	110.9	D654 T656 R660 L661	D654-S658 VanDerWaalsContact CG-N 3.28Å; D654-S658 PolarHBondContact OD1-N 2.8Å; D654-S658 PolarHBondContact OD2-N 3.07Å; T656-S658 VanDerWaalsContact C-N 3.3Å; T656-S658 PolarHBondContact O-N 2.93Å; S658-R660 PolarHBondContact O-N 2.99Å; S658-L661 PolarHBondContact O-N 2.83Å; S658-L661 VanDerWaalsContact O-N 3.13Å
659	H	65.5	Low	77.9	Confident	95 Å²	95	47.5 Å²	47.5	44%	0.44	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-3.5	174.7	-67.2	-82.8	0	0	0	115.4	W612 C657	W612-H659 HydrophobicContact CB-CB 4.28Å; W612-H659 HydrophobicContact CD2-CB 4.13Å; W612-H659 AromaticContact CD2-ND1 3.65Å; W612-H659 HydrophobicContact CE3-CB 3.74Å; W612-H659 HydrophobicContact CG-CB 4.37Å; W612-H659 AromaticContact CG-ND1 3.63Å; W612-H659 HydrophobicContact CZ3-CB 4.41Å; C657-H659 PolarHBondContact O-N 3.48Å
660	R	64.8	Low	78	Confident	210 Å²	210	50.2 Å²	50.2	79%	0.792	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-15.6	-179.7	-62.6	-173.1	177.6	-165.2	-0.9	113.9	Q593 S658	Q593-R660 PolarHBondContact NE2-O 2.72Å; S658-R660 PolarHBondContact O-N 2.99Å
661	L	73.9	Confident	78.4	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.115	25%	0.247	C	C	.	.	S	Bend	trans	-90.6	133.5	-176.8	-68.7	172.7	0	0	0	111.3	Q593 D654 S658	Q593-L661 HydrophobicContact CG-CD2 4.12Å; D654-L661 HydrophobicContact CB-CB 4.15Å; D654-L661 HydrophobicContact CB-CD1 3.6Å; S658-L661 PolarHBondContact O-N 2.83Å; S658-L661 VanDerWaalsContact O-N 3.13Å
662	S	83.8	Confident	79	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.028	25%	0.248	C	C	.	.			trans	-73.6	143.5	176.3	-56.8	0	0	0	0	110.6	Q593 H594	Q593-S662 VanDerWaalsContact OE1-CB 3.29Å; Q593-S662 PolarHBondContact OE1-OG 3.23Å; H594-S662 PolarHBondContact CE1-O 2.85Å; H594-S662 PolarHBondContact NE2-O 3.16Å
663	T	87.1	Confident	79.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.3	173.1	-62.3	0	0	0	0	109.4	C609 A610 T622 V649 S652 F665	C609-T663 WeakPolarHBondContact CA-O 3.36Å; A610-T663 PolarHBondContact N-O 3.15Å; A610-T663 PolarHBondContact O-N 3.23Å; T622-T663 PolarHBondContact OG1-OG1 2.72Å; V649-T663 HydrophobicContact CG1-CG2 4.24Å; S652-T663 PolarHBondContact OG-OG1 3.09Å; T663-F665 HydrophobicContact CG2-CD2 4.37Å; T663-F665 HydrophobicContact CG2-CE2 3.82Å; T663-F665 HydrophobicContact CG2-CZ 4.03Å; T663-F665 VanDerWaalsContact O-CD2 3.26Å; T663-F665 WeakPolarHBondContact O-CD2 3.29Å; T663-F665 WeakPolarHBondContact O-CE2 3.46Å
664	A	89.8	Confident	81.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	136	175.7	0	0	0	0	0	111.4	S650 W651	S650-A664 PolarHBondContact N-O 2.94Å; W651-A664 HydrophobicContact CD2-CB 3.47Å; W651-A664 VanDerWaalsContact CD2-CB 3.47Å; W651-A664 HydrophobicContact CE3-CB 3.84Å; W651-A664 HydrophobicContact CG-CB 4.05Å; W651-A664 HydrophobicContact CH2-CB 3.73Å; W651-A664 HydrophobicContact CZ2-CB 3.38Å; W651-A664 HydrophobicContact CZ3-CB 3.95Å; W651-A664 PolarHBondContact N-O 2.98Å; W651-A664 PolarHBondContact O-N 2.87Å
665	F	92.1	Very high	83	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	179.5	-63.4	-101.8	0	0	0	110.1	V558 M607 F608 A610 T622 A629 L648 V649 T663 K667	V558-F665 HydrophobicContact CG1-CE1 4.06Å; V558-F665 HydrophobicContact CG1-CZ 4.48Å; V558-F665 HydrophobicContact CG2-CE1 3.85Å; V558-F665 HydrophobicContact CG2-CZ 3.86Å; M607-F665 CarbonylContact C-O 3.26Å; M607-F665 VanDerWaalsContact CA-O 3.28Å; M607-F665 WeakPolarHBondContact CA-O 3.44Å; F608-F665 HydrophobicContact CD1-CB 3.95Å; F608-F665 HydrophobicContact CD2-CB 4.38Å; F608-F665 HydrophobicContact CD2-CD2 4.46Å; F608-F665 HydrophobicContact CE1-CB 3.47Å; F608-F665 VanDerWaalsContact CE1-CB 3.47Å; F608-F665 HydrophobicContact CE1-CG 4.35Å; F608-F665 HydrophobicContact CE2-CB 3.95Å; F608-F665 AromaticContact CE2-CD2 3.98Å; F608-F665 HydrophobicContact CE2-CD2 3.98Å; F608-F665 HydrophobicContact CE2-CG 4.05Å; F608-F665 HydrophobicContact CG-CB 4.39Å; F608-F665 HydrophobicContact CZ-CB 3.47Å; F608-F665 VanDerWaalsContact CZ-CB 3.47Å; F608-F665 HydrophobicContact CZ-CD1 4.44Å; F608-F665 HydrophobicContact CZ-CD2 4.26Å; F608-F665 AromaticContact CZ-CG 3.84Å; F608-F665 HydrophobicContact CZ-CG 3.84Å; F608-F665 PolarHBondContact N-O 2.99Å; F608-F665 PolarHBondContact O-N 3.41Å; A610-F665 HydrophobicContact CB-CD2 4.23Å; A610-F665 HydrophobicContact CB-CE2 3.84Å; T622-F665 HydrophobicContact CG2-CZ 4.26Å; A629-F665 HydrophobicContact CB-CD1 3.9Å; A629-F665 HydrophobicContact CB-CE1 4.03Å; L648-F665 CarbonylContact O-C 3.57Å; L648-F665 WeakPolarHBondContact O-CA 3.5Å; V649-F665 HydrophobicContact CB-CD1 4.45Å; V649-F665 HydrophobicContact CB-CE1 4.39Å; V649-F665 HydrophobicContact CG2-CD1 3.83Å; V649-F665 HydrophobicContact CG2-CE1 3.35Å; V649-F665 HydrophobicContact CG2-CZ 4.14Å; T663-F665 HydrophobicContact CG2-CD2 4.37Å; T663-F665 HydrophobicContact CG2-CE2 3.82Å; T663-F665 HydrophobicContact CG2-CZ 4.03Å; T663-F665 VanDerWaalsContact O-CD2 3.26Å; T663-F665 WeakPolarHBondContact O-CD2 3.29Å; T663-F665 WeakPolarHBondContact O-CE2 3.46Å; F665-K667 PolarHBondContact O-N 3.27Å
666	T	93.9	Very high	84.6	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	119.7	166.4	-51.1	0	0	0	0	108.6	D520 I521 G647 L648 V668 F671	D520-T666 WeakPolarHBondContact O-CG2 3.36Å; D520-T666 PolarHBondContact O-OG1 2.96Å; I521-T666 HydrophobicContact CB-CG2 4.27Å; G647-T666 CarbonylContact C-O 3.52Å; G647-T666 WeakPolarHBondContact CA-O 3.15Å; L648-T666 PolarHBondContact N-O 3.26Å; L648-T666 VanDerWaalsContact N-O 3.11Å; L648-T666 PolarHBondContact O-N 3.2Å; T666-V668 PolarHBondContact O-N 3.26Å; T666-F671 HydrophobicContact CG2-CD2 4.48Å; T666-F671 HydrophobicContact CG2-CE2 3.98Å
667	K	92.7	Very high	86.1	Confident	52 Å²	52	48.3 Å²	48.3	23%	0.226	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	115.5	177.1	-163.6	178.5	-174.6	170.8	0	109.2	N606 F608 F665 P670 F671	N606-K667 VanDerWaalsContact O-CB 3.25Å; N606-K667 WeakPolarHBondContact O-CB 3.08Å; N606-K667 PolarHBondContact O-N 3.44Å; F608-K667 HydrophobicContact CD1-CB 3.97Å; F608-K667 HydrophobicContact CD1-CG 4.14Å; F665-K667 PolarHBondContact O-N 3.27Å; K667-P670 HydrophobicContact CD-CG 4.3Å; K667-P670 HydrophobicContact CG-CG 4.46Å; K667-P670 VanDerWaalsContact O-CD 3.28Å; K667-P670 WeakPolarHBondContact O-CD 3.35Å; K667-F671 WeakPolarHBondContact O-CD2 3.27Å; K667-F671 VanDerWaalsContact O-CE2 3.3Å; K667-F671 WeakPolarHBondContact O-CE2 3.47Å
668	V	93.7	Very high	87.3	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.012	23%	0.225	C	C	.	.	S	Bend	trans	-78.1	-24.4	-174.8	172.4	0	0	0	0	112.6	I521 L541 L645 M646 L648 T666 F671 K672 I675	I521-V668 HydrophobicContact CD1-CG2 4.49Å; L541-V668 HydrophobicContact CD2-CG1 4.2Å; L645-V668 HydrophobicContact CD2-CG1 4.05Å; L645-V668 HydrophobicContact CD2-CG2 4.18Å; L645-V668 HydrophobicContact CG-CB 4.41Å; L645-V668 HydrophobicContact CG-CG1 4.18Å; L645-V668 HydrophobicContact CG-CG2 4.06Å; M646-V668 PolarHBondContact O-N 3.16Å; L648-V668 HydrophobicContact CD1-CG2 4.23Å; L648-V668 HydrophobicContact CG-CG2 3.96Å; T666-V668 PolarHBondContact O-N 3.26Å; V668-F671 PolarHBondContact O-N 2.79Å; V668-K672 PolarHBondContact O-N 3.35Å; V668-I675 HydrophobicContact CG1-CD1 3.78Å
669	L	90.4	Very high	88.4	Confident	29 Å²	29	48.1 Å²	48.1	15%	0.152	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-55.6	-46.8	-173.9	-174.5	69.3	0	0	0	114.3	A542 L547 F671 K672	A542-L669 HydrophobicContact CB-CD1 4.09Å; A542-L669 WeakPolarHBondContact O-CD1 3.38Å; L547-L669 HydrophobicContact CD1-CD2 3.82Å; L669-F671 PolarHBondContact O-N 3.28Å; L669-K672 PolarHBondContact O-N 3.43Å
670	P	92.2	Very high	88.6	Confident	71 Å²	71	54.5 Å²	54.5	46%	0.461	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63	-26.2	176.8	-21.2	34.7	0	0	0	113.5	K667	K667-P670 HydrophobicContact CD-CG 4.3Å; K667-P670 HydrophobicContact CG-CG 4.46Å; K667-P670 VanDerWaalsContact O-CD 3.28Å; K667-P670 WeakPolarHBondContact O-CD 3.35Å
671	F	94.1	Very high	89.8	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.035	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-90.8	0.1	-176	-57	-70.6	0	0	0	113.9	H509 A519 I521 N606 T666 K667 V668 L669 D673 W674 I675	H509-F671 AromaticContact CD2-CD1 3.67Å; H509-F671 AromaticContact CD2-CE1 3.91Å; H509-F671 AromaticContact CE1-CE1 3.74Å; H509-F671 AromaticContact NE2-CD1 3.56Å; H509-F671 AromaticContact NE2-CE1 3.64Å; A519-F671 HydrophobicContact CB-CE1 3.86Å; A519-F671 HydrophobicContact CB-CZ 3.71Å; I521-F671 HydrophobicContact CD1-CB 3.94Å; I521-F671 HydrophobicContact CD1-CD2 4.18Å; I521-F671 HydrophobicContact CD1-CG 4.2Å; I521-F671 HydrophobicContact CG2-CD1 4.02Å; I521-F671 HydrophobicContact CG2-CD2 4.13Å; I521-F671 HydrophobicContact CG2-CE1 4.26Å; I521-F671 HydrophobicContact CG2-CE2 4.38Å; I521-F671 HydrophobicContact CG2-CG 3.96Å; I521-F671 HydrophobicContact CG2-CZ 4.45Å; N606-F671 HydrophobicContact CB-CE2 4.06Å; N606-F671 HydrophobicContact CB-CZ 3.84Å; T666-F671 HydrophobicContact CG2-CD2 4.48Å; T666-F671 HydrophobicContact CG2-CE2 3.98Å; K667-F671 WeakPolarHBondContact O-CD2 3.27Å; K667-F671 VanDerWaalsContact O-CE2 3.3Å; K667-F671 WeakPolarHBondContact O-CE2 3.47Å; V668-F671 PolarHBondContact O-N 2.79Å; L669-F671 PolarHBondContact O-N 3.28Å; F671-D673 PolarHBondContact O-N 2.61Å; F671-W674 WeakPolarHBondContact O-CB 3.38Å; F671-W674 PolarHBondContact O-N 3.45Å; F671-I675 HydrophobicContact CB-CD1 4.31Å; F671-I675 HydrophobicContact CB-CG1 4.49Å; F671-I675 WeakPolarHBondContact O-CG1 3.48Å; F671-I675 PolarHBondContact O-N 3Å
672	K	92.3	Very high	90.6	Very high	41 Å²	41	48 Å²	48	18%	0.178	22%	0.224	C	C	.	.	H	α-helix	trans	-49.5	-53.2	-176.5	-178.6	-169.7	-178.7	164.4	0	113	L541 A542 A543 V668 L669 W674 I675 E676	L541-K672 HydrophobicContact CB-CG 4.34Å; A542-K672 WeakPolarHBondContact O-CD 3.46Å; A543-K672 VanDerWaalsContact CB-NZ 3.27Å; V668-K672 PolarHBondContact O-N 3.35Å; L669-K672 PolarHBondContact O-N 3.43Å; K672-W674 PolarHBondContact O-N 3.3Å; K672-I675 PolarHBondContact O-N 3.31Å; K672-I675 VanDerWaalsContact O-N 3.11Å; K672-E676 WeakPolarHBondContact CE-OE1 3.25Å; K672-E676 HydrophobicContact CG-CG 4.4Å; K672-E676 IonicContact NZ-OE1 3.21Å; K672-E676 PolarHBondContact O-N 3.07Å
673	D	92.6	Very high	91	Very high	107 Å²	107	50.4 Å²	50.4	57%	0.572	23%	0.234	S	C	*	.	H	α-helix	trans	-66.7	-30.4	-176	-68.7	-17	0	0	0	111.9	F671 R677	F671-D673 PolarHBondContact O-N 2.61Å; D673-R677 WeakPolarHBondContact O-CB 3.25Å; D673-R677 VanDerWaalsContact O-CG 3.25Å; D673-R677 WeakPolarHBondContact O-CG 3.23Å; D673-R677 PolarHBondContact O-N 3.3Å; D673-R677 VanDerWaalsContact O-N 3.16Å; D673-R677 PolarHBondContact O-NE 2.52Å
674	W	95.1	Very high	91.2	Very high	28 Å²	28	53.4 Å²	53.4	11%	0.106	25%	0.248	C	C	.	.	H	α-helix	trans	-69.6	-42.8	172.3	176.8	85.5	0	0	0	111.2	I507 H509 I521 I523 F671 K672 N678	I507-W674 HydrophobicContact CG2-CZ2 4.01Å; H509-W674 HydrophobicContact CB-CH2 4.12Å; H509-W674 HydrophobicContact CB-CZ2 4.06Å; H509-W674 AromaticContact CD2-CD2 3.61Å; H509-W674 AromaticContact CD2-CE2 3.68Å; H509-W674 AromaticContact CD2-CE3 3.97Å; H509-W674 AromaticContact CD2-CG 3.88Å; H509-W674 AromaticContact CD2-NE1 3.92Å; I521-W674 HydrophobicContact CD1-CZ3 4.47Å; I521-W674 HydrophobicContact CG1-CZ3 4.23Å; I521-W674 HydrophobicContact CG2-CZ3 4.04Å; I523-W674 HydrophobicContact CB-CH2 4.47Å; I523-W674 HydrophobicContact CD1-CD2 4.44Å; I523-W674 HydrophobicContact CD1-CE3 3.89Å; I523-W674 HydrophobicContact CD1-CH2 3.66Å; I523-W674 HydrophobicContact CD1-CZ2 4.23Å; I523-W674 HydrophobicContact CD1-CZ3 3.47Å; I523-W674 VanDerWaalsContact CD1-CZ3 3.47Å; I523-W674 HydrophobicContact CG1-CH2 3.76Å; I523-W674 HydrophobicContact CG1-CZ3 3.67Å; F671-W674 WeakPolarHBondContact O-CB 3.38Å; F671-W674 PolarHBondContact O-N 3.45Å; K672-W674 PolarHBondContact O-N 3.3Å; W674-N678 PolarHBondContact NE1-ND2 3.41Å; W674-N678 WeakPolarHBondContact O-CB 3.45Å; W674-N678 PolarHBondContact O-N 2.9Å; W674-N678 VanDerWaalsContact O-N 3.14Å; W674-N678 PolarHBondContact O-ND2 3.13Å
675	I	95	Very high	91.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-50	176.2	-59.5	163.3	0	0	0	110.7	V460 I521 I523 L541 V668 F671 K672 R677 N678 M679	V460-I675 HydrophobicContact CG2-CD1 4.3Å; V460-I675 HydrophobicContact CG2-CG1 4.46Å; V460-I675 HydrophobicContact CG2-CG2 3.9Å; I521-I675 HydrophobicContact CD1-CD1 3.91Å; I521-I675 HydrophobicContact CD1-CG1 4.35Å; I523-I675 HydrophobicContact CD1-CB 4.42Å; I523-I675 HydrophobicContact CD1-CG1 4.38Å; I523-I675 HydrophobicContact CD1-CG2 4.35Å; L541-I675 HydrophobicContact CD1-CB 4.16Å; L541-I675 HydrophobicContact CD1-CG2 3.8Å; L541-I675 HydrophobicContact CD2-CD1 4.09Å; V668-I675 HydrophobicContact CG1-CD1 3.78Å; F671-I675 HydrophobicContact CB-CD1 4.31Å; F671-I675 HydrophobicContact CB-CG1 4.49Å; F671-I675 WeakPolarHBondContact O-CG1 3.48Å; F671-I675 PolarHBondContact O-N 3Å; K672-I675 PolarHBondContact O-N 3.31Å; K672-I675 VanDerWaalsContact O-N 3.11Å; I675-R677 VanDerWaalsContact C-N 3.34Å; I675-R677 PolarHBondContact O-N 3.24Å; I675-N678 CarbonylContact O-C 3.59Å; I675-N678 PolarHBondContact O-N 3.41Å; I675-N678 VanDerWaalsContact O-N 3.15Å; I675-M679 HydrophobicContact CG2-CE 4.46Å; I675-M679 HydrophobicContact CG2-CG 4.33Å; I675-M679 WeakPolarHBondContact O-CG 3.48Å; I675-M679 PolarHBondContact O-N 3.09Å
676	E	92.8	Very high	91.3	Very high	84 Å²	84	60.4 Å²	60.4	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-35.9	-178	-71.6	-173.7	171.6	0	0	113	L541 K672 N678 M679	L541-E676 HydrophobicContact CD1-CG 4.01Å; K672-E676 WeakPolarHBondContact CE-OE1 3.25Å; K672-E676 HydrophobicContact CG-CG 4.4Å; K672-E676 IonicContact NZ-OE1 3.21Å; K672-E676 PolarHBondContact O-N 3.07Å; E676-N678 VanDerWaalsContact C-N 3.35Å; E676-M679 WeakPolarHBondContact O-CB 3.38Å; E676-M679 PolarHBondContact O-N 2.99Å
677	R	93.9	Very high	91.1	Very high	170 Å²	170	64.6 Å²	64.6	64%	0.642	30%	0.3	S	S	*	.	H	α-helix	trans	-64.6	-41.6	173.7	-80.4	-178.3	-70.3	-170.4	1.2	111.7	D673 I675 M679	D673-R677 WeakPolarHBondContact O-CB 3.25Å; D673-R677 VanDerWaalsContact O-CG 3.25Å; D673-R677 WeakPolarHBondContact O-CG 3.23Å; D673-R677 PolarHBondContact O-N 3.3Å; D673-R677 VanDerWaalsContact O-N 3.16Å; D673-R677 PolarHBondContact O-NE 2.52Å; I675-R677 VanDerWaalsContact C-N 3.34Å; I675-R677 PolarHBondContact O-N 3.24Å; R677-M679 VanDerWaalsContact C-N 3.29Å; R677-M679 PolarHBondContact O-N 3.48Å
678	N	93	Very high	91	Very high	42 Å²	42	65.6 Å²	65.6	23%	0.225	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	1.3	177.7	-72.3	-72.2	0	0	0	113.1	I507 I523 K525 W674 I675 E676	I507-N678 HydrophobicContact CD1-CB 4.32Å; I523-N678 HydrophobicContact CD1-CB 3.52Å; K525-N678 WeakPolarHBondContact CE-O 3.32Å; K525-N678 PolarHBondContact NZ-O 3.17Å; W674-N678 PolarHBondContact NE1-ND2 3.41Å; W674-N678 WeakPolarHBondContact O-CB 3.45Å; W674-N678 PolarHBondContact O-N 2.9Å; W674-N678 VanDerWaalsContact O-N 3.14Å; W674-N678 PolarHBondContact O-ND2 3.13Å; I675-N678 CarbonylContact O-C 3.59Å; I675-N678 PolarHBondContact O-N 3.41Å; I675-N678 VanDerWaalsContact O-N 3.15Å; E676-N678 VanDerWaalsContact C-N 3.35Å
679	M	87.3	Confident	90.7	Very high	42 Å²	42	70.9 Å²	70.9	21%	0.207	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-30	174	-86.4	-176.4	152.7	0	0	113.5	V454 N455 T458 K525 L541 I675 E676 R677	V454-M679 HydrophobicContact CB-CE 3.32Å; V454-M679 HydrophobicContact CG2-CE 3.22Å; V454-M679 WeakPolarHBondContact O-CE 3.46Å; N455-M679 HydrophobicContact CB-CE 4.06Å; N455-M679 WeakPolarHBondContact ND2-CG 3.34Å; T458-M679 HydrophobicContact CG2-CG 4.3Å; K525-M679 VanDerWaalsContact NZ-C 3.34Å; K525-M679 PolarHBondContact NZ-O 2.98Å; K525-M679 VanDerWaalsContact NZ-O 3.13Å; L541-M679 HydrophobicContact CD1-CE 4.23Å; I675-M679 HydrophobicContact CG2-CE 4.46Å; I675-M679 HydrophobicContact CG2-CG 4.33Å; I675-M679 WeakPolarHBondContact O-CG 3.48Å; I675-M679 PolarHBondContact O-N 3.09Å; E676-M679 WeakPolarHBondContact O-CB 3.38Å; E676-M679 PolarHBondContact O-N 2.99Å; R677-M679 VanDerWaalsContact C-N 3.29Å; R677-M679 PolarHBondContact O-N 3.48Å
680	K	70.1	Confident	90.8	Very high	229 Å²	229	74.7 Å²	74.7	100%	0.996	35%	0.347	S	S	*	.			trans	-62.3	0	176.3	-63.3	177.6	-176.3	173.2	0	110	K525	K525-K680 PolarHBondContact NZ-OXT 2.03Å; K525-K680 VanDerWaalsContact NZ-OXT 3.12Å

Retrieved 680 of 680 residues in 430.2 ms (Link to these results)

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