A0A087YHI0_POEFO Loading...

Spondin-1

AlphaFold DB , UniProt , Accession A0A087YHI0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 806 aa.

						>A0A087YHI0_POEFO|A0A087YHI0
MIAARLYPRAVLLLCFISSAACNTFAFTEEPFDRAVKADSYCSRVLRAQSNRKETNNEFQLQVEGEPERYQPGSTYRVSLTATSPSYFRGFTLIALKEGAEGDKDEDYAGNFQIIDEEETQFMTNCPPAVTESTPRRRSNIQVFWTAPPSGTGCVLLKASIVQKRIIYFQDEGALTKRMCEKESLNGDGTDKPLLDCCACGTAKYRVTFYGNWSEKIHPKDFPRRTNHWSAIIGASHSKNYVLWEFGGLASEGVKQVAELGSPVKMEEEIRQKGDEVLTVIKMKAQWPAWQPLNVRAAPSAEFSVDRSRHIMSFLTMMGPSPDWNVGLSAEDLCTKECGWAQRVVQDLIPWDAGTDSGVSYEAPNNPTAAPDKIRPLTSLDHPQSPFYDPEGGAITPVARVIVERIARKGEQCNIVPDNVDDIVADIAQEEKEEDDTPETCIYSNWSPWSACSSATCEKGKRMRQRMLKAQLDLSVPCPHTQDFEPCMGPGCSDEDASTCMMSEWITWSPCSVSCGSGTRSRERYVKQFPDDGSVCTLPTQENENCVVNEDCSPSSCLVTEWGEWDVCSATCGLGMKRRERMVKMPPADGSICGAEVLEVEKCMMPECHTIPCLLTPWCEWSDCSVTCGKGLRTRQRMLKSPVELGDCTEELEQVEKCMLPECPIDCIMSDWTEWSECNKSCGKGHTIRTRIVTMEPQFGGDSCTETIQRKKCKIRKCSRGQGNSDEKRRRKEQREKQRSKHGRVEGASEHPGCRMRPWSSWSECTKLCGGGIQERLMTVKQKFKTAQLSSCKDRKEIRACNVQPC
					

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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	32.6	Very low	33.4	Very low	230 Å²	230	163.6 Å²	163.6	100%	1.133	86%	0.858	S	S	*	*				0	140.4	0	-75.9	178.6	-170	0	0	108.4
2	I	33.3	Very low	32.8	Very low	161 Å²	161	161.4 Å²	161.4	83%	0.826	85%	0.846	S	S	*	*			trans	69.1	136.1	149.1	-62.5	166.1	0	0	0	119.6
3	A	31.1	Very low	32.4	Very low	100 Å²	100	160.2 Å²	160.2	83%	0.826	84%	0.839	S	S	*	*			trans	74.5	125.5	162.3	0	0	0	0	0	119.4
4	A	33.5	Very low	32.1	Very low	95 Å²	95	157.4 Å²	157.4	79%	0.785	83%	0.825	S	S	*	*			trans	-130.4	156.1	172.6	0	0	0	0	0	109.2
5	R	32.9	Very low	31.7	Very low	247 Å²	247	153.2 Å²	153.2	93%	0.932	81%	0.812	S	S	*	*				-178	139.8	125.5	-100.8	170.4	-176.5	-162.4	0.8	111.4
6	L	31	Very low	31.5	Very low	175 Å²	175	154.9 Å²	154.9	92%	0.916	81%	0.811	S	S	*	*			trans	-132.4	147.9	173.2	-91.4	156.7	0	0	0	108.5
7	Y	32.7	Very low	31.3	Very low	223 Å²	223	154.9 Å²	154.9	88%	0.875	81%	0.81	S	S	*	*			trans	-68.9	-178.3	161.3	-82.3	-89.1	0	0	0	110.7
8	P	51.6	Low	31.1	Very low	104 Å²	104	152.1 Å²	152.1	68%	0.675	81%	0.806	S	S	*	*			cis	-135.6	178.7	-13.3	20.7	4.8	0	0	0	115.6
9	R	31.4	Very low	30.9	Very low	245 Å²	245	149.2 Å²	149.2	93%	0.925	80%	0.799	S	S	*	*			trans	56.3	133.4	143.1	-79.5	-178.2	173	-179.8	-1.9	123.5
10	A	28.5	Very low	30.9	Very low	94 Å²	94	146.6 Å²	146.6	78%	0.777	80%	0.799	S	S	*	*			trans	94.3	160.9	141.1	0	0	0	0	0	120.2
11	V	28.4	Very low	30.9	Very low	126 Å²	126	143.5 Å²	143.5	76%	0.764	79%	0.793	S	S	*	*			trans	98.4	106.4	157.3	173.1	0	0	0	0	119.7
12	L	26.5	Very low	30.5	Very low	137 Å²	137	137.8 Å²	137.8	72%	0.717	77%	0.774	S	S	*	*			trans	63.8	123.2	138.9	-86.9	84.2	0	0	0	121.2
13	L	27.4	Very low	30.2	Very low	145 Å²	145	136.2 Å²	136.2	76%	0.759	77%	0.768	S	S	*	*				69.9	143	99.3	-95.1	67.1	0	0	0	113.1
14	L	28.2	Very low	30.1	Very low	121 Å²	121	136.8 Å²	136.8	63%	0.634	76%	0.761	S	S	*	*			cis	-173.5	144.6	30.9	-129.6	167.2	0	0	0	107.2	F16	L14-F16 HydrophobicContact CD2-CD2 4Å; L14-F16 HydrophobicContact CD2-CE2 3.68Å; L14-F16 HydrophobicContact CD2-CZ 4.4Å
15	C	26.4	Very low	29.8	Very low	95 Å²	95	142.4 Å²	142.4	64%	0.642	77%	0.768	S	S	*	*				152	120.7	106.8	-87	0	0	0	0	107.8
16	F	27.9	Very low	29.6	Very low	180 Å²	180	134.7 Å²	134.7	79%	0.789	76%	0.757	S	S	*	*				69.4	139.3	99.6	-66	-58	0	0	0	115.2	L14	L14-F16 HydrophobicContact CD2-CD2 4Å; L14-F16 HydrophobicContact CD2-CE2 3.68Å; L14-F16 HydrophobicContact CD2-CZ 4.4Å
17	I	29.6	Very low	29.3	Very low	155 Å²	155	135.7 Å²	135.7	80%	0.795	76%	0.755	S	S	*	*			cis	-152.7	147.9	36.4	-75.4	-179.2	0	0	0	112.3
18	S	27.3	Very low	29	Very low	105 Å²	105	131 Å²	131	73%	0.734	75%	0.75	S	S	*	*			trans	73.4	137.2	151.3	-171.6	0	0	0	0	120.7
19	S	27.7	Very low	28.2	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	76%	0.76	S	S	*	*			cis	-170.6	148.6	-15.4	54.3	0	0	0	0	112.4
20	A	30.5	Very low	28	Very low	96 Å²	96	132.5 Å²	132.5	79%	0.793	76%	0.758	S	S	*	*			trans	60.1	147.1	137.2	0	0	0	0	0	121.8
21	A	29.6	Very low	28.3	Very low	82 Å²	82	133.1 Å²	133.1	68%	0.678	75%	0.754	S	S	*	*			cis	-172.9	170.1	-17.6	0	0	0	0	0	111.6
22	C	25.2	Very low	28.8	Very low	110 Å²	110	137.1 Å²	137.1	74%	0.743	76%	0.761	S	S	*	*			trans	69.7	139.8	158	-61.5	0	0	0	0	117.9
23	N	27.7	Very low	29.1	Very low	129 Å²	129	137.8 Å²	137.8	69%	0.69	77%	0.766	S	S	*	*			cis	-148.2	135.6	-12.8	-88.2	-25.4	0	0	0	106.9
24	T	27.3	Very low	29.2	Very low	111 Å²	111	141.7 Å²	141.7	68%	0.681	77%	0.77	S	S	*	*				55.2	109.4	66.1	60	0	0	0	0	116.7
25	F	28.4	Very low	29.6	Very low	214 Å²	214	141.1 Å²	141.1	94%	0.939	78%	0.783	S	S	*	*				-144.1	131.6	127.6	-91.7	-74.3	0	0	0	108.1
26	A	27.8	Very low	29.9	Very low	85 Å²	85	142.3 Å²	142.3	70%	0.702	79%	0.787	S	S	*	*			trans	-114.2	163.1	173.2	0	0	0	0	0	109.1
27	F	25.1	Very low	30.2	Very low	196 Å²	196	142.6 Å²	142.6	86%	0.86	79%	0.788	S	S	*	*			trans	-171.6	140.9	134.3	-103.5	-63.4	0	0	0	113.5
28	T	27.1	Very low	30.3	Very low	125 Å²	125	140.4 Å²	140.4	77%	0.767	79%	0.793	S	S	*	*			trans	58.4	112.2	156.6	57.6	0	0	0	0	121.3
29	E	34.3	Very low	30.9	Very low	193 Å²	193	140.5 Å²	140.5	90%	0.902	79%	0.785	S	S	*	*			trans	-90.3	147.3	139.5	-74.1	-177.7	120.4	0	0	110
30	E	27.6	Very low	31.9	Very low	187 Å²	187	138.1 Å²	138.1	87%	0.874	77%	0.768	S	S	*	*			trans	-170.4	160.4	155.7	-99.3	-94.5	131.5	0	0	107
31	P	33.1	Very low	33	Very low	106 Å²	106	143 Å²	143	69%	0.688	77%	0.767	S	S	*	*				-104.4	178.7	-119.7	37.9	-40.6	0	0	0	117.8	D33	P31-D33 PolarHBondContact O-N 2.68Å
32	F	39	Very low	34.3	Very low	210 Å²	210	139.7 Å²	139.7	92%	0.921	74%	0.739	S	S	*	*			trans	-44.4	118.7	168.5	-90.7	-112.8	0	0	0	113
33	D	33.4	Very low	35.5	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	71%	0.706	S	S	*	*				-166.4	111.1	114.5	-134.1	-21.7	0	0	0	113	P31	P31-D33 PolarHBondContact O-N 2.68Å
34	R	30.1	Very low	36.6	Very low	228 Å²	228	139 Å²	139	86%	0.86	71%	0.712	S	S	*	*			trans	-167.7	111.4	155.5	-115.5	174.7	-172.4	-176.7	3.3	109.8	V36	R34-V36 PolarHBondContact O-N 3.15Å
35	A	37.2	Very low	37.9	Very low	109 Å²	109	135 Å²	135	90%	0.901	69%	0.688	S	S	*	*			trans	-62.4	97.9	169.6	0	0	0	0	0	110.2
36	V	32.7	Very low	38.8	Very low	119 Å²	119	127.2 Å²	127.2	72%	0.721	66%	0.656	S	S	*	*			trans	-101.8	134.5	166.2	-178.2	0	0	0	0	107	R34	R34-V36 PolarHBondContact O-N 3.15Å
37	K	32.7	Very low	39.6	Very low	187 Å²	187	130 Å²	130	81%	0.813	65%	0.648	S	S	*	*			trans	-53.4	148.7	179.8	-68.9	175.8	174.8	-179.7	0	110.6	D39	K37-D39 PolarHBondContact O-N 2.81Å
38	A	32.9	Very low	40.3	Very low	108 Å²	108	123.2 Å²	123.2	89%	0.893	63%	0.628	S	S	*	*			trans	-67.3	82.3	168.4	0	0	0	0	0	110.1	S40	A38-S40 PolarHBondContact O-N 3.34Å
39	D	39.9	Very low	40.8	Very low	108 Å²	108	126.3 Å²	126.3	58%	0.578	63%	0.634	S	S	*	*			trans	-67.5	120.3	159	-78.4	-20.9	0	0	0	107.2	K37	K37-D39 PolarHBondContact O-N 2.81Å
40	S	47.4	Very low	40.7	Very low	46 Å²	46	121.5 Å²	121.5	32%	0.322	62%	0.622	S	S	.	*			trans	-58.1	144.9	-178.8	180	0	0	0	0	111.9	A38 C42 S43 D103	A38-S40 PolarHBondContact O-N 3.34Å; S40-C42 PolarHBondContact O-N 2.85Å; S40-C42 VanDerWaalsContact O-N 3.11Å; S40-S43 VanDerWaalsContact O-CB 3.27Å; S40-S43 WeakPolarHBondContact O-CB 3.07Å; S40-S43 PolarHBondContact O-N 2.99Å; S40-S43 PolarHBondContact O-OG 2.83Å; S40-D103 WeakPolarHBondContact CB-O 3.28Å; S40-D103 PolarHBondContact OG-O 2.87Å
41	Y	53.4	Low	41	Very low	198 Å²	198	119.6 Å²	119.6	78%	0.776	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-26.7	-167.9	-78.9	-101.6	0	0	0	114.2
42	C	57.1	Low	41.6	Very low	13 Å²	13	126 Å²	126	9%	0.088	63%	0.628	C	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	-15.2	176.7	-62.6	0	0	0	0	114.6	S40 R44 V45 Y108 C126	S40-C42 PolarHBondContact O-N 2.85Å; S40-C42 VanDerWaalsContact O-N 3.11Å; C42-R44 PolarHBondContact O-N 2.83Å; C42-V45 WeakPolarHBondContact O-CB 3.49Å; C42-V45 WeakPolarHBondContact O-CG2 3.24Å; C42-V45 PolarHBondContact O-N 3.11Å; C42-Y108 HydrophobicContact CB-CE2 4.39Å; C42-Y108 WeakPolarHBondContact CB-OH 3.45Å; C42-C126 HydrophobicContact CB-CB 4.09Å; C42-C126 WeakPolarHBondContact CB-SG 3.29Å; C42-C126 WeakPolarHBondContact SG-CB 2.98Å; C42-C126 CovalentContact SG-SG 2.04Å; C42-C126 PolarHBondContact SG-SG 3.32Å
43	S	51.2	Low	41.6	Very low	6 Å²	6	124.8 Å²	124.8	4%	0.042	62%	0.623	C	S	.	*	H	α-helix	trans	-58.4	-24.5	-174.9	65.8	0	0	0	0	114.5	S40 V45 L46 R47 D103	S40-S43 VanDerWaalsContact O-CB 3.27Å; S40-S43 WeakPolarHBondContact O-CB 3.07Å; S40-S43 PolarHBondContact O-N 2.99Å; S40-S43 PolarHBondContact O-OG 2.83Å; S43-V45 VanDerWaalsContact C-N 3.33Å; S43-L46 PolarHBondContact O-N 2.04Å; S43-R47 PolarHBondContact O-N 3.45Å; S43-D103 WeakPolarHBondContact CA-OD1 3.08Å; S43-D103 WeakPolarHBondContact CB-OD1 3.36Å
44	R	51	Low	41.9	Very low	218 Å²	218	125 Å²	125	82%	0.823	62%	0.619	S	S	*	*	H	α-helix	trans	-71.1	-22.3	174.6	-78.3	-173.3	176.6	178.6	1.5	114.3	C42 L46	C42-R44 PolarHBondContact O-N 2.83Å; R44-L46 PolarHBondContact O-N 2.86Å
45	V	53.5	Low	42.6	Very low	29 Å²	29	119.3 Å²	119.3	18%	0.176	61%	0.609	C	S	.	*	H	α-helix	trans	-69.3	-29.1	175.3	-177	0	0	0	0	110.5	C42 S43 T92 M123	C42-V45 WeakPolarHBondContact O-CB 3.49Å; C42-V45 WeakPolarHBondContact O-CG2 3.24Å; C42-V45 PolarHBondContact O-N 3.11Å; S43-V45 VanDerWaalsContact C-N 3.33Å; V45-T92 HydrophobicContact CG1-CG2 3.94Å; V45-M123 HydrophobicContact CG2-CE 3.43Å; V45-M123 VanDerWaalsContact CG2-CE 3.43Å
46	L	48.1	Very low	43.3	Very low	49 Å²	49	117.1 Å²	117.1	26%	0.257	58%	0.582	S	S	.	*	H	α-helix	trans	-94.8	-28.1	-172.8	-63.1	143.7	0	0	0	112.5	S43 R44 I94 L96 E101 G102	S43-L46 PolarHBondContact O-N 2.04Å; R44-L46 PolarHBondContact O-N 2.86Å; L46-I94 HydrophobicContact CD2-CD1 4.39Å; L46-L96 HydrophobicContact CD2-CD1 4.38Å; L46-E101 WeakPolarHBondContact CD1-O 3.5Å; L46-E101 WeakPolarHBondContact CD2-O 3.36Å; L46-G102 WeakPolarHBondContact CD1-O 3.44Å
47	R	45.1	Very low	44.7	Very low	144 Å²	144	117.9 Å²	117.9	54%	0.543	58%	0.583	S	S	.	*			trans	-103.8	72.6	-175.4	-66.1	-173.8	-176.7	142.2	15.1	113.5	S43 D103	S43-R47 PolarHBondContact O-N 3.45Å; R47-D103 IonicContact NH2-OD2 2.7Å; R47-D103 PolarHBondContact NH2-OD2 2.04Å
48	A	40	Very low	46.6	Very low	54 Å²	54	112.4 Å²	112.4	45%	0.446	56%	0.56	S	S	.	*			trans	-105.4	119.9	163.5	0	0	0	0	0	110.6	F169	A48-F169 HydrophobicContact CB-CD1 4.4Å; A48-F169 HydrophobicContact CB-CE1 3.5Å; A48-F169 HydrophobicContact CB-CZ 4Å
49	Q	37.2	Very low	49	Very low	189 Å²	189	107.3 Å²	107.3	88%	0.883	52%	0.518	S	S	*	.			trans	-89.9	133.3	-169.9	-68.5	-178.4	-27.5	0	0	114.2
50	S	32.7	Very low	51	Low	93 Å²	93	105.7 Å²	105.7	65%	0.65	51%	0.506	S	S	*	.			trans	72.4	147.6	158.2	-143.9	0	0	0	0	116.1
51	N	33.7	Very low	52.9	Low	147 Å²	147	103.9 Å²	103.9	79%	0.786	49%	0.493	S	S	*	.			cis	-149	150.8	1.4	-143.9	-19.4	0	0	0	109
52	R	45.3	Very low	54.5	Low	239 Å²	239	97.7 Å²	97.7	90%	0.902	47%	0.471	S	S	*	.			trans	-42	134.9	-169.9	-75.5	175.5	164.4	165.5	-5.2	117.1
53	K	38	Very low	55.9	Low	186 Å²	186	97.2 Å²	97.2	81%	0.809	47%	0.468	S	S	*	.			trans	-162.6	138.7	140	-118.7	178.8	-179.9	-167.9	0	114.6
54	E	40.1	Very low	57.3	Low	155 Å²	155	102 Å²	102	72%	0.724	49%	0.49	S	S	*	.			trans	25.9	131.8	159.5	-70.3	162.9	169.5	0	0	121.5	N56	E54-N56 PolarHBondContact O-N 3.29Å
55	T	45.2	Very low	58.1	Low	108 Å²	108	95.4 Å²	95.4	66%	0.663	49%	0.489	S	S	*	.			trans	-63.7	110.7	178.3	-33.5	0	0	0	0	111.5
56	N	52.7	Low	58.7	Low	63 Å²	63	100 Å²	100	34%	0.337	51%	0.509	S	S	.	.			trans	-98.7	117.5	-175.5	-90.7	-1.2	0	0	0	112.5	E54 E58 Y168	E54-N56 PolarHBondContact O-N 3.29Å; N56-E58 PolarHBondContact O-N 2.74Å; N56-Y168 VanDerWaalsContact ND2-CE1 3.34Å; N56-Y168 WeakPolarHBondContact ND2-CE1 3.5Å
57	N	60.9	Low	60	Low	136 Å²	136	98.9 Å²	98.9	73%	0.727	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	11.4	168.9	-68.4	-0.3	0	0	0	113.2	F59	N57-F59 VanDerWaalsContact C-N 3.34Å
58	E	73.2	Confident	61.3	Low	71 Å²	71	99.4 Å²	99.4	33%	0.332	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-22.8	-175.8	-66	-169.5	-167.8	0	0	113.6	N56 A82 T83 S86	N56-E58 PolarHBondContact O-N 2.74Å; E58-A82 CarbonylContact O-C 3.56Å; E58-A82 WeakPolarHBondContact O-CA 3.21Å; E58-T83 PolarHBondContact O-N 3.17Å; E58-S86 WeakPolarHBondContact OE2-CB 3.4Å; E58-S86 PolarHBondContact OE2-OG 2.85Å
59	F	82.4	Confident	63.4	Low	2 Å²	2	102.2 Å²	102.2	1%	0.009	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.7	-178.9	-53.4	-82.6	0	0	0	110.1	N57 T81 A82 F88 I161 Y168 A174 L175	N57-F59 VanDerWaalsContact C-N 3.34Å; F59-T81 CarbonylContact C-O 3.57Å; F59-T81 VanDerWaalsContact CA-O 3.27Å; F59-T81 WeakPolarHBondContact CA-O 3.48Å; F59-A82 HydrophobicContact CD1-CB 3.56Å; F59-A82 HydrophobicContact CE1-CB 3.69Å; F59-F88 HydrophobicContact CD1-CD1 4.27Å; F59-F88 HydrophobicContact CE1-CB 4.37Å; F59-F88 HydrophobicContact CE1-CD1 4.26Å; F59-I161 HydrophobicContact CB-CD1 3.5Å; F59-I161 VanDerWaalsContact CB-CD1 3.5Å; F59-I161 HydrophobicContact CD1-CD1 3.51Å; F59-I161 HydrophobicContact CD1-CG2 4.31Å; F59-I161 HydrophobicContact CD2-CD1 4.3Å; F59-I161 HydrophobicContact CE1-CD1 4.28Å; F59-I161 HydrophobicContact CE1-CG2 4.09Å; F59-I161 HydrophobicContact CE2-CG2 4.43Å; F59-I161 HydrophobicContact CG-CD1 3.52Å; F59-I161 HydrophobicContact CZ-CG2 4.15Å; F59-Y168 HydrophobicContact CD2-CD2 4.32Å; F59-Y168 AromaticContact CE2-CD2 3.67Å; F59-Y168 HydrophobicContact CE2-CD2 3.67Å; F59-Y168 AromaticContact CE2-CE2 3.57Å; F59-Y168 HydrophobicContact CE2-CE2 3.57Å; F59-Y168 HydrophobicContact CE2-CG 4.36Å; F59-Y168 HydrophobicContact CZ-CD2 4.31Å; F59-Y168 HydrophobicContact CZ-CE2 4.09Å; F59-A174 VanDerWaalsContact O-CB 3.27Å; F59-A174 WeakPolarHBondContact O-CB 3.43Å; F59-L175 HydrophobicContact CB-CD2 3.79Å; F59-L175 HydrophobicContact CB-CG 4.44Å
60	Q	83.3	Confident	65.6	Low	73 Å²	73	93.2 Å²	93.2	34%	0.341	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128	-177.2	-165.6	-178.6	1.6	0	0	111.7	Q62 T81 A174	Q60-Q62 VanDerWaalsContact CD-NE2 3.26Å; Q60-Q62 HydrophobicContact CG-CG 3.81Å; Q60-T81 PolarHBondContact N-O 2.93Å; Q60-T81 PolarHBondContact O-N 2.96Å; Q60-T81 PolarHBondContact O-OG1 2.8Å; Q60-T81 VanDerWaalsContact O-OG1 3.14Å; Q60-A174 WeakPolarHBondContact CA-O 2.91Å; Q60-A174 HydrophobicContact CB-CB 4.47Å; Q60-A174 HydrophobicContact CG-CB 4.28Å
61	L	87.6	Confident	68	Low	8 Å²	8	93.2 Å²	93.2	4%	0.042	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.5	165.8	-173.5	70.4	0	0	0	108	V78 S79 L80 L93 L157 A159 A174 K177	L61-V78 HydrophobicContact CD1-CG1 3.53Å; L61-V78 HydrophobicContact CG-CG1 4.24Å; L61-S79 CarbonylContact C-O 3.56Å; L61-S79 WeakPolarHBondContact CA-O 3.46Å; L61-L80 HydrophobicContact CB-CD1 4.06Å; L61-L80 HydrophobicContact CD1-CB 4.21Å; L61-L80 HydrophobicContact CD1-CD1 4.03Å; L61-L93 HydrophobicContact CD1-CD1 3.78Å; L61-L93 HydrophobicContact CD2-CD1 4.2Å; L61-L157 HydrophobicContact CD2-CB 3.88Å; L61-L157 WeakPolarHBondContact CD2-O 3.45Å; L61-A159 HydrophobicContact CD1-CB 4.25Å; L61-A159 HydrophobicContact CD2-CB 4.34Å; L61-A174 PolarHBondContact N-O 2.89Å; L61-K177 HydrophobicContact CD2-CB 4.31Å
62	Q	86.5	Confident	70.3	Confident	68 Å²	68	88.5 Å²	88.5	32%	0.318	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151.5	177.3	-63.7	-177.6	-1.6	0	0	109.9	Q60 S79	Q60-Q62 VanDerWaalsContact CD-NE2 3.26Å; Q60-Q62 HydrophobicContact CG-CG 3.81Å; Q62-S79 PolarHBondContact N-O 2.76Å; Q62-S79 PolarHBondContact O-N 2.83Å
63	V	87.1	Confident	71.7	Confident	3 Å²	3	79.5 Å²	79.5	2%	0.018	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.7	168.9	-179.9	0	0	0	0	106.5	G65 E66 P67 Y76 R77 V78 L157 K177 M179	V63-G65 PolarHBondContact O-N 2.97Å; V63-E66 WeakPolarHBondContact O-CA 3.36Å; V63-E66 PolarHBondContact O-N 3.46Å; V63-P67 HydrophobicContact CB-CG 4.43Å; V63-P67 HydrophobicContact CG1-CG 3.83Å; V63-Y76 HydrophobicContact CG1-CD1 4.05Å; V63-Y76 HydrophobicContact CG1-CG 4.24Å; V63-R77 WeakPolarHBondContact CA-O 3.24Å; V63-V78 HydrophobicContact CG2-CG2 4.33Å; V63-L157 HydrophobicContact CG2-CD1 3.89Å; V63-K177 HydrophobicContact CG2-CG 3.93Å; V63-M179 HydrophobicContact CB-SD 4.31Å; V63-M179 HydrophobicContact CG1-SD 4.13Å; V63-M179 HydrophobicContact CG2-CE 4.11Å; V63-M179 HydrophobicContact CG2-SD 3.99Å
64	E	79.9	Confident	73.7	Confident	108 Å²	108	72.6 Å²	72.6	51%	0.505	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	132.1	-174.5	-171.1	163.7	-136.2	0	0	111.4	E66 P67 R77	E64-E66 VanDerWaalsContact C-N 3.32Å; E64-P67 WeakPolarHBondContact O-CD 3.22Å; E64-R77 HydrophobicContact CB-CB 3.97Å; E64-R77 PolarHBondContact N-O 2.9Å; E64-R77 IonicContact OE1-CZ 2.76Å; E64-R77 IonicContact OE1-NH1 2.7Å; E64-R77 PolarHBondContact OE1-NH1 2.92Å; E64-R77 WeakPolarHBondContact OE2-CB 3.3Å; E64-R77 VanDerWaalsContact OE2-CD 3.25Å; E64-R77 WeakPolarHBondContact OE2-CD 3.38Å; E64-R77 IonicContact OE2-CZ 3.18Å; E64-R77 IonicContact OE2-NE 2.86Å; E64-R77 PolarHBondContact OE2-NE 3.27Å; E64-R77 IonicContact OE2-NH1 3.99Å; E64-R77 PolarHBondContact OE2-NH1 2.95Å
65	G	67.9	Low	75.7	Confident	78 Å²	78	68.6 Å²	68.6	80%	0.804	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	2.5	-171.7	0	0	0	0	0	115.8	V63	V63-G65 PolarHBondContact O-N 2.97Å
66	E	66.2	Low	77.7	Confident	125 Å²	125	64.8 Å²	64.8	58%	0.584	35%	0.354	S	S	*	.			trans	42.9	45.1	-175.6	-63.4	-155.5	139.6	0	0	116.1	V63 E64 E68	V63-E66 WeakPolarHBondContact O-CA 3.36Å; V63-E66 PolarHBondContact O-N 3.46Å; E64-E66 VanDerWaalsContact C-N 3.32Å; E66-E68 PolarHBondContact O-N 3.01Å
67	P	74.2	Confident	79.5	Confident	26 Å²	26	65.1 Å²	65.1	17%	0.169	35%	0.35	C	S	.	.			trans	-57.3	134.5	-179.7	25.5	-34.9	0	0	0	111.7	V63 E64 R69 Y76 K177 M179	V63-P67 HydrophobicContact CB-CG 4.43Å; V63-P67 HydrophobicContact CG1-CG 3.83Å; E64-P67 WeakPolarHBondContact O-CD 3.22Å; P67-R69 VanDerWaalsContact C-N 3.34Å; P67-Y76 HydrophobicContact CB-CE1 4.42Å; P67-Y76 HydrophobicContact CG-CD1 4.05Å; P67-Y76 HydrophobicContact CG-CE1 3.98Å; P67-K177 VanDerWaalsContact O-CE 3.28Å; P67-K177 WeakPolarHBondContact O-CE 3.49Å; P67-K177 PolarHBondContact O-NZ 2.91Å; P67-K177 VanDerWaalsContact O-NZ 3.08Å; P67-M179 HydrophobicContact CG-SD 4.19Å
68	E	73.8	Confident	80.9	Confident	155 Å²	155	58.6 Å²	58.6	72%	0.724	32%	0.316	S	S	*	.	S	Bend	trans	-75.5	-27.7	168.4	-66.1	-170	149.8	0	0	111.7	E66	E66-E68 PolarHBondContact O-N 3.01Å
69	R	83.3	Confident	81.7	Confident	114 Å²	114	56 Å²	56	43%	0.43	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.7	-174.9	-73.8	176.1	-82.6	-163.9	-7.1	111.2	P67 C180 K182 E183	P67-R69 VanDerWaalsContact C-N 3.34Å; R69-C180 CarbonylContact C-O 3.57Å; R69-C180 WeakPolarHBondContact CA-O 3.42Å; R69-C180 WeakPolarHBondContact CB-O 3.34Å; R69-C180 HydrophobicContact CG-CB 4.5Å; R69-K182 HydrophobicContact CB-CB 3.87Å; R69-K182 HydrophobicContact CB-CG 4.3Å; R69-E183 IonicContact NH1-OE2 3.4Å
70	Y	83.9	Confident	82	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	147	177.5	73	-105.7	0	0	0	111.1	Y76 W145 A147 P148 G153 V155 M179 C180 E181 K182	Y70-Y76 WeakPolarHBondContact CA-OH 3.3Å; Y70-W145 HydrophobicContact CD1-CH2 4.08Å; Y70-W145 HydrophobicContact CG-CH2 4.15Å; Y70-W145 HydrophobicContact CG-CZ3 4.43Å; Y70-A147 HydrophobicContact CD2-CB 3.56Å; Y70-A147 HydrophobicContact CE2-CB 4.17Å; Y70-A147 HydrophobicContact CG-CB 4.1Å; Y70-P148 HydrophobicContact CE2-CG 4.15Å; Y70-G153 PolarHBondContact OH-O 3.48Å; Y70-G153 VanDerWaalsContact OH-O 3.11Å; Y70-V155 HydrophobicContact CE1-CB 4.34Å; Y70-V155 HydrophobicContact CE1-CG2 3.89Å; Y70-M179 HydrophobicContact CD1-CB 3.9Å; Y70-M179 WeakPolarHBondContact CD1-O 3.49Å; Y70-M179 WeakPolarHBondContact CE1-O 3.37Å; Y70-C180 VanDerWaalsContact CD1-C 3.43Å; Y70-C180 WeakPolarHBondContact CD1-O 3.41Å; Y70-C180 VanDerWaalsContact CE1-C 3.48Å; Y70-C180 PolarHBondContact N-O 3.17Å; Y70-E181 HydrophobicContact CE1-CB 4.42Å; Y70-E181 VanDerWaalsContact CE1-N 3.3Å; Y70-E181 HydrophobicContact CE2-CB 4.03Å; Y70-E181 HydrophobicContact CE2-CG 4.25Å; Y70-E181 CarbonylContact O-C 3.59Å; Y70-K182 VanDerWaalsContact O-CB 3.31Å; Y70-K182 WeakPolarHBondContact O-CB 3.42Å; Y70-K182 PolarHBondContact O-N 3.04Å
71	Q	81.9	Confident	82.2	Confident	93 Å²	93	54 Å²	54	44%	0.435	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-93	130.6	169.3	-70.9	177.5	57.4	0	0	108.5	G73 S74 Y76 A147 K182	Q71-G73 PolarHBondContact O-N 3.05Å; Q71-S74 WeakPolarHBondContact CB-OG 3.41Å; Q71-S74 VanDerWaalsContact O-CB 3.29Å; Q71-S74 WeakPolarHBondContact O-CB 3.47Å; Q71-S74 PolarHBondContact O-N 3.33Å; Q71-S74 VanDerWaalsContact O-N 3.11Å; Q71-S74 PolarHBondContact O-OG 2.74Å; Q71-Y76 PolarHBondContact N-OH 3.39Å; Q71-A147 WeakPolarHBondContact O-CB 3.48Å; Q71-K182 HydrophobicContact CG-CB 4.2Å; Q71-K182 HydrophobicContact CG-CD 3.77Å
72	P	81.9	Confident	82.1	Confident	47 Å²	47	54.2 Å²	54.2	31%	0.305	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	138.1	177.9	-30.1	36.9	0	0	0	112.8	S74 P148 E181	P72-S74 PolarHBondContact O-N 3.28Å; P72-P148 WeakPolarHBondContact CA-O 3.46Å; P72-E181 HydrophobicContact CG-CG 3.79Å; P72-E181 WeakPolarHBondContact CG-OE1 3.46Å
73	G	75.2	Confident	81.9	Confident	50 Å²	50	55.1 Å²	55.1	52%	0.515	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	-4.1	-178.6	0	0	0	0	0	116.1	Q71 A147 P148	Q71-G73 PolarHBondContact O-N 3.05Å; G73-A147 WeakPolarHBondContact CA-O 3.34Å; G73-A147 PolarHBondContact N-O 3.22Å; G73-P148 PolarHBondContact N-O 3.11Å
74	S	79.8	Confident	81.4	Confident	41 Å²	41	60.1 Å²	60.1	29%	0.287	35%	0.347	S	S	.	.			trans	-79	142.4	175.8	-62.6	0	0	0	0	111.7	Q71 P72 Y76 A147	Q71-S74 WeakPolarHBondContact CB-OG 3.41Å; Q71-S74 VanDerWaalsContact O-CB 3.29Å; Q71-S74 WeakPolarHBondContact O-CB 3.47Å; Q71-S74 PolarHBondContact O-N 3.33Å; Q71-S74 VanDerWaalsContact O-N 3.11Å; Q71-S74 PolarHBondContact O-OG 2.74Å; P72-S74 PolarHBondContact O-N 3.28Å; S74-Y76 WeakPolarHBondContact O-CD2 3.38Å; S74-Y76 WeakPolarHBondContact O-CE2 3.44Å; S74-A147 WeakPolarHBondContact O-CB 3.24Å; S74-A147 PolarHBondContact O-N 3.31Å
75	T	83.8	Confident	81.2	Confident	71 Å²	71	60.9 Å²	60.9	44%	0.436	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	132.9	177.8	-60.2	0	0	0	0	111.5	F144 T146	T75-F144 HydrophobicContact CG2-CB 3.71Å; T75-F144 HydrophobicContact CG2-CD1 4.03Å; T75-F144 HydrophobicContact CG2-CG 4.05Å; T75-T146 PolarHBondContact OG1-OG1 3.12Å
76	Y	86	Confident	81.8	Confident	28 Å²	28	58.2 Å²	58.2	11%	0.11	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.3	-177.5	-66.2	-84.7	0	0	0	110.8	V63 P67 Y70 Q71 S74 F144 W145 A147	V63-Y76 HydrophobicContact CG1-CD1 4.05Å; V63-Y76 HydrophobicContact CG1-CG 4.24Å; P67-Y76 HydrophobicContact CB-CE1 4.42Å; P67-Y76 HydrophobicContact CG-CD1 4.05Å; P67-Y76 HydrophobicContact CG-CE1 3.98Å; Y70-Y76 WeakPolarHBondContact CA-OH 3.3Å; Q71-Y76 PolarHBondContact N-OH 3.39Å; S74-Y76 WeakPolarHBondContact O-CD2 3.38Å; S74-Y76 WeakPolarHBondContact O-CE2 3.44Å; Y76-F144 CarbonylContact O-C 3.55Å; Y76-F144 WeakPolarHBondContact O-CA 3.3Å; Y76-W145 AromaticContact CD2-CE3 3.91Å; Y76-W145 HydrophobicContact CD2-CE3 3.91Å; Y76-W145 AromaticContact CD2-CZ3 3.89Å; Y76-W145 HydrophobicContact CD2-CZ3 3.89Å; Y76-W145 HydrophobicContact CE2-CZ3 4.44Å; Y76-W145 HydrophobicContact CG-CE3 4.46Å; Y76-W145 PolarHBondContact N-O 2.52Å; Y76-W145 PolarHBondContact O-N 3.15Å; Y76-A147 HydrophobicContact CD2-CB 4.39Å; Y76-A147 HydrophobicContact CE2-CB 4.1Å
77	R	89.9	Confident	82.5	Confident	70 Å²	70	54 Å²	54	26%	0.264	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.4	169.8	-168.5	179.4	-72	147.3	-10.9	109.5	V63 E64 I115 F144	V63-R77 WeakPolarHBondContact CA-O 3.24Å; E64-R77 HydrophobicContact CB-CB 3.97Å; E64-R77 PolarHBondContact N-O 2.9Å; E64-R77 IonicContact OE1-CZ 2.76Å; E64-R77 IonicContact OE1-NH1 2.7Å; E64-R77 PolarHBondContact OE1-NH1 2.92Å; E64-R77 WeakPolarHBondContact OE2-CB 3.3Å; E64-R77 VanDerWaalsContact OE2-CD 3.25Å; E64-R77 WeakPolarHBondContact OE2-CD 3.38Å; E64-R77 IonicContact OE2-CZ 3.18Å; E64-R77 IonicContact OE2-NE 2.86Å; E64-R77 PolarHBondContact OE2-NE 3.27Å; E64-R77 IonicContact OE2-NH1 3.99Å; E64-R77 PolarHBondContact OE2-NH1 2.95Å; R77-I115 HydrophobicContact CG-CD1 4.2Å; R77-F144 HydrophobicContact CB-CD1 4.04Å; R77-F144 HydrophobicContact CB-CE1 3.92Å; R77-F144 HydrophobicContact CG-CD1 4.39Å; R77-F144 HydrophobicContact CG-CE1 4.18Å
78	V	90.7	Very high	82.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.5	177	-173.2	0	0	0	0	107.9	L61 V63 L93 Q142 V143 W145 L157	L61-V78 HydrophobicContact CD1-CG1 3.53Å; L61-V78 HydrophobicContact CG-CG1 4.24Å; V63-V78 HydrophobicContact CG2-CG2 4.33Å; V78-L93 HydrophobicContact CG1-CD2 4.16Å; V78-Q142 WeakPolarHBondContact O-CA 3.42Å; V78-V143 HydrophobicContact CB-CG2 4.04Å; V78-V143 PolarHBondContact N-O 2.78Å; V78-V143 PolarHBondContact O-N 2.77Å; V78-W145 HydrophobicContact CG2-CB 3.65Å; V78-L157 HydrophobicContact CG1-CD1 4.13Å; V78-L157 HydrophobicContact CG2-CD1 3.76Å
79	S	89.7	Confident	83.2	Confident	15 Å²	15	50 Å²	50	11%	0.105	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.9	178.6	62.6	0	0	0	0	111.1	L61 Q62 I141	L61-S79 CarbonylContact C-O 3.56Å; L61-S79 WeakPolarHBondContact CA-O 3.46Å; Q62-S79 PolarHBondContact N-O 2.76Å; Q62-S79 PolarHBondContact O-N 2.83Å; S79-I141 CarbonylContact C-O 3.59Å; S79-I141 WeakPolarHBondContact CA-O 2.98Å
80	L	89	Confident	83	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.9	176.5	-178.6	67.3	0	0	0	109.1	L61 F88 F91 N140 I141 A159 I161 L175	L61-L80 HydrophobicContact CB-CD1 4.06Å; L61-L80 HydrophobicContact CD1-CB 4.21Å; L61-L80 HydrophobicContact CD1-CD1 4.03Å; L80-F88 WeakPolarHBondContact O-CZ 3.01Å; L80-F91 HydrophobicContact CD2-CB 3.99Å; L80-F91 HydrophobicContact CD2-CD2 4.24Å; L80-F91 HydrophobicContact CD2-CG 4.27Å; L80-N140 CarbonylContact O-C 3.56Å; L80-N140 VanDerWaalsContact O-CA 3.29Å; L80-N140 WeakPolarHBondContact O-CA 3.4Å; L80-I141 HydrophobicContact CB-CD1 3.64Å; L80-I141 HydrophobicContact CB-CG1 3.92Å; L80-I141 HydrophobicContact CD2-CD1 4.33Å; L80-I141 HydrophobicContact CD2-CG1 4.39Å; L80-I141 PolarHBondContact N-O 3.49Å; L80-I141 PolarHBondContact O-N 2.73Å; L80-A159 HydrophobicContact CD1-CB 3.75Å; L80-A159 HydrophobicContact CD2-CB 3.99Å; L80-I161 HydrophobicContact CD1-CD1 4.05Å; L80-I161 HydrophobicContact CD2-CD1 4.06Å; L80-I161 HydrophobicContact CD2-CG1 4Å; L80-I161 HydrophobicContact CG-CD1 4.16Å; L80-L175 HydrophobicContact CD1-CD2 3.59Å
81	T	88.1	Confident	83.1	Confident	34 Å²	34	44.6 Å²	44.6	21%	0.209	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	153.9	-169.2	60.1	0	0	0	0	112.4	F59 Q60 S139	F59-T81 CarbonylContact C-O 3.57Å; F59-T81 VanDerWaalsContact CA-O 3.27Å; F59-T81 WeakPolarHBondContact CA-O 3.48Å; Q60-T81 PolarHBondContact N-O 2.93Å; Q60-T81 PolarHBondContact O-N 2.96Å; Q60-T81 PolarHBondContact O-OG1 2.8Å; Q60-T81 VanDerWaalsContact O-OG1 3.14Å; T81-S139 CarbonylContact C-O 3.5Å; T81-S139 WeakPolarHBondContact CA-O 3.09Å
82	A	86	Confident	83.2	Confident	13 Å²	13	41.2 Å²	41.2	11%	0.107	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.4	172.3	0	0	0	0	0	110.6	E58 F59 S86 F88 S139	E58-A82 CarbonylContact O-C 3.56Å; E58-A82 WeakPolarHBondContact O-CA 3.21Å; F59-A82 HydrophobicContact CD1-CB 3.56Å; F59-A82 HydrophobicContact CE1-CB 3.69Å; A82-S86 WeakPolarHBondContact CB-O 3.11Å; A82-F88 HydrophobicContact CB-CD1 4.04Å; A82-F88 HydrophobicContact CB-CE1 4.23Å; A82-S139 PolarHBondContact N-O 2.71Å
83	T	81.9	Confident	83.5	Confident	86 Å²	86	39 Å²	39	53%	0.528	24%	0.235	S	C	.	.			trans	-76.3	125.8	178.3	-57.7	0	0	0	0	110.1	E58 S86	E58-T83 PolarHBondContact O-N 3.17Å; T83-S86 WeakPolarHBondContact O-CB 3.06Å; T83-S86 PolarHBondContact O-N 3.44Å
84	S	76.3	Confident	84.1	Confident	109 Å²	109	36.6 Å²	36.6	76%	0.762	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	132.5	178.2	-173.8	0	0	0	0	111.3
85	P	76.2	Confident	84.6	Confident	124 Å²	124	34.8 Å²	34.8	81%	0.805	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	cis	-94.4	12.5	15	38.2	-37.7	0	0	0	115.7
86	S	79.4	Confident	84.8	Confident	21 Å²	21	31.6 Å²	31.6	15%	0.147	18%	0.178	C	C	.	.			trans	-77.2	151.1	-178.2	-88.9	0	0	0	0	113.2	E58 A82 T83	E58-S86 WeakPolarHBondContact OE2-CB 3.4Å; E58-S86 PolarHBondContact OE2-OG 2.85Å; A82-S86 WeakPolarHBondContact CB-O 3.11Å; T83-S86 WeakPolarHBondContact O-CB 3.06Å; T83-S86 PolarHBondContact O-N 3.44Å
87	Y	82.3	Confident	84.8	Confident	36 Å²	36	34 Å²	34	14%	0.141	19%	0.189	C	C	.	.			trans	-147.8	156.3	179.9	67.8	-94.7	0	0	0	109.8	R89 R137 R138 Q163 K164	Y87-R89 HydrophobicContact CE2-CG 4.25Å; Y87-R137 HydrophobicContact CD2-CB 3.78Å; Y87-R137 HydrophobicContact CD2-CG 3.64Å; Y87-R137 HydrophobicContact CE2-CB 4.25Å; Y87-R137 HydrophobicContact CE2-CG 3.57Å; Y87-R137 HydrophobicContact CG-CB 4.27Å; Y87-R137 HydrophobicContact CG-CG 4.37Å; Y87-R138 CarbonylContact C-O 3.59Å; Y87-R138 VanDerWaalsContact CA-O 3.31Å; Y87-R138 WeakPolarHBondContact CA-O 3.49Å; Y87-R138 WeakPolarHBondContact CB-O 3.26Å; Y87-Q163 WeakPolarHBondContact O-CG 3.25Å; Y87-Q163 PolarHBondContact O-NE2 3.34Å; Y87-K164 WeakPolarHBondContact OH-CE 3.22Å
88	F	82.2	Confident	84.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-111.2	164.6	170.9	53	-87.5	0	0	0	111.8	F59 L80 A82 F91 R137 R138 I141 I161	F59-F88 HydrophobicContact CD1-CD1 4.27Å; F59-F88 HydrophobicContact CE1-CB 4.37Å; F59-F88 HydrophobicContact CE1-CD1 4.26Å; L80-F88 WeakPolarHBondContact O-CZ 3.01Å; A82-F88 HydrophobicContact CB-CD1 4.04Å; A82-F88 HydrophobicContact CB-CE1 4.23Å; F88-F91 HydrophobicContact CD2-CB 4.42Å; F88-F91 HydrophobicContact CD2-CD1 4.4Å; F88-F91 HydrophobicContact CE2-CD1 4.07Å; F88-R137 WeakPolarHBondContact O-CA 3.28Å; F88-R138 HydrophobicContact CD2-CB 4.07Å; F88-R138 HydrophobicContact CE2-CB 3.75Å; F88-R138 HydrophobicContact CZ-CB 4.03Å; F88-R138 PolarHBondContact N-O 2.81Å; F88-R138 PolarHBondContact O-N 2.59Å; F88-I141 HydrophobicContact CE2-CG1 4.05Å; F88-I141 HydrophobicContact CE2-CG2 3.94Å; F88-I141 HydrophobicContact CZ-CB 4.5Å; F88-I141 HydrophobicContact CZ-CG1 3.98Å; F88-I141 HydrophobicContact CZ-CG2 4.11Å; F88-I161 HydrophobicContact CB-CG2 3.56Å; F88-I161 HydrophobicContact CD1-CD1 4.42Å; F88-I161 HydrophobicContact CG-CG2 4.43Å
89	R	79.6	Confident	83.6	Confident	97 Å²	97	38.9 Å²	38.9	37%	0.366	24%	0.236	S	C	.	.	S	Bend	trans	-119.3	-34.9	177.2	-86.5	-178.3	166.2	175.6	-8.4	113.7	Y87 R136 R137 V162	Y87-R89 HydrophobicContact CE2-CG 4.25Å; R89-R136 WeakPolarHBondContact CA-O 3.47Å; R89-R137 HydrophobicContact CG-CG 4.47Å; R89-V162 PolarHBondContact N-O 3.33Å
90	G	78.7	Confident	83.1	Confident	2 Å²	2	39.5 Å²	39.5	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	161.1	169.7	0	0	0	0	0	110.5	E132 V162	G90-E132 WeakPolarHBondContact CA-OE1 3.46Å; G90-E132 WeakPolarHBondContact CA-OE2 3.38Å; G90-V162 PolarHBondContact N-O 2.9Å; G90-V162 PolarHBondContact O-N 2.79Å
91	F	85.6	Confident	82	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	163.5	177.5	72.3	-81.5	0	0	0	110.3	L80 F88 L93 T120 V130 T131 E132 I141 S160	L80-F91 HydrophobicContact CD2-CB 3.99Å; L80-F91 HydrophobicContact CD2-CD2 4.24Å; L80-F91 HydrophobicContact CD2-CG 4.27Å; F88-F91 HydrophobicContact CD2-CB 4.42Å; F88-F91 HydrophobicContact CD2-CD1 4.4Å; F88-F91 HydrophobicContact CE2-CD1 4.07Å; F91-L93 HydrophobicContact CD2-CB 4.33Å; F91-L93 HydrophobicContact CE2-CB 4.33Å; F91-T120 HydrophobicContact CE1-CG2 4.09Å; F91-T120 HydrophobicContact CZ-CG2 3.67Å; F91-V130 HydrophobicContact CE2-CG1 4.31Å; F91-V130 HydrophobicContact CZ-CG1 4.38Å; F91-T131 WeakPolarHBondContact O-CA 3.44Å; F91-T131 WeakPolarHBondContact O-CB 3.35Å; F91-T131 PolarHBondContact O-OG1 3.11Å; F91-E132 HydrophobicContact CD1-CB 4.3Å; F91-E132 HydrophobicContact CE1-CB 4.12Å; F91-E132 PolarHBondContact N-OE2 3.16Å; F91-I141 HydrophobicContact CD1-CG1 4.2Å; F91-I141 HydrophobicContact CD2-CD1 4.05Å; F91-I141 HydrophobicContact CD2-CG1 4.3Å; F91-I141 HydrophobicContact CE1-CB 4.4Å; F91-I141 HydrophobicContact CE1-CD1 4.38Å; F91-I141 HydrophobicContact CE1-CG1 3.91Å; F91-I141 HydrophobicContact CE1-CG2 4.03Å; F91-I141 HydrophobicContact CE2-CD1 3.61Å; F91-I141 HydrophobicContact CE2-CG1 4.03Å; F91-I141 HydrophobicContact CG-CG1 4.39Å; F91-I141 HydrophobicContact CZ-CB 4.4Å; F91-I141 HydrophobicContact CZ-CD1 3.8Å; F91-I141 HydrophobicContact CZ-CG1 3.83Å; F91-I141 HydrophobicContact CZ-CG2 4.49Å; F91-S160 CarbonylContact C-O 3.55Å; F91-S160 WeakPolarHBondContact CA-O 3.37Å; F91-S160 WeakPolarHBondContact CB-O 3.37Å
92	T	85.2	Confident	81.2	Confident	22 Å²	22	44.5 Å²	44.5	14%	0.135	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	121.6	168.8	-43.4	0	0	0	0	108.2	V45 I94 M123 A129 V130 A159 S160	V45-T92 HydrophobicContact CG1-CG2 3.94Å; T92-I94 HydrophobicContact CG2-CG2 4.44Å; T92-M123 HydrophobicContact CG2-SD 4.31Å; T92-A129 HydrophobicContact CG2-CB 4.09Å; T92-V130 CarbonylContact C-O 3.46Å; T92-V130 WeakPolarHBondContact CA-O 2.99Å; T92-A159 CarbonylContact O-C 3.52Å; T92-A159 WeakPolarHBondContact O-CA 3.24Å; T92-S160 PolarHBondContact N-O 3.46Å; T92-S160 PolarHBondContact O-N 2.03Å
93	L	88.1	Confident	80.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.6	179	-177.5	66.4	0	0	0	109.1	L61 V78 F91 F112 A129 V130 V143 A159	L61-L93 HydrophobicContact CD1-CD1 3.78Å; L61-L93 HydrophobicContact CD2-CD1 4.2Å; V78-L93 HydrophobicContact CG1-CD2 4.16Å; F91-L93 HydrophobicContact CD2-CB 4.33Å; F91-L93 HydrophobicContact CE2-CB 4.33Å; L93-F112 HydrophobicContact CD2-CD1 4.32Å; L93-F112 HydrophobicContact CD2-CE1 3.68Å; L93-F112 HydrophobicContact CD2-CZ 4.09Å; L93-F112 HydrophobicContact CG-CE1 3.94Å; L93-F112 HydrophobicContact CG-CZ 3.8Å; L93-A129 WeakPolarHBondContact O-CA 3.38Å; L93-V130 HydrophobicContact CB-CB 4.49Å; L93-V130 PolarHBondContact N-O 2.91Å; L93-V130 PolarHBondContact O-N 2.9Å; L93-V143 HydrophobicContact CD2-CG2 3.45Å; L93-V143 VanDerWaalsContact CD2-CG2 3.45Å; L93-A159 HydrophobicContact CD1-CB 4.13Å
94	I	88.7	Confident	79.8	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.2	179.4	60.5	178.1	0	0	0	110.5	L46 T92 L96 Y108 A129 L157 K158	L46-I94 HydrophobicContact CD2-CD1 4.39Å; T92-I94 HydrophobicContact CG2-CG2 4.44Å; I94-L96 HydrophobicContact CD1-CD1 3.82Å; I94-L96 HydrophobicContact CD1-CG 4.16Å; I94-Y108 HydrophobicContact CB-CE1 4.14Å; I94-Y108 HydrophobicContact CG2-CE1 4.14Å; I94-A129 HydrophobicContact CG2-CB 3.6Å; I94-L157 WeakPolarHBondContact O-CA 3.27Å; I94-K158 HydrophobicContact CD1-CB 4.4Å; I94-K158 HydrophobicContact CG1-CB 3.89Å; I94-K158 PolarHBondContact N-O 2.84Å; I94-K158 PolarHBondContact O-N 3.4Å
95	A	89.4	Confident	79.4	Confident	3 Å²	3	49 Å²	49	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	113.8	174.6	0	0	0	0	0	108.9	Y108 A109 F112 V155 L157	A95-Y108 VanDerWaalsContact O-CA 3.29Å; A95-Y108 WeakPolarHBondContact O-CA 2.87Å; A95-A109 WeakPolarHBondContact CB-O 3.22Å; A95-A109 PolarHBondContact O-N 3.17Å; A95-F112 HydrophobicContact CB-CE2 3.76Å; A95-F112 HydrophobicContact CB-CZ 3.77Å; A95-V155 HydrophobicContact CB-CG1 4.07Å; A95-L157 HydrophobicContact CB-CD2 3.53Å
96	L	87.6	Confident	79.3	Confident	3 Å²	3	50 Å²	50	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	147.5	-175.8	-68.4	176.5	0	0	0	111.5	L46 I94 D107 Y108 V155 L156	L46-L96 HydrophobicContact CD2-CD1 4.38Å; I94-L96 HydrophobicContact CD1-CD1 3.82Å; I94-L96 HydrophobicContact CD1-CG 4.16Å; L96-D107 WeakPolarHBondContact CA-O 3.01Å; L96-D107 HydrophobicContact CD2-CB 4.23Å; L96-Y108 HydrophobicContact CD2-CD1 3.66Å; L96-Y108 HydrophobicContact CD2-CD2 4.45Å; L96-Y108 HydrophobicContact CD2-CE1 3.6Å; L96-Y108 HydrophobicContact CD2-CE2 4.4Å; L96-Y108 HydrophobicContact CD2-CG 4.09Å; L96-V155 CarbonylContact O-C 3.49Å; L96-V155 WeakPolarHBondContact O-CA 3.37Å; L96-V155 WeakPolarHBondContact O-CG1 3.02Å; L96-L156 PolarHBondContact N-O 3.11Å; L96-L156 PolarHBondContact O-N 3.02Å
97	K	86.9	Confident	79.4	Confident	78 Å²	78	50.4 Å²	50.4	34%	0.339	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	144	168.5	-62.9	175	-174.8	167.2	0	110.1	G99 A100 E106 D107 A109 T152	K97-G99 PolarHBondContact O-N 2.87Å; K97-A100 HydrophobicContact CB-CB 4.12Å; K97-A100 WeakPolarHBondContact O-CB 3.07Å; K97-A100 PolarHBondContact O-N 2.04Å; K97-E106 VanDerWaalsContact CE-O 3.27Å; K97-E106 WeakPolarHBondContact CE-O 3.14Å; K97-E106 PolarHBondContact NZ-O 2.82Å; K97-D107 PolarHBondContact N-O 2.96Å; K97-A109 HydrophobicContact CG-CB 3.75Å; K97-T152 HydrophobicContact CD-CG2 4.36Å; K97-T152 HydrophobicContact CG-CG2 4.18Å
98	E	82.7	Confident	79.5	Confident	95 Å²	95	49.7 Å²	49.7	44%	0.444	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	126.1	178.7	-178.3	160.6	-126.3	0	0	111.4	A100 C154 R178	E98-A100 VanDerWaalsContact C-N 3.33Å; E98-C154 HydrophobicContact CB-CB 4.02Å; E98-C154 WeakPolarHBondContact CB-O 3.17Å; E98-C154 PolarHBondContact N-O 2.82Å; E98-C154 VanDerWaalsContact OE2-CB 3.31Å; E98-C154 WeakPolarHBondContact OE2-CB 3.04Å; E98-R178 IonicContact OE1-CZ 2.97Å; E98-R178 IonicContact OE1-NE 2.77Å; E98-R178 PolarHBondContact OE1-NE 2.94Å; E98-R178 IonicContact OE1-NH2 3.81Å; E98-R178 PolarHBondContact OE1-NH2 3.29Å; E98-R178 IonicContact OE2-CZ 2.69Å; E98-R178 IonicContact OE2-NE 2.79Å; E98-R178 IonicContact OE2-NH2 2.59Å; E98-R178 PolarHBondContact OE2-NH2 3.13Å
99	G	72.3	Confident	79.5	Confident	78 Å²	78	49.9 Å²	49.9	80%	0.804	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-4.1	-175.8	0	0	0	0	0	115.5	K97	K97-G99 PolarHBondContact O-N 2.87Å
100	A	78.3	Confident	79.8	Confident	29 Å²	29	46.9 Å²	46.9	24%	0.24	26%	0.26	C	S	.	.			trans	-85.1	140.8	173.9	0	0	0	0	0	111.6	K97 E98 D107	K97-A100 HydrophobicContact CB-CB 4.12Å; K97-A100 WeakPolarHBondContact O-CB 3.07Å; K97-A100 PolarHBondContact O-N 2.04Å; E98-A100 VanDerWaalsContact C-N 3.33Å; A100-D107 HydrophobicContact CB-CB 3.75Å
101	E	67.4	Low	80.2	Confident	138 Å²	138	51.2 Å²	51.2	65%	0.645	28%	0.282	S	S	*	.			trans	-84.3	-19.3	-179.7	-67.5	-166.5	177	0	0	113.1	L46	L46-E101 WeakPolarHBondContact CD1-O 3.5Å; L46-E101 WeakPolarHBondContact CD2-O 3.36Å
102	G	70.1	Confident	80.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	87.1	23.2	-176.9	0	0	0	0	0	113.7	L46 D107 Y108	L46-G102 WeakPolarHBondContact CD1-O 3.44Å; G102-D107 WeakPolarHBondContact CA-OD2 3.31Å; G102-D107 PolarHBondContact N-OD2 2.95Å; G102-D107 VanDerWaalsContact N-OD2 3.07Å; G102-Y108 PolarHBondContact O-OH 3.45Å
103	D	66.6	Low	80.4	Confident	47 Å²	47	54.9 Å²	54.9	25%	0.251	30%	0.298	S	S	.	.			trans	-88.6	-8.9	176.7	-88.1	-5.1	0	0	0	111.5	S40 S43 R47 D107	S40-D103 WeakPolarHBondContact CB-O 3.28Å; S40-D103 PolarHBondContact OG-O 2.87Å; S43-D103 WeakPolarHBondContact CA-OD1 3.08Å; S43-D103 WeakPolarHBondContact CB-OD1 3.36Å; R47-D103 IonicContact NH2-OD2 2.7Å; R47-D103 PolarHBondContact NH2-OD2 2.04Å; D103-D107 PolarHBondContact N-OD2 3.35Å
104	K	72.5	Confident	80.5	Confident	127 Å²	127	56.8 Å²	56.8	55%	0.552	31%	0.308	S	S	*	.	S	Bend	trans	-127.2	154.8	174.9	-60.4	177.4	-176.9	175.1	0	112.2	E106 D107 Y108	K104-E106 PolarHBondContact O-N 3.47Å; K104-D107 PolarHBondContact N-OD2 2.68Å; K104-D107 VanDerWaalsContact O-CB 3.25Å; K104-D107 WeakPolarHBondContact O-CB 3.27Å; K104-D107 PolarHBondContact O-N 3.2Å; K104-Y108 WeakPolarHBondContact O-CD2 3.21Å; K104-Y108 WeakPolarHBondContact O-CE2 3.47Å
105	D	68.1	Low	80.3	Confident	130 Å²	130	60.1 Å²	60.1	70%	0.695	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-60.4	-35.7	173.2	-158.1	51.3	0	0	0	111.6	D107 Y108	D105-D107 PolarHBondContact O-N 3.47Å; D105-Y108 PolarHBondContact O-N 2.74Å
106	E	72.9	Confident	79.9	Confident	145 Å²	145	63.1 Å²	63.1	68%	0.678	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.3	-14.4	174	-62	176.6	177.3	0	0	114.6	K97 K104 Y108	K97-E106 VanDerWaalsContact CE-O 3.27Å; K97-E106 WeakPolarHBondContact CE-O 3.14Å; K97-E106 PolarHBondContact NZ-O 2.82Å; K104-E106 PolarHBondContact O-N 3.47Å; E106-Y108 VanDerWaalsContact C-N 3.32Å
107	D	81.4	Confident	79.6	Confident	28 Å²	28	70.7 Å²	70.7	15%	0.15	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-77.9	-21.5	178.4	-64.6	-15.2	0	0	0	111.8	L96 K97 A100 G102 D103 K104 D105	L96-D107 WeakPolarHBondContact CA-O 3.01Å; L96-D107 HydrophobicContact CD2-CB 4.23Å; K97-D107 PolarHBondContact N-O 2.96Å; A100-D107 HydrophobicContact CB-CB 3.75Å; G102-D107 WeakPolarHBondContact CA-OD2 3.31Å; G102-D107 PolarHBondContact N-OD2 2.95Å; G102-D107 VanDerWaalsContact N-OD2 3.07Å; D103-D107 PolarHBondContact N-OD2 3.35Å; K104-D107 PolarHBondContact N-OD2 2.68Å; K104-D107 VanDerWaalsContact O-CB 3.25Å; K104-D107 WeakPolarHBondContact O-CB 3.27Å; K104-D107 PolarHBondContact O-N 3.2Å; D105-D107 PolarHBondContact O-N 3.47Å
108	Y	84.4	Confident	79.3	Confident	22 Å²	22	75.2 Å²	75.2	9%	0.086	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-78.4	148.6	179.1	-64.8	-87.1	0	0	0	111.4	C42 I94 A95 L96 G102 K104 D105 E106 P128	C42-Y108 HydrophobicContact CB-CE2 4.39Å; C42-Y108 WeakPolarHBondContact CB-OH 3.45Å; I94-Y108 HydrophobicContact CB-CE1 4.14Å; I94-Y108 HydrophobicContact CG2-CE1 4.14Å; A95-Y108 VanDerWaalsContact O-CA 3.29Å; A95-Y108 WeakPolarHBondContact O-CA 2.87Å; L96-Y108 HydrophobicContact CD2-CD1 3.66Å; L96-Y108 HydrophobicContact CD2-CD2 4.45Å; L96-Y108 HydrophobicContact CD2-CE1 3.6Å; L96-Y108 HydrophobicContact CD2-CE2 4.4Å; L96-Y108 HydrophobicContact CD2-CG 4.09Å; G102-Y108 PolarHBondContact O-OH 3.45Å; K104-Y108 WeakPolarHBondContact O-CD2 3.21Å; K104-Y108 WeakPolarHBondContact O-CE2 3.47Å; D105-Y108 PolarHBondContact O-N 2.74Å; E106-Y108 VanDerWaalsContact C-N 3.32Å; Y108-P128 HydrophobicContact CD1-CB 3.81Å; Y108-P128 HydrophobicContact CD1-CG 3.76Å; Y108-P128 HydrophobicContact CD2-CB 4.35Å; Y108-P128 HydrophobicContact CD2-CG 3.67Å; Y108-P128 HydrophobicContact CE1-CB 4.38Å; Y108-P128 HydrophobicContact CE1-CG 3.96Å; Y108-P128 HydrophobicContact CE2-CG 3.89Å; Y108-P128 HydrophobicContact CG-CB 3.81Å; Y108-P128 HydrophobicContact CG-CG 3.62Å
109	A	83.8	Confident	79.1	Confident	3 Å²	3	74 Å²	74	3%	0.025	39%	0.393	C	S	.	.			trans	-141.5	129.2	-174.2	0	0	0	0	0	113.8	A95 K97 W145 P148 T152 V155	A95-A109 WeakPolarHBondContact CB-O 3.22Å; A95-A109 PolarHBondContact O-N 3.17Å; K97-A109 HydrophobicContact CG-CB 3.75Å; A109-W145 PolarHBondContact O-NE1 3.23Å; A109-P148 HydrophobicContact CB-CG 4.31Å; A109-T152 HydrophobicContact CB-CG2 4.06Å; A109-V155 HydrophobicContact CB-CB 4.5Å; A109-V155 HydrophobicContact CB-CG1 4.05Å; A109-V155 HydrophobicContact CB-CG2 3.63Å
110	G	85.2	Confident	79.8	Confident	34 Å²	34	70.4 Å²	70.4	35%	0.351	36%	0.355	S	S	.	.	S	Bend	trans	76.1	178.4	-170.1	0	0	0	0	0	111.7	T146	G110-T146 CarbonylContact C-O 3.45Å; G110-T146 WeakPolarHBondContact CA-O 3.35Å
111	N	86.5	Confident	80.2	Confident	93 Å²	93	73 Å²	73	50%	0.497	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.1	179.7	-176.2	52.2	0	0	0	110.2	W145 T146	N111-W145 CarbonylContact O-C 3.53Å; N111-W145 WeakPolarHBondContact O-CA 3.41Å; N111-T146 PolarHBondContact N-O 3.29Å; N111-T146 PolarHBondContact O-N 3.06Å
112	F	89.3	Confident	81.1	Confident	7 Å²	7	70.3 Å²	70.3	3%	0.031	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	150.9	171	-69.2	-74.3	0	0	0	111	L93 A95 F122 V130 V143 F144 W145 L157	L93-F112 HydrophobicContact CD2-CD1 4.32Å; L93-F112 HydrophobicContact CD2-CE1 3.68Å; L93-F112 HydrophobicContact CD2-CZ 4.09Å; L93-F112 HydrophobicContact CG-CE1 3.94Å; L93-F112 HydrophobicContact CG-CZ 3.8Å; A95-F112 HydrophobicContact CB-CE2 3.76Å; A95-F112 HydrophobicContact CB-CZ 3.77Å; F112-F122 HydrophobicContact CB-CE1 4.08Å; F112-F122 WeakPolarHBondContact O-CZ 3.17Å; F112-V130 HydrophobicContact CB-CG2 3.6Å; F112-V130 HydrophobicContact CD1-CG2 4.43Å; F112-V130 HydrophobicContact CD2-CG2 4.02Å; F112-V130 HydrophobicContact CG-CG2 3.78Å; F112-V143 HydrophobicContact CD1-CG2 3.73Å; F112-V143 HydrophobicContact CE1-CG2 4.08Å; F112-F144 CarbonylContact C-O 3.56Å; F112-F144 VanDerWaalsContact CA-O 3.28Å; F112-F144 WeakPolarHBondContact CA-O 3.37Å; F112-W145 HydrophobicContact CD1-CB 3.82Å; F112-W145 AromaticContact CD1-CD1 3.92Å; F112-W145 HydrophobicContact CD1-CG 4.27Å; F112-W145 HydrophobicContact CE1-CB 3.78Å; F112-W145 AromaticContact CE1-CD1 3.65Å; F112-W145 AromaticContact CE1-CG 3.98Å; F112-W145 HydrophobicContact CE1-CG 3.98Å; F112-W145 AromaticContact CZ-CD1 3.86Å; F112-L157 HydrophobicContact CE1-CD2 4.42Å; F112-L157 HydrophobicContact CZ-CD2 4.08Å
113	Q	87.1	Confident	81.6	Confident	92 Å²	92	71.5 Å²	71.5	43%	0.43	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.6	167.6	-66.5	173.3	-21.6	0	0	108.1	F144	Q113-F144 HydrophobicContact CB-CB 4.13Å; Q113-F144 PolarHBondContact N-O 3.07Å; Q113-F144 PolarHBondContact O-N 3.47Å
114	I	88.4	Confident	82.1	Confident	41 Å²	41	75.7 Å²	75.7	21%	0.21	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	135.1	-179.9	-71.2	161.6	0	0	0	109.1	D116 E117 T120 F122	I114-D116 VanDerWaalsContact CG2-C 3.44Å; I114-D116 WeakPolarHBondContact CG2-O 3.38Å; I114-E117 HydrophobicContact CG2-CB 4.39Å; I114-E117 HydrophobicContact CG2-CG 3.71Å; I114-T120 WeakPolarHBondContact CG2-OG1 3.28Å; I114-F122 HydrophobicContact CD1-CD2 3.48Å; I114-F122 VanDerWaalsContact CD1-CD2 3.48Å; I114-F122 HydrophobicContact CD1-CE2 3.47Å; I114-F122 VanDerWaalsContact CD1-CE2 3.47Å; I114-F122 HydrophobicContact CD1-CG 4.26Å; I114-F122 HydrophobicContact CD1-CZ 4.24Å; I114-F122 HydrophobicContact CG1-CD2 4.35Å; I114-F122 HydrophobicContact CG1-CE2 3.94Å; I114-F122 HydrophobicContact CG1-CZ 4.27Å
115	I	85.1	Confident	82	Confident	70 Å²	70	73.3 Å²	73.3	36%	0.359	38%	0.375	S	S	.	.	S	Bend	trans	-94.7	-36.7	173.2	-63.3	176.7	0	0	0	110.6	R77 Q142 F144	R77-I115 HydrophobicContact CG-CD1 4.2Å; I115-Q142 HydrophobicContact CD1-CB 4.02Å; I115-F144 HydrophobicContact CD1-CD1 4.09Å; I115-F144 HydrophobicContact CD1-CD2 3.68Å; I115-F144 HydrophobicContact CD1-CE1 4.07Å; I115-F144 HydrophobicContact CD1-CE2 3.67Å; I115-F144 HydrophobicContact CD1-CG 3.89Å; I115-F144 HydrophobicContact CD1-CZ 3.87Å; I115-F144 HydrophobicContact CG1-CD2 3.45Å; I115-F144 VanDerWaalsContact CG1-CD2 3.45Å; I115-F144 HydrophobicContact CG1-CE2 3.6Å; I115-F144 HydrophobicContact CG1-CG 4.06Å; I115-F144 HydrophobicContact CG1-CZ 4.31Å
116	D	81.3	Confident	82.3	Confident	66 Å²	66	67.2 Å²	67.2	35%	0.353	34%	0.343	S	S	.	.			trans	-130.8	104.6	-177.9	-174.2	-26.6	0	0	0	109.6	I114 E118 E119 T120	I114-D116 VanDerWaalsContact CG2-C 3.44Å; I114-D116 WeakPolarHBondContact CG2-O 3.38Å; D116-E118 VanDerWaalsContact C-N 3.34Å; D116-E118 WeakPolarHBondContact OD1-CA 3.26Å; D116-E118 WeakPolarHBondContact OD1-CB 3.5Å; D116-E118 PolarHBondContact OD1-N 3.34Å; D116-E119 HydrophobicContact CB-CB 4.34Å; D116-E119 PolarHBondContact O-N 3.45Å; D116-E119 PolarHBondContact OD1-N 3.45Å; D116-T120 PolarHBondContact O-N 2.91Å; D116-T120 PolarHBondContact O-OG1 3.17Å
117	E	82.1	Confident	82.4	Confident	161 Å²	161	64.8 Å²	64.8	75%	0.752	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.8	177.3	-62.3	-172	162.5	0	0	112.7	I114 E119	I114-E117 HydrophobicContact CG2-CB 4.39Å; I114-E117 HydrophobicContact CG2-CG 3.71Å; E117-E119 VanDerWaalsContact C-N 3.28Å
118	E	79.4	Confident	82.4	Confident	174 Å²	174	64.9 Å²	64.9	81%	0.813	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-26.4	172.9	-63.8	-162.7	-174.7	0	0	111.3	D116 S133	D116-E118 VanDerWaalsContact C-N 3.34Å; D116-E118 WeakPolarHBondContact OD1-CA 3.26Å; D116-E118 WeakPolarHBondContact OD1-CB 3.5Å; D116-E118 PolarHBondContact OD1-N 3.34Å; E118-S133 VanDerWaalsContact C-OG 3.28Å; E118-S133 PolarHBondContact O-OG 3.38Å
119	E	77.9	Confident	82.4	Confident	69 Å²	69	63.8 Å²	63.8	32%	0.322	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-29.2	-179.7	-68.9	-142.1	161.9	0	0	116	D116 E117 S133 R138	D116-E119 HydrophobicContact CB-CB 4.34Å; D116-E119 PolarHBondContact O-N 3.45Å; D116-E119 PolarHBondContact OD1-N 3.45Å; E117-E119 VanDerWaalsContact C-N 3.28Å; E119-S133 VanDerWaalsContact CA-OG 3.32Å; E119-S133 WeakPolarHBondContact CA-OG 3.46Å; E119-S133 PolarHBondContact O-N 2.96Å; E119-S133 PolarHBondContact O-OG 2.89Å; E119-R138 PolarHBondContact O-NH2 3.36Å; E119-R138 VanDerWaalsContact O-NH2 3.09Å; E119-R138 WeakPolarHBondContact OE2-CD 3.02Å; E119-R138 IonicContact OE2-NE 3.23Å; E119-R138 PolarHBondContact OE2-NE 3.02Å
120	T	88.2	Confident	82.6	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.5	-170.9	69.6	0	0	0	0	112.5	F91 I114 D116 T131 I141	F91-T120 HydrophobicContact CE1-CG2 4.09Å; F91-T120 HydrophobicContact CZ-CG2 3.67Å; I114-T120 WeakPolarHBondContact CG2-OG1 3.28Å; D116-T120 PolarHBondContact O-N 2.91Å; D116-T120 PolarHBondContact O-OG1 3.17Å; T120-T131 WeakPolarHBondContact CA-O 3.32Å; T120-I141 HydrophobicContact CG2-CB 4.2Å; T120-I141 HydrophobicContact CG2-CG2 4.2Å
121	Q	86.3	Confident	82.7	Confident	83 Å²	83	62.8 Å²	62.8	39%	0.388	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.6	179.5	68.3	-177.4	-22.2	0	0	111.3	T131 E132	Q121-T131 HydrophobicContact CG-CG2 3.9Å; Q121-T131 PolarHBondContact N-O 3.34Å; Q121-T131 PolarHBondContact O-N 2.04Å; Q121-T131 VanDerWaalsContact O-O 3.13Å; Q121-E132 PolarHBondContact NE2-O 3.15Å
122	F	87	Confident	82.6	Confident	81 Å²	81	60.6 Å²	60.6	36%	0.355	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.9	168	-68	-75.6	0	0	0	110.9	F112 I114 T124 P127 V130	F112-F122 HydrophobicContact CB-CE1 4.08Å; F112-F122 WeakPolarHBondContact O-CZ 3.17Å; I114-F122 HydrophobicContact CD1-CD2 3.48Å; I114-F122 VanDerWaalsContact CD1-CD2 3.48Å; I114-F122 HydrophobicContact CD1-CE2 3.47Å; I114-F122 VanDerWaalsContact CD1-CE2 3.47Å; I114-F122 HydrophobicContact CD1-CG 4.26Å; I114-F122 HydrophobicContact CD1-CZ 4.24Å; I114-F122 HydrophobicContact CG1-CD2 4.35Å; I114-F122 HydrophobicContact CG1-CE2 3.94Å; I114-F122 HydrophobicContact CG1-CZ 4.27Å; F122-T124 PolarHBondContact O-N 3.42Å; F122-P127 WeakPolarHBondContact CD1-O 3.49Å; F122-V130 HydrophobicContact CD1-CG2 4.14Å; F122-V130 HydrophobicContact CE1-CG2 4Å
123	M	80.6	Confident	82.3	Confident	25 Å²	25	61.7 Å²	61.7	12%	0.123	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118.3	-175.7	-157.8	177.6	68	0	0	110.4	V45 T92 N125 C126 A129 T131	V45-M123 HydrophobicContact CG2-CE 3.43Å; V45-M123 VanDerWaalsContact CG2-CE 3.43Å; T92-M123 HydrophobicContact CG2-SD 4.31Å; M123-N125 WeakPolarHBondContact CE-OD1 3.49Å; M123-N125 WeakPolarHBondContact CG-OD1 3.39Å; M123-N125 PolarHBondContact O-N 3.32Å; M123-C126 HydrophobicContact CE-CB 3.4Å; M123-C126 CarbonylContact O-C 3.58Å; M123-C126 PolarHBondContact O-N 2.04Å; M123-C126 VanDerWaalsContact O-O 3.12Å; M123-A129 HydrophobicContact CB-CB 4.15Å; M123-A129 HydrophobicContact CE-CB 4.35Å; M123-A129 PolarHBondContact N-O 3.35Å; M123-T131 HydrophobicContact CB-CG2 3.89Å; M123-T131 HydrophobicContact CG-CG2 3.87Å
124	T	76.6	Confident	81.7	Confident	136 Å²	136	59.7 Å²	59.7	83%	0.834	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.7	-169.5	55	0	0	0	0	115.1	F122	F122-T124 PolarHBondContact O-N 3.42Å
125	N	71.2	Confident	80.8	Confident	77 Å²	77	62.6 Å²	62.6	41%	0.412	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	1.4	176.2	67.4	-58.7	0	0	0	114.5	M123	M123-N125 WeakPolarHBondContact CE-OD1 3.49Å; M123-N125 WeakPolarHBondContact CG-OD1 3.39Å; M123-N125 PolarHBondContact O-N 3.32Å
126	C	74.5	Confident	80.4	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.007	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	86.3	170.5	-172.4	0	0	0	0	108.3	C42 M123 A129	C42-C126 HydrophobicContact CB-CB 4.09Å; C42-C126 WeakPolarHBondContact CB-SG 3.29Å; C42-C126 WeakPolarHBondContact SG-CB 2.98Å; C42-C126 CovalentContact SG-SG 2.04Å; C42-C126 PolarHBondContact SG-SG 3.32Å; M123-C126 HydrophobicContact CE-CB 3.4Å; M123-C126 CarbonylContact O-C 3.58Å; M123-C126 PolarHBondContact O-N 2.04Å; M123-C126 VanDerWaalsContact O-O 3.12Å; C126-A129 HydrophobicContact CB-CB 4.27Å; C126-A129 WeakPolarHBondContact O-CB 2.97Å; C126-A129 PolarHBondContact O-N 3.26Å
127	P	74.4	Confident	80.4	Confident	94 Å²	94	72.4 Å²	72.4	61%	0.61	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49.9	-37.1	-174.1	-28.9	36.2	0	0	0	117.1	F122 A129	F122-P127 WeakPolarHBondContact CD1-O 3.49Å; P127-A129 PolarHBondContact O-N 3.37Å
128	P	80.7	Confident	80.4	Confident	30 Å²	30	65.2 Å²	65.2	20%	0.195	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	0.3	178.3	29.9	-36	0	0	0	114.6	Y108	Y108-P128 HydrophobicContact CD1-CB 3.81Å; Y108-P128 HydrophobicContact CD1-CG 3.76Å; Y108-P128 HydrophobicContact CD2-CB 4.35Å; Y108-P128 HydrophobicContact CD2-CG 3.67Å; Y108-P128 HydrophobicContact CE1-CB 4.38Å; Y108-P128 HydrophobicContact CE1-CG 3.96Å; Y108-P128 HydrophobicContact CE2-CG 3.89Å; Y108-P128 HydrophobicContact CG-CB 3.81Å; Y108-P128 HydrophobicContact CG-CG 3.62Å
129	A	84.3	Confident	80.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.1	177.6	0	0	0	0	0	111.9	T92 L93 I94 M123 C126 P127	T92-A129 HydrophobicContact CG2-CB 4.09Å; L93-A129 WeakPolarHBondContact O-CA 3.38Å; I94-A129 HydrophobicContact CG2-CB 3.6Å; M123-A129 HydrophobicContact CB-CB 4.15Å; M123-A129 HydrophobicContact CE-CB 4.35Å; M123-A129 PolarHBondContact N-O 3.35Å; C126-A129 HydrophobicContact CB-CB 4.27Å; C126-A129 WeakPolarHBondContact O-CB 2.97Å; C126-A129 PolarHBondContact O-N 3.26Å; P127-A129 PolarHBondContact O-N 3.37Å
130	V	88	Confident	81.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	139	172.4	-171.4	0	0	0	0	110.2	F91 T92 L93 F112 F122 V143	F91-V130 HydrophobicContact CE2-CG1 4.31Å; F91-V130 HydrophobicContact CZ-CG1 4.38Å; T92-V130 CarbonylContact C-O 3.46Å; T92-V130 WeakPolarHBondContact CA-O 2.99Å; L93-V130 HydrophobicContact CB-CB 4.49Å; L93-V130 PolarHBondContact N-O 2.91Å; L93-V130 PolarHBondContact O-N 2.9Å; F112-V130 HydrophobicContact CB-CG2 3.6Å; F112-V130 HydrophobicContact CD1-CG2 4.43Å; F112-V130 HydrophobicContact CD2-CG2 4.02Å; F112-V130 HydrophobicContact CG-CG2 3.78Å; F122-V130 HydrophobicContact CD1-CG2 4.14Å; F122-V130 HydrophobicContact CE1-CG2 4Å; V130-V143 HydrophobicContact CG1-CG1 4.08Å
131	T	88.1	Confident	81.2	Confident	16 Å²	16	60.4 Å²	60.4	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	179.1	-178.8	-166.2	0	0	0	0	111.2	F91 T120 Q121 M123	F91-T131 WeakPolarHBondContact O-CA 3.44Å; F91-T131 WeakPolarHBondContact O-CB 3.35Å; F91-T131 PolarHBondContact O-OG1 3.11Å; T120-T131 WeakPolarHBondContact CA-O 3.32Å; Q121-T131 HydrophobicContact CG-CG2 3.9Å; Q121-T131 PolarHBondContact N-O 3.34Å; Q121-T131 PolarHBondContact O-N 2.04Å; Q121-T131 VanDerWaalsContact O-O 3.13Å; M123-T131 HydrophobicContact CB-CG2 3.89Å; M123-T131 HydrophobicContact CG-CG2 3.87Å
132	E	85.2	Confident	81.3	Confident	46 Å²	46	60 Å²	60	22%	0.215	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.9	176.2	68.8	-81.2	-164.6	0	0	113.4	G90 F91 Q121	G90-E132 WeakPolarHBondContact CA-OE1 3.46Å; G90-E132 WeakPolarHBondContact CA-OE2 3.38Å; F91-E132 HydrophobicContact CD1-CB 4.3Å; F91-E132 HydrophobicContact CE1-CB 4.12Å; F91-E132 PolarHBondContact N-OE2 3.16Å; Q121-E132 PolarHBondContact NE2-O 3.15Å
133	S	82.3	Confident	81.5	Confident	31 Å²	31	56.1 Å²	56.1	22%	0.217	30%	0.298	C	S	.	.	S	Bend	trans	-66.5	-39.3	165.6	64.8	0	0	0	0	111.7	E118 E119	E118-S133 VanDerWaalsContact C-OG 3.28Å; E118-S133 PolarHBondContact O-OG 3.38Å; E119-S133 VanDerWaalsContact CA-OG 3.32Å; E119-S133 WeakPolarHBondContact CA-OG 3.46Å; E119-S133 PolarHBondContact O-N 2.96Å; E119-S133 PolarHBondContact O-OG 2.89Å
134	T	75.3	Confident	82	Confident	49 Å²	49	57.5 Å²	57.5	30%	0.301	30%	0.303	S	S	.	.	S	Bend	trans	-146.3	144.6	-171.9	59.7	0	0	0	0	111.3	R136 R138	T134-R136 PolarHBondContact O-N 3.4Å; T134-R138 PolarHBondContact O-NH1 2.62Å; T134-R138 PolarHBondContact O-NH2 2.69Å; T134-R138 PolarHBondContact OG1-NH2 2.83Å
135	P	69.1	Low	82.7	Confident	102 Å²	102	51 Å²	51	66%	0.662	26%	0.263	S	S	*	.			trans	-81.2	47	-175	33.5	-37.4	0	0	0	113.7
136	R	76.8	Confident	83.4	Confident	178 Å²	178	48.9 Å²	48.9	67%	0.672	25%	0.253	S	S	*	.			trans	-81	161.8	177.7	-68.4	-175.5	175.9	-165.7	3.2	111.3	R89 T134	R89-R136 WeakPolarHBondContact CA-O 3.47Å; T134-R136 PolarHBondContact O-N 3.4Å
137	R	80.2	Confident	84	Confident	164 Å²	164	49 Å²	49	62%	0.619	25%	0.254	S	S	*	.			trans	-77.5	124	175.3	-62.4	-170.2	-175.3	-177.2	3.7	109.2	Y87 F88 R89	Y87-R137 HydrophobicContact CD2-CB 3.78Å; Y87-R137 HydrophobicContact CD2-CG 3.64Å; Y87-R137 HydrophobicContact CE2-CB 4.25Å; Y87-R137 HydrophobicContact CE2-CG 3.57Å; Y87-R137 HydrophobicContact CG-CB 4.27Å; Y87-R137 HydrophobicContact CG-CG 4.37Å; F88-R137 WeakPolarHBondContact O-CA 3.28Å; R89-R137 HydrophobicContact CG-CG 4.47Å
138	R	83	Confident	84.5	Confident	10 Å²	10	44.9 Å²	44.9	4%	0.038	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-125.6	153.9	178.3	-61.9	-174.5	-179.6	82.7	5.1	111.6	Y87 F88 E119 T134 I141	Y87-R138 CarbonylContact C-O 3.59Å; Y87-R138 VanDerWaalsContact CA-O 3.31Å; Y87-R138 WeakPolarHBondContact CA-O 3.49Å; Y87-R138 WeakPolarHBondContact CB-O 3.26Å; F88-R138 HydrophobicContact CD2-CB 4.07Å; F88-R138 HydrophobicContact CE2-CB 3.75Å; F88-R138 HydrophobicContact CZ-CB 4.03Å; F88-R138 PolarHBondContact N-O 2.81Å; F88-R138 PolarHBondContact O-N 2.59Å; E119-R138 PolarHBondContact O-NH2 3.36Å; E119-R138 VanDerWaalsContact O-NH2 3.09Å; E119-R138 WeakPolarHBondContact OE2-CD 3.02Å; E119-R138 IonicContact OE2-NE 3.23Å; E119-R138 PolarHBondContact OE2-NE 3.02Å; T134-R138 PolarHBondContact O-NH1 2.62Å; T134-R138 PolarHBondContact O-NH2 2.69Å; T134-R138 PolarHBondContact OG1-NH2 2.83Å; R138-I141 VanDerWaalsContact CD-CG2 3.42Å
139	S	84.4	Confident	84.3	Confident	73 Å²	73	48 Å²	48	51%	0.51	25%	0.247	S	C	.	.	S	Bend	trans	-123	-8.3	173	54	0	0	0	0	113.5	T81 A82	T81-S139 CarbonylContact C-O 3.5Å; T81-S139 WeakPolarHBondContact CA-O 3.09Å; A82-S139 PolarHBondContact N-O 2.71Å
140	N	87.3	Confident	83.9	Confident	67 Å²	67	52.2 Å²	52.2	36%	0.358	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	144.3	174.1	-172.1	16	0	0	0	107.8	L80	L80-N140 CarbonylContact O-C 3.56Å; L80-N140 VanDerWaalsContact O-CA 3.29Å; L80-N140 WeakPolarHBondContact O-CA 3.4Å
141	I	89.6	Confident	83.1	Confident	6 Å²	6	55.6 Å²	55.6	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	151.6	158.5	55.7	84.5	0	0	0	108.2	S79 L80 F88 F91 T120 R138	S79-I141 CarbonylContact C-O 3.59Å; S79-I141 WeakPolarHBondContact CA-O 2.98Å; L80-I141 HydrophobicContact CB-CD1 3.64Å; L80-I141 HydrophobicContact CB-CG1 3.92Å; L80-I141 HydrophobicContact CD2-CD1 4.33Å; L80-I141 HydrophobicContact CD2-CG1 4.39Å; L80-I141 PolarHBondContact N-O 3.49Å; L80-I141 PolarHBondContact O-N 2.73Å; F88-I141 HydrophobicContact CE2-CG1 4.05Å; F88-I141 HydrophobicContact CE2-CG2 3.94Å; F88-I141 HydrophobicContact CZ-CB 4.5Å; F88-I141 HydrophobicContact CZ-CG1 3.98Å; F88-I141 HydrophobicContact CZ-CG2 4.11Å; F91-I141 HydrophobicContact CD1-CG1 4.2Å; F91-I141 HydrophobicContact CD2-CD1 4.05Å; F91-I141 HydrophobicContact CD2-CG1 4.3Å; F91-I141 HydrophobicContact CE1-CB 4.4Å; F91-I141 HydrophobicContact CE1-CD1 4.38Å; F91-I141 HydrophobicContact CE1-CG1 3.91Å; F91-I141 HydrophobicContact CE1-CG2 4.03Å; F91-I141 HydrophobicContact CE2-CD1 3.61Å; F91-I141 HydrophobicContact CE2-CG1 4.03Å; F91-I141 HydrophobicContact CG-CG1 4.39Å; F91-I141 HydrophobicContact CZ-CB 4.4Å; F91-I141 HydrophobicContact CZ-CD1 3.8Å; F91-I141 HydrophobicContact CZ-CG1 3.83Å; F91-I141 HydrophobicContact CZ-CG2 4.49Å; T120-I141 HydrophobicContact CG2-CB 4.2Å; T120-I141 HydrophobicContact CG2-CG2 4.2Å; R138-I141 VanDerWaalsContact CD-CG2 3.42Å
142	Q	89.4	Confident	82.6	Confident	74 Å²	74	56.5 Å²	56.5	35%	0.346	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	138.6	178.8	-64.3	-175.5	-30.9	0	0	110.1	V78 I115	V78-Q142 WeakPolarHBondContact O-CA 3.42Å; I115-Q142 HydrophobicContact CD1-CB 4.02Å
143	V	90.3	Very high	82.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	160.1	170.7	-57	0	0	0	0	109.1	V78 L93 F112 V130	V78-V143 HydrophobicContact CB-CG2 4.04Å; V78-V143 PolarHBondContact N-O 2.78Å; V78-V143 PolarHBondContact O-N 2.77Å; L93-V143 HydrophobicContact CD2-CG2 3.45Å; L93-V143 VanDerWaalsContact CD2-CG2 3.45Å; F112-V143 HydrophobicContact CD1-CG2 3.73Å; F112-V143 HydrophobicContact CE1-CG2 4.08Å; V130-V143 HydrophobicContact CG1-CG1 4.08Å
144	F	90.5	Very high	82.7	Confident	54 Å²	54	55.5 Å²	55.5	24%	0.237	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	144.9	164.9	-70.8	-58	0	0	0	110	T75 Y76 R77 F112 Q113 I115	T75-F144 HydrophobicContact CG2-CB 3.71Å; T75-F144 HydrophobicContact CG2-CD1 4.03Å; T75-F144 HydrophobicContact CG2-CG 4.05Å; Y76-F144 CarbonylContact O-C 3.55Å; Y76-F144 WeakPolarHBondContact O-CA 3.3Å; R77-F144 HydrophobicContact CB-CD1 4.04Å; R77-F144 HydrophobicContact CB-CE1 3.92Å; R77-F144 HydrophobicContact CG-CD1 4.39Å; R77-F144 HydrophobicContact CG-CE1 4.18Å; F112-F144 CarbonylContact C-O 3.56Å; F112-F144 VanDerWaalsContact CA-O 3.28Å; F112-F144 WeakPolarHBondContact CA-O 3.37Å; Q113-F144 HydrophobicContact CB-CB 4.13Å; Q113-F144 PolarHBondContact N-O 3.07Å; Q113-F144 PolarHBondContact O-N 3.47Å; I115-F144 HydrophobicContact CD1-CD1 4.09Å; I115-F144 HydrophobicContact CD1-CD2 3.68Å; I115-F144 HydrophobicContact CD1-CE1 4.07Å; I115-F144 HydrophobicContact CD1-CE2 3.67Å; I115-F144 HydrophobicContact CD1-CG 3.89Å; I115-F144 HydrophobicContact CD1-CZ 3.87Å; I115-F144 HydrophobicContact CG1-CD2 3.45Å; I115-F144 VanDerWaalsContact CG1-CD2 3.45Å; I115-F144 HydrophobicContact CG1-CE2 3.6Å; I115-F144 HydrophobicContact CG1-CG 4.06Å; I115-F144 HydrophobicContact CG1-CZ 4.31Å
145	W	92.3	Very high	83.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	113.4	171.4	174.1	75.9	0	0	0	108.7	Y70 Y76 V78 A109 N111 F112 A147 V155 L157 M179	Y70-W145 HydrophobicContact CD1-CH2 4.08Å; Y70-W145 HydrophobicContact CG-CH2 4.15Å; Y70-W145 HydrophobicContact CG-CZ3 4.43Å; Y76-W145 AromaticContact CD2-CE3 3.91Å; Y76-W145 HydrophobicContact CD2-CE3 3.91Å; Y76-W145 AromaticContact CD2-CZ3 3.89Å; Y76-W145 HydrophobicContact CD2-CZ3 3.89Å; Y76-W145 HydrophobicContact CE2-CZ3 4.44Å; Y76-W145 HydrophobicContact CG-CE3 4.46Å; Y76-W145 PolarHBondContact N-O 2.52Å; Y76-W145 PolarHBondContact O-N 3.15Å; V78-W145 HydrophobicContact CG2-CB 3.65Å; A109-W145 PolarHBondContact O-NE1 3.23Å; N111-W145 CarbonylContact O-C 3.53Å; N111-W145 WeakPolarHBondContact O-CA 3.41Å; F112-W145 HydrophobicContact CD1-CB 3.82Å; F112-W145 AromaticContact CD1-CD1 3.92Å; F112-W145 HydrophobicContact CD1-CG 4.27Å; F112-W145 HydrophobicContact CE1-CB 3.78Å; F112-W145 AromaticContact CE1-CD1 3.65Å; F112-W145 AromaticContact CE1-CG 3.98Å; F112-W145 HydrophobicContact CE1-CG 3.98Å; F112-W145 AromaticContact CZ-CD1 3.86Å; W145-A147 HydrophobicContact CE3-CB 4.46Å; W145-A147 HydrophobicContact CH2-CB 3.76Å; W145-A147 HydrophobicContact CZ2-CB 4.43Å; W145-A147 HydrophobicContact CZ3-CB 3.76Å; W145-V155 HydrophobicContact CH2-CB 4.3Å; W145-V155 HydrophobicContact CH2-CG1 4.42Å; W145-V155 HydrophobicContact CH2-CG2 4.44Å; W145-V155 HydrophobicContact CZ2-CB 4.05Å; W145-V155 HydrophobicContact CZ2-CG1 3.75Å; W145-V155 HydrophobicContact CZ2-CG2 4.14Å; W145-L157 HydrophobicContact CD2-CD2 3.97Å; W145-L157 HydrophobicContact CG-CD2 4.05Å; W145-L157 HydrophobicContact CZ2-CD2 4.45Å; W145-M179 HydrophobicContact CE3-CE 3.73Å; W145-M179 HydrophobicContact CH2-CE 3.97Å; W145-M179 HydrophobicContact CZ3-CE 3.31Å
146	T	86.8	Confident	84.3	Confident	31 Å²	31	49.9 Å²	49.9	19%	0.19	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	120.2	172	-54.7	0	0	0	0	108.9	T75 G110 N111	T75-T146 PolarHBondContact OG1-OG1 3.12Å; G110-T146 CarbonylContact C-O 3.45Å; G110-T146 WeakPolarHBondContact CA-O 3.35Å; N111-T146 PolarHBondContact N-O 3.29Å; N111-T146 PolarHBondContact O-N 3.06Å
147	A	86.9	Confident	84.9	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.033	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-62.6	144.6	179.9	0	0	0	0	0	111.6	Y70 Q71 G73 S74 Y76 W145	Y70-A147 HydrophobicContact CD2-CB 3.56Å; Y70-A147 HydrophobicContact CE2-CB 4.17Å; Y70-A147 HydrophobicContact CG-CB 4.1Å; Q71-A147 WeakPolarHBondContact O-CB 3.48Å; G73-A147 WeakPolarHBondContact CA-O 3.34Å; G73-A147 PolarHBondContact N-O 3.22Å; S74-A147 WeakPolarHBondContact O-CB 3.24Å; S74-A147 PolarHBondContact O-N 3.31Å; Y76-A147 HydrophobicContact CD2-CB 4.39Å; Y76-A147 HydrophobicContact CE2-CB 4.1Å; W145-A147 HydrophobicContact CE3-CB 4.46Å; W145-A147 HydrophobicContact CH2-CB 3.76Å; W145-A147 HydrophobicContact CZ2-CB 4.43Å; W145-A147 HydrophobicContact CZ3-CB 3.76Å
148	P	83.6	Confident	85.2	Confident	7 Å²	7	35.1 Å²	35.1	5%	0.045	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-63.3	164.5	178.3	30.2	-38.3	0	0	0	112.3	Y70 P72 G73 A109 T152 V155	Y70-P148 HydrophobicContact CE2-CG 4.15Å; P72-P148 WeakPolarHBondContact CA-O 3.46Å; G73-P148 PolarHBondContact N-O 3.11Å; A109-P148 HydrophobicContact CB-CG 4.31Å; P148-T152 HydrophobicContact CB-CG2 3.8Å; P148-T152 HydrophobicContact CG-CG2 3.66Å; P148-V155 HydrophobicContact CG-CG2 3.91Å
149	P	76.9	Confident	85.3	Confident	96 Å²	96	34.7 Å²	34.7	62%	0.623	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-61.7	163.6	171.1	28.1	-36.1	0	0	0	112.2	T152	P149-T152 WeakPolarHBondContact O-CB 3.35Å; P149-T152 PolarHBondContact O-OG1 3.28Å
150	S	75.8	Confident	85.1	Confident	88 Å²	88	31.6 Å²	31.6	62%	0.615	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	148.4	-176.6	42.5	0	0	0	0	112.9	E181	S150-E181 WeakPolarHBondContact CA-OE1 3.35Å; S150-E181 WeakPolarHBondContact CB-OE1 3.36Å
151	G	71.3	Confident	84.8	Confident	71 Å²	71	28.4 Å²	28.4	73%	0.732	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.2	7.4	-174.8	0	0	0	0	0	114.6	G153 E181	G151-G153 VanDerWaalsContact C-N 3.34Å; G151-E181 PolarHBondContact N-OE1 2.98Å; G151-E181 PolarHBondContact N-OE2 2.85Å
152	T	77.1	Confident	84.1	Confident	35 Å²	35	30.4 Å²	30.4	22%	0.215	20%	0.2	C	C	.	.			trans	-81.1	-16.1	173.9	-55.9	0	0	0	0	112.5	K97 A109 P148 P149	K97-T152 HydrophobicContact CD-CG2 4.36Å; K97-T152 HydrophobicContact CG-CG2 4.18Å; A109-T152 HydrophobicContact CB-CG2 4.06Å; P148-T152 HydrophobicContact CB-CG2 3.8Å; P148-T152 HydrophobicContact CG-CG2 3.66Å; P149-T152 WeakPolarHBondContact O-CB 3.35Å; P149-T152 PolarHBondContact O-OG1 3.28Å
153	G	83.3	Confident	83.1	Confident	34 Å²	34	27.8 Å²	27.8	35%	0.351	19%	0.188	S	C	.	.			trans	87.3	-117.1	172.5	0	0	0	0	0	113.5	Y70 G151 E181	Y70-G153 PolarHBondContact OH-O 3.48Å; Y70-G153 VanDerWaalsContact OH-O 3.11Å; G151-G153 VanDerWaalsContact C-N 3.34Å; G153-E181 WeakPolarHBondContact O-CB 3.5Å; G153-E181 PolarHBondContact O-N 3.26Å
154	C	87.4	Confident	81.9	Confident	23 Å²	23	34.1 Å²	34.1	16%	0.155	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140.9	177.9	-55.9	0	0	0	0	110.9	E98 R178 C180	E98-C154 HydrophobicContact CB-CB 4.02Å; E98-C154 WeakPolarHBondContact CB-O 3.17Å; E98-C154 PolarHBondContact N-O 2.82Å; E98-C154 VanDerWaalsContact OE2-CB 3.31Å; E98-C154 WeakPolarHBondContact OE2-CB 3.04Å; C154-R178 PolarHBondContact SG-NH2 3.08Å; C154-R178 VanDerWaalsContact SG-NH2 3.39Å; C154-C180 HydrophobicContact CB-CB 4.05Å; C154-C180 WeakPolarHBondContact CB-SG 3.08Å; C154-C180 WeakPolarHBondContact SG-CB 3.49Å; C154-C180 CovalentContact SG-SG 2.04Å; C154-C180 PolarHBondContact SG-SG 3.43Å
155	V	89.1	Confident	80	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.2	179.9	-176.9	0	0	0	0	109.9	Y70 A95 L96 A109 W145 P148 L157 M179	Y70-V155 HydrophobicContact CE1-CB 4.34Å; Y70-V155 HydrophobicContact CE1-CG2 3.89Å; A95-V155 HydrophobicContact CB-CG1 4.07Å; L96-V155 CarbonylContact O-C 3.49Å; L96-V155 WeakPolarHBondContact O-CA 3.37Å; L96-V155 WeakPolarHBondContact O-CG1 3.02Å; A109-V155 HydrophobicContact CB-CB 4.5Å; A109-V155 HydrophobicContact CB-CG1 4.05Å; A109-V155 HydrophobicContact CB-CG2 3.63Å; W145-V155 HydrophobicContact CH2-CB 4.3Å; W145-V155 HydrophobicContact CH2-CG1 4.42Å; W145-V155 HydrophobicContact CH2-CG2 4.44Å; W145-V155 HydrophobicContact CZ2-CB 4.05Å; W145-V155 HydrophobicContact CZ2-CG1 3.75Å; W145-V155 HydrophobicContact CZ2-CG2 4.14Å; P148-V155 HydrophobicContact CG-CG2 3.91Å; V155-L157 HydrophobicContact CG1-CD2 4.5Å; V155-M179 PolarHBondContact N-O 3.28Å; V155-M179 PolarHBondContact O-N 2.84Å
156	L	88.2	Confident	77.9	Confident	33 Å²	33	48 Å²	48	17%	0.173	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	105.8	173.4	-61.4	175.4	0	0	0	108.5	L96 K158 T176 R178	L96-L156 PolarHBondContact N-O 3.11Å; L96-L156 PolarHBondContact O-N 3.02Å; L156-K158 PolarHBondContact O-N 3.16Å; L156-T176 HydrophobicContact CD2-CG2 4.47Å; L156-R178 HydrophobicContact CD2-CB 3.72Å; L156-R178 HydrophobicContact CD2-CG 3.79Å
157	L	89.2	Confident	76.3	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	118.5	163.7	-59.3	-177.4	0	0	0	107.8	L61 V63 V78 I94 A95 F112 W145 V155 T176 K177 M179	L61-L157 HydrophobicContact CD2-CB 3.88Å; L61-L157 WeakPolarHBondContact CD2-O 3.45Å; V63-L157 HydrophobicContact CG2-CD1 3.89Å; V78-L157 HydrophobicContact CG1-CD1 4.13Å; V78-L157 HydrophobicContact CG2-CD1 3.76Å; I94-L157 WeakPolarHBondContact O-CA 3.27Å; A95-L157 HydrophobicContact CB-CD2 3.53Å; F112-L157 HydrophobicContact CE1-CD2 4.42Å; F112-L157 HydrophobicContact CZ-CD2 4.08Å; W145-L157 HydrophobicContact CD2-CD2 3.97Å; W145-L157 HydrophobicContact CG-CD2 4.05Å; W145-L157 HydrophobicContact CZ2-CD2 4.45Å; V155-L157 HydrophobicContact CG1-CD2 4.5Å; L157-T176 CarbonylContact O-C 3.48Å; L157-T176 VanDerWaalsContact O-CA 3.29Å; L157-T176 WeakPolarHBondContact O-CA 3.41Å; L157-K177 HydrophobicContact CB-CB 4.39Å; L157-K177 PolarHBondContact N-O 2.98Å; L157-K177 PolarHBondContact O-N 2.03Å; L157-M179 HydrophobicContact CD1-CE 3.55Å; L157-M179 HydrophobicContact CG-CE 4.1Å
158	K	86.6	Confident	74.8	Confident	32 Å²	32	52.3 Å²	52.3	14%	0.139	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.3	-178.9	-77	-177.2	166	-159.6	0	110.6	I94 L156 Q170 D171 T176	I94-K158 HydrophobicContact CD1-CB 4.4Å; I94-K158 HydrophobicContact CG1-CB 3.89Å; I94-K158 PolarHBondContact N-O 2.84Å; I94-K158 PolarHBondContact O-N 3.4Å; L156-K158 PolarHBondContact O-N 3.16Å; K158-Q170 HydrophobicContact CB-CB 4.3Å; K158-Q170 HydrophobicContact CD-CB 4.1Å; K158-Q170 HydrophobicContact CG-CB 4.49Å; K158-D171 IonicContact NZ-OD1 3.38Å; K158-D171 PolarHBondContact NZ-OD1 2.95Å; K158-T176 HydrophobicContact CG-CG2 3.97Å
159	A	85.6	Confident	73.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.9	174.1	0	0	0	0	0	112.1	L61 L80 T92 L93 L175	L61-A159 HydrophobicContact CD1-CB 4.25Å; L61-A159 HydrophobicContact CD2-CB 4.34Å; L80-A159 HydrophobicContact CD1-CB 3.75Å; L80-A159 HydrophobicContact CD2-CB 3.99Å; T92-A159 CarbonylContact O-C 3.52Å; T92-A159 WeakPolarHBondContact O-CA 3.24Å; L93-A159 HydrophobicContact CD1-CB 4.13Å; A159-L175 HydrophobicContact CB-CD2 4.29Å; A159-L175 PolarHBondContact N-O 2.83Å
160	S	80.8	Confident	72.3	Confident	9 Å²	9	52.5 Å²	52.5	6%	0.063	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	141.9	162.4	-65.1	0	0	0	0	109.7	F91 T92 Q170	F91-S160 CarbonylContact C-O 3.55Å; F91-S160 WeakPolarHBondContact CA-O 3.37Å; F91-S160 WeakPolarHBondContact CB-O 3.37Å; T92-S160 PolarHBondContact N-O 3.46Å; T92-S160 PolarHBondContact O-N 2.03Å; S160-Q170 VanDerWaalsContact OG-CD 3.31Å; S160-Q170 WeakPolarHBondContact OG-CG 3.02Å; S160-Q170 PolarHBondContact OG-NE2 3.15Å
161	I	79.4	Confident	71.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.4	176.5	-74.1	-176.3	0	0	0	111.5	F59 L80 F88 I167 Y168 L175	F59-I161 HydrophobicContact CB-CD1 3.5Å; F59-I161 VanDerWaalsContact CB-CD1 3.5Å; F59-I161 HydrophobicContact CD1-CD1 3.51Å; F59-I161 HydrophobicContact CD1-CG2 4.31Å; F59-I161 HydrophobicContact CD2-CD1 4.3Å; F59-I161 HydrophobicContact CE1-CD1 4.28Å; F59-I161 HydrophobicContact CE1-CG2 4.09Å; F59-I161 HydrophobicContact CE2-CG2 4.43Å; F59-I161 HydrophobicContact CG-CD1 3.52Å; F59-I161 HydrophobicContact CZ-CG2 4.15Å; L80-I161 HydrophobicContact CD1-CD1 4.05Å; L80-I161 HydrophobicContact CD2-CD1 4.06Å; L80-I161 HydrophobicContact CD2-CG1 4Å; L80-I161 HydrophobicContact CG-CD1 4.16Å; F88-I161 HydrophobicContact CB-CG2 3.56Å; F88-I161 HydrophobicContact CD1-CD1 4.42Å; F88-I161 HydrophobicContact CG-CG2 4.43Å; I161-I167 CarbonylContact O-C 3.6Å; I161-I167 WeakPolarHBondContact O-CA 3.46Å; I161-Y168 HydrophobicContact CG2-CD2 4.15Å; I161-Y168 PolarHBondContact N-O 3.36Å; I161-Y168 VanDerWaalsContact N-O 3.07Å; I161-Y168 PolarHBondContact O-N 3.07Å; I161-L175 HydrophobicContact CD1-CD1 4.38Å; I161-L175 HydrophobicContact CD1-CD2 3.7Å; I161-L175 HydrophobicContact CG1-CD2 4.34Å
162	V	75.4	Confident	70.2	Confident	47 Å²	47	58.2 Å²	58.2	29%	0.285	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	111.3	174.7	-172.3	0	0	0	0	110.5	R89 G90 I167	R89-V162 PolarHBondContact N-O 3.33Å; G90-V162 PolarHBondContact N-O 2.9Å; G90-V162 PolarHBondContact O-N 2.79Å; V162-I167 HydrophobicContact CG1-CG1 4.46Å; V162-I167 HydrophobicContact CG2-CG1 4.32Å; V162-I167 HydrophobicContact CG2-CG2 4.46Å
163	Q	67.9	Low	69.6	Low	20 Å²	20	58.9 Å²	58.9	9%	0.093	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	107.5	173.7	-169.5	-178.2	75.1	0	0	110.9	Y87 R165 I166 Y168	Y87-Q163 WeakPolarHBondContact O-CG 3.25Å; Y87-Q163 PolarHBondContact O-NE2 3.34Å; Q163-R165 PolarHBondContact O-N 2.86Å; Q163-I166 CarbonylContact C-O 3.59Å; Q163-I166 PolarHBondContact N-O 3.36Å; Q163-I166 PolarHBondContact O-N 3.43Å; Q163-I166 VanDerWaalsContact O-O 3.11Å; Q163-Y168 HydrophobicContact CB-CD2 4.29Å; Q163-Y168 HydrophobicContact CB-CE2 3.72Å; Q163-Y168 PolarHBondContact OE1-OH 3.36Å
164	K	66.1	Low	69	Low	132 Å²	132	58.8 Å²	58.8	57%	0.574	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-85.5	179.7	-57.1	168.6	-176.7	163.6	0	114.1	Y87	Y87-K164 WeakPolarHBondContact OH-CE 3.22Å
165	R	49.8	Very low	68.6	Low	247 Å²	247	58.5 Å²	58.5	93%	0.932	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	7.8	178.9	-77.8	-170	176.7	-177.2	-0.9	111.6	Q163	Q163-R165 PolarHBondContact O-N 2.86Å
166	I	48.4	Very low	68.4	Low	100 Å²	100	60.3 Å²	60.3	51%	0.513	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.8	-178.3	-57.7	174.3	0	0	0	106.3	Q163 Y168	Q163-I166 CarbonylContact C-O 3.59Å; Q163-I166 PolarHBondContact N-O 3.36Å; Q163-I166 PolarHBondContact O-N 3.43Å; Q163-I166 VanDerWaalsContact O-O 3.11Å; I166-Y168 HydrophobicContact CG2-CE1 4.37Å
167	I	53.9	Low	68.3	Low	73 Å²	73	60.8 Å²	60.8	37%	0.374	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131	174.6	-52.3	175.4	0	0	0	106.6	I161 V162 F169	I161-I167 CarbonylContact O-C 3.6Å; I161-I167 WeakPolarHBondContact O-CA 3.46Å; V162-I167 HydrophobicContact CG1-CG1 4.46Å; V162-I167 HydrophobicContact CG2-CG1 4.32Å; V162-I167 HydrophobicContact CG2-CG2 4.46Å; I167-F169 HydrophobicContact CB-CD1 4.49Å; I167-F169 HydrophobicContact CB-CE1 3.77Å; I167-F169 HydrophobicContact CB-CE2 4.28Å; I167-F169 HydrophobicContact CB-CZ 3.66Å; I167-F169 HydrophobicContact CD1-CE1 4.49Å; I167-F169 HydrophobicContact CG2-CD1 3.82Å; I167-F169 HydrophobicContact CG2-CE1 3.42Å; I167-F169 VanDerWaalsContact CG2-CE1 3.42Å; I167-F169 HydrophobicContact CG2-CZ 3.88Å; I167-F169 WeakPolarHBondContact O-CE2 3.27Å
168	Y	54.8	Low	68.3	Low	52 Å²	52	66.9 Å²	66.9	20%	0.204	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.9	169.6	-60.5	-77.6	0	0	0	107.8	N56 F59 I161 Q163 I166	N56-Y168 VanDerWaalsContact ND2-CE1 3.34Å; N56-Y168 WeakPolarHBondContact ND2-CE1 3.5Å; F59-Y168 HydrophobicContact CD2-CD2 4.32Å; F59-Y168 AromaticContact CE2-CD2 3.67Å; F59-Y168 HydrophobicContact CE2-CD2 3.67Å; F59-Y168 AromaticContact CE2-CE2 3.57Å; F59-Y168 HydrophobicContact CE2-CE2 3.57Å; F59-Y168 HydrophobicContact CE2-CG 4.36Å; F59-Y168 HydrophobicContact CZ-CD2 4.31Å; F59-Y168 HydrophobicContact CZ-CE2 4.09Å; I161-Y168 HydrophobicContact CG2-CD2 4.15Å; I161-Y168 PolarHBondContact N-O 3.36Å; I161-Y168 VanDerWaalsContact N-O 3.07Å; I161-Y168 PolarHBondContact O-N 3.07Å; Q163-Y168 HydrophobicContact CB-CD2 4.29Å; Q163-Y168 HydrophobicContact CB-CE2 3.72Å; Q163-Y168 PolarHBondContact OE1-OH 3.36Å; I166-Y168 HydrophobicContact CG2-CE1 4.37Å
169	F	55.2	Low	68.3	Low	97 Å²	97	65.3 Å²	65.3	43%	0.425	32%	0.317	S	S	.	.			trans	-106.7	166.1	-161.5	-64	-70.2	0	0	0	114.2	A48 I167 D171	A48-F169 HydrophobicContact CB-CD1 4.4Å; A48-F169 HydrophobicContact CB-CE1 3.5Å; A48-F169 HydrophobicContact CB-CZ 4Å; I167-F169 HydrophobicContact CB-CD1 4.49Å; I167-F169 HydrophobicContact CB-CE1 3.77Å; I167-F169 HydrophobicContact CB-CE2 4.28Å; I167-F169 HydrophobicContact CB-CZ 3.66Å; I167-F169 HydrophobicContact CD1-CE1 4.49Å; I167-F169 HydrophobicContact CG2-CD1 3.82Å; I167-F169 HydrophobicContact CG2-CE1 3.42Å; I167-F169 VanDerWaalsContact CG2-CE1 3.42Å; I167-F169 HydrophobicContact CG2-CZ 3.88Å; I167-F169 WeakPolarHBondContact O-CE2 3.27Å; F169-D171 PolarHBondContact O-N 3.42Å
170	Q	54.1	Low	68.4	Low	10 Å²	10	66.4 Å²	66.4	5%	0.047	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.9	-156.7	-59.3	-179.6	-35.8	0	0	117	K158 S160 T176	K158-Q170 HydrophobicContact CB-CB 4.3Å; K158-Q170 HydrophobicContact CD-CB 4.1Å; K158-Q170 HydrophobicContact CG-CB 4.49Å; S160-Q170 VanDerWaalsContact OG-CD 3.31Å; S160-Q170 WeakPolarHBondContact OG-CG 3.02Å; S160-Q170 PolarHBondContact OG-NE2 3.15Å; Q170-T176 PolarHBondContact O-OG1 3.13Å
171	D	50.7	Low	68.5	Low	114 Å²	114	68.2 Å²	68.2	61%	0.61	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	7.8	-155.2	-71.7	-30.9	0	0	0	116.8	K158 F169	K158-D171 IonicContact NZ-OD1 3.38Å; K158-D171 PolarHBondContact NZ-OD1 2.95Å; F169-D171 PolarHBondContact O-N 3.42Å
172	E	52.1	Low	68.3	Low	164 Å²	164	73.1 Å²	73.1	77%	0.766	35%	0.353	S	S	*	.	S	Bend	trans	-157.5	128.3	169.9	-116.6	161.3	-135.6	0	0	114.8
173	G	64.1	Low	67.2	Low	49 Å²	49	78 Å²	78	51%	0.505	37%	0.372	S	S	.	.	S	Bend	trans	86.5	-129	165.2	0	0	0	0	0	115.6	L175 T176	G173-L175 PolarHBondContact O-N 3.07Å; G173-L175 VanDerWaalsContact O-N 3.14Å; G173-T176 PolarHBondContact O-N 3.07Å
174	A	70.4	Confident	66.1	Low	33 Å²	33	81.5 Å²	81.5	27%	0.273	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-11.8	-162.8	0	0	0	0	0	115.8	F59 Q60 L61	F59-A174 VanDerWaalsContact O-CB 3.27Å; F59-A174 WeakPolarHBondContact O-CB 3.43Å; Q60-A174 WeakPolarHBondContact CA-O 2.91Å; Q60-A174 HydrophobicContact CB-CB 4.47Å; Q60-A174 HydrophobicContact CG-CB 4.28Å; L61-A174 PolarHBondContact N-O 2.89Å
175	L	79.3	Confident	64.8	Low	16 Å²	16	83.8 Å²	83.8	8%	0.084	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	2.9	179.5	-69	178.1	0	0	0	114.1	F59 L80 A159 I161 G173	F59-L175 HydrophobicContact CB-CD2 3.79Å; F59-L175 HydrophobicContact CB-CG 4.44Å; L80-L175 HydrophobicContact CD1-CD2 3.59Å; A159-L175 HydrophobicContact CB-CD2 4.29Å; A159-L175 PolarHBondContact N-O 2.83Å; I161-L175 HydrophobicContact CD1-CD1 4.38Å; I161-L175 HydrophobicContact CD1-CD2 3.7Å; I161-L175 HydrophobicContact CG1-CD2 4.34Å; G173-L175 PolarHBondContact O-N 3.07Å; G173-L175 VanDerWaalsContact O-N 3.14Å
176	T	84.1	Confident	64.3	Low	38 Å²	38	78.1 Å²	78.1	23%	0.233	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121.2	177.5	-55.1	0	0	0	0	110.1	L156 L157 K158 Q170 G173	L156-T176 HydrophobicContact CD2-CG2 4.47Å; L157-T176 CarbonylContact O-C 3.48Å; L157-T176 VanDerWaalsContact O-CA 3.29Å; L157-T176 WeakPolarHBondContact O-CA 3.41Å; K158-T176 HydrophobicContact CG-CG2 3.97Å; Q170-T176 PolarHBondContact O-OG1 3.13Å; G173-T176 PolarHBondContact O-N 3.07Å
177	K	87.3	Confident	63.6	Low	44 Å²	44	76.2 Å²	76.2	19%	0.191	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	112.4	171.5	-178.7	77.7	176.9	-176.3	0	108.6	L61 V63 P67 L157 M179	L61-K177 HydrophobicContact CD2-CB 4.31Å; V63-K177 HydrophobicContact CG2-CG 3.93Å; P67-K177 VanDerWaalsContact O-CE 3.28Å; P67-K177 WeakPolarHBondContact O-CE 3.49Å; P67-K177 PolarHBondContact O-NZ 2.91Å; P67-K177 VanDerWaalsContact O-NZ 3.08Å; L157-K177 HydrophobicContact CB-CB 4.39Å; L157-K177 PolarHBondContact N-O 2.98Å; L157-K177 PolarHBondContact O-N 2.03Å; K177-M179 HydrophobicContact CG-CG 3.87Å; K177-M179 HydrophobicContact CG-SD 4.26Å
178	R	88.6	Confident	62.9	Low	127 Å²	127	80.7 Å²	80.7	48%	0.479	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	129.3	166.8	-176.2	176.7	-173.4	-89.5	-2.9	108.8	E98 C154 L156 C180	E98-R178 IonicContact OE1-CZ 2.97Å; E98-R178 IonicContact OE1-NE 2.77Å; E98-R178 PolarHBondContact OE1-NE 2.94Å; E98-R178 IonicContact OE1-NH2 3.81Å; E98-R178 PolarHBondContact OE1-NH2 3.29Å; E98-R178 IonicContact OE2-CZ 2.69Å; E98-R178 IonicContact OE2-NE 2.79Å; E98-R178 IonicContact OE2-NH2 2.59Å; E98-R178 PolarHBondContact OE2-NH2 3.13Å; C154-R178 PolarHBondContact SG-NH2 3.08Å; C154-R178 VanDerWaalsContact SG-NH2 3.39Å; L156-R178 HydrophobicContact CD2-CB 3.72Å; L156-R178 HydrophobicContact CD2-CG 3.79Å; R178-C180 PolarHBondContact NH1-SG 3.11Å; R178-C180 PolarHBondContact NH2-SG 3.24Å; R178-C180 VanDerWaalsContact NH2-SG 3.37Å
179	M	87	Confident	61.8	Low	0 Å²	0	80.6 Å²	80.6	0%	0	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.5	169.6	-61.6	-173.5	-64.7	0	0	108.2	V63 P67 Y70 W145 V155 L157 K177	V63-M179 HydrophobicContact CB-SD 4.31Å; V63-M179 HydrophobicContact CG1-SD 4.13Å; V63-M179 HydrophobicContact CG2-CE 4.11Å; V63-M179 HydrophobicContact CG2-SD 3.99Å; P67-M179 HydrophobicContact CG-SD 4.19Å; Y70-M179 HydrophobicContact CD1-CB 3.9Å; Y70-M179 WeakPolarHBondContact CD1-O 3.49Å; Y70-M179 WeakPolarHBondContact CE1-O 3.37Å; W145-M179 HydrophobicContact CE3-CE 3.73Å; W145-M179 HydrophobicContact CH2-CE 3.97Å; W145-M179 HydrophobicContact CZ3-CE 3.31Å; V155-M179 PolarHBondContact N-O 3.28Å; V155-M179 PolarHBondContact O-N 2.84Å; L157-M179 HydrophobicContact CD1-CE 3.55Å; L157-M179 HydrophobicContact CG-CE 4.1Å; K177-M179 HydrophobicContact CG-CG 3.87Å; K177-M179 HydrophobicContact CG-SD 4.26Å
180	C	86.6	Confident	60.9	Low	22 Å²	22	82.8 Å²	82.8	15%	0.149	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	156	173	-67.6	0	0	0	0	111	R69 Y70 C154 R178 K182	R69-C180 CarbonylContact C-O 3.57Å; R69-C180 WeakPolarHBondContact CA-O 3.42Å; R69-C180 WeakPolarHBondContact CB-O 3.34Å; R69-C180 HydrophobicContact CG-CB 4.5Å; Y70-C180 VanDerWaalsContact CD1-C 3.43Å; Y70-C180 WeakPolarHBondContact CD1-O 3.41Å; Y70-C180 VanDerWaalsContact CE1-C 3.48Å; Y70-C180 PolarHBondContact N-O 3.17Å; C154-C180 HydrophobicContact CB-CB 4.05Å; C154-C180 WeakPolarHBondContact CB-SG 3.08Å; C154-C180 WeakPolarHBondContact SG-CB 3.49Å; C154-C180 CovalentContact SG-SG 2.04Å; C154-C180 PolarHBondContact SG-SG 3.43Å; R178-C180 PolarHBondContact NH1-SG 3.11Å; R178-C180 PolarHBondContact NH2-SG 3.24Å; R178-C180 VanDerWaalsContact NH2-SG 3.37Å; C180-K182 PolarHBondContact O-N 3.21Å
181	E	82.8	Confident	59.8	Low	47 Å²	47	90 Å²	90	22%	0.22	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	132.5	167.9	-170.8	165.4	166.2	0	0	110.4	Y70 P72 S150 G151 G153 E183	Y70-E181 HydrophobicContact CE1-CB 4.42Å; Y70-E181 VanDerWaalsContact CE1-N 3.3Å; Y70-E181 HydrophobicContact CE2-CB 4.03Å; Y70-E181 HydrophobicContact CE2-CG 4.25Å; Y70-E181 CarbonylContact O-C 3.59Å; P72-E181 HydrophobicContact CG-CG 3.79Å; P72-E181 WeakPolarHBondContact CG-OE1 3.46Å; S150-E181 WeakPolarHBondContact CA-OE1 3.35Å; S150-E181 WeakPolarHBondContact CB-OE1 3.36Å; G151-E181 PolarHBondContact N-OE1 2.98Å; G151-E181 PolarHBondContact N-OE2 2.85Å; G153-E181 WeakPolarHBondContact O-CB 3.5Å; G153-E181 PolarHBondContact O-N 3.26Å; E181-E183 PolarHBondContact O-N 2.91Å; E181-E183 VanDerWaalsContact O-N 3.13Å
182	K	75	Confident	58.9	Low	104 Å²	104	94.2 Å²	94.2	45%	0.452	52%	0.523	S	S	.	.			trans	-73.2	106.1	175.7	-173.8	-175.5	176.9	-171.4	0	107.4	R69 Y70 Q71 C180 S184	R69-K182 HydrophobicContact CB-CB 3.87Å; R69-K182 HydrophobicContact CB-CG 4.3Å; Y70-K182 VanDerWaalsContact O-CB 3.31Å; Y70-K182 WeakPolarHBondContact O-CB 3.42Å; Y70-K182 PolarHBondContact O-N 3.04Å; Q71-K182 HydrophobicContact CG-CB 4.2Å; Q71-K182 HydrophobicContact CG-CD 3.77Å; C180-K182 PolarHBondContact O-N 3.21Å; K182-S184 PolarHBondContact O-N 2.71Å
183	E	53.2	Low	58.1	Low	148 Å²	148	91.3 Å²	91.3	69%	0.692	52%	0.518	S	S	*	.			trans	-45.8	112.9	166.8	-67.6	171.7	154.8	0	0	109.3	R69 E181	R69-E183 IonicContact NH1-OE2 3.4Å; E181-E183 PolarHBondContact O-N 2.91Å; E181-E183 VanDerWaalsContact O-N 3.13Å
184	S	44.1	Very low	57.1	Low	94 Å²	94	95.9 Å²	95.9	66%	0.657	53%	0.53	S	S	*	.			trans	-53.9	142.9	158.2	-64.3	0	0	0	0	107.9	K182 N186	K182-S184 PolarHBondContact O-N 2.71Å; S184-N186 PolarHBondContact O-N 3.3Å
185	L	39.1	Very low	56.2	Low	180 Å²	180	100.3 Å²	100.3	94%	0.942	55%	0.548	S	S	*	.	S	Bend	trans	-73	57.4	173.4	-75.7	167.4	0	0	0	110.9
186	N	39.8	Very low	55.8	Low	129 Å²	129	105 Å²	105	69%	0.69	57%	0.574	S	S	*	*	S	Bend	trans	-152.2	95.2	177.3	-87.1	-28.8	0	0	0	106.9	S184	S184-N186 PolarHBondContact O-N 3.3Å
187	G	34.3	Very low	55.8	Low	59 Å²	59	103.5 Å²	103.5	61%	0.608	57%	0.565	S	S	*	*			trans	-67.1	156.9	-158.1	0	0	0	0	0	117.3	K336	G187-K336 PolarHBondContact O-NZ 3.11Å
188	D	38.2	Very low	55.9	Low	167 Å²	167	103 Å²	103	89%	0.893	57%	0.567	S	S	*	*			trans	69.3	146.4	161.8	-140.6	0.6	0	0	0	119.3
189	G	31.3	Very low	55.9	Low	51 Å²	51	97 Å²	97	53%	0.526	54%	0.544	S	S	.	.			trans	-137	164.8	-160.3	0	0	0	0	0	116.4
190	T	38	Very low	55.9	Low	143 Å²	143	98.9 Å²	98.9	88%	0.877	56%	0.557	S	S	*	*			trans	59.2	73.1	166	57.1	0	0	0	0	117.6
191	D	30.8	Very low	56	Low	161 Å²	161	99.3 Å²	99.3	86%	0.861	57%	0.565	S	S	*	*	S	Bend		-129.5	155.8	126.3	-115.9	-32.5	0	0	0	108.8
192	K	31.8	Very low	56.5	Low	203 Å²	203	99.5 Å²	99.5	88%	0.883	57%	0.569	S	S	*	*	S	Bend	trans	-78.9	146.6	174.6	-79.4	-178.9	175	179.2	0	110.7
193	P	35.7	Very low	57.2	Low	102 Å²	102	94.5 Å²	94.5	66%	0.662	55%	0.548	S	S	*	.	S	Bend	cis	-81.3	-178.1	-42.5	34.4	-25.6	0	0	0	110.1	L195	P193-L195 PolarHBondContact O-N 3.02Å
194	L	43	Very low	59.2	Low	146 Å²	146	91.3 Å²	91.3	76%	0.764	53%	0.531	S	S	*	.			trans	-50.7	136	161.1	-89.1	164.1	0	0	0	109.2	D196	L194-D196 PolarHBondContact O-N 3.29Å
195	L	51.2	Low	61.6	Low	125 Å²	125	86.8 Å²	86.8	65%	0.654	50%	0.5	S	S	*	.			trans	-37.5	130.5	-177.3	-105.8	63.9	0	0	0	111.5	P193 C197 C198	P193-L195 PolarHBondContact O-N 3.02Å; L195-C197 PolarHBondContact O-N 3.33Å; L195-C197 VanDerWaalsContact O-N 3.16Å; L195-C198 HydrophobicContact CD2-CB 4.49Å
196	D	69.9	Low	64.2	Low	114 Å²	114	82.9 Å²	82.9	61%	0.61	47%	0.473	S	S	*	.			trans	-49	125.6	152.4	-117.4	11.3	0	0	0	106.6	L194 C198 K239	L194-D196 PolarHBondContact O-N 3.29Å; D196-C198 PolarHBondContact O-N 2.91Å; D196-C198 VanDerWaalsContact O-N 3.11Å; D196-K239 IonicContact OD1-NZ 3.18Å; D196-K239 PolarHBondContact OD1-NZ 2.83Å
197	C	84.6	Confident	66.9	Low	7 Å²	7	76.8 Å²	76.8	5%	0.047	44%	0.44	C	S	.	.			trans	-44.9	123.6	-173.4	166.6	0	0	0	0	110.2	L195 R307 H310 C334	L195-C197 PolarHBondContact O-N 3.33Å; L195-C197 VanDerWaalsContact O-N 3.16Å; C197-R307 HydrophobicContact CB-CG 4.33Å; C197-R307 WeakPolarHBondContact CB-O 3.48Å; C197-R307 VanDerWaalsContact O-CD 3.27Å; C197-R307 WeakPolarHBondContact O-CD 3.42Å; C197-R307 WeakPolarHBondContact O-CG 3.42Å; C197-H310 HydrophobicContact CB-CB 4.18Å; C197-C334 WeakPolarHBondContact CA-SG 3.1Å; C197-C334 HydrophobicContact CB-CB 3.68Å; C197-C334 WeakPolarHBondContact CB-SG 3.41Å; C197-C334 WeakPolarHBondContact SG-CB 3.38Å; C197-C334 CovalentContact SG-SG 2.03Å; C197-C334 PolarHBondContact SG-SG 3.14Å
198	C	88.8	Confident	69.7	Low	35 Å²	35	74.6 Å²	74.6	24%	0.236	42%	0.415	C	S	.	.			trans	-91.4	-2.9	-176.2	63.3	0	0	0	0	113	L195 D196 C338 C413	L195-C198 HydrophobicContact CD2-CB 4.49Å; D196-C198 PolarHBondContact O-N 2.91Å; D196-C198 VanDerWaalsContact O-N 3.11Å; C198-C338 HydrophobicContact CB-CB 3.93Å; C198-C338 WeakPolarHBondContact CB-SG 3.33Å; C198-C338 WeakPolarHBondContact O-CB 3.33Å; C198-C338 WeakPolarHBondContact SG-CA 3.05Å; C198-C338 WeakPolarHBondContact SG-CB 3.35Å; C198-C338 CovalentContact SG-SG 2.04Å; C198-C338 PolarHBondContact SG-SG 3.05Å; C198-C413 PolarHBondContact O-SG 3.11Å
199	A	88.5	Confident	72.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.373	C	S	.	.			trans	-65.4	147.6	178.8	0	0	0	0	0	112.9	R307 C338 G339 W340	A199-R307 WeakPolarHBondContact O-CD 3.46Å; A199-R307 VanDerWaalsContact O-CG 3.28Å; A199-R307 WeakPolarHBondContact O-CG 3.31Å; A199-C338 WeakPolarHBondContact CA-O 3.28Å; A199-G339 WeakPolarHBondContact CB-O 3.49Å; A199-W340 HydrophobicContact CB-CD2 4.12Å; A199-W340 HydrophobicContact CB-CH2 4.19Å; A199-W340 HydrophobicContact CB-CZ2 3.73Å
200	C	88.2	Confident	75.4	Confident	40 Å²	40	67.8 Å²	67.8	27%	0.27	36%	0.361	S	S	.	.			trans	-108.9	160.9	-177.1	-57.2	0	0	0	0	112	W340 E411 Q412 C413	C200-W340 PolarHBondContact O-NE1 2.98Å; C200-W340 VanDerWaalsContact O-NE1 3.07Å; C200-E411 CarbonylContact C-O 3.56Å; C200-E411 WeakPolarHBondContact CB-O 2.99Å; C200-Q412 PolarHBondContact O-NE2 2.85Å; C200-C413 HydrophobicContact CB-CB 3.82Å; C200-C413 WeakPolarHBondContact CB-SG 3.42Å; C200-C413 PolarHBondContact N-SG 3.31Å; C200-C413 WeakPolarHBondContact SG-CB 3.19Å; C200-C413 CovalentContact SG-SG 2.04Å; C200-C413 PolarHBondContact SG-SG 2.89Å
201	G	88.9	Confident	78	Confident	31 Å²	31	61.5 Å²	61.5	32%	0.32	33%	0.325	S	S	.	.	S	Bend	trans	63.7	-149.3	-174.2	0	0	0	0	0	112.5	K409 E411	G201-K409 CarbonylContact C-O 3.59Å; G201-K409 WeakPolarHBondContact CA-O 3.14Å; G201-E411 PolarHBondContact N-O 2.95Å
202	T	91.6	Very high	80.9	Confident	50 Å²	50	56.1 Å²	56.1	31%	0.307	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.2	174.4	62.3	0	0	0	0	110.2	V305 D306 R408 K409	T202-V305 VanDerWaalsContact CA-O 3.28Å; T202-V305 WeakPolarHBondContact CA-O 3.07Å; T202-V305 VanDerWaalsContact CB-O 3.26Å; T202-V305 WeakPolarHBondContact CB-O 3.33Å; T202-D306 HydrophobicContact CG2-CB 3.77Å; T202-R408 CarbonylContact O-C 3.54Å; T202-R408 WeakPolarHBondContact O-CA 3.15Å; T202-K409 PolarHBondContact N-O 3.07Å; T202-K409 PolarHBondContact O-N 2.83Å
203	A	91.5	Very high	83.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.5	170.6	0	0	0	0	0	110.3	Y205 S304 V305 W340 R405 R408	A203-Y205 HydrophobicContact CB-CD2 4.24Å; A203-Y205 HydrophobicContact CB-CE2 3.6Å; A203-S304 CarbonylContact O-C 3.56Å; A203-S304 WeakPolarHBondContact O-CA 3.38Å; A203-V305 HydrophobicContact CB-CG2 3.94Å; A203-V305 PolarHBondContact N-O 2.96Å; A203-V305 VanDerWaalsContact N-O 3.07Å; A203-V305 WeakPolarHBondContact O-CG2 3.31Å; A203-V305 PolarHBondContact O-N 3.49Å; A203-W340 HydrophobicContact CB-CB 3.74Å; A203-W340 HydrophobicContact CB-CD2 3.56Å; A203-W340 HydrophobicContact CB-CE3 4.12Å; A203-W340 HydrophobicContact CB-CG 3.37Å; A203-R405 HydrophobicContact CB-CG 4.38Å; A203-R408 HydrophobicContact CB-CG 4.23Å
204	K	93.7	Very high	86.6	Confident	80 Å²	80	42.1 Å²	42.1	35%	0.348	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133	173.8	-164.2	-176.1	173.7	-166.5	0	108.5	E302 F303 I406 A407	K204-E302 WeakPolarHBondContact CE-OE2 3.48Å; K204-E302 IonicContact NZ-OE2 3.1Å; K204-E302 PolarHBondContact NZ-OE2 2.8Å; K204-F303 WeakPolarHBondContact CA-O 3.45Å; K204-I406 HydrophobicContact CB-CG1 4.12Å; K204-I406 HydrophobicContact CD-CD1 3.94Å; K204-I406 HydrophobicContact CD-CG1 4.35Å; K204-I406 HydrophobicContact CG-CD1 3.99Å; K204-I406 HydrophobicContact CG-CG1 4.06Å; K204-I406 VanDerWaalsContact O-CG1 3.24Å; K204-I406 WeakPolarHBondContact O-CG1 3.1Å; K204-I406 PolarHBondContact O-N 3.25Å; K204-A407 HydrophobicContact CB-CB 4.27Å; K204-A407 PolarHBondContact N-O 2.82Å; K204-A407 PolarHBondContact O-N 3.33Å
205	Y	95.2	Very high	89	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	154.3	-176.3	-76.3	-90.2	0	0	0	111.1	A203 E302 F303 V305 L333 A341 V403 E404 R405	A203-Y205 HydrophobicContact CB-CD2 4.24Å; A203-Y205 HydrophobicContact CB-CE2 3.6Å; Y205-E302 CarbonylContact O-C 3.49Å; Y205-E302 WeakPolarHBondContact O-CA 3.34Å; Y205-F303 VanDerWaalsContact CB-CE1 3.46Å; Y205-F303 VanDerWaalsContact CB-CZ 3.45Å; Y205-F303 HydrophobicContact CD2-CE2 4.33Å; Y205-F303 HydrophobicContact CD2-CZ 4.44Å; Y205-F303 HydrophobicContact CG-CE1 4.47Å; Y205-F303 HydrophobicContact CG-CE2 4.36Å; Y205-F303 HydrophobicContact CG-CZ 4.01Å; Y205-F303 PolarHBondContact N-O 3.27Å; Y205-F303 PolarHBondContact O-N 2.66Å; Y205-V305 HydrophobicContact CD2-CG2 3.83Å; Y205-V305 HydrophobicContact CE2-CG2 3.47Å; Y205-V305 VanDerWaalsContact CE2-CG2 3.47Å; Y205-L333 HydrophobicContact CD1-CD1 4.35Å; Y205-L333 HydrophobicContact CD2-CD1 3.94Å; Y205-L333 HydrophobicContact CE1-CD1 4.32Å; Y205-L333 HydrophobicContact CE1-CD2 4.39Å; Y205-L333 HydrophobicContact CE2-CB 4.17Å; Y205-L333 HydrophobicContact CE2-CD1 3.92Å; Y205-L333 HydrophobicContact CG-CD1 4.15Å; Y205-L333 PolarHBondContact OH-O 3.02Å; Y205-A341 WeakPolarHBondContact CE1-O 3.37Å; Y205-A341 PolarHBondContact OH-N 2.91Å; Y205-A341 VanDerWaalsContact OH-N 3.08Å; Y205-A341 PolarHBondContact OH-O 3.2Å; Y205-V403 HydrophobicContact CD1-CG1 3.74Å; Y205-V403 HydrophobicContact CE1-CG1 4.48Å; Y205-V403 HydrophobicContact CG-CG1 4.22Å; Y205-E404 CarbonylContact C-O 3.4Å; Y205-E404 WeakPolarHBondContact CA-O 3Å; Y205-R405 HydrophobicContact CD1-CB 4Å; Y205-R405 HydrophobicContact CD1-CG 4.47Å; Y205-R405 HydrophobicContact CE1-CB 3.63Å; Y205-R405 HydrophobicContact CE1-CG 4.05Å; Y205-R405 HydrophobicContact CE2-CG 4.42Å
206	R	94	Very high	90.8	Very high	97 Å²	97	42.1 Å²	42.1	37%	0.366	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.3	164	-172.2	176.6	-62.6	140.9	1.1	108.4	A301 E302 E404 I406	R206-A301 WeakPolarHBondContact CA-O 3.26Å; R206-E302 HydrophobicContact CB-CG 4.35Å; R206-E302 HydrophobicContact CG-CG 4.29Å; R206-E302 IonicContact CZ-OE1 2.69Å; R206-E302 IonicContact NE-OE1 2.76Å; R206-E302 PolarHBondContact NE-OE1 2.94Å; R206-E302 VanDerWaalsContact NE-OE1 3.1Å; R206-E302 IonicContact NH2-OE1 3.66Å; R206-E302 PolarHBondContact NH2-OE1 3.34Å; R206-E404 PolarHBondContact N-O 2.81Å; R206-E404 PolarHBondContact O-N 2.88Å; R206-I406 HydrophobicContact CB-CD1 4.49Å; R206-I406 HydrophobicContact CB-CG2 3.8Å
207	V	95.4	Very high	91.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	132.4	168.1	50.1	0	0	0	0	108.6	I281 M283 S300 A301 F303 V401 I402 V403	V207-I281 HydrophobicContact CG1-CG2 4.01Å; V207-M283 HydrophobicContact CB-CE 4.23Å; V207-M283 HydrophobicContact CG1-CE 3.6Å; V207-M283 HydrophobicContact CG2-CE 3.97Å; V207-M283 WeakPolarHBondContact O-CE 3.41Å; V207-S300 CarbonylContact O-C 3.39Å; V207-S300 WeakPolarHBondContact O-CA 3.37Å; V207-S300 WeakPolarHBondContact O-CB 3.43Å; V207-A301 HydrophobicContact CG1-CB 4.41Å; V207-A301 WeakPolarHBondContact CG1-O 3.4Å; V207-A301 PolarHBondContact N-O 3.45Å; V207-A301 PolarHBondContact O-N 2.93Å; V207-F303 HydrophobicContact CB-CD1 4.43Å; V207-F303 HydrophobicContact CB-CE1 3.84Å; V207-F303 HydrophobicContact CG1-CD1 3.79Å; V207-F303 HydrophobicContact CG1-CE1 3.69Å; V207-V401 HydrophobicContact CG2-CG2 3.48Å; V207-V401 VanDerWaalsContact CG2-CG2 3.48Å; V207-I402 CarbonylContact C-O 3.55Å; V207-I402 WeakPolarHBondContact CA-O 3.45Å; V207-V403 HydrophobicContact CB-CG2 4.33Å; V207-V403 HydrophobicContact CG2-CG2 4.17Å
208	T	94.1	Very high	92.2	Very high	14 Å²	14	40.6 Å²	40.6	9%	0.086	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.7	-180	-51.8	0	0	0	0	109.4	Y210 A298 P299 I402	T208-Y210 HydrophobicContact CG2-CD2 4.29Å; T208-Y210 HydrophobicContact CG2-CE1 4.43Å; T208-Y210 HydrophobicContact CG2-CE2 3.55Å; T208-A298 HydrophobicContact CG2-CB 3.54Å; T208-P299 WeakPolarHBondContact CA-O 3.27Å; T208-I402 PolarHBondContact N-O 3.32Å; T208-I402 PolarHBondContact O-N 3.08Å
209	F	95.3	Very high	92.4	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	122.8	-176.4	176.5	-90.2	0	0	0	111.5	W229 I232 M283 P299 F314 T316 V326 L348 A399	F209-W229 AromaticContact CE1-CD1 4Å; F209-W229 AromaticContact CE1-CD2 3.9Å; F209-W229 HydrophobicContact CE1-CD2 3.9Å; F209-W229 AromaticContact CE1-CE2 3.98Å; F209-W229 HydrophobicContact CE1-CE3 4.47Å; F209-W229 AromaticContact CE1-CG 3.92Å; F209-W229 HydrophobicContact CE1-CG 3.92Å; F209-W229 AromaticContact CZ-CD2 3.82Å; F209-W229 HydrophobicContact CZ-CD2 3.82Å; F209-W229 AromaticContact CZ-CE2 3.91Å; F209-W229 AromaticContact CZ-CE3 3.97Å; F209-W229 HydrophobicContact CZ-CE3 3.97Å; F209-W229 HydrophobicContact CZ-CG 4.31Å; F209-W229 HydrophobicContact CZ-CH2 4.26Å; F209-W229 HydrophobicContact CZ-CZ2 4.13Å; F209-W229 HydrophobicContact CZ-CZ3 4.21Å; F209-I232 HydrophobicContact CB-CD1 3.59Å; F209-I232 HydrophobicContact CD1-CD1 3.87Å; F209-I232 HydrophobicContact CD2-CD1 4.16Å; F209-I232 HydrophobicContact CG-CD1 3.62Å; F209-M283 HydrophobicContact CB-SD 4.39Å; F209-P299 HydrophobicContact CB-CG 4.28Å; F209-P299 HydrophobicContact CD1-CG 4.29Å; F209-P299 PolarHBondContact N-O 2.94Å; F209-P299 WeakPolarHBondContact O-CD 3.41Å; F209-F314 HydrophobicContact CD2-CE2 4.18Å; F209-F314 HydrophobicContact CD2-CZ 4.47Å; F209-T316 HydrophobicContact CE2-CG2 3.91Å; F209-T316 HydrophobicContact CZ-CG2 3.87Å; F209-V326 HydrophobicContact CE2-CG2 3.72Å; F209-V326 HydrophobicContact CZ-CG2 3.91Å; F209-L348 HydrophobicContact CE2-CD1 4.2Å; F209-A399 HydrophobicContact CD2-CB 4.38Å; F209-A399 HydrophobicContact CE1-CB 4.35Å; F209-A399 HydrophobicContact CE2-CB 3.48Å; F209-A399 VanDerWaalsContact CE2-CB 3.48Å; F209-A399 HydrophobicContact CZ-CB 3.47Å; F209-A399 VanDerWaalsContact CZ-CB 3.47Å
210	Y	93.6	Very high	92.5	Very high	73 Å²	73	46.9 Å²	46.9	29%	0.286	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	97.3	178.6	-60.8	-92.9	0	0	0	109.4	T208 N212 L293 A298 A399 R400 I402	T208-Y210 HydrophobicContact CG2-CD2 4.29Å; T208-Y210 HydrophobicContact CG2-CE1 4.43Å; T208-Y210 HydrophobicContact CG2-CE2 3.55Å; Y210-N212 PolarHBondContact O-N 3.46Å; Y210-L293 HydrophobicContact CD1-CD1 4.38Å; Y210-L293 HydrophobicContact CD1-CD2 3.99Å; Y210-L293 HydrophobicContact CE1-CD1 3.97Å; Y210-L293 HydrophobicContact CE1-CD2 3.84Å; Y210-A298 HydrophobicContact CD1-CB 3.82Å; Y210-A298 HydrophobicContact CE1-CB 3.67Å; Y210-A298 HydrophobicContact CG-CB 4.39Å; Y210-A399 CarbonylContact O-C 3.1Å; Y210-A399 VanDerWaalsContact O-CA 3.22Å; Y210-A399 WeakPolarHBondContact O-CA 3.43Å; Y210-R400 WeakPolarHBondContact CA-O 3.46Å; Y210-R400 WeakPolarHBondContact CB-O 3.27Å; Y210-R400 PolarHBondContact N-O 2.03Å; Y210-R400 PolarHBondContact O-N 2.82Å; Y210-I402 HydrophobicContact CD2-CD1 4.24Å; Y210-I402 HydrophobicContact CD2-CG1 4.16Å; Y210-I402 HydrophobicContact CE2-CB 4.13Å; Y210-I402 HydrophobicContact CE2-CD1 3.62Å; Y210-I402 HydrophobicContact CE2-CG1 3.79Å
211	G	91.6	Very high	92.6	Very high	11 Å²	11	50 Å²	50	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	119.6	169.4	0	0	0	0	0	110.8	W290	G211-W290 VanDerWaalsContact O-CD1 3.23Å
212	N	92.6	Very high	92.8	Very high	49 Å²	49	49.5 Å²	49.5	26%	0.262	24%	0.242	S	C	.	.			trans	-101	-12.1	174.5	-73.9	-16.4	0	0	0	112.5	Y210 S214 I217 V398	Y210-N212 PolarHBondContact O-N 3.46Å; N212-S214 PolarHBondContact O-N 3.36Å; N212-S214 VanDerWaalsContact O-N 3.1Å; N212-S214 PolarHBondContact O-OG 3.23Å; N212-I217 WeakPolarHBondContact O-CD1 3.22Å; N212-V398 CarbonylContact C-O 3.56Å; N212-V398 WeakPolarHBondContact CA-O 3.37Å; N212-V398 PolarHBondContact N-O 3.2Å
213	W	95.1	Very high	92.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.229	C	C	.	.			trans	-61.5	108.9	176.6	-177.7	55.8	0	0	0	111.4	H218 F222 P223 N227 W229 A289 W290 M318 G319 Y361 V398	W213-H218 AromaticContact CD1-CG 3.85Å; W213-H218 AromaticContact CD1-ND1 3.74Å; W213-F222 AromaticContact CD2-CE2 3.92Å; W213-F222 HydrophobicContact CD2-CE2 3.92Å; W213-F222 AromaticContact CE2-CE2 3.62Å; W213-F222 HydrophobicContact CG-CE2 4.19Å; W213-F222 HydrophobicContact CZ2-CD2 4.32Å; W213-F222 HydrophobicContact CZ2-CE2 4.02Å; W213-F222 AromaticContact NE1-CD2 3.87Å; W213-F222 AromaticContact NE1-CE2 3.73Å; W213-P223 HydrophobicContact CH2-CG 3.58Å; W213-P223 HydrophobicContact CZ2-CG 3.6Å; W213-N227 HydrophobicContact CH2-CB 3.81Å; W213-N227 HydrophobicContact CZ3-CB 3.76Å; W213-W229 HydrophobicContact CB-CH2 4.47Å; W213-W229 HydrophobicContact CB-CZ2 3.71Å; W213-A289 HydrophobicContact CE3-CB 3.49Å; W213-A289 VanDerWaalsContact CE3-CB 3.49Å; W213-A289 HydrophobicContact CZ3-CB 3.77Å; W213-W290 WeakPolarHBondContact O-CB 3.35Å; W213-M318 HydrophobicContact CB-CE 4Å; W213-M318 HydrophobicContact CD2-CE 3.82Å; W213-M318 HydrophobicContact CD2-CG 4.01Å; W213-M318 HydrophobicContact CD2-SD 3.96Å; W213-M318 HydrophobicContact CE3-CE 4.32Å; W213-M318 HydrophobicContact CE3-CG 3.85Å; W213-M318 HydrophobicContact CE3-SD 4.41Å; W213-M318 HydrophobicContact CG-CE 3.65Å; W213-M318 HydrophobicContact CG-SD 4.27Å; W213-M318 HydrophobicContact CH2-CG 3.82Å; W213-M318 HydrophobicContact CZ2-CG 3.96Å; W213-M318 HydrophobicContact CZ2-SD 4.08Å; W213-M318 HydrophobicContact CZ3-CG 3.75Å; W213-G319 VanDerWaalsContact CH2-O 3.25Å; W213-G319 WeakPolarHBondContact CH2-O 3.41Å; W213-G319 VanDerWaalsContact CZ3-O 3.31Å; W213-G319 WeakPolarHBondContact CZ3-O 3.47Å; W213-Y361 AromaticContact CE2-CE1 3.86Å; W213-Y361 AromaticContact CE2-CZ 3.94Å; W213-Y361 HydrophobicContact CH2-CE1 4.48Å; W213-Y361 AromaticContact CZ2-CD1 3.83Å; W213-Y361 HydrophobicContact CZ2-CD1 3.83Å; W213-Y361 AromaticContact CZ2-CE1 3.46Å; W213-Y361 HydrophobicContact CZ2-CE1 3.46Å; W213-Y361 VanDerWaalsContact CZ2-CE1 3.46Å; W213-Y361 HydrophobicContact CZ2-CE2 4.39Å; W213-Y361 HydrophobicContact CZ2-CG 4.46Å; W213-Y361 AromaticContact CZ2-CZ 3.77Å; W213-Y361 AromaticContact NE1-CE1 3.78Å; W213-Y361 AromaticContact NE1-CZ 3.5Å; W213-Y361 PolarHBondContact NE1-OH 2.64Å; W213-V398 HydrophobicContact CB-CB 4.2Å; W213-V398 PolarHBondContact N-O 3.23Å
214	S	92.3	Very high	92.5	Very high	10 Å²	10	55.7 Å²	55.7	7%	0.07	26%	0.26	C	S	.	.			trans	-152.7	154.1	-175.8	61.6	0	0	0	0	110.3	N212 K216 I217 H218 F222	N212-S214 PolarHBondContact O-N 3.36Å; N212-S214 VanDerWaalsContact O-N 3.1Å; N212-S214 PolarHBondContact O-OG 3.23Å; S214-K216 PolarHBondContact O-N 2.64Å; S214-I217 PolarHBondContact O-N 3.11Å; S214-H218 PolarHBondContact O-N 2.67Å; S214-F222 VanDerWaalsContact C-CE2 3.43Å
215	E	92.3	Very high	91.9	Very high	77 Å²	77	63.4 Å²	63.4	36%	0.36	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-30.4	178.4	-168.3	-171.9	138.6	0	0	113.4	P219 F222 R224	E215-P219 WeakPolarHBondContact O-CA 3.47Å; E215-P219 WeakPolarHBondContact O-CB 3.36Å; E215-F222 HydrophobicContact CB-CB 4.37Å; E215-F222 HydrophobicContact CB-CD1 3.57Å; E215-F222 HydrophobicContact CB-CE1 3.97Å; E215-F222 HydrophobicContact CB-CG 3.89Å; E215-F222 HydrophobicContact CG-CB 4.23Å; E215-F222 HydrophobicContact CG-CD1 4.07Å; E215-F222 HydrophobicContact CG-CG 4.28Å; E215-R224 IonicContact OE1-CZ 3.18Å; E215-R224 IonicContact OE1-NH1 3.38Å; E215-R224 PolarHBondContact OE1-NH1 3.22Å; E215-R224 IonicContact OE1-NH2 2.84Å; E215-R224 PolarHBondContact OE1-NH2 3Å; E215-R224 IonicContact OE2-CZ 3.16Å; E215-R224 IonicContact OE2-NE 2.83Å; E215-R224 IonicContact OE2-NH1 3.54Å; E215-R224 PolarHBondContact OE2-NH1 3.42Å; E215-R224 IonicContact OE2-NH2 2.67Å
216	K	89.8	Confident	91.4	Very high	195 Å²	195	65.9 Å²	65.9	85%	0.848	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-32.7	179.1	-174.3	-178.4	175.9	-171.3	0	113.2	S214	S214-K216 PolarHBondContact O-N 2.64Å
217	I	91.1	Very high	91.1	Very high	75 Å²	75	61.9 Å²	61.9	39%	0.385	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-35.6	-174.1	-61	173.7	0	0	0	110.4	N212 S214 T396	N212-I217 WeakPolarHBondContact O-CD1 3.22Å; S214-I217 PolarHBondContact O-N 3.11Å; I217-T396 HydrophobicContact CG2-CG2 3.77Å
218	H	93.7	Very high	90.9	Very high	14 Å²	14	63 Å²	63	7%	0.065	29%	0.294	C	S	.	.	S	Bend	trans	-126.5	74.6	179.1	-56.7	93.1	0	0	0	109.3	W213 S214 F222 F387 T396	W213-H218 AromaticContact CD1-CG 3.85Å; W213-H218 AromaticContact CD1-ND1 3.74Å; S214-H218 PolarHBondContact O-N 2.67Å; H218-F222 WeakPolarHBondContact O-CD2 3.48Å; H218-F387 AromaticContact CD2-CE1 3.78Å; H218-T396 PolarHBondContact NE2-O 2.02Å
219	P	91.3	Very high	90.9	Very high	94 Å²	94	62.4 Å²	62.4	61%	0.61	29%	0.29	S	S	*	.			trans	-75.7	-24.2	-171.1	28.5	-35.8	0	0	0	114.7	E215 D221	E215-P219 WeakPolarHBondContact O-CA 3.47Å; E215-P219 WeakPolarHBondContact O-CB 3.36Å; P219-D221 PolarHBondContact O-N 2.81Å
220	K	91.2	Very high	90.7	Very high	72 Å²	72	62.6 Å²	62.6	31%	0.313	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	118.7	-175.7	-173.2	178.1	177.8	-167.2	0	109.8	F222 P383 S385 P386 Y388	K220-F222 PolarHBondContact O-N 2.85Å; K220-F222 VanDerWaalsContact O-N 3.08Å; K220-P383 PolarHBondContact NZ-O 2.69Å; K220-S385 VanDerWaalsContact CE-O 3.32Å; K220-S385 WeakPolarHBondContact CE-O 3.32Å; K220-S385 PolarHBondContact NZ-O 2.92Å; K220-P386 WeakPolarHBondContact O-CB 3.48Å; K220-Y388 PolarHBondContact NZ-O 3.5Å
221	D	90.6	Very high	90.6	Very high	105 Å²	105	60.1 Å²	60.1	56%	0.561	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	26.9	178.1	-54.2	-47.9	0	0	0	115.2	P219 Y361	P219-D221 PolarHBondContact O-N 2.81Å; D221-Y361 VanDerWaalsContact O-CD2 3.27Å; D221-Y361 WeakPolarHBondContact O-CD2 3.03Å
222	F	93.2	Very high	90.8	Very high	22 Å²	22	59.8 Å²	59.8	10%	0.096	28%	0.282	C	S	.	.			trans	-60.7	125.5	-172.9	-172.6	-93.4	0	0	0	113.4	W213 S214 E215 H218 K220 R224 N227	W213-F222 AromaticContact CD2-CE2 3.92Å; W213-F222 HydrophobicContact CD2-CE2 3.92Å; W213-F222 AromaticContact CE2-CE2 3.62Å; W213-F222 HydrophobicContact CG-CE2 4.19Å; W213-F222 HydrophobicContact CZ2-CD2 4.32Å; W213-F222 HydrophobicContact CZ2-CE2 4.02Å; W213-F222 AromaticContact NE1-CD2 3.87Å; W213-F222 AromaticContact NE1-CE2 3.73Å; S214-F222 VanDerWaalsContact C-CE2 3.43Å; E215-F222 HydrophobicContact CB-CB 4.37Å; E215-F222 HydrophobicContact CB-CD1 3.57Å; E215-F222 HydrophobicContact CB-CE1 3.97Å; E215-F222 HydrophobicContact CB-CG 3.89Å; E215-F222 HydrophobicContact CG-CB 4.23Å; E215-F222 HydrophobicContact CG-CD1 4.07Å; E215-F222 HydrophobicContact CG-CG 4.28Å; H218-F222 WeakPolarHBondContact O-CD2 3.48Å; K220-F222 PolarHBondContact O-N 2.85Å; K220-F222 VanDerWaalsContact O-N 3.08Å; F222-R224 HydrophobicContact CD1-CG 4.48Å; F222-R224 PolarHBondContact O-N 3.33Å; F222-N227 HydrophobicContact CE1-CB 4.04Å; F222-N227 HydrophobicContact CZ-CB 3.74Å
223	P	90.2	Very high	91	Very high	5 Å²	5	57.5 Å²	57.5	3%	0.032	27%	0.269	C	S	.	.			trans	-76.9	78.8	-173.8	27	-30.9	0	0	0	112.6	W213 R225 T226 N227 P320 Y361 E362	W213-P223 HydrophobicContact CH2-CG 3.58Å; W213-P223 HydrophobicContact CZ2-CG 3.6Å; P223-R225 PolarHBondContact O-N 2.97Å; P223-T226 WeakPolarHBondContact CB-OG1 3.48Å; P223-T226 PolarHBondContact O-N 3.23Å; P223-N227 HydrophobicContact CG-CB 4.14Å; P223-N227 VanDerWaalsContact O-CB 3.28Å; P223-N227 WeakPolarHBondContact O-CB 3.35Å; P223-N227 PolarHBondContact O-N 3.38Å; P223-N227 PolarHBondContact O-ND2 3.22Å; P223-P320 HydrophobicContact CB-CG 3.8Å; P223-P320 HydrophobicContact CG-CG 4.06Å; P223-Y361 HydrophobicContact CG-CD2 4.29Å; P223-Y361 HydrophobicContact CG-CG 4.17Å; P223-E362 HydrophobicContact CB-CG 4.49Å
224	R	86.3	Confident	91	Very high	174 Å²	174	57.5 Å²	57.5	66%	0.657	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-31.8	-171.3	-65.7	179.9	-177.4	-96.2	-2.8	116.2	E215 F222 N227	E215-R224 IonicContact OE1-CZ 3.18Å; E215-R224 IonicContact OE1-NH1 3.38Å; E215-R224 PolarHBondContact OE1-NH1 3.22Å; E215-R224 IonicContact OE1-NH2 2.84Å; E215-R224 PolarHBondContact OE1-NH2 3Å; E215-R224 IonicContact OE2-CZ 3.16Å; E215-R224 IonicContact OE2-NE 2.83Å; E215-R224 IonicContact OE2-NH1 3.54Å; E215-R224 PolarHBondContact OE2-NH1 3.42Å; E215-R224 IonicContact OE2-NH2 2.67Å; F222-R224 HydrophobicContact CD1-CG 4.48Å; F222-R224 PolarHBondContact O-N 3.33Å; R224-N227 PolarHBondContact O-ND2 2.79Å
225	R	80.2	Confident	91.2	Very high	243 Å²	243	57 Å²	57	92%	0.917	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-25.8	-175.9	-66.6	-175.9	178	-172	-0.3	114	P223	P223-R225 PolarHBondContact O-N 2.97Å
226	T	84.6	Confident	91.4	Very high	51 Å²	51	53.4 Å²	53.4	31%	0.313	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-11.4	-164.4	35.4	0	0	0	0	112.2	P223 H228 P320 E362	P223-T226 WeakPolarHBondContact CB-OG1 3.48Å; P223-T226 PolarHBondContact O-N 3.23Å; T226-H228 PolarHBondContact O-N 2.81Å; T226-H228 PolarHBondContact O-ND1 2.75Å; T226-P320 WeakPolarHBondContact O-CD 3.22Å; T226-E362 PolarHBondContact OG1-OE1 3.06Å
227	N	89.3	Confident	91.7	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.07	21%	0.209	C	C	.	.			trans	-54.4	123.4	177.9	67.5	97.7	0	0	0	112.9	W213 F222 P223 R224 P288 A289 G319	W213-N227 HydrophobicContact CH2-CB 3.81Å; W213-N227 HydrophobicContact CZ3-CB 3.76Å; F222-N227 HydrophobicContact CE1-CB 4.04Å; F222-N227 HydrophobicContact CZ-CB 3.74Å; P223-N227 HydrophobicContact CG-CB 4.14Å; P223-N227 VanDerWaalsContact O-CB 3.28Å; P223-N227 WeakPolarHBondContact O-CB 3.35Å; P223-N227 PolarHBondContact O-N 3.38Å; P223-N227 PolarHBondContact O-ND2 3.22Å; R224-N227 PolarHBondContact O-ND2 2.79Å; N227-P288 CarbonylContact O-C 3.59Å; N227-P288 WeakPolarHBondContact O-CA 3.33Å; N227-P288 WeakPolarHBondContact OD1-CB 3.44Å; N227-A289 HydrophobicContact CB-CB 4.05Å; N227-A289 PolarHBondContact O-N 3.13Å; N227-A289 PolarHBondContact OD1-N 2.93Å; N227-G319 CarbonylContact C-O 3.53Å; N227-G319 VanDerWaalsContact CA-O 3.23Å; N227-G319 WeakPolarHBondContact CA-O 3.36Å
228	H	89.7	Confident	91.7	Very high	25 Å²	25	40.9 Å²	40.9	12%	0.116	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	164.5	175.2	64.2	-81.7	0	0	0	111.7	T226 Q286 W287 M317 G319	T226-H228 PolarHBondContact O-N 2.81Å; T226-H228 PolarHBondContact O-ND1 2.75Å; H228-Q286 CarbonylContact C-O 3.54Å; H228-Q286 WeakPolarHBondContact CA-O 3.41Å; H228-Q286 VanDerWaalsContact CB-O 3.28Å; H228-Q286 WeakPolarHBondContact CB-O 3.47Å; H228-W287 HydrophobicContact CB-CD2 3.45Å; H228-W287 VanDerWaalsContact CB-CD2 3.45Å; H228-W287 VanDerWaalsContact CB-CE2 3.43Å; H228-W287 HydrophobicContact CB-CE3 3.82Å; H228-W287 HydrophobicContact CB-CG 3.86Å; H228-W287 HydrophobicContact CB-CH2 4.18Å; H228-W287 HydrophobicContact CB-CZ2 3.84Å; H228-W287 HydrophobicContact CB-CZ3 4.16Å; H228-W287 AromaticContact CD2-CE2 3.6Å; H228-W287 AromaticContact CD2-CZ2 3.33Å; H228-W287 WeakPolarHBondContact CD2-CZ2 3.4Å; H228-W287 AromaticContact CD2-NE1 3.83Å; H228-W287 AromaticContact CE1-CH2 3.5Å; H228-W287 VanDerWaalsContact CE1-CH2 3.5Å; H228-W287 WeakPolarHBondContact CE1-CH2 3.03Å; H228-W287 AromaticContact CE1-CZ2 3.56Å; H228-W287 AromaticContact CG-CD2 3.94Å; H228-W287 AromaticContact CG-CE2 3.45Å; H228-W287 VanDerWaalsContact CG-CE2 3.45Å; H228-W287 AromaticContact CG-CH2 3.63Å; H228-W287 AromaticContact CG-CZ2 3.3Å; H228-W287 AromaticContact CG-NE1 3.95Å; H228-W287 AromaticContact ND1-CH2 3.3Å; H228-W287 VanDerWaalsContact ND1-CH2 3.3Å; H228-W287 WeakPolarHBondContact ND1-CH2 3.21Å; H228-W287 AromaticContact ND1-CZ2 3.46Å; H228-W287 WeakPolarHBondContact ND1-CZ2 3.16Å; H228-W287 AromaticContact ND1-CZ3 3.76Å; H228-W287 AromaticContact NE2-CH2 3.94Å; H228-W287 AromaticContact NE2-CZ2 3.49Å; H228-W287 WeakPolarHBondContact NE2-CZ2 3.29Å; H228-M317 VanDerWaalsContact NE2-CE 3.27Å; H228-M317 WeakPolarHBondContact NE2-CE 3.29Å; H228-G319 VanDerWaalsContact CE1-CA 3.49Å; H228-G319 WeakPolarHBondContact CE1-CA 3.45Å; H228-G319 PolarHBondContact N-O 2.69Å; H228-G319 PolarHBondContact ND1-O 3.47Å; H228-G319 PolarHBondContact O-N 2.79Å
229	W	94.4	Very high	91.5	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	138.2	157.6	-62.1	99.8	0	0	0	108.5	F209 W213 A285 Q286 T316 M317 M318 V326 V398 A399	F209-W229 AromaticContact CE1-CD1 4Å; F209-W229 AromaticContact CE1-CD2 3.9Å; F209-W229 HydrophobicContact CE1-CD2 3.9Å; F209-W229 AromaticContact CE1-CE2 3.98Å; F209-W229 HydrophobicContact CE1-CE3 4.47Å; F209-W229 AromaticContact CE1-CG 3.92Å; F209-W229 HydrophobicContact CE1-CG 3.92Å; F209-W229 AromaticContact CZ-CD2 3.82Å; F209-W229 HydrophobicContact CZ-CD2 3.82Å; F209-W229 AromaticContact CZ-CE2 3.91Å; F209-W229 AromaticContact CZ-CE3 3.97Å; F209-W229 HydrophobicContact CZ-CE3 3.97Å; F209-W229 HydrophobicContact CZ-CG 4.31Å; F209-W229 HydrophobicContact CZ-CH2 4.26Å; F209-W229 HydrophobicContact CZ-CZ2 4.13Å; F209-W229 HydrophobicContact CZ-CZ3 4.21Å; W213-W229 HydrophobicContact CB-CH2 4.47Å; W213-W229 HydrophobicContact CB-CZ2 3.71Å; W229-A285 WeakPolarHBondContact O-CA 3.22Å; W229-A285 WeakPolarHBondContact O-CB 3.43Å; W229-Q286 HydrophobicContact CB-CB 4.11Å; W229-Q286 PolarHBondContact N-O 3.1Å; W229-Q286 PolarHBondContact O-N 2.73Å; W229-T316 HydrophobicContact CE3-CG2 4.05Å; W229-M317 WeakPolarHBondContact CA-O 3.22Å; W229-M318 HydrophobicContact CE3-CB 4.32Å; W229-M318 HydrophobicContact CH2-CB 4.35Å; W229-M318 HydrophobicContact CH2-CE 3.46Å; W229-M318 VanDerWaalsContact CH2-CE 3.46Å; W229-M318 HydrophobicContact CZ2-CE 4.09Å; W229-M318 HydrophobicContact CZ3-CB 3.79Å; W229-M318 HydrophobicContact CZ3-CE 4.07Å; W229-M318 HydrophobicContact CZ3-CG 4.48Å; W229-V326 HydrophobicContact CE3-CG2 4.09Å; W229-V326 HydrophobicContact CH2-CG1 3.89Å; W229-V326 HydrophobicContact CH2-CG2 3.89Å; W229-V326 HydrophobicContact CZ3-CB 4.26Å; W229-V326 HydrophobicContact CZ3-CG1 3.84Å; W229-V326 HydrophobicContact CZ3-CG2 3.38Å; W229-V398 HydrophobicContact CH2-CB 4.26Å; W229-V398 HydrophobicContact CH2-CG2 4.13Å; W229-V398 WeakPolarHBondContact CZ2-O 3.44Å; W229-A399 HydrophobicContact CH2-CB 4.3Å; W229-A399 HydrophobicContact CZ2-CB 4.24Å
230	S	91.4	Very high	91.4	Very high	5 Å²	5	46.6 Å²	46.6	4%	0.035	21%	0.213	C	C	.	.			trans	-64.7	177.7	172.8	72.2	0	0	0	0	112	I232 G261 A285 T316 M317	S230-I232 PolarHBondContact O-N 2.73Å; S230-G261 VanDerWaalsContact CB-CA 3.5Å; S230-A285 WeakPolarHBondContact O-CA 3.34Å; S230-T316 PolarHBondContact N-OG1 3.41Å; S230-T316 PolarHBondContact O-OG1 3.17Å; S230-T316 VanDerWaalsContact O-OG1 3.12Å; S230-T316 PolarHBondContact OG-OG1 3.16Å; S230-M317 PolarHBondContact N-O 3.33Å; S230-M317 VanDerWaalsContact N-O 3.11Å; S230-M317 WeakPolarHBondContact OG-CB 3.47Å; S230-M317 PolarHBondContact OG-N 3.38Å
231	A	91.3	Very high	91.3	Very high	22 Å²	22	43.9 Å²	43.9	18%	0.182	20%	0.201	C	C	.	.			trans	-64	128.7	169.5	0	0	0	0	0	109.4	I233 P263 M283	A231-I233 PolarHBondContact O-N 2.73Å; A231-P263 HydrophobicContact CB-CB 4.45Å; A231-P263 HydrophobicContact CB-CG 3.9Å; A231-M283 WeakPolarHBondContact CB-O 3.23Å
232	I	96.1	Very high	91.4	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	20%	0.195	C	C	.	.			trans	-71.3	128.8	174.1	-67.8	156.4	0	0	0	108.2	F209 S230 K282 M283 P299 F314 T316	F209-I232 HydrophobicContact CB-CD1 3.59Å; F209-I232 HydrophobicContact CD1-CD1 3.87Å; F209-I232 HydrophobicContact CD2-CD1 4.16Å; F209-I232 HydrophobicContact CG-CD1 3.62Å; S230-I232 PolarHBondContact O-N 2.73Å; I232-K282 WeakPolarHBondContact O-CA 3.04Å; I232-M283 HydrophobicContact CB-CB 3.96Å; I232-M283 HydrophobicContact CB-CG 4.04Å; I232-M283 HydrophobicContact CB-SD 4.37Å; I232-M283 HydrophobicContact CD1-CB 4.14Å; I232-M283 HydrophobicContact CD1-CE 4.42Å; I232-M283 HydrophobicContact CD1-CG 4.17Å; I232-M283 HydrophobicContact CD1-SD 3.47Å; I232-M283 WeakPolarHBondContact CD1-SD 3.49Å; I232-M283 HydrophobicContact CG2-CE 4.48Å; I232-M283 HydrophobicContact CG2-CG 4.28Å; I232-M283 HydrophobicContact CG2-SD 4.47Å; I232-M283 PolarHBondContact N-O 2.64Å; I232-M283 PolarHBondContact O-N 2.96Å; I232-P299 HydrophobicContact CD1-CG 4.43Å; I232-F314 HydrophobicContact CG2-CB 4.2Å; I232-F314 HydrophobicContact CG2-CD2 3.68Å; I232-F314 HydrophobicContact CG2-CE2 4.44Å; I232-F314 HydrophobicContact CG2-CG 4.22Å; I232-T316 HydrophobicContact CG1-CG2 3.78Å
233	I	96.8	Very high	91.3	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.8	175.7	-176.3	60.5	0	0	0	109.4	A231 V257 P263 M266 E267 I270 V280 I281 K282 F314 L315	A231-I233 PolarHBondContact O-N 2.73Å; I233-V257 HydrophobicContact CG2-CG2 3.78Å; I233-P263 HydrophobicContact CB-CB 3.85Å; I233-P263 HydrophobicContact CG1-CB 4.26Å; I233-P263 HydrophobicContact CG2-CB 4.04Å; I233-M266 HydrophobicContact CG1-CB 4.1Å; I233-M266 HydrophobicContact CG1-CG 4.05Å; I233-M266 HydrophobicContact CG2-CB 4.07Å; I233-M266 HydrophobicContact CG2-CG 3.93Å; I233-E267 HydrophobicContact CD1-CB 4.1Å; I233-I270 HydrophobicContact CD1-CD1 3.96Å; I233-I270 HydrophobicContact CG1-CD1 3.77Å; I233-V280 HydrophobicContact CD1-CG1 3.87Å; I233-I281 CarbonylContact C-O 3.54Å; I233-I281 WeakPolarHBondContact CA-O 3.13Å; I233-K282 HydrophobicContact CD1-CG 4Å; I233-F314 CarbonylContact O-C 3.56Å; I233-F314 VanDerWaalsContact O-CA 3.3Å; I233-F314 WeakPolarHBondContact O-CA 3.29Å; I233-F314 WeakPolarHBondContact O-CB 3.42Å; I233-L315 HydrophobicContact CG2-CD2 4.06Å; I233-L315 HydrophobicContact CG2-CG 4.32Å; I233-L315 PolarHBondContact N-O 3.45Å; I233-L315 VanDerWaalsContact N-O 3.14Å; I233-L315 PolarHBondContact O-N 3.48Å
234	G	96.3	Very high	91.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	-171.9	-178.5	0	0	0	0	0	112.5	I281 S313	G234-I281 PolarHBondContact N-O 2.98Å; G234-I281 PolarHBondContact O-N 2.86Å; G234-S313 CarbonylContact C-O 3.51Å; G234-S313 WeakPolarHBondContact CA-O 3.45Å
235	A	96.3	Very high	91.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	152.4	179.2	0	0	0	0	0	111.9	H237 I270 V277 T279 M312 S313	A235-H237 PolarHBondContact O-CD2 2.67Å; A235-I270 HydrophobicContact CB-CG2 3.84Å; A235-V277 HydrophobicContact CB-CG1 4.03Å; A235-V277 HydrophobicContact CB-CG2 4.37Å; A235-T279 CarbonylContact C-O 3.59Å; A235-T279 WeakPolarHBondContact CA-O 3.2Å; A235-M312 WeakPolarHBondContact O-CA 3.49Å; A235-S313 PolarHBondContact N-O 3.19Å; A235-S313 PolarHBondContact O-N 3.07Å
236	S	96.4	Very high	92	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.1	149.2	51.3	0	0	0	0	109.4	V277 L278 T279 S304 I311	S236-V277 WeakPolarHBondContact O-CA 3.08Å; S236-L278 PolarHBondContact O-N 2.71Å; S236-T279 PolarHBondContact N-O 2.95Å; S236-T279 WeakPolarHBondContact OG-CB 3.04Å; S236-T279 PolarHBondContact OG-N 3.27Å; S236-T279 VanDerWaalsContact OG-N 3.11Å; S236-S304 VanDerWaalsContact CB-O 3.27Å; S236-S304 WeakPolarHBondContact CB-O 3.45Å; S236-S304 PolarHBondContact OG-O 3Å; S236-I311 CarbonylContact C-O 3.13Å; S236-I311 VanDerWaalsContact CA-O 3.26Å; S236-I311 WeakPolarHBondContact CA-O 3.47Å
237	H	94.8	Very high	91.9	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.009	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	172.7	-167.9	62.5	87.9	0	0	0	112.7	A235 Y241 E276 V277 R309 I311 S313	A235-H237 PolarHBondContact O-CD2 2.67Å; H237-Y241 HydrophobicContact CB-CD1 3.89Å; H237-Y241 PolarHBondContact CE1-O 2.92Å; H237-Y241 PolarHBondContact ND1-O 3.08Å; H237-E276 CarbonylContact C-O 3.59Å; H237-E276 WeakPolarHBondContact CA-O 3.36Å; H237-E276 WeakPolarHBondContact CB-O 3.32Å; H237-V277 HydrophobicContact CB-CG2 4.13Å; H237-R309 CarbonylContact O-C 3.54Å; H237-R309 VanDerWaalsContact O-CA 3.24Å; H237-R309 WeakPolarHBondContact O-CA 3.08Å; H237-I311 PolarHBondContact N-O 3.33Å; H237-I311 WeakPolarHBondContact O-CB 3.31Å; H237-I311 PolarHBondContact O-N 3.11Å; H237-S313 WeakPolarHBondContact NE2-CB 3.25Å; H237-S313 PolarHBondContact NE2-OG 2.87Å
238	S	92.4	Very high	91.6	Very high	5 Å²	5	31.4 Å²	31.4	4%	0.035	17%	0.17	C	C	.	.			trans	-84.8	169.5	172.8	84.3	0	0	0	0	111.8	N240 Y241 E276 S308	S238-N240 PolarHBondContact O-N 2.74Å; S238-N240 VanDerWaalsContact O-N 3.15Å; S238-N240 WeakPolarHBondContact OG-CB 3.38Å; S238-N240 PolarHBondContact OG-N 2.87Å; S238-N240 VanDerWaalsContact OG-N 3.07Å; S238-Y241 PolarHBondContact O-N 2.87Å; S238-E276 VanDerWaalsContact CB-OE2 3.28Å; S238-E276 WeakPolarHBondContact CB-OE2 3.31Å; S238-E276 PolarHBondContact N-O 3.26Å; S238-E276 PolarHBondContact OG-OE2 3.49Å; S238-S308 WeakPolarHBondContact CA-O 3.31Å; S238-S308 WeakPolarHBondContact CB-O 3.11Å
239	K	88.6	Confident	91.7	Very high	115 Å²	115	35.6 Å²	35.6	50%	0.5	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-13.3	170.7	68.3	-164.1	179.2	-169.9	0	115.1	D196 Y241 I311	D196-K239 IonicContact OD1-NZ 3.18Å; D196-K239 PolarHBondContact OD1-NZ 2.83Å; K239-Y241 VanDerWaalsContact C-N 3.34Å; K239-I311 HydrophobicContact CB-CD1 3.92Å
240	N	89.1	Confident	91.6	Very high	114 Å²	114	36.6 Å²	36.6	61%	0.61	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.7	179.7	-60.4	-18.6	0	0	0	112.5	S238 E276	S238-N240 PolarHBondContact O-N 2.74Å; S238-N240 VanDerWaalsContact O-N 3.15Å; S238-N240 WeakPolarHBondContact OG-CB 3.38Å; S238-N240 PolarHBondContact OG-N 2.87Å; S238-N240 VanDerWaalsContact OG-N 3.07Å; N240-E276 WeakPolarHBondContact CB-OE1 3.47Å; N240-E276 PolarHBondContact ND2-OE1 3.02Å; N240-E276 PolarHBondContact ND2-OE2 2.85Å
241	Y	90.4	Very high	91.8	Very high	15 Å²	15	38.3 Å²	38.3	6%	0.059	21%	0.213	C	C	.	.			trans	-110.5	127.8	175.2	-178.9	-143.6	0	0	0	110.4	H237 S238 K239 L243 I270 K273 V277	H237-Y241 HydrophobicContact CB-CD1 3.89Å; H237-Y241 PolarHBondContact CE1-O 2.92Å; H237-Y241 PolarHBondContact ND1-O 3.08Å; S238-Y241 PolarHBondContact O-N 2.87Å; K239-Y241 VanDerWaalsContact C-N 3.34Å; Y241-L243 HydrophobicContact CE1-CD1 3.95Å; Y241-L243 WeakPolarHBondContact OH-CD1 3.13Å; Y241-I270 HydrophobicContact CE1-CG1 4.22Å; Y241-I270 WeakPolarHBondContact OH-CG1 3.43Å; Y241-K273 HydrophobicContact CD1-CB 4.5Å; Y241-K273 HydrophobicContact CD1-CG 4.09Å; Y241-K273 HydrophobicContact CD2-CD 3.94Å; Y241-K273 HydrophobicContact CD2-CG 3.77Å; Y241-K273 HydrophobicContact CE1-CG 4.07Å; Y241-K273 HydrophobicContact CE2-CD 4.15Å; Y241-K273 HydrophobicContact CE2-CG 3.77Å; Y241-K273 HydrophobicContact CG-CD 4.4Å; Y241-K273 HydrophobicContact CG-CG 3.93Å; Y241-V277 HydrophobicContact CD1-CG2 3.76Å; Y241-V277 HydrophobicContact CE1-CG2 3.97Å
242	V	92.1	Very high	91.9	Very high	72 Å²	72	41.8 Å²	41.8	44%	0.436	23%	0.225	S	C	.	.			trans	-109.3	122.2	169.5	179.1	0	0	0	0	107.4	E245	V242-E245 HydrophobicContact CG1-CB 3.85Å; V242-E245 HydrophobicContact CG1-CG 3.91Å
243	L	91.8	Very high	91.8	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.031	22%	0.224	C	C	.	.	S	Bend	trans	-75.7	-48.9	179.2	-167.3	78.5	0	0	0	110.8	Y241 M266 I270 S313 L315	Y241-L243 HydrophobicContact CE1-CD1 3.95Å; Y241-L243 WeakPolarHBondContact OH-CD1 3.13Å; L243-M266 HydrophobicContact CD1-CE 3.26Å; L243-M266 HydrophobicContact CG-CE 3.6Å; L243-I270 HydrophobicContact CD1-CD1 3.88Å; L243-I270 HydrophobicContact CD1-CG1 3.72Å; L243-S313 VanDerWaalsContact CD2-CB 3.48Å; L243-L315 HydrophobicContact CD2-CD2 3.82Å; L243-L315 HydrophobicContact CG-CD2 4.3Å
244	W	95.1	Very high	91.7	Very high	10 Å²	10	41.6 Å²	41.6	4%	0.038	22%	0.224	C	C	.	.			trans	-162.8	156.9	170.5	63.4	-88.4	0	0	0	106.3	F246 V254 F314 L328 S329 W351 I374	W244-F246 HydrophobicContact CH2-CE2 4.38Å; W244-F246 HydrophobicContact CH2-CZ 4.17Å; W244-F246 HydrophobicContact CZ3-CD1 4.33Å; W244-F246 HydrophobicContact CZ3-CD2 4.48Å; W244-F246 HydrophobicContact CZ3-CE1 4.02Å; W244-F246 HydrophobicContact CZ3-CE2 4.18Å; W244-F246 AromaticContact CZ3-CZ 3.94Å; W244-F246 HydrophobicContact CZ3-CZ 3.94Å; W244-V254 HydrophobicContact CB-CG2 4.12Å; W244-F314 PolarHBondContact NE1-O 3.2Å; W244-L328 VanDerWaalsContact CZ2-C 3.43Å; W244-L328 PolarHBondContact NE1-O 3.18Å; W244-S329 WeakPolarHBondContact O-CB 3.17Å; W244-S329 PolarHBondContact O-OG 2.83Å; W244-W351 HydrophobicContact CD2-CH2 4.03Å; W244-W351 AromaticContact CD2-CZ2 3.59Å; W244-W351 HydrophobicContact CD2-CZ2 3.59Å; W244-W351 AromaticContact CE2-CZ2 3.6Å; W244-W351 HydrophobicContact CE3-CD2 4.48Å; W244-W351 AromaticContact CE3-CE2 3.98Å; W244-W351 HydrophobicContact CE3-CH2 4.27Å; W244-W351 AromaticContact CE3-CZ2 3.87Å; W244-W351 HydrophobicContact CE3-CZ2 3.87Å; W244-W351 HydrophobicContact CG-CH2 4.17Å; W244-W351 HydrophobicContact CG-CZ2 4.09Å; W244-W351 AromaticContact CH2-CD1 3.88Å; W244-W351 AromaticContact CH2-CE2 3.77Å; W244-W351 HydrophobicContact CH2-CZ2 4.17Å; W244-W351 AromaticContact CH2-NE1 3.3Å; W244-W351 VanDerWaalsContact CH2-NE1 3.3Å; W244-W351 AromaticContact CZ2-CE2 3.9Å; W244-W351 AromaticContact CZ2-CZ2 3.9Å; W244-W351 HydrophobicContact CZ2-CZ2 3.9Å; W244-W351 AromaticContact CZ2-NE1 3.55Å; W244-W351 HydrophobicContact CZ3-CD2 4.26Å; W244-W351 AromaticContact CZ3-CE2 3.81Å; W244-W351 HydrophobicContact CZ3-CG 4.44Å; W244-W351 HydrophobicContact CZ3-CZ2 4.15Å; W244-W351 AromaticContact CZ3-NE1 3.74Å; W244-I374 HydrophobicContact CB-CD1 4.03Å; W244-I374 HydrophobicContact CE3-CG2 4.15Å; W244-I374 HydrophobicContact CZ3-CG2 4.46Å
245	E	89.9	Confident	91.7	Very high	99 Å²	99	44.8 Å²	44.8	46%	0.463	24%	0.238	S	C	.	.			trans	-152.4	153.5	175.1	67	-176.6	160.5	0	0	111.1	V242 G247 G248	V242-E245 HydrophobicContact CG1-CB 3.85Å; V242-E245 HydrophobicContact CG1-CG 3.91Å; E245-G247 PolarHBondContact O-N 2.82Å; E245-G248 PolarHBondContact O-N 3.39Å; E245-G248 VanDerWaalsContact O-N 3.11Å
246	F	86.2	Confident	91.5	Very high	112 Å²	112	47.1 Å²	47.1	49%	0.491	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	131.1	175.2	-68.8	-59.6	0	0	0	111.3	W244 G248 W351 I374 P376	W244-F246 HydrophobicContact CH2-CE2 4.38Å; W244-F246 HydrophobicContact CH2-CZ 4.17Å; W244-F246 HydrophobicContact CZ3-CD1 4.33Å; W244-F246 HydrophobicContact CZ3-CD2 4.48Å; W244-F246 HydrophobicContact CZ3-CE1 4.02Å; W244-F246 HydrophobicContact CZ3-CE2 4.18Å; W244-F246 AromaticContact CZ3-CZ 3.94Å; W244-F246 HydrophobicContact CZ3-CZ 3.94Å; F246-G248 PolarHBondContact O-N 2.72Å; F246-W351 HydrophobicContact CE1-CB 3.8Å; F246-W351 HydrophobicContact CE1-CG 4.18Å; F246-W351 HydrophobicContact CZ-CB 4.45Å; F246-I374 HydrophobicContact CD1-CG2 4.15Å; F246-P376 HydrophobicContact CE1-CB 4.26Å; F246-P376 HydrophobicContact CE1-CG 4.5Å
247	G	82.1	Confident	91.4	Very high	39 Å²	39	47.1 Å²	47.1	40%	0.402	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-6.2	-174	0	0	0	0	0	114.8	E245 K373 I374	E245-G247 PolarHBondContact O-N 2.82Å; G247-K373 VanDerWaalsContact O-CD 3.23Å; G247-K373 WeakPolarHBondContact O-CD 3.33Å; G247-K373 WeakPolarHBondContact O-CE 3.38Å; G247-K373 PolarHBondContact O-NZ 3.23Å; G247-I374 PolarHBondContact N-O 2.72Å
248	G	82.5	Confident	91.4	Very high	12 Å²	12	47 Å²	47	12%	0.124	25%	0.249	C	C	.	.	S	Bend	trans	-79.5	173.5	167	0	0	0	0	0	112.3	E245 F246 K373 I374	E245-G248 PolarHBondContact O-N 3.39Å; E245-G248 VanDerWaalsContact O-N 3.11Å; F246-G248 PolarHBondContact O-N 2.72Å; G248-K373 CarbonylContact O-C 3.59Å; G248-K373 WeakPolarHBondContact O-CA 3.43Å; G248-I374 PolarHBondContact O-N 2.84Å
249	L	91.6	Very high	91.3	Very high	113 Å²	113	48.9 Å²	48.9	59%	0.592	26%	0.257	S	S	*	.	B	Isolated β-bridge	trans	-99.5	144.2	171.8	-63.6	175.2	0	0	0	109.6	D372 K373	L249-D372 WeakPolarHBondContact CD2-O 3.28Å; L249-K373 HydrophobicContact CD2-CG 4.15Å
250	A	93.6	Very high	91.2	Very high	23 Å²	23	49 Å²	49	19%	0.19	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-62.8	135.3	172.9	0	0	0	0	0	111.6	V254 A353 T355 I374	A250-V254 HydrophobicContact CB-CB 4.11Å; A250-V254 HydrophobicContact CB-CG1 3.8Å; A250-A353 HydrophobicContact CB-CB 4.46Å; A250-T355 HydrophobicContact CB-CG2 4.1Å; A250-I374 HydrophobicContact CB-CD1 4.38Å; A250-I374 HydrophobicContact CB-CG1 4.48Å
251	S	95.3	Very high	91.1	Very high	40 Å²	40	44.3 Å²	44.3	28%	0.28	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-73.3	168.6	165.7	77.6	0	0	0	0	110.8	G253 V254 K255 E269	S251-G253 PolarHBondContact O-N 3.36Å; S251-G253 PolarHBondContact OG-N 3.37Å; S251-V254 PolarHBondContact O-N 2.66Å; S251-V254 PolarHBondContact OG-N 2.04Å; S251-K255 WeakPolarHBondContact O-CB 3.11Å; S251-K255 PolarHBondContact O-N 3.28Å; S251-E269 VanDerWaalsContact CB-OE2 3.22Å; S251-E269 WeakPolarHBondContact CB-OE2 3.45Å; S251-E269 PolarHBondContact OG-OE2 3.21Å
252	E	93.2	Very high	91	Very high	96 Å²	96	45.2 Å²	45.2	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-35.5	173.9	-177.6	58.9	-151.2	0	0	111.1	Q256 K265	E252-Q256 WeakPolarHBondContact O-CG 3.24Å; E252-Q256 PolarHBondContact O-N 3.26Å; E252-Q256 PolarHBondContact OE1-NE2 2.79Å; E252-K265 HydrophobicContact CG-CG 4.21Å
253	G	92.9	Very high	91	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-48	169.3	0	0	0	0	0	113.6	S251 Q256 V257 E269	S251-G253 PolarHBondContact O-N 3.36Å; S251-G253 PolarHBondContact OG-N 3.37Å; G253-Q256 PolarHBondContact O-N 2.82Å; G253-V257 WeakPolarHBondContact O-CG2 3.19Å; G253-V257 PolarHBondContact O-N 2.84Å; G253-V257 VanDerWaalsContact O-N 3.16Å; G253-E269 PolarHBondContact N-OE1 2.68Å
254	V	96.3	Very high	90.9	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-63.1	-43.9	177.9	172.2	0	0	0	0	110.6	W244 A250 S251 Q256 V257 A258 M266 L315 W351	W244-V254 HydrophobicContact CB-CG2 4.12Å; A250-V254 HydrophobicContact CB-CB 4.11Å; A250-V254 HydrophobicContact CB-CG1 3.8Å; S251-V254 PolarHBondContact O-N 2.66Å; S251-V254 PolarHBondContact OG-N 2.04Å; V254-Q256 PolarHBondContact O-N 2.88Å; V254-V257 PolarHBondContact O-N 2.9Å; V254-A258 WeakPolarHBondContact O-CB 3.44Å; V254-A258 PolarHBondContact O-N 3.44Å; V254-M266 HydrophobicContact CG2-CE 3.97Å; V254-M266 HydrophobicContact CG2-SD 3.84Å; V254-M266 PolarHBondContact N-SD 2.98Å; V254-M266 VanDerWaalsContact N-SD 3.41Å; V254-L315 HydrophobicContact CB-CD1 4.37Å; V254-L315 HydrophobicContact CG1-CD1 4.01Å; V254-L315 HydrophobicContact CG2-CD1 4.25Å; V254-W351 HydrophobicContact CG1-CH2 4.08Å; V254-W351 HydrophobicContact CG1-CZ3 4.28Å
255	K	95.1	Very high	90.6	Very high	67 Å²	67	49 Å²	49	29%	0.291	27%	0.27	S	S	.	.	H	α-helix	trans	-57.7	-46.3	176	-178	-178.3	-178.9	-170.3	0	112.5	S251 V257 A258 E259 T355	S251-K255 WeakPolarHBondContact O-CB 3.11Å; S251-K255 PolarHBondContact O-N 3.28Å; K255-V257 VanDerWaalsContact C-N 3.29Å; K255-V257 PolarHBondContact O-N 2.76Å; K255-A258 WeakPolarHBondContact O-CB 3.41Å; K255-A258 PolarHBondContact O-N 2.93Å; K255-A258 VanDerWaalsContact O-N 3.11Å; K255-E259 WeakPolarHBondContact CE-OE1 3.43Å; K255-E259 WeakPolarHBondContact CE-OE2 3.45Å; K255-E259 HydrophobicContact CG-CG 4.34Å; K255-E259 IonicContact NZ-OE1 2.71Å; K255-E259 IonicContact NZ-OE2 3.15Å; K255-E259 PolarHBondContact O-N 3.01Å; K255-T355 HydrophobicContact CB-CG2 4.31Å; K255-T355 HydrophobicContact CD-CG2 4.22Å; K255-T355 HydrophobicContact CG-CG2 3.99Å
256	Q	91.6	Very high	90.8	Very high	49 Å²	49	44.3 Å²	44.3	23%	0.229	25%	0.248	C	C	.	.	H	α-helix	trans	-69.4	-25.4	179.1	-72.2	-173.6	29.1	0	0	113.6	E252 G253 V254 L260 G261 S262 K265	E252-Q256 WeakPolarHBondContact O-CG 3.24Å; E252-Q256 PolarHBondContact O-N 3.26Å; E252-Q256 PolarHBondContact OE1-NE2 2.79Å; G253-Q256 PolarHBondContact O-N 2.82Å; V254-Q256 PolarHBondContact O-N 2.88Å; Q256-L260 WeakPolarHBondContact O-CB 3.42Å; Q256-L260 PolarHBondContact O-N 3.11Å; Q256-G261 PolarHBondContact O-N 2.82Å; Q256-S262 CarbonylContact C-O 3.6Å; Q256-S262 PolarHBondContact O-N 2.85Å; Q256-K265 HydrophobicContact CB-CB 4.36Å; Q256-K265 HydrophobicContact CG-CB 4.45Å; Q256-K265 VanDerWaalsContact OE1-CB 3.27Å
257	V	94.6	Very high	91.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-70.1	-48.7	166.1	179	0	0	0	0	109.6	I233 G253 V254 K255 G261 M266 L315 M317	I233-V257 HydrophobicContact CG2-CG2 3.78Å; G253-V257 WeakPolarHBondContact O-CG2 3.19Å; G253-V257 PolarHBondContact O-N 2.84Å; G253-V257 VanDerWaalsContact O-N 3.16Å; V254-V257 PolarHBondContact O-N 2.9Å; K255-V257 VanDerWaalsContact C-N 3.29Å; K255-V257 PolarHBondContact O-N 2.76Å; V257-G261 WeakPolarHBondContact O-CA 3.34Å; V257-G261 PolarHBondContact O-N 3.05Å; V257-M266 HydrophobicContact CG2-CB 4Å; V257-M266 HydrophobicContact CG2-CG 4.45Å; V257-L315 HydrophobicContact CB-CD1 3.87Å; V257-L315 HydrophobicContact CB-CG 4.47Å; V257-L315 HydrophobicContact CG1-CD1 3.84Å; V257-L315 HydrophobicContact CG1-CG 4.09Å; V257-L315 HydrophobicContact CG2-CD1 4.29Å; V257-M317 HydrophobicContact CG1-CB 4.4Å; V257-M317 VanDerWaalsContact O-CB 3.3Å; V257-M317 WeakPolarHBondContact O-CB 3.11Å; V257-M317 VanDerWaalsContact O-SD 3.37Å
258	A	94.8	Very high	91.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59	-47.8	-176.3	0	0	0	0	0	114.6	V254 K255 M317 D323 N325 A353	V254-A258 WeakPolarHBondContact O-CB 3.44Å; V254-A258 PolarHBondContact O-N 3.44Å; K255-A258 WeakPolarHBondContact O-CB 3.41Å; K255-A258 PolarHBondContact O-N 2.93Å; K255-A258 VanDerWaalsContact O-N 3.11Å; A258-M317 VanDerWaalsContact O-CG 3.28Å; A258-M317 WeakPolarHBondContact O-CG 3.49Å; A258-D323 HydrophobicContact CB-CB 4Å; A258-D323 WeakPolarHBondContact O-CA 3.49Å; A258-N325 WeakPolarHBondContact CA-ND2 3.4Å; A258-N325 WeakPolarHBondContact CB-ND2 3.27Å; A258-A353 HydrophobicContact CB-CB 3.75Å
259	E	90.6	Very high	92.2	Very high	44 Å²	44	43.5 Å²	43.5	21%	0.206	23%	0.232	C	C	.	.	H	α-helix	trans	-93.2	-29	-172.6	-65.5	175.3	-176.6	0	0	113.1	K255 D323 T355	K255-E259 WeakPolarHBondContact CE-OE1 3.43Å; K255-E259 WeakPolarHBondContact CE-OE2 3.45Å; K255-E259 HydrophobicContact CG-CG 4.34Å; K255-E259 IonicContact NZ-OE1 2.71Å; K255-E259 IonicContact NZ-OE2 3.15Å; K255-E259 PolarHBondContact O-N 3.01Å; E259-D323 HydrophobicContact CG-CB 4.42Å; E259-T355 WeakPolarHBondContact OE1-CB 3.28Å; E259-T355 PolarHBondContact OE1-OG1 3.2Å
260	L	86.4	Confident	92.2	Very high	118 Å²	118	38.1 Å²	38.1	62%	0.618	20%	0.204	S	C	*	.	H	α-helix	trans	-123.5	-6	-169.2	-53.4	175.7	0	0	0	113.8	Q256 S262	Q256-L260 WeakPolarHBondContact O-CB 3.42Å; Q256-L260 PolarHBondContact O-N 3.11Å; L260-S262 PolarHBondContact O-N 2.91Å
261	G	86.2	Confident	92.1	Very high	15 Å²	15	44.8 Å²	44.8	16%	0.155	22%	0.224	C	C	.	.			trans	62.4	18.4	-172.3	0	0	0	0	0	114	S230 Q256 V257 P263 M317	S230-G261 VanDerWaalsContact CB-CA 3.5Å; Q256-G261 PolarHBondContact O-N 2.82Å; V257-G261 WeakPolarHBondContact O-CA 3.34Å; V257-G261 PolarHBondContact O-N 3.05Å; G261-P263 WeakPolarHBondContact O-CD 3.45Å; G261-M317 PolarHBondContact N-SD 3.28Å
262	S	90	Very high	91.9	Very high	34 Å²	34	49.8 Å²	49.8	24%	0.238	24%	0.243	C	C	.	.			trans	-95.4	110.4	-171.4	-177.3	0	0	0	0	111.6	Q256 L260 V264	Q256-S262 CarbonylContact C-O 3.6Å; Q256-S262 PolarHBondContact O-N 2.85Å; L260-S262 PolarHBondContact O-N 2.91Å; S262-V264 PolarHBondContact O-N 2.8Å
263	P	90.4	Very high	91.7	Very high	26 Å²	26	50.2 Å²	50.2	17%	0.169	24%	0.243	C	C	.	.			trans	-79.1	-5.1	179.8	36.1	-40.2	0	0	0	113.4	A231 I233 G261 K265 M266 E267	A231-P263 HydrophobicContact CB-CB 4.45Å; A231-P263 HydrophobicContact CB-CG 3.9Å; I233-P263 HydrophobicContact CB-CB 3.85Å; I233-P263 HydrophobicContact CG1-CB 4.26Å; I233-P263 HydrophobicContact CG2-CB 4.04Å; G261-P263 WeakPolarHBondContact O-CD 3.45Å; P263-K265 PolarHBondContact O-N 2.72Å; P263-M266 PolarHBondContact O-N 2.83Å; P263-E267 WeakPolarHBondContact O-CB 3.38Å; P263-E267 PolarHBondContact O-N 2.6Å
264	V	90.6	Very high	91.5	Very high	85 Å²	85	52.3 Å²	52.3	52%	0.515	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-51.1	-167.6	-179.4	0	0	0	0	111.2	S262 M266 E267 E268	S262-V264 PolarHBondContact O-N 2.8Å; V264-M266 VanDerWaalsContact C-N 3.34Å; V264-M266 PolarHBondContact O-N 3.26Å; V264-E267 PolarHBondContact O-N 3.07Å; V264-E268 PolarHBondContact O-N 2.97Å; V264-E268 VanDerWaalsContact O-N 3.15Å
265	K	89.9	Confident	91.1	Very high	57 Å²	57	59.2 Å²	59.2	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-37.1	-179.9	-172.5	71.9	-156.1	162.6	0	112.4	E252 Q256 P263 E267 E268 E269	E252-K265 HydrophobicContact CG-CG 4.21Å; Q256-K265 HydrophobicContact CB-CB 4.36Å; Q256-K265 HydrophobicContact CG-CB 4.45Å; Q256-K265 VanDerWaalsContact OE1-CB 3.27Å; P263-K265 PolarHBondContact O-N 2.72Å; K265-E267 VanDerWaalsContact C-N 3.35Å; K265-E268 IonicContact NZ-OE2 3.23Å; K265-E268 PolarHBondContact NZ-OE2 3.24Å; K265-E268 WeakPolarHBondContact O-CB 3.41Å; K265-E268 PolarHBondContact O-N 3.32Å; K265-E269 PolarHBondContact O-N 3.27Å
266	M	92.8	Very high	91	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-39.4	176.7	-162.4	66	-158.1	0	0	111.9	I233 L243 V254 V257 P263 V264 E269 I270 L315	I233-M266 HydrophobicContact CG1-CB 4.1Å; I233-M266 HydrophobicContact CG1-CG 4.05Å; I233-M266 HydrophobicContact CG2-CB 4.07Å; I233-M266 HydrophobicContact CG2-CG 3.93Å; L243-M266 HydrophobicContact CD1-CE 3.26Å; L243-M266 HydrophobicContact CG-CE 3.6Å; V254-M266 HydrophobicContact CG2-CE 3.97Å; V254-M266 HydrophobicContact CG2-SD 3.84Å; V254-M266 PolarHBondContact N-SD 2.98Å; V254-M266 VanDerWaalsContact N-SD 3.41Å; V257-M266 HydrophobicContact CG2-CB 4Å; V257-M266 HydrophobicContact CG2-CG 4.45Å; P263-M266 PolarHBondContact O-N 2.83Å; V264-M266 VanDerWaalsContact C-N 3.34Å; V264-M266 PolarHBondContact O-N 3.26Å; M266-E269 PolarHBondContact O-N 3.15Å; M266-I270 HydrophobicContact CE-CG1 4.41Å; M266-I270 HydrophobicContact CG-CD1 4.14Å; M266-I270 WeakPolarHBondContact O-CD1 3.47Å; M266-I270 WeakPolarHBondContact O-CG1 3.24Å; M266-I270 PolarHBondContact O-N 3.36Å; M266-L315 HydrophobicContact CE-CD2 4.41Å; M266-L315 HydrophobicContact CG-CD2 4.27Å
267	E	93.6	Very high	91.1	Very high	27 Å²	27	57.7 Å²	57.7	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-65.1	-36.6	174.3	179.4	170.6	-159.3	0	0	112.6	I233 P263 V264 K265 R271 K282	I233-E267 HydrophobicContact CD1-CB 4.1Å; P263-E267 WeakPolarHBondContact O-CB 3.38Å; P263-E267 PolarHBondContact O-N 2.6Å; V264-E267 PolarHBondContact O-N 3.07Å; K265-E267 VanDerWaalsContact C-N 3.35Å; E267-R271 HydrophobicContact CG-CG 4.44Å; E267-R271 WeakPolarHBondContact O-CB 3.3Å; E267-R271 VanDerWaalsContact O-CG 3.24Å; E267-R271 WeakPolarHBondContact O-CG 3.12Å; E267-R271 PolarHBondContact O-N 2.9Å; E267-R271 IonicContact OE1-CZ 3.02Å; E267-R271 IonicContact OE1-NE 3.27Å; E267-R271 PolarHBondContact OE1-NE 2.04Å; E267-R271 IonicContact OE1-NH2 3.61Å; E267-R271 PolarHBondContact OE1-NH2 2.86Å; E267-K282 IonicContact OE1-NZ 3.33Å; E267-K282 PolarHBondContact OE1-NZ 3.33Å; E267-K282 VanDerWaalsContact OE2-CE 3.32Å; E267-K282 WeakPolarHBondContact OE2-CE 3.34Å; E267-K282 IonicContact OE2-NZ 3.38Å; E267-K282 PolarHBondContact OE2-NZ 2.74Å
268	E	92.9	Very high	90.9	Very high	84 Å²	84	60.5 Å²	60.5	39%	0.393	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-49.4	171.1	-68.3	177	-175.1	0	0	111.5	V264 K265 I270 R271 Q272	V264-E268 PolarHBondContact O-N 2.97Å; V264-E268 VanDerWaalsContact O-N 3.15Å; K265-E268 IonicContact NZ-OE2 3.23Å; K265-E268 PolarHBondContact NZ-OE2 3.24Å; K265-E268 WeakPolarHBondContact O-CB 3.41Å; K265-E268 PolarHBondContact O-N 3.32Å; E268-I270 PolarHBondContact O-N 3.04Å; E268-R271 PolarHBondContact O-N 3.03Å; E268-Q272 WeakPolarHBondContact O-CB 3.42Å; E268-Q272 WeakPolarHBondContact O-CG 3.36Å; E268-Q272 PolarHBondContact O-N 2.7Å
269	E	93.3	Very high	90.8	Very high	35 Å²	35	62.1 Å²	62.1	16%	0.164	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-42.7	-179.4	-73.3	-178.8	-174	0	0	112.1	S251 G253 K265 M266 Q272	S251-E269 VanDerWaalsContact CB-OE2 3.22Å; S251-E269 WeakPolarHBondContact CB-OE2 3.45Å; S251-E269 PolarHBondContact OG-OE2 3.21Å; G253-E269 PolarHBondContact N-OE1 2.68Å; K265-E269 PolarHBondContact O-N 3.27Å; M266-E269 PolarHBondContact O-N 3.15Å; E269-Q272 PolarHBondContact O-N 3.4Å
270	I	92.3	Very high	91.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-49.8	175.3	-67.6	162.4	0	0	0	110.4	I233 A235 Y241 L243 M266 E268 Q272 K273 V277 V280	I233-I270 HydrophobicContact CD1-CD1 3.96Å; I233-I270 HydrophobicContact CG1-CD1 3.77Å; A235-I270 HydrophobicContact CB-CG2 3.84Å; Y241-I270 HydrophobicContact CE1-CG1 4.22Å; Y241-I270 WeakPolarHBondContact OH-CG1 3.43Å; L243-I270 HydrophobicContact CD1-CD1 3.88Å; L243-I270 HydrophobicContact CD1-CG1 3.72Å; M266-I270 HydrophobicContact CE-CG1 4.41Å; M266-I270 HydrophobicContact CG-CD1 4.14Å; M266-I270 WeakPolarHBondContact O-CD1 3.47Å; M266-I270 WeakPolarHBondContact O-CG1 3.24Å; M266-I270 PolarHBondContact O-N 3.36Å; E268-I270 PolarHBondContact O-N 3.04Å; I270-Q272 VanDerWaalsContact C-N 3.27Å; I270-Q272 PolarHBondContact O-N 3.49Å; I270-K273 WeakPolarHBondContact O-CB 3.49Å; I270-K273 PolarHBondContact O-N 2.91Å; I270-K273 VanDerWaalsContact O-N 3.11Å; I270-V277 HydrophobicContact CG2-CG1 3.9Å; I270-V277 HydrophobicContact CG2-CG2 4.08Å; I270-V280 HydrophobicContact CG2-CG1 4.31Å; I270-V280 HydrophobicContact CG2-CG2 3.85Å
271	R	91.4	Very high	91.5	Very high	163 Å²	163	56.5 Å²	56.5	62%	0.615	30%	0.295	S	S	*	.	H	α-helix	trans	-64.9	-30.5	-178.5	-73.1	174.1	-178.8	-126.2	8.1	112.7	E267 E268 K273 G274 V280	E267-R271 HydrophobicContact CG-CG 4.44Å; E267-R271 WeakPolarHBondContact O-CB 3.3Å; E267-R271 VanDerWaalsContact O-CG 3.24Å; E267-R271 WeakPolarHBondContact O-CG 3.12Å; E267-R271 PolarHBondContact O-N 2.9Å; E267-R271 IonicContact OE1-CZ 3.02Å; E267-R271 IonicContact OE1-NE 3.27Å; E267-R271 PolarHBondContact OE1-NE 2.04Å; E267-R271 IonicContact OE1-NH2 3.61Å; E267-R271 PolarHBondContact OE1-NH2 2.86Å; E268-R271 PolarHBondContact O-N 3.03Å; R271-K273 PolarHBondContact O-N 2.73Å; R271-G274 PolarHBondContact O-N 2.93Å; R271-V280 HydrophobicContact CG-CG2 4.34Å
272	Q	91	Very high	91.8	Very high	144 Å²	144	60.7 Å²	60.7	67%	0.673	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.8	175.5	-75.9	169.8	24.9	0	0	113.8	E268 E269 I270 G274	E268-Q272 WeakPolarHBondContact O-CB 3.42Å; E268-Q272 WeakPolarHBondContact O-CG 3.36Å; E268-Q272 PolarHBondContact O-N 2.7Å; E269-Q272 PolarHBondContact O-N 3.4Å; I270-Q272 VanDerWaalsContact C-N 3.27Å; I270-Q272 PolarHBondContact O-N 3.49Å; Q272-G274 VanDerWaalsContact C-N 3.28Å; Q272-G274 PolarHBondContact O-N 2.84Å
273	K	88.6	Confident	91.8	Very high	105 Å²	105	59.9 Å²	59.9	46%	0.457	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.9	175.7	-60.6	-61.8	179.3	177.6	0	114.2	Y241 I270 R271 D275 E276 V277	Y241-K273 HydrophobicContact CD1-CB 4.5Å; Y241-K273 HydrophobicContact CD1-CG 4.09Å; Y241-K273 HydrophobicContact CD2-CD 3.94Å; Y241-K273 HydrophobicContact CD2-CG 3.77Å; Y241-K273 HydrophobicContact CE1-CG 4.07Å; Y241-K273 HydrophobicContact CE2-CD 4.15Å; Y241-K273 HydrophobicContact CE2-CG 3.77Å; Y241-K273 HydrophobicContact CG-CD 4.4Å; Y241-K273 HydrophobicContact CG-CG 3.93Å; I270-K273 WeakPolarHBondContact O-CB 3.49Å; I270-K273 PolarHBondContact O-N 2.91Å; I270-K273 VanDerWaalsContact O-N 3.11Å; R271-K273 PolarHBondContact O-N 2.73Å; K273-D275 PolarHBondContact O-N 2.79Å; K273-E276 HydrophobicContact CB-CB 4.37Å; K273-E276 PolarHBondContact O-N 2.94Å; K273-V277 HydrophobicContact CB-CG2 3.95Å
274	G	89.4	Confident	91.6	Very high	45 Å²	45	67.4 Å²	67.4	46%	0.464	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	54.1	-121.7	171.5	0	0	0	0	0	112.5	R271 Q272 E276 V277	R271-G274 PolarHBondContact O-N 2.93Å; Q272-G274 VanDerWaalsContact C-N 3.28Å; Q272-G274 PolarHBondContact O-N 2.84Å; G274-E276 PolarHBondContact O-N 2.81Å; G274-E276 VanDerWaalsContact O-N 3.12Å; G274-V277 PolarHBondContact O-N 2.89Å; G274-V277 VanDerWaalsContact O-N 3.11Å
275	D	88.5	Confident	91.4	Very high	146 Å²	146	65.5 Å²	65.5	78%	0.781	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-61	-20.8	-174.5	-65.7	-42.7	0	0	0	114.5	K273 V277 R309	K273-D275 PolarHBondContact O-N 2.79Å; D275-V277 PolarHBondContact O-N 3.39Å; D275-R309 VanDerWaalsContact O-CD 3.26Å; D275-R309 WeakPolarHBondContact O-CD 3.32Å; D275-R309 PolarHBondContact O-NH1 3.45Å
276	E	91.6	Very high	91.2	Very high	66 Å²	66	63.4 Å²	63.4	31%	0.308	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-73.2	-10.9	178	-59.5	-71.4	-162.8	0	0	113.2	H237 S238 N240 K273 G274	H237-E276 CarbonylContact C-O 3.59Å; H237-E276 WeakPolarHBondContact CA-O 3.36Å; H237-E276 WeakPolarHBondContact CB-O 3.32Å; S238-E276 VanDerWaalsContact CB-OE2 3.28Å; S238-E276 WeakPolarHBondContact CB-OE2 3.31Å; S238-E276 PolarHBondContact N-O 3.26Å; S238-E276 PolarHBondContact OG-OE2 3.49Å; N240-E276 WeakPolarHBondContact CB-OE1 3.47Å; N240-E276 PolarHBondContact ND2-OE1 3.02Å; N240-E276 PolarHBondContact ND2-OE2 2.85Å; K273-E276 HydrophobicContact CB-CB 4.37Å; K273-E276 PolarHBondContact O-N 2.94Å; G274-E276 PolarHBondContact O-N 2.81Å; G274-E276 VanDerWaalsContact O-N 3.12Å
277	V	93.8	Very high	90.9	Very high	18 Å²	18	70.9 Å²	70.9	11%	0.109	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.9	178.1	171	0	0	0	0	109.7	A235 S236 H237 Y241 I270 K273 G274 D275 V280	A235-V277 HydrophobicContact CB-CG1 4.03Å; A235-V277 HydrophobicContact CB-CG2 4.37Å; S236-V277 WeakPolarHBondContact O-CA 3.08Å; H237-V277 HydrophobicContact CB-CG2 4.13Å; Y241-V277 HydrophobicContact CD1-CG2 3.76Å; Y241-V277 HydrophobicContact CE1-CG2 3.97Å; I270-V277 HydrophobicContact CG2-CG1 3.9Å; I270-V277 HydrophobicContact CG2-CG2 4.08Å; K273-V277 HydrophobicContact CB-CG2 3.95Å; G274-V277 PolarHBondContact O-N 2.89Å; G274-V277 VanDerWaalsContact O-N 3.11Å; D275-V277 PolarHBondContact O-N 3.39Å; V277-V280 HydrophobicContact CG1-CG2 4.45Å
278	L	91.4	Very high	90.5	Very high	58 Å²	58	72 Å²	72	30%	0.304	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-45.9	177.7	178.9	56.4	0	0	0	112.3	S236 S304 D306 R309	S236-L278 PolarHBondContact O-N 2.71Å; L278-S304 WeakPolarHBondContact CD2-O 3.35Å; L278-D306 HydrophobicContact CD2-CB 4.06Å; L278-R309 HydrophobicContact CB-CB 3.95Å; L278-R309 HydrophobicContact CB-CG 4.48Å
279	T	92.4	Very high	90.2	Very high	34 Å²	34	68 Å²	68	21%	0.209	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	134.3	178.2	-48.7	0	0	0	0	110.5	A235 S236 F303 S304	A235-T279 CarbonylContact C-O 3.59Å; A235-T279 WeakPolarHBondContact CA-O 3.2Å; S236-T279 PolarHBondContact N-O 2.95Å; S236-T279 WeakPolarHBondContact OG-CB 3.04Å; S236-T279 PolarHBondContact OG-N 3.27Å; S236-T279 VanDerWaalsContact OG-N 3.11Å; T279-F303 HydrophobicContact CG2-CB 3.91Å; T279-S304 PolarHBondContact OG1-N 2.94Å
280	V	95.6	Very high	90.1	Very high	43 Å²	43	71.5 Å²	71.5	26%	0.261	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	118.7	168.9	-171.9	0	0	0	0	108.7	I233 I270 R271 V277 K282	I233-V280 HydrophobicContact CD1-CG1 3.87Å; I270-V280 HydrophobicContact CG2-CG1 4.31Å; I270-V280 HydrophobicContact CG2-CG2 3.85Å; R271-V280 HydrophobicContact CG-CG2 4.34Å; V277-V280 HydrophobicContact CG1-CG2 4.45Å; V280-K282 HydrophobicContact CG1-CD 4.3Å; V280-K282 HydrophobicContact CG1-CG 4.04Å
281	I	95.4	Very high	89.5	Confident	2 Å²	2	74.8 Å²	74.8	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.4	-179.4	-56.6	177.1	0	0	0	108.1	V207 I233 G234 A301 F303 M312	V207-I281 HydrophobicContact CG1-CG2 4.01Å; I233-I281 CarbonylContact C-O 3.54Å; I233-I281 WeakPolarHBondContact CA-O 3.13Å; G234-I281 PolarHBondContact N-O 2.98Å; G234-I281 PolarHBondContact O-N 2.86Å; I281-A301 HydrophobicContact CG2-CB 3.98Å; I281-F303 HydrophobicContact CD1-CB 4.2Å; I281-F303 HydrophobicContact CD1-CD1 3.96Å; I281-F303 HydrophobicContact CD1-CD2 4.26Å; I281-F303 HydrophobicContact CD1-CE1 4.41Å; I281-F303 HydrophobicContact CD1-CG 3.88Å; I281-F303 HydrophobicContact CG1-CB 3.94Å; I281-F303 HydrophobicContact CG1-CD1 4.42Å; I281-F303 HydrophobicContact CG1-CG 4.18Å; I281-M312 HydrophobicContact CD1-CG 3.45Å; I281-M312 VanDerWaalsContact CD1-CG 3.45Å; I281-M312 HydrophobicContact CD1-SD 3.85Å
282	K	92.3	Very high	88.9	Confident	102 Å²	102	69 Å²	69	44%	0.443	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	130.8	179.8	-57.9	-177.6	72.4	173.3	0	110.6	I232 I233 E267 V280	I232-K282 WeakPolarHBondContact O-CA 3.04Å; I233-K282 HydrophobicContact CD1-CG 4Å; E267-K282 IonicContact OE1-NZ 3.33Å; E267-K282 PolarHBondContact OE1-NZ 3.33Å; E267-K282 VanDerWaalsContact OE2-CE 3.32Å; E267-K282 WeakPolarHBondContact OE2-CE 3.34Å; E267-K282 IonicContact OE2-NZ 3.38Å; E267-K282 PolarHBondContact OE2-NZ 2.74Å; V280-K282 HydrophobicContact CG1-CD 4.3Å; V280-K282 HydrophobicContact CG1-CG 4.04Å
283	M	90.6	Very high	88.1	Confident	17 Å²	17	67.4 Å²	67.4	8%	0.084	34%	0.341	C	S	.	.			trans	-129.6	159.1	168.7	-44.5	-176.4	-169.6	0	0	111.7	V207 F209 A231 I232 P299 A301	V207-M283 HydrophobicContact CB-CE 4.23Å; V207-M283 HydrophobicContact CG1-CE 3.6Å; V207-M283 HydrophobicContact CG2-CE 3.97Å; V207-M283 WeakPolarHBondContact O-CE 3.41Å; F209-M283 HydrophobicContact CB-SD 4.39Å; A231-M283 WeakPolarHBondContact CB-O 3.23Å; I232-M283 HydrophobicContact CB-CB 3.96Å; I232-M283 HydrophobicContact CB-CG 4.04Å; I232-M283 HydrophobicContact CB-SD 4.37Å; I232-M283 HydrophobicContact CD1-CB 4.14Å; I232-M283 HydrophobicContact CD1-CE 4.42Å; I232-M283 HydrophobicContact CD1-CG 4.17Å; I232-M283 HydrophobicContact CD1-SD 3.47Å; I232-M283 WeakPolarHBondContact CD1-SD 3.49Å; I232-M283 HydrophobicContact CG2-CE 4.48Å; I232-M283 HydrophobicContact CG2-CG 4.28Å; I232-M283 HydrophobicContact CG2-SD 4.47Å; I232-M283 PolarHBondContact N-O 2.64Å; I232-M283 PolarHBondContact O-N 2.96Å; M283-P299 HydrophobicContact CB-CB 4.04Å; M283-P299 HydrophobicContact SD-CB 3.81Å; M283-P299 HydrophobicContact SD-CG 4.36Å; M283-P299 VanDerWaalsContact SD-O 3.34Å; M283-A301 HydrophobicContact CE-CB 3.98Å; M283-A301 HydrophobicContact CG-CB 3.85Å
284	K	85.6	Confident	87.4	Confident	185 Å²	185	69.2 Å²	69.2	80%	0.804	36%	0.356	S	S	*	.			trans	-69.3	143.1	175.8	-63	-177.7	-179.8	-179.6	0	110.7
285	A	88	Confident	86.5	Confident	44 Å²	44	71.6 Å²	71.6	36%	0.364	36%	0.361	S	S	.	.			trans	-57.8	152.8	169.7	0	0	0	0	0	111.9	W229 S230	W229-A285 WeakPolarHBondContact O-CA 3.22Å; W229-A285 WeakPolarHBondContact O-CB 3.43Å; S230-A285 WeakPolarHBondContact O-CA 3.34Å
286	Q	85.8	Confident	86	Confident	14 Å²	14	67.5 Å²	67.5	7%	0.065	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-112.7	109.5	-178.5	-64.8	-168	-74.7	0	0	111.6	H228 W229 P288 P299	H228-Q286 CarbonylContact C-O 3.54Å; H228-Q286 WeakPolarHBondContact CA-O 3.41Å; H228-Q286 VanDerWaalsContact CB-O 3.28Å; H228-Q286 WeakPolarHBondContact CB-O 3.47Å; W229-Q286 HydrophobicContact CB-CB 4.11Å; W229-Q286 PolarHBondContact N-O 3.1Å; W229-Q286 PolarHBondContact O-N 2.73Å; Q286-P288 CarbonylContact C-O 3.52Å; Q286-P288 CarbonylContact O-C 3.56Å; Q286-P299 HydrophobicContact CG-CG 3.96Å
287	W	85.3	Confident	85.5	Confident	156 Å²	156	68.2 Å²	68.2	59%	0.591	35%	0.352	S	S	*	.	S	Bend	trans	-121.9	122.9	175.1	-68.2	74.8	0	0	0	109.4	H228 R296	H228-W287 HydrophobicContact CB-CD2 3.45Å; H228-W287 VanDerWaalsContact CB-CD2 3.45Å; H228-W287 VanDerWaalsContact CB-CE2 3.43Å; H228-W287 HydrophobicContact CB-CE3 3.82Å; H228-W287 HydrophobicContact CB-CG 3.86Å; H228-W287 HydrophobicContact CB-CH2 4.18Å; H228-W287 HydrophobicContact CB-CZ2 3.84Å; H228-W287 HydrophobicContact CB-CZ3 4.16Å; H228-W287 AromaticContact CD2-CE2 3.6Å; H228-W287 AromaticContact CD2-CZ2 3.33Å; H228-W287 WeakPolarHBondContact CD2-CZ2 3.4Å; H228-W287 AromaticContact CD2-NE1 3.83Å; H228-W287 AromaticContact CE1-CH2 3.5Å; H228-W287 VanDerWaalsContact CE1-CH2 3.5Å; H228-W287 WeakPolarHBondContact CE1-CH2 3.03Å; H228-W287 AromaticContact CE1-CZ2 3.56Å; H228-W287 AromaticContact CG-CD2 3.94Å; H228-W287 AromaticContact CG-CE2 3.45Å; H228-W287 VanDerWaalsContact CG-CE2 3.45Å; H228-W287 AromaticContact CG-CH2 3.63Å; H228-W287 AromaticContact CG-CZ2 3.3Å; H228-W287 AromaticContact CG-NE1 3.95Å; H228-W287 AromaticContact ND1-CH2 3.3Å; H228-W287 VanDerWaalsContact ND1-CH2 3.3Å; H228-W287 WeakPolarHBondContact ND1-CH2 3.21Å; H228-W287 AromaticContact ND1-CZ2 3.46Å; H228-W287 WeakPolarHBondContact ND1-CZ2 3.16Å; H228-W287 AromaticContact ND1-CZ3 3.76Å; H228-W287 AromaticContact NE2-CH2 3.94Å; H228-W287 AromaticContact NE2-CZ2 3.49Å; H228-W287 WeakPolarHBondContact NE2-CZ2 3.29Å; W287-R296 VanDerWaalsContact C-NH1 3.32Å; W287-R296 PolarHBondContact O-NH1 3.35Å
288	P	85.6	Confident	85.1	Confident	51 Å²	51	68.1 Å²	68.1	33%	0.331	35%	0.353	S	S	.	.	S	Bend	cis	-63.1	172.7	-16.1	30.6	-36	0	0	0	112	N227 Q286 W290 Q291 R296	N227-P288 CarbonylContact O-C 3.59Å; N227-P288 WeakPolarHBondContact O-CA 3.33Å; N227-P288 WeakPolarHBondContact OD1-CB 3.44Å; Q286-P288 CarbonylContact C-O 3.52Å; Q286-P288 CarbonylContact O-C 3.56Å; P288-W290 PolarHBondContact O-N 2.81Å; P288-Q291 HydrophobicContact CG-CG 4.13Å; P288-Q291 VanDerWaalsContact CG-NE2 3.33Å; P288-R296 VanDerWaalsContact O-CZ 3.27Å; P288-R296 PolarHBondContact O-NH1 3.21Å; P288-R296 PolarHBondContact O-NH2 2.85Å
289	A	86	Confident	84.9	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-56.9	-47.6	-177.7	0	0	0	0	0	112.6	W213 N227 R296	W213-A289 HydrophobicContact CE3-CB 3.49Å; W213-A289 VanDerWaalsContact CE3-CB 3.49Å; W213-A289 HydrophobicContact CZ3-CB 3.77Å; N227-A289 HydrophobicContact CB-CB 4.05Å; N227-A289 PolarHBondContact O-N 3.13Å; N227-A289 PolarHBondContact OD1-N 2.93Å; A289-R296 PolarHBondContact O-NH2 2.96Å
290	W	91.3	Very high	84.9	Confident	108 Å²	108	67.7 Å²	67.7	41%	0.409	36%	0.356	S	S	.	.			trans	-110.5	135.4	-178.6	-170.6	92.1	0	0	0	112.8	G211 W213 P288 P292	G211-W290 VanDerWaalsContact O-CD1 3.23Å; W213-W290 WeakPolarHBondContact O-CB 3.35Å; P288-W290 PolarHBondContact O-N 2.81Å; W290-P292 HydrophobicContact CH2-CB 3.97Å; W290-P292 HydrophobicContact CH2-CG 4.35Å; W290-P292 HydrophobicContact CZ2-CB 4.41Å; W290-P292 HydrophobicContact CZ3-CG 4.46Å
291	Q	79.6	Confident	84.7	Confident	70 Å²	70	66.3 Å²	66.3	33%	0.327	35%	0.349	S	S	.	.			trans	-146.9	147.6	166.8	-76.9	-63.3	-12.8	0	0	107.8	P288 R296	P288-Q291 HydrophobicContact CG-CG 4.13Å; P288-Q291 VanDerWaalsContact CG-NE2 3.33Å; Q291-R296 HydrophobicContact CB-CB 3.87Å; Q291-R296 HydrophobicContact CG-CB 4.41Å
292	P	78.4	Confident	84.7	Confident	40 Å²	40	69.8 Å²	69.8	26%	0.26	37%	0.365	S	S	.	.			trans	-72.1	151.2	175.6	33.7	-35	0	0	0	110.3	W290 N294 V295 R296	W290-P292 HydrophobicContact CH2-CB 3.97Å; W290-P292 HydrophobicContact CH2-CG 4.35Å; W290-P292 HydrophobicContact CZ2-CB 4.41Å; W290-P292 HydrophobicContact CZ3-CG 4.46Å; P292-N294 WeakPolarHBondContact CB-OD1 3.38Å; P292-N294 WeakPolarHBondContact CG-OD1 3.36Å; P292-N294 PolarHBondContact O-N 2.73Å; P292-V295 HydrophobicContact CG-CB 4.13Å; P292-V295 HydrophobicContact CG-CG2 3.8Å; P292-V295 PolarHBondContact O-N 2.97Å; P292-R296 PolarHBondContact O-N 3.37Å; P292-R296 VanDerWaalsContact O-N 3.11Å
293	L	75.8	Confident	84.8	Confident	112 Å²	112	65 Å²	65	59%	0.586	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.5	-169	-67.4	172.1	0	0	0	114.8	Y210 V295 A298	Y210-L293 HydrophobicContact CD1-CD1 4.38Å; Y210-L293 HydrophobicContact CD1-CD2 3.99Å; Y210-L293 HydrophobicContact CE1-CD1 3.97Å; Y210-L293 HydrophobicContact CE1-CD2 3.84Å; L293-V295 VanDerWaalsContact C-N 3.35Å; L293-A298 HydrophobicContact CD2-CB 3.92Å
294	N	73.8	Confident	85	Confident	142 Å²	142	66.1 Å²	66.1	76%	0.759	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.3	174	66.5	-58.9	0	0	0	113.7	P292	P292-N294 WeakPolarHBondContact CB-OD1 3.38Å; P292-N294 WeakPolarHBondContact CG-OD1 3.36Å; P292-N294 PolarHBondContact O-N 2.73Å
295	V	69	Low	85.5	Confident	96 Å²	96	57.3 Å²	57.3	58%	0.582	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-40.1	176.8	174	0	0	0	0	110.6	P292 L293	P292-V295 HydrophobicContact CG-CB 4.13Å; P292-V295 HydrophobicContact CG-CG2 3.8Å; P292-V295 PolarHBondContact O-N 2.97Å; L293-V295 VanDerWaalsContact C-N 3.35Å
296	R	79.9	Confident	85.7	Confident	59 Å²	59	56.1 Å²	56.1	22%	0.223	30%	0.303	C	S	.	.	S	Bend	trans	-140.9	124	177	-170.2	177.2	64.8	-163.3	-1	110.7	W287 P288 A289 Q291 P292	W287-R296 VanDerWaalsContact C-NH1 3.32Å; W287-R296 PolarHBondContact O-NH1 3.35Å; P288-R296 VanDerWaalsContact O-CZ 3.27Å; P288-R296 PolarHBondContact O-NH1 3.21Å; P288-R296 PolarHBondContact O-NH2 2.85Å; A289-R296 PolarHBondContact O-NH2 2.96Å; Q291-R296 HydrophobicContact CB-CB 3.87Å; Q291-R296 HydrophobicContact CG-CB 4.41Å; P292-R296 PolarHBondContact O-N 3.37Å; P292-R296 VanDerWaalsContact O-N 3.11Å
297	A	79.5	Confident	86	Confident	81 Å²	81	63.2 Å²	63.2	67%	0.669	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-57.3	141.1	170.5	0	0	0	0	0	110.7
298	A	86.1	Confident	86.3	Confident	17 Å²	17	59.1 Å²	59.1	14%	0.14	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-61	132.5	171.4	0	0	0	0	0	109.4	T208 Y210 L293 S300	T208-A298 HydrophobicContact CG2-CB 3.54Å; Y210-A298 HydrophobicContact CD1-CB 3.82Å; Y210-A298 HydrophobicContact CE1-CB 3.67Å; Y210-A298 HydrophobicContact CG-CB 4.39Å; L293-A298 HydrophobicContact CD2-CB 3.92Å; A298-S300 PolarHBondContact O-N 3.38Å
299	P	86.7	Confident	86.7	Confident	20 Å²	20	59 Å²	59	13%	0.13	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-60.3	134.7	176.2	25.8	-35.3	0	0	0	109.4	T208 F209 I232 M283 Q286	T208-P299 WeakPolarHBondContact CA-O 3.27Å; F209-P299 HydrophobicContact CB-CG 4.28Å; F209-P299 HydrophobicContact CD1-CG 4.29Å; F209-P299 PolarHBondContact N-O 2.94Å; F209-P299 WeakPolarHBondContact O-CD 3.41Å; I232-P299 HydrophobicContact CD1-CG 4.43Å; M283-P299 HydrophobicContact CB-CB 4.04Å; M283-P299 HydrophobicContact SD-CB 3.81Å; M283-P299 HydrophobicContact SD-CG 4.36Å; M283-P299 VanDerWaalsContact SD-O 3.34Å; Q286-P299 HydrophobicContact CG-CG 3.96Å
300	S	92.7	Very high	87.1	Confident	62 Å²	62	59.5 Å²	59.5	43%	0.434	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.4	177.9	62.2	0	0	0	0	110.9	V207 A298	V207-S300 CarbonylContact O-C 3.39Å; V207-S300 WeakPolarHBondContact O-CA 3.37Å; V207-S300 WeakPolarHBondContact O-CB 3.43Å; A298-S300 PolarHBondContact O-N 3.38Å
301	A	92.5	Very high	87.2	Confident	14 Å²	14	55.2 Å²	55.2	12%	0.116	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	152.4	172.1	0	0	0	0	0	109.5	R206 V207 I281 M283	R206-A301 WeakPolarHBondContact CA-O 3.26Å; V207-A301 HydrophobicContact CG1-CB 4.41Å; V207-A301 WeakPolarHBondContact CG1-O 3.4Å; V207-A301 PolarHBondContact N-O 3.45Å; V207-A301 PolarHBondContact O-N 2.93Å; I281-A301 HydrophobicContact CG2-CB 3.98Å; M283-A301 HydrophobicContact CE-CB 3.98Å; M283-A301 HydrophobicContact CG-CB 3.85Å
302	E	94.6	Very high	88	Confident	76 Å²	76	51.9 Å²	51.9	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	139.4	175.9	-59	-173.2	164.1	0	0	110.2	K204 Y205 R206 I406	K204-E302 WeakPolarHBondContact CE-OE2 3.48Å; K204-E302 IonicContact NZ-OE2 3.1Å; K204-E302 PolarHBondContact NZ-OE2 2.8Å; Y205-E302 CarbonylContact O-C 3.49Å; Y205-E302 WeakPolarHBondContact O-CA 3.34Å; R206-E302 HydrophobicContact CB-CG 4.35Å; R206-E302 HydrophobicContact CG-CG 4.29Å; R206-E302 IonicContact CZ-OE1 2.69Å; R206-E302 IonicContact NE-OE1 2.76Å; R206-E302 PolarHBondContact NE-OE1 2.94Å; R206-E302 VanDerWaalsContact NE-OE1 3.1Å; R206-E302 IonicContact NH2-OE1 3.66Å; R206-E302 PolarHBondContact NH2-OE1 3.34Å; E302-I406 HydrophobicContact CB-CD1 4.46Å; E302-I406 VanDerWaalsContact CD-CD1 3.44Å; E302-I406 HydrophobicContact CG-CD1 3.98Å; E302-I406 WeakPolarHBondContact OE1-CD1 3.44Å
303	F	95.2	Very high	88.8	Confident	2 Å²	2	50 Å²	50	1%	0.009	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.1	179.2	67.6	-80.5	0	0	0	111.1	K204 Y205 V207 T279 I281 V305 M312 L333 V403	K204-F303 WeakPolarHBondContact CA-O 3.45Å; Y205-F303 VanDerWaalsContact CB-CE1 3.46Å; Y205-F303 VanDerWaalsContact CB-CZ 3.45Å; Y205-F303 HydrophobicContact CD2-CE2 4.33Å; Y205-F303 HydrophobicContact CD2-CZ 4.44Å; Y205-F303 HydrophobicContact CG-CE1 4.47Å; Y205-F303 HydrophobicContact CG-CE2 4.36Å; Y205-F303 HydrophobicContact CG-CZ 4.01Å; Y205-F303 PolarHBondContact N-O 3.27Å; Y205-F303 PolarHBondContact O-N 2.66Å; V207-F303 HydrophobicContact CB-CD1 4.43Å; V207-F303 HydrophobicContact CB-CE1 3.84Å; V207-F303 HydrophobicContact CG1-CD1 3.79Å; V207-F303 HydrophobicContact CG1-CE1 3.69Å; T279-F303 HydrophobicContact CG2-CB 3.91Å; I281-F303 HydrophobicContact CD1-CB 4.2Å; I281-F303 HydrophobicContact CD1-CD1 3.96Å; I281-F303 HydrophobicContact CD1-CD2 4.26Å; I281-F303 HydrophobicContact CD1-CE1 4.41Å; I281-F303 HydrophobicContact CD1-CG 3.88Å; I281-F303 HydrophobicContact CG1-CB 3.94Å; I281-F303 HydrophobicContact CG1-CD1 4.42Å; I281-F303 HydrophobicContact CG1-CG 4.18Å; F303-V305 HydrophobicContact CD2-CG1 4.17Å; F303-V305 HydrophobicContact CE2-CG1 3.91Å; F303-M312 HydrophobicContact CD2-CG 4.34Å; F303-M312 HydrophobicContact CE1-CG 4.38Å; F303-M312 HydrophobicContact CE2-CB 3.99Å; F303-M312 HydrophobicContact CE2-CG 3.71Å; F303-M312 HydrophobicContact CZ-CB 4.23Å; F303-M312 HydrophobicContact CZ-CE 4.26Å; F303-M312 HydrophobicContact CZ-CG 3.73Å; F303-L333 HydrophobicContact CE2-CD1 3.54Å; F303-L333 HydrophobicContact CZ-CD1 3.62Å; F303-V403 HydrophobicContact CE1-CG1 4Å; F303-V403 HydrophobicContact CZ-CG1 3.74Å
304	S	94.9	Very high	89.9	Confident	39 Å²	39	44.8 Å²	44.8	27%	0.273	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	149	176.7	-58.9	0	0	0	0	110.2	A203 S236 L278 T279	A203-S304 CarbonylContact O-C 3.56Å; A203-S304 WeakPolarHBondContact O-CA 3.38Å; S236-S304 VanDerWaalsContact CB-O 3.27Å; S236-S304 WeakPolarHBondContact CB-O 3.45Å; S236-S304 PolarHBondContact OG-O 3Å; L278-S304 WeakPolarHBondContact CD2-O 3.35Å; T279-S304 PolarHBondContact OG1-N 2.94Å
305	V	94.9	Very high	91	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.2	167.4	-69.9	0	0	0	0	110.4	T202 A203 Y205 F303 R309 L333 W340	T202-V305 VanDerWaalsContact CA-O 3.28Å; T202-V305 WeakPolarHBondContact CA-O 3.07Å; T202-V305 VanDerWaalsContact CB-O 3.26Å; T202-V305 WeakPolarHBondContact CB-O 3.33Å; A203-V305 HydrophobicContact CB-CG2 3.94Å; A203-V305 PolarHBondContact N-O 2.96Å; A203-V305 VanDerWaalsContact N-O 3.07Å; A203-V305 WeakPolarHBondContact O-CG2 3.31Å; A203-V305 PolarHBondContact O-N 3.49Å; Y205-V305 HydrophobicContact CD2-CG2 3.83Å; Y205-V305 HydrophobicContact CE2-CG2 3.47Å; Y205-V305 VanDerWaalsContact CE2-CG2 3.47Å; F303-V305 HydrophobicContact CD2-CG1 4.17Å; F303-V305 HydrophobicContact CE2-CG1 3.91Å; V305-R309 WeakPolarHBondContact CA-O 3.33Å; V305-R309 WeakPolarHBondContact CB-O 3.44Å; V305-R309 WeakPolarHBondContact CG1-O 3.38Å; V305-L333 HydrophobicContact CG1-CD1 4.04Å; V305-W340 HydrophobicContact CB-CH2 4.35Å; V305-W340 HydrophobicContact CB-CZ3 3.99Å; V305-W340 HydrophobicContact CG2-CD2 4.33Å; V305-W340 HydrophobicContact CG2-CE3 3.59Å; V305-W340 HydrophobicContact CG2-CH2 4.01Å; V305-W340 HydrophobicContact CG2-CZ3 3.41Å; V305-W340 VanDerWaalsContact CG2-CZ3 3.41Å
306	D	93.3	Very high	92.4	Very high	20 Å²	20	33.4 Å²	33.4	11%	0.107	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	173.4	172.6	72.5	37.2	0	0	0	110.4	T202 L278 S308 R309 H310	T202-D306 HydrophobicContact CG2-CB 3.77Å; L278-D306 HydrophobicContact CD2-CB 4.06Å; D306-S308 PolarHBondContact O-N 3.26Å; D306-S308 VanDerWaalsContact O-N 3.08Å; D306-S308 WeakPolarHBondContact OD1-CA 3.34Å; D306-S308 WeakPolarHBondContact OD1-CB 3.44Å; D306-S308 PolarHBondContact OD1-N 3Å; D306-S308 PolarHBondContact OD1-OG 3.05Å; D306-R309 PolarHBondContact N-O 3.42Å; D306-R309 CarbonylContact O-C 3.42Å; D306-R309 PolarHBondContact O-N 2.93Å; D306-R309 PolarHBondContact OD1-N 2.88Å; D306-R309 IonicContact OD1-NE 3.11Å; D306-R309 IonicContact OD2-CZ 2.66Å; D306-R309 VanDerWaalsContact OD2-CZ 3.27Å; D306-R309 IonicContact OD2-NE 2.71Å; D306-R309 PolarHBondContact OD2-NE 2.98Å; D306-R309 IonicContact OD2-NH2 2.6Å; D306-R309 PolarHBondContact OD2-NH2 2.6Å; D306-H310 PolarHBondContact O-N 2.99Å; D306-H310 VanDerWaalsContact O-N 3.13Å
307	R	91.8	Very high	93.2	Very high	162 Å²	162	31 Å²	31	61%	0.611	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-29.8	-176.9	-161.8	-177.2	68	177.8	-0.3	114.9	C197 A199 H310	C197-R307 HydrophobicContact CB-CG 4.33Å; C197-R307 WeakPolarHBondContact CB-O 3.48Å; C197-R307 VanDerWaalsContact O-CD 3.27Å; C197-R307 WeakPolarHBondContact O-CD 3.42Å; C197-R307 WeakPolarHBondContact O-CG 3.42Å; A199-R307 WeakPolarHBondContact O-CD 3.46Å; A199-R307 VanDerWaalsContact O-CG 3.28Å; A199-R307 WeakPolarHBondContact O-CG 3.31Å; R307-H310 PolarHBondContact O-CD2 2.97Å
308	S	90.6	Very high	94	Very high	71 Å²	71	27.2 Å²	27.2	50%	0.497	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-26.1	176.5	49.4	0	0	0	0	113.6	S238 D306	S238-S308 WeakPolarHBondContact CA-O 3.31Å; S238-S308 WeakPolarHBondContact CB-O 3.11Å; D306-S308 PolarHBondContact O-N 3.26Å; D306-S308 VanDerWaalsContact O-N 3.08Å; D306-S308 WeakPolarHBondContact OD1-CA 3.34Å; D306-S308 WeakPolarHBondContact OD1-CB 3.44Å; D306-S308 PolarHBondContact OD1-N 3Å; D306-S308 PolarHBondContact OD1-OG 3.05Å
309	R	94.5	Very high	94.2	Very high	48 Å²	48	26.4 Å²	26.4	18%	0.181	14%	0.139	C	C	.	.	B	Isolated β-bridge	trans	-127.9	61.5	-172	-65.2	167	-67.2	-160.4	1.6	109	H237 D275 L278 V305 D306	H237-R309 CarbonylContact O-C 3.54Å; H237-R309 VanDerWaalsContact O-CA 3.24Å; H237-R309 WeakPolarHBondContact O-CA 3.08Å; D275-R309 VanDerWaalsContact O-CD 3.26Å; D275-R309 WeakPolarHBondContact O-CD 3.32Å; D275-R309 PolarHBondContact O-NH1 3.45Å; L278-R309 HydrophobicContact CB-CB 3.95Å; L278-R309 HydrophobicContact CB-CG 4.48Å; V305-R309 WeakPolarHBondContact CA-O 3.33Å; V305-R309 WeakPolarHBondContact CB-O 3.44Å; V305-R309 WeakPolarHBondContact CG1-O 3.38Å; D306-R309 PolarHBondContact N-O 3.42Å; D306-R309 CarbonylContact O-C 3.42Å; D306-R309 PolarHBondContact O-N 2.93Å; D306-R309 PolarHBondContact OD1-N 2.88Å; D306-R309 IonicContact OD1-NE 3.11Å; D306-R309 IonicContact OD2-CZ 2.66Å; D306-R309 VanDerWaalsContact OD2-CZ 3.27Å; D306-R309 IonicContact OD2-NE 2.71Å; D306-R309 PolarHBondContact OD2-NE 2.98Å; D306-R309 IonicContact OD2-NH2 2.6Å; D306-R309 PolarHBondContact OD2-NH2 2.6Å
310	H	93.6	Very high	94.5	Very high	11 Å²	11	26.8 Å²	26.8	5%	0.051	14%	0.141	C	C	.	.			trans	-93.1	-5.1	-175.1	58.3	99.3	0	0	0	113.3	C197 D306 R307 D332 L333 C334 W340	C197-H310 HydrophobicContact CB-CB 4.18Å; D306-H310 PolarHBondContact O-N 2.99Å; D306-H310 VanDerWaalsContact O-N 3.13Å; R307-H310 PolarHBondContact O-CD2 2.97Å; H310-D332 IonicContact CE1-OD1 2.77Å; H310-D332 IonicContact CE1-OD2 3.88Å; H310-D332 PolarHBondContact CE1-OD2 2.93Å; H310-D332 VanDerWaalsContact CE1-OD2 3.28Å; H310-D332 IonicContact CG-OD1 3.25Å; H310-D332 IonicContact ND1-OD1 3.7Å; H310-D332 PolarHBondContact ND1-OD1 2.87Å; H310-D332 IonicContact ND1-OD2 3.32Å; H310-D332 PolarHBondContact ND1-OD2 2.8Å; H310-L333 PolarHBondContact O-N 2.98Å; H310-C334 HydrophobicContact CB-CB 3.93Å; H310-W340 HydrophobicContact CB-CH2 4.25Å; H310-W340 HydrophobicContact CB-CZ3 3.98Å
311	I	94.8	Very high	94.6	Very high	17 Å²	17	24.6 Å²	24.6	9%	0.087	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	143.6	-175.4	-58.1	-179.3	0	0	0	109.7	S236 H237 K239 A330 E331	S236-I311 CarbonylContact C-O 3.13Å; S236-I311 VanDerWaalsContact CA-O 3.26Å; S236-I311 WeakPolarHBondContact CA-O 3.47Å; H237-I311 PolarHBondContact N-O 3.33Å; H237-I311 WeakPolarHBondContact O-CB 3.31Å; H237-I311 PolarHBondContact O-N 3.11Å; K239-I311 HydrophobicContact CB-CD1 3.92Å; I311-A330 HydrophobicContact CG2-CB 4.04Å; I311-E331 CarbonylContact C-O 3.56Å; I311-E331 WeakPolarHBondContact CA-O 3.4Å
312	M	95.3	Very high	94.6	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.5	175.2	-170.7	-88.1	-67.6	0	0	111.5	A235 I281 F303 F314 L328 E331 L333 V403	A235-M312 WeakPolarHBondContact O-CA 3.49Å; I281-M312 HydrophobicContact CD1-CG 3.45Å; I281-M312 VanDerWaalsContact CD1-CG 3.45Å; I281-M312 HydrophobicContact CD1-SD 3.85Å; F303-M312 HydrophobicContact CD2-CG 4.34Å; F303-M312 HydrophobicContact CE1-CG 4.38Å; F303-M312 HydrophobicContact CE2-CB 3.99Å; F303-M312 HydrophobicContact CE2-CG 3.71Å; F303-M312 HydrophobicContact CZ-CB 4.23Å; F303-M312 HydrophobicContact CZ-CE 4.26Å; F303-M312 HydrophobicContact CZ-CG 3.73Å; M312-F314 HydrophobicContact CE-CD1 4.29Å; M312-F314 HydrophobicContact CE-CE1 4.48Å; M312-F314 HydrophobicContact SD-CD1 3.73Å; M312-F314 HydrophobicContact SD-CE1 4.47Å; M312-L328 HydrophobicContact CE-CD1 4.05Å; M312-E331 PolarHBondContact N-O 2.7Å; M312-E331 WeakPolarHBondContact O-CB 3.32Å; M312-E331 PolarHBondContact O-N 3.36Å; M312-L333 HydrophobicContact CB-CD1 4.23Å; M312-V403 HydrophobicContact CE-CG1 4.44Å; M312-V403 HydrophobicContact CE-CG2 3.65Å
313	S	96.1	Very high	94.6	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.007	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147.9	172	-54.7	0	0	0	0	110.6	G234 A235 H237 L243 L328 A330	G234-S313 CarbonylContact C-O 3.51Å; G234-S313 WeakPolarHBondContact CA-O 3.45Å; A235-S313 PolarHBondContact N-O 3.19Å; A235-S313 PolarHBondContact O-N 3.07Å; H237-S313 WeakPolarHBondContact NE2-CB 3.25Å; H237-S313 PolarHBondContact NE2-OG 2.87Å; L243-S313 VanDerWaalsContact CD2-CB 3.48Å; S313-L328 CarbonylContact C-O 3.52Å; S313-L328 VanDerWaalsContact CA-O 3.24Å; S313-L328 WeakPolarHBondContact CA-O 3.38Å; S313-L328 WeakPolarHBondContact CB-O 3.4Å; S313-A330 PolarHBondContact OG-N 2.91Å
314	F	97.6	Very high	94.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.009	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	165.3	170.2	74.6	-86.2	0	0	0	111.3	F209 I232 I233 W244 M312 G327 L328 L348 V401	F209-F314 HydrophobicContact CD2-CE2 4.18Å; F209-F314 HydrophobicContact CD2-CZ 4.47Å; I232-F314 HydrophobicContact CG2-CB 4.2Å; I232-F314 HydrophobicContact CG2-CD2 3.68Å; I232-F314 HydrophobicContact CG2-CE2 4.44Å; I232-F314 HydrophobicContact CG2-CG 4.22Å; I233-F314 CarbonylContact O-C 3.56Å; I233-F314 VanDerWaalsContact O-CA 3.3Å; I233-F314 WeakPolarHBondContact O-CA 3.29Å; I233-F314 WeakPolarHBondContact O-CB 3.42Å; W244-F314 PolarHBondContact NE1-O 3.2Å; M312-F314 HydrophobicContact CE-CD1 4.29Å; M312-F314 HydrophobicContact CE-CE1 4.48Å; M312-F314 HydrophobicContact SD-CD1 3.73Å; M312-F314 HydrophobicContact SD-CE1 4.47Å; F314-G327 VanDerWaalsContact O-CA 3.22Å; F314-G327 WeakPolarHBondContact O-CA 3.38Å; F314-L328 HydrophobicContact CD1-CB 4.07Å; F314-L328 HydrophobicContact CD1-CG 4.39Å; F314-L328 HydrophobicContact CE1-CB 3.84Å; F314-L328 HydrophobicContact CE1-CD1 3.99Å; F314-L328 HydrophobicContact CE1-CG 3.66Å; F314-L328 HydrophobicContact CZ-CG 4.36Å; F314-L328 PolarHBondContact N-O 2.9Å; F314-L328 PolarHBondContact O-N 3.02Å; F314-L328 VanDerWaalsContact O-O 3.07Å; F314-L348 HydrophobicContact CZ-CD1 4.13Å; F314-V401 HydrophobicContact CE1-CB 4.4Å; F314-V401 HydrophobicContact CE1-CG1 4.39Å; F314-V401 HydrophobicContact CE1-CG2 3.89Å; F314-V401 HydrophobicContact CZ-CB 4.03Å; F314-V401 HydrophobicContact CZ-CG1 4.28Å; F314-V401 HydrophobicContact CZ-CG2 3.84Å
315	L	97.8	Very high	94.8	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	158	168.5	67	160.5	0	0	0	112.1	I233 L243 V254 V257 M266 V326 W351	I233-L315 HydrophobicContact CG2-CD2 4.06Å; I233-L315 HydrophobicContact CG2-CG 4.32Å; I233-L315 PolarHBondContact N-O 3.45Å; I233-L315 VanDerWaalsContact N-O 3.14Å; I233-L315 PolarHBondContact O-N 3.48Å; L243-L315 HydrophobicContact CD2-CD2 3.82Å; L243-L315 HydrophobicContact CG-CD2 4.3Å; V254-L315 HydrophobicContact CB-CD1 4.37Å; V254-L315 HydrophobicContact CG1-CD1 4.01Å; V254-L315 HydrophobicContact CG2-CD1 4.25Å; V257-L315 HydrophobicContact CB-CD1 3.87Å; V257-L315 HydrophobicContact CB-CG 4.47Å; V257-L315 HydrophobicContact CG1-CD1 3.84Å; V257-L315 HydrophobicContact CG1-CG 4.09Å; V257-L315 HydrophobicContact CG2-CD1 4.29Å; M266-L315 HydrophobicContact CE-CD2 4.41Å; M266-L315 HydrophobicContact CG-CD2 4.27Å; L315-V326 CarbonylContact C-O 3.56Å; L315-V326 WeakPolarHBondContact CA-O 3.2Å; L315-W351 HydrophobicContact CB-CH2 4.36Å; L315-W351 HydrophobicContact CB-CZ2 3.93Å; L315-W351 HydrophobicContact CD1-CH2 4.02Å; L315-W351 HydrophobicContact CD1-CZ2 4.43Å
316	T	97.1	Very high	94.9	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	142.5	167.5	179.7	0	0	0	0	110.2	F209 W229 S230 I232 N325 V326	F209-T316 HydrophobicContact CE2-CG2 3.91Å; F209-T316 HydrophobicContact CZ-CG2 3.87Å; W229-T316 HydrophobicContact CE3-CG2 4.05Å; S230-T316 PolarHBondContact N-OG1 3.41Å; S230-T316 PolarHBondContact O-OG1 3.17Å; S230-T316 VanDerWaalsContact O-OG1 3.12Å; S230-T316 PolarHBondContact OG-OG1 3.16Å; I232-T316 HydrophobicContact CG1-CG2 3.78Å; T316-N325 CarbonylContact O-C 3.36Å; T316-N325 WeakPolarHBondContact O-CA 3.36Å; T316-V326 HydrophobicContact CG2-CG2 3.53Å; T316-V326 PolarHBondContact N-O 2.83Å; T316-V326 PolarHBondContact O-N 2.87Å
317	M	96.9	Very high	94.9	Very high	9 Å²	9	18.3 Å²	18.3	4%	0.044	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.7	178.5	-173.4	-165.5	72.1	0	0	111	H228 W229 S230 V257 A258 G261 N325	H228-M317 VanDerWaalsContact NE2-CE 3.27Å; H228-M317 WeakPolarHBondContact NE2-CE 3.29Å; W229-M317 WeakPolarHBondContact CA-O 3.22Å; S230-M317 PolarHBondContact N-O 3.33Å; S230-M317 VanDerWaalsContact N-O 3.11Å; S230-M317 WeakPolarHBondContact OG-CB 3.47Å; S230-M317 PolarHBondContact OG-N 3.38Å; V257-M317 HydrophobicContact CG1-CB 4.4Å; V257-M317 VanDerWaalsContact O-CB 3.3Å; V257-M317 WeakPolarHBondContact O-CB 3.11Å; V257-M317 VanDerWaalsContact O-SD 3.37Å; A258-M317 VanDerWaalsContact O-CG 3.28Å; A258-M317 WeakPolarHBondContact O-CG 3.49Å; G261-M317 PolarHBondContact N-SD 3.28Å; M317-N325 VanDerWaalsContact CA-OD1 3.27Å; M317-N325 WeakPolarHBondContact CA-OD1 3.3Å; M317-N325 PolarHBondContact N-OD1 2.88Å
318	M	96.3	Very high	95	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	111.4	162.6	175.4	173.9	-72	0	0	108	W213 W229 P320 S321 W324 P350 Y361 F387 V398	W213-M318 HydrophobicContact CB-CE 4Å; W213-M318 HydrophobicContact CD2-CE 3.82Å; W213-M318 HydrophobicContact CD2-CG 4.01Å; W213-M318 HydrophobicContact CD2-SD 3.96Å; W213-M318 HydrophobicContact CE3-CE 4.32Å; W213-M318 HydrophobicContact CE3-CG 3.85Å; W213-M318 HydrophobicContact CE3-SD 4.41Å; W213-M318 HydrophobicContact CG-CE 3.65Å; W213-M318 HydrophobicContact CG-SD 4.27Å; W213-M318 HydrophobicContact CH2-CG 3.82Å; W213-M318 HydrophobicContact CZ2-CG 3.96Å; W213-M318 HydrophobicContact CZ2-SD 4.08Å; W213-M318 HydrophobicContact CZ3-CG 3.75Å; W229-M318 HydrophobicContact CE3-CB 4.32Å; W229-M318 HydrophobicContact CH2-CB 4.35Å; W229-M318 HydrophobicContact CH2-CE 3.46Å; W229-M318 VanDerWaalsContact CH2-CE 3.46Å; W229-M318 HydrophobicContact CZ2-CE 4.09Å; W229-M318 HydrophobicContact CZ3-CB 3.79Å; W229-M318 HydrophobicContact CZ3-CE 4.07Å; W229-M318 HydrophobicContact CZ3-CG 4.48Å; M318-P320 CarbonylContact O-C 3.58Å; M318-S321 WeakPolarHBondContact O-CB 3.45Å; M318-S321 PolarHBondContact O-N 3.48Å; M318-S321 PolarHBondContact O-OG 3.45Å; M318-W324 PolarHBondContact N-O 2.86Å; M318-P350 HydrophobicContact CE-CG 4.28Å; M318-Y361 HydrophobicContact SD-CD1 4.5Å; M318-Y361 HydrophobicContact SD-CE1 3.73Å; M318-F387 HydrophobicContact CE-CZ 4.3Å; M318-F387 HydrophobicContact SD-CE2 4.4Å; M318-F387 HydrophobicContact SD-CZ 3.81Å; M318-V398 HydrophobicContact CE-CB 3.56Å; M318-V398 HydrophobicContact CE-CG1 3.63Å; M318-V398 HydrophobicContact CE-CG2 3.83Å
319	G	90.3	Very high	95.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.2	-172.6	0	0	0	0	0	113.6	W213 N227 H228	W213-G319 VanDerWaalsContact CH2-O 3.25Å; W213-G319 WeakPolarHBondContact CH2-O 3.41Å; W213-G319 VanDerWaalsContact CZ3-O 3.31Å; W213-G319 WeakPolarHBondContact CZ3-O 3.47Å; N227-G319 CarbonylContact C-O 3.53Å; N227-G319 VanDerWaalsContact CA-O 3.23Å; N227-G319 WeakPolarHBondContact CA-O 3.36Å; H228-G319 VanDerWaalsContact CE1-CA 3.49Å; H228-G319 WeakPolarHBondContact CE1-CA 3.45Å; H228-G319 PolarHBondContact N-O 2.69Å; H228-G319 PolarHBondContact ND1-O 3.47Å; H228-G319 PolarHBondContact O-N 2.79Å
320	P	94	Very high	95	Very high	28 Å²	28	10.1 Å²	10.1	18%	0.182	7%	0.069	C	C	.	.	S	Bend	cis	-72.3	146	-11.6	33.4	-36.1	0	0	0	111.1	P223 T226 M318 Y361 E362	P223-P320 HydrophobicContact CB-CG 3.8Å; P223-P320 HydrophobicContact CG-CG 4.06Å; T226-P320 WeakPolarHBondContact O-CD 3.22Å; M318-P320 CarbonylContact O-C 3.58Å; P320-Y361 CarbonylContact C-O 3.51Å; P320-Y361 WeakPolarHBondContact CB-O 3.34Å; P320-Y361 WeakPolarHBondContact O-CA 3.38Å; P320-Y361 WeakPolarHBondContact O-CB 3.45Å; P320-Y361 WeakPolarHBondContact O-CD1 3.28Å; P320-E362 HydrophobicContact CB-CG 4.35Å; P320-E362 HydrophobicContact CG-CG 3.64Å
321	S	94.4	Very high	94.9	Very high	16 Å²	16	12 Å²	12	11%	0.112	8%	0.078	C	C	.	.	S	Bend	trans	-154.5	170.3	165.4	67.4	0	0	0	0	108.6	M318 W324 Y361	M318-S321 WeakPolarHBondContact O-CB 3.45Å; M318-S321 PolarHBondContact O-N 3.48Å; M318-S321 PolarHBondContact O-OG 3.45Å; S321-W324 WeakPolarHBondContact OG-CB 3.18Å; S321-W324 PolarHBondContact OG-N 2.98Å; S321-W324 PolarHBondContact OG-O 3.39Å; S321-Y361 WeakPolarHBondContact CA-O 3.25Å; S321-Y361 PolarHBondContact N-O 3.35Å
322	P	91.8	Very high	94.8	Very high	7 Å²	7	14.7 Å²	14.7	5%	0.045	9%	0.092	C	C	.	.	S	Bend	trans	-64.5	-57.9	174.4	-16.8	30.9	0	0	0	111	W324 D356 G358	P322-W324 HydrophobicContact CG-CZ2 4.04Å; P322-D356 HydrophobicContact CB-CB 3.92Å; P322-G358 VanDerWaalsContact CG-C 3.48Å; P322-G358 WeakPolarHBondContact CG-O 3.37Å
323	D	95.8	Very high	94.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-154.3	25.4	-177.8	70.2	-5.4	0	0	0	113	A258 E259 N325 A353 G354 T355 D356	A258-D323 HydrophobicContact CB-CB 4Å; A258-D323 WeakPolarHBondContact O-CA 3.49Å; E259-D323 HydrophobicContact CG-CB 4.42Å; D323-N325 PolarHBondContact O-ND2 3.36Å; D323-A353 HydrophobicContact CB-CB 4.03Å; D323-A353 WeakPolarHBondContact O-CB 3.46Å; D323-A353 PolarHBondContact O-N 2.85Å; D323-A353 PolarHBondContact OD2-N 3.2Å; D323-G354 PolarHBondContact OD2-N 3.24Å; D323-T355 PolarHBondContact OD2-N 3.25Å; D323-D356 HydrophobicContact CB-CB 4.2Å; D323-D356 PolarHBondContact OD2-N 2.89Å
324	W	96.8	Very high	94.5	Very high	6 Å²	6	15.6 Å²	15.6	2%	0.023	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	127.1	-168.6	-52.9	-19.8	0	0	0	113.1	M318 S321 P322 W351 Y361 L377 P386 F387	M318-W324 PolarHBondContact N-O 2.86Å; S321-W324 WeakPolarHBondContact OG-CB 3.18Å; S321-W324 PolarHBondContact OG-N 2.98Å; S321-W324 PolarHBondContact OG-O 3.39Å; P322-W324 HydrophobicContact CG-CZ2 4.04Å; W324-W351 WeakPolarHBondContact CA-O 2.97Å; W324-Y361 HydrophobicContact CE3-CD1 4.16Å; W324-Y361 HydrophobicContact CE3-CE1 4.31Å; W324-Y361 AromaticContact CZ3-CD1 3.69Å; W324-Y361 HydrophobicContact CZ3-CD1 3.69Å; W324-Y361 AromaticContact CZ3-CE1 3.89Å; W324-Y361 HydrophobicContact CZ3-CE1 3.89Å; W324-Y361 HydrophobicContact CZ3-CG 4.4Å; W324-L377 HydrophobicContact CD2-CD1 3.82Å; W324-L377 HydrophobicContact CE3-CD1 4.16Å; W324-L377 HydrophobicContact CG-CD1 4.07Å; W324-P386 HydrophobicContact CH2-CG 3.95Å; W324-P386 HydrophobicContact CZ3-CG 3.74Å; W324-F387 HydrophobicContact CE3-CE2 4.02Å; W324-F387 HydrophobicContact CZ3-CD2 4.45Å; W324-F387 AromaticContact CZ3-CE2 3.91Å; W324-F387 HydrophobicContact CZ3-CE2 3.91Å
325	N	97.4	Very high	94	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	168.2	-179.7	-67.9	-73.9	0	0	0	112.6	A258 T316 M317 D323 P350 W351	A258-N325 WeakPolarHBondContact CA-ND2 3.4Å; A258-N325 WeakPolarHBondContact CB-ND2 3.27Å; T316-N325 CarbonylContact O-C 3.36Å; T316-N325 WeakPolarHBondContact O-CA 3.36Å; M317-N325 VanDerWaalsContact CA-OD1 3.27Å; M317-N325 WeakPolarHBondContact CA-OD1 3.3Å; M317-N325 PolarHBondContact N-OD1 2.88Å; D323-N325 PolarHBondContact O-ND2 3.36Å; N325-P350 CarbonylContact O-C 3.16Å; N325-P350 VanDerWaalsContact O-CA 3.29Å; N325-P350 WeakPolarHBondContact O-CA 3.18Å; N325-W351 HydrophobicContact CB-CD2 3.8Å; N325-W351 HydrophobicContact CB-CE3 3.84Å; N325-W351 HydrophobicContact CB-CH2 3.47Å; N325-W351 VanDerWaalsContact CB-CH2 3.47Å; N325-W351 HydrophobicContact CB-CZ2 3.4Å; N325-W351 HydrophobicContact CB-CZ3 3.68Å; N325-W351 PolarHBondContact N-O 2.87Å; N325-W351 WeakPolarHBondContact ND2-CZ3 3.03Å; N325-W351 PolarHBondContact O-N 3.01Å
326	V	97.3	Very high	93.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.2	160.8	-59.2	0	0	0	0	109.1	F209 W229 L315 T316 L348 V398	F209-V326 HydrophobicContact CE2-CG2 3.72Å; F209-V326 HydrophobicContact CZ-CG2 3.91Å; W229-V326 HydrophobicContact CE3-CG2 4.09Å; W229-V326 HydrophobicContact CH2-CG1 3.89Å; W229-V326 HydrophobicContact CH2-CG2 3.89Å; W229-V326 HydrophobicContact CZ3-CB 4.26Å; W229-V326 HydrophobicContact CZ3-CG1 3.84Å; W229-V326 HydrophobicContact CZ3-CG2 3.38Å; L315-V326 CarbonylContact C-O 3.56Å; L315-V326 WeakPolarHBondContact CA-O 3.2Å; T316-V326 HydrophobicContact CG2-CG2 3.53Å; T316-V326 PolarHBondContact N-O 2.83Å; T316-V326 PolarHBondContact O-N 2.87Å; V326-L348 HydrophobicContact CB-CB 4.3Å; V326-L348 HydrophobicContact CB-CD1 4.33Å; V326-L348 HydrophobicContact CG2-CD1 4.4Å; V326-V398 HydrophobicContact CG1-CG2 3.55Å
327	G	93.7	Very high	92.8	Very high	7 Å²	7	26.6 Å²	26.6	7%	0.072	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.9	-177.7	176.9	0	0	0	0	0	113.3	F314 L348	F314-G327 VanDerWaalsContact O-CA 3.22Å; F314-G327 WeakPolarHBondContact O-CA 3.38Å; G327-L348 WeakPolarHBondContact O-CD2 3.42Å
328	L	93.6	Very high	92.4	Very high	12 Å²	12	27 Å²	27	6%	0.063	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.2	162.6	-65.7	-179.2	0	0	0	110	W244 M312 S313 F314 E331 Q346 L348 V401	W244-L328 VanDerWaalsContact CZ2-C 3.43Å; W244-L328 PolarHBondContact NE1-O 3.18Å; M312-L328 HydrophobicContact CE-CD1 4.05Å; S313-L328 CarbonylContact C-O 3.52Å; S313-L328 VanDerWaalsContact CA-O 3.24Å; S313-L328 WeakPolarHBondContact CA-O 3.38Å; S313-L328 WeakPolarHBondContact CB-O 3.4Å; F314-L328 HydrophobicContact CD1-CB 4.07Å; F314-L328 HydrophobicContact CD1-CG 4.39Å; F314-L328 HydrophobicContact CE1-CB 3.84Å; F314-L328 HydrophobicContact CE1-CD1 3.99Å; F314-L328 HydrophobicContact CE1-CG 3.66Å; F314-L328 HydrophobicContact CZ-CG 4.36Å; F314-L328 PolarHBondContact N-O 2.9Å; F314-L328 PolarHBondContact O-N 3.02Å; F314-L328 VanDerWaalsContact O-O 3.07Å; L328-E331 HydrophobicContact CB-CB 4.44Å; L328-E331 HydrophobicContact CD1-CB 4.16Å; L328-E331 HydrophobicContact CD1-CG 4.14Å; L328-Q346 HydrophobicContact CD2-CB 4.09Å; L328-Q346 HydrophobicContact CD2-CG 3.7Å; L328-L348 HydrophobicContact CD2-CD2 3.75Å; L328-L348 HydrophobicContact CG-CD2 4.46Å; L328-V401 HydrophobicContact CD1-CG1 3.75Å; L328-V401 HydrophobicContact CD2-CG1 4.25Å; L328-V401 HydrophobicContact CG-CG1 3.98Å
329	S	93.4	Very high	91.9	Very high	38 Å²	38	27.2 Å²	27.2	27%	0.266	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.6	173.4	157.8	0	0	0	0	108	W244 E331	W244-S329 WeakPolarHBondContact O-CB 3.17Å; W244-S329 PolarHBondContact O-OG 2.83Å; S329-E331 PolarHBondContact O-N 2.77Å
330	A	90.8	Very high	91.9	Very high	58 Å²	58	27.5 Å²	27.5	48%	0.479	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.6	39.3	172.2	0	0	0	0	0	115.8	I311 S313 D332	I311-A330 HydrophobicContact CG2-CB 4.04Å; S313-A330 PolarHBondContact OG-N 2.91Å; A330-D332 PolarHBondContact O-N 2.86Å
331	E	92.2	Very high	91.7	Very high	52 Å²	52	27.1 Å²	27.1	24%	0.243	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	118.8	177.2	-172.3	66.5	-154.5	0	0	110.6	I311 M312 L328 S329 L333	I311-E331 CarbonylContact C-O 3.56Å; I311-E331 WeakPolarHBondContact CA-O 3.4Å; M312-E331 PolarHBondContact N-O 2.7Å; M312-E331 WeakPolarHBondContact O-CB 3.32Å; M312-E331 PolarHBondContact O-N 3.36Å; L328-E331 HydrophobicContact CB-CB 4.44Å; L328-E331 HydrophobicContact CD1-CB 4.16Å; L328-E331 HydrophobicContact CD1-CG 4.14Å; S329-E331 PolarHBondContact O-N 2.77Å; E331-L333 HydrophobicContact CG-CD2 4.49Å
332	D	92.3	Very high	91.3	Very high	73 Å²	73	29.5 Å²	29.5	39%	0.39	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	121.6	-179	-163.9	-16.2	0	0	0	111.6	H310 A330 C334	H310-D332 IonicContact CE1-OD1 2.77Å; H310-D332 IonicContact CE1-OD2 3.88Å; H310-D332 PolarHBondContact CE1-OD2 2.93Å; H310-D332 VanDerWaalsContact CE1-OD2 3.28Å; H310-D332 IonicContact CG-OD1 3.25Å; H310-D332 IonicContact ND1-OD1 3.7Å; H310-D332 PolarHBondContact ND1-OD1 2.87Å; H310-D332 IonicContact ND1-OD2 3.32Å; H310-D332 PolarHBondContact ND1-OD2 2.8Å; A330-D332 PolarHBondContact O-N 2.86Å; D332-C334 VanDerWaalsContact OD1-CB 3.3Å; D332-C334 WeakPolarHBondContact OD1-CB 3.41Å; D332-C334 PolarHBondContact OD1-N 2.93Å
333	L	92.6	Very high	91.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.			trans	-97.8	-0.6	179.2	-60.5	176.5	0	0	0	113.3	Y205 F303 V305 H310 M312 E331 A341 V344 V403	Y205-L333 HydrophobicContact CD1-CD1 4.35Å; Y205-L333 HydrophobicContact CD2-CD1 3.94Å; Y205-L333 HydrophobicContact CE1-CD1 4.32Å; Y205-L333 HydrophobicContact CE1-CD2 4.39Å; Y205-L333 HydrophobicContact CE2-CB 4.17Å; Y205-L333 HydrophobicContact CE2-CD1 3.92Å; Y205-L333 HydrophobicContact CG-CD1 4.15Å; Y205-L333 PolarHBondContact OH-O 3.02Å; F303-L333 HydrophobicContact CE2-CD1 3.54Å; F303-L333 HydrophobicContact CZ-CD1 3.62Å; V305-L333 HydrophobicContact CG1-CD1 4.04Å; H310-L333 PolarHBondContact O-N 2.98Å; M312-L333 HydrophobicContact CB-CD1 4.23Å; E331-L333 HydrophobicContact CG-CD2 4.49Å; L333-A341 PolarHBondContact O-N 2.9Å; L333-V344 HydrophobicContact CD2-CG2 3.88Å; L333-V403 HydrophobicContact CD1-CG1 4.31Å; L333-V403 HydrophobicContact CD2-CG1 4.26Å
334	C	91.4	Very high	90.9	Very high	19 Å²	19	37.3 Å²	37.3	13%	0.128	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-86.7	134.7	172.6	-165.9	0	0	0	0	110.7	C197 H310 D332 W340	C197-C334 WeakPolarHBondContact CA-SG 3.1Å; C197-C334 HydrophobicContact CB-CB 3.68Å; C197-C334 WeakPolarHBondContact CB-SG 3.41Å; C197-C334 WeakPolarHBondContact SG-CB 3.38Å; C197-C334 CovalentContact SG-SG 2.03Å; C197-C334 PolarHBondContact SG-SG 3.14Å; H310-C334 HydrophobicContact CB-CB 3.93Å; D332-C334 VanDerWaalsContact OD1-CB 3.3Å; D332-C334 WeakPolarHBondContact OD1-CB 3.41Å; D332-C334 PolarHBondContact OD1-N 2.93Å; C334-W340 HydrophobicContact CB-CZ3 4.27Å
335	T	88.3	Confident	90.6	Very high	35 Å²	35	40.1 Å²	40.1	22%	0.215	22%	0.215	C	C	.	.			trans	-100.6	157.8	-179.9	87.4	0	0	0	0	112.1	E337 C338 G339 A341	T335-E337 WeakPolarHBondContact CB-OE2 3.4Å; T335-E337 PolarHBondContact O-N 2.94Å; T335-E337 VanDerWaalsContact O-N 3.15Å; T335-E337 PolarHBondContact OG1-N 2.85Å; T335-E337 PolarHBondContact OG1-OE2 3.47Å; T335-C338 PolarHBondContact O-N 3.48Å; T335-C338 VanDerWaalsContact O-N 3.13Å; T335-G339 PolarHBondContact N-O 3.39Å; T335-G339 PolarHBondContact OG1-N 3.22Å; T335-A341 HydrophobicContact CG2-CB 4.09Å
336	K	85.6	Confident	90.2	Very high	111 Å²	111	44.2 Å²	44.2	48%	0.483	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.1	178.4	-64.6	-166.5	-178.8	-166.4	0	112.5	G187 C338	G187-K336 PolarHBondContact O-NZ 3.11Å; K336-C338 PolarHBondContact O-N 3.27Å
337	E	84.6	Confident	89.9	Confident	87 Å²	87	47 Å²	47	41%	0.407	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	13.9	178.6	-52	67.9	-144.4	0	0	112.7	T335 G339 N414 I415 V416	T335-E337 WeakPolarHBondContact CB-OE2 3.4Å; T335-E337 PolarHBondContact O-N 2.94Å; T335-E337 VanDerWaalsContact O-N 3.15Å; T335-E337 PolarHBondContact OG1-N 2.85Å; T335-E337 PolarHBondContact OG1-OE2 3.47Å; E337-G339 PolarHBondContact O-N 3.11Å; E337-N414 CarbonylContact O-C 3.53Å; E337-N414 WeakPolarHBondContact O-CA 3.37Å; E337-I415 PolarHBondContact O-N 3.47Å; E337-V416 HydrophobicContact CB-CG2 4.41Å; E337-V416 HydrophobicContact CG-CG2 4.14Å
338	C	87.1	Confident	89.8	Confident	19 Å²	19	47.1 Å²	47.1	13%	0.128	25%	0.248	C	C	.	.	S	Bend	trans	58.3	34.1	-175.3	-48.3	0	0	0	0	113.2	C198 A199 T335 K336 N414	C198-C338 HydrophobicContact CB-CB 3.93Å; C198-C338 WeakPolarHBondContact CB-SG 3.33Å; C198-C338 WeakPolarHBondContact O-CB 3.33Å; C198-C338 WeakPolarHBondContact SG-CA 3.05Å; C198-C338 WeakPolarHBondContact SG-CB 3.35Å; C198-C338 CovalentContact SG-SG 2.04Å; C198-C338 PolarHBondContact SG-SG 3.05Å; A199-C338 WeakPolarHBondContact CA-O 3.28Å; T335-C338 PolarHBondContact O-N 3.48Å; T335-C338 VanDerWaalsContact O-N 3.13Å; K336-C338 PolarHBondContact O-N 3.27Å; C338-N414 WeakPolarHBondContact O-CA 3.35Å; C338-N414 PolarHBondContact O-N 3.18Å
339	G	86.7	Confident	89.7	Confident	4 Å²	4	49.7 Å²	49.7	4%	0.041	26%	0.261	C	S	.	.	S	Bend	trans	-115.3	-172.6	175.9	0	0	0	0	0	112.8	A199 T335 E337	A199-G339 WeakPolarHBondContact CB-O 3.49Å; T335-G339 PolarHBondContact N-O 3.39Å; T335-G339 PolarHBondContact OG1-N 3.22Å; E337-G339 PolarHBondContact O-N 3.11Å
340	W	90	Very high	89.8	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.019	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-117.3	124.8	-179.8	-67.1	111.4	0	0	0	108.7	A199 C200 A203 V305 H310 C334 Q342 R405	A199-W340 HydrophobicContact CB-CD2 4.12Å; A199-W340 HydrophobicContact CB-CH2 4.19Å; A199-W340 HydrophobicContact CB-CZ2 3.73Å; C200-W340 PolarHBondContact O-NE1 2.98Å; C200-W340 VanDerWaalsContact O-NE1 3.07Å; A203-W340 HydrophobicContact CB-CB 3.74Å; A203-W340 HydrophobicContact CB-CD2 3.56Å; A203-W340 HydrophobicContact CB-CE3 4.12Å; A203-W340 HydrophobicContact CB-CG 3.37Å; V305-W340 HydrophobicContact CB-CH2 4.35Å; V305-W340 HydrophobicContact CB-CZ3 3.99Å; V305-W340 HydrophobicContact CG2-CD2 4.33Å; V305-W340 HydrophobicContact CG2-CE3 3.59Å; V305-W340 HydrophobicContact CG2-CH2 4.01Å; V305-W340 HydrophobicContact CG2-CZ3 3.41Å; V305-W340 VanDerWaalsContact CG2-CZ3 3.41Å; H310-W340 HydrophobicContact CB-CH2 4.25Å; H310-W340 HydrophobicContact CB-CZ3 3.98Å; C334-W340 HydrophobicContact CB-CZ3 4.27Å; W340-Q342 PolarHBondContact O-N 2.98Å; W340-R405 PolarHBondContact O-NH1 3.38Å
341	A	90.1	Very high	90	Very high	20 Å²	20	45.3 Å²	45.3	17%	0.165	23%	0.226	C	C	.	.			trans	-55.6	123.4	-175.1	0	0	0	0	0	112.1	Y205 L333 T335 R343 V344	Y205-A341 WeakPolarHBondContact CE1-O 3.37Å; Y205-A341 PolarHBondContact OH-N 2.91Å; Y205-A341 VanDerWaalsContact OH-N 3.08Å; Y205-A341 PolarHBondContact OH-O 3.2Å; L333-A341 PolarHBondContact O-N 2.9Å; T335-A341 HydrophobicContact CG2-CB 4.09Å; A341-R343 PolarHBondContact O-N 2.87Å; A341-V344 HydrophobicContact CB-CG2 4.4Å
342	Q	86.9	Confident	90.1	Very high	66 Å²	66	43.8 Å²	43.8	31%	0.308	22%	0.22	S	C	.	.	S	Bend	trans	-65.5	-40.2	-175	-178.6	57.4	24.6	0	0	113	W340 R405 V420	W340-Q342 PolarHBondContact O-N 2.98Å; Q342-R405 PolarHBondContact O-N 2.85Å; Q342-V420 HydrophobicContact CG-CG2 4.29Å
343	R	88.4	Confident	90.2	Very high	147 Å²	147	40.3 Å²	40.3	56%	0.555	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-156	126	-172.2	-171.6	179	-154	-149.7	7.9	111.2	A341 V345 V403 E404	A341-R343 PolarHBondContact O-N 2.87Å; R343-V345 HydrophobicContact CG-CG2 4.16Å; R343-V403 CarbonylContact C-O 3.57Å; R343-V403 VanDerWaalsContact CA-O 3.31Å; R343-V403 WeakPolarHBondContact CA-O 3.17Å; R343-E404 HydrophobicContact CB-CG 4.46Å; R343-E404 HydrophobicContact CG-CG 3.82Å; R343-E404 IonicContact CZ-OE1 2.73Å; R343-E404 IonicContact NE-OE1 3.41Å; R343-E404 PolarHBondContact NE-OE1 2.9Å; R343-E404 IonicContact NH2-OE1 2.73Å; R343-E404 PolarHBondContact NH2-OE1 3.14Å
344	V	88.9	Confident	90.2	Very high	24 Å²	24	40.4 Å²	40.4	15%	0.145	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.3	169.3	-175.8	0	0	0	0	108.5	L333 A341 I402 V403	L333-V344 HydrophobicContact CD2-CG2 3.88Å; A341-V344 HydrophobicContact CB-CG2 4.4Å; V344-I402 WeakPolarHBondContact O-CA 3.2Å; V344-V403 HydrophobicContact CB-CB 4.19Å; V344-V403 PolarHBondContact N-O 2.99Å; V344-V403 PolarHBondContact O-N 3.48Å
345	V	91	Very high	90.2	Very high	66 Å²	66	40.1 Å²	40.1	40%	0.4	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	115.7	175.5	-179.3	0	0	0	0	107.6	R343 R400 V401 I402	R343-V345 HydrophobicContact CG-CG2 4.16Å; V345-R400 HydrophobicContact CG1-CG 4.18Å; V345-V401 WeakPolarHBondContact CA-O 3.13Å; V345-I402 HydrophobicContact CG1-CG1 4.28Å; V345-I402 HydrophobicContact CG2-CG1 4.25Å; V345-I402 HydrophobicContact CG2-CG2 4.35Å
346	Q	88.4	Confident	90.4	Very high	86 Å²	86	38.7 Å²	38.7	40%	0.402	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.1	-177.8	-174.3	54.2	51.6	0	0	110.8	L328 L348 R400 V401	L328-Q346 HydrophobicContact CD2-CB 4.09Å; L328-Q346 HydrophobicContact CD2-CG 3.7Å; Q346-L348 HydrophobicContact CG-CD2 4.06Å; Q346-R400 WeakPolarHBondContact O-CA 3.28Å; Q346-V401 HydrophobicContact CB-CG1 3.93Å; Q346-V401 PolarHBondContact N-O 3.34Å; Q346-V401 PolarHBondContact O-N 2.96Å
347	D	91.1	Very high	90.6	Very high	59 Å²	59	35.9 Å²	35.9	32%	0.316	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	136.1	170.7	-80.1	-35	0	0	0	109.7	P397 R400	D347-P397 HydrophobicContact CB-CB 3.91Å; D347-P397 HydrophobicContact CB-CG 3.87Å; D347-R400 VanDerWaalsContact CG-NH2 3.29Å; D347-R400 WeakPolarHBondContact OD1-CB 2.87Å; D347-R400 IonicContact OD1-CZ 3.68Å; D347-R400 VanDerWaalsContact OD1-CZ 3.25Å; D347-R400 IonicContact OD1-NE 3.4Å; D347-R400 PolarHBondContact OD1-NE 3.18Å; D347-R400 IonicContact OD1-NH2 3.71Å; D347-R400 PolarHBondContact OD1-NH2 2.74Å; D347-R400 IonicContact OD2-CZ 3.07Å; D347-R400 IonicContact OD2-NE 2.72Å; D347-R400 IonicContact OD2-NH2 2.74Å; D347-R400 PolarHBondContact OD2-NH2 2.73Å
348	L	92.3	Very high	90.9	Very high	9 Å²	9	32.3 Å²	32.3	5%	0.047	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.1	-171.4	-55.3	179.4	0	0	0	110.9	F209 F314 V326 G327 L328 Q346 P397 V398 A399 V401	F209-L348 HydrophobicContact CE2-CD1 4.2Å; F314-L348 HydrophobicContact CZ-CD1 4.13Å; V326-L348 HydrophobicContact CB-CB 4.3Å; V326-L348 HydrophobicContact CB-CD1 4.33Å; V326-L348 HydrophobicContact CG2-CD1 4.4Å; G327-L348 WeakPolarHBondContact O-CD2 3.42Å; L328-L348 HydrophobicContact CD2-CD2 3.75Å; L328-L348 HydrophobicContact CG-CD2 4.46Å; Q346-L348 HydrophobicContact CG-CD2 4.06Å; L348-P397 CarbonylContact O-C 3.46Å; L348-P397 WeakPolarHBondContact O-CA 3.34Å; L348-V398 WeakPolarHBondContact O-CG2 3.07Å; L348-V398 PolarHBondContact O-N 2.81Å; L348-A399 HydrophobicContact CB-CB 4.27Å; L348-A399 HydrophobicContact CD1-CB 4.29Å; L348-A399 PolarHBondContact N-O 3.07Å; L348-A399 PolarHBondContact O-N 2.84Å; L348-V401 HydrophobicContact CD1-CB 4.29Å; L348-V401 HydrophobicContact CD1-CG1 4.13Å; L348-V401 HydrophobicContact CD2-CG1 4.23Å; L348-V401 HydrophobicContact CG-CG1 4.3Å
349	I	92.6	Very high	91	Very high	66 Å²	66	33.7 Å²	33.7	34%	0.338	18%	0.179	S	C	.	.			trans	-105	157.1	167.1	59.9	171.9	0	0	0	109.4	P376 I395	I349-P376 HydrophobicContact CD1-CB 3.9Å; I349-I395 HydrophobicContact CG2-CB 4.34Å
350	P	94.5	Very high	91.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.188	C	C	.	.			trans	-69.6	151	176.1	-2.6	17.9	0	0	0	111.5	M318 N325 L377 F387 V398	M318-P350 HydrophobicContact CE-CG 4.28Å; N325-P350 CarbonylContact O-C 3.16Å; N325-P350 VanDerWaalsContact O-CA 3.29Å; N325-P350 WeakPolarHBondContact O-CA 3.18Å; P350-L377 HydrophobicContact CB-CD1 3.81Å; P350-L377 HydrophobicContact CB-CG 4.25Å; P350-L377 HydrophobicContact CG-CD1 4.21Å; P350-L377 PolarHBondContact O-N 2.81Å; P350-F387 HydrophobicContact CG-CD2 4.48Å; P350-F387 HydrophobicContact CG-CE1 4.2Å; P350-F387 HydrophobicContact CG-CE2 3.85Å; P350-F387 HydrophobicContact CG-CZ 3.69Å; P350-V398 HydrophobicContact CG-CG1 3.92Å; P350-V398 HydrophobicContact CG-CG2 3.85Å
351	W	94.4	Very high	91.1	Very high	3 Å²	3	35.1 Å²	35.1	1%	0.011	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	146.8	171.4	53.2	-101.1	0	0	0	110.9	W244 F246 V254 L315 W324 N325 A353 I374 R375	W244-W351 HydrophobicContact CD2-CH2 4.03Å; W244-W351 AromaticContact CD2-CZ2 3.59Å; W244-W351 HydrophobicContact CD2-CZ2 3.59Å; W244-W351 AromaticContact CE2-CZ2 3.6Å; W244-W351 HydrophobicContact CE3-CD2 4.48Å; W244-W351 AromaticContact CE3-CE2 3.98Å; W244-W351 HydrophobicContact CE3-CH2 4.27Å; W244-W351 AromaticContact CE3-CZ2 3.87Å; W244-W351 HydrophobicContact CE3-CZ2 3.87Å; W244-W351 HydrophobicContact CG-CH2 4.17Å; W244-W351 HydrophobicContact CG-CZ2 4.09Å; W244-W351 AromaticContact CH2-CD1 3.88Å; W244-W351 AromaticContact CH2-CE2 3.77Å; W244-W351 HydrophobicContact CH2-CZ2 4.17Å; W244-W351 AromaticContact CH2-NE1 3.3Å; W244-W351 VanDerWaalsContact CH2-NE1 3.3Å; W244-W351 AromaticContact CZ2-CE2 3.9Å; W244-W351 AromaticContact CZ2-CZ2 3.9Å; W244-W351 HydrophobicContact CZ2-CZ2 3.9Å; W244-W351 AromaticContact CZ2-NE1 3.55Å; W244-W351 HydrophobicContact CZ3-CD2 4.26Å; W244-W351 AromaticContact CZ3-CE2 3.81Å; W244-W351 HydrophobicContact CZ3-CG 4.44Å; W244-W351 HydrophobicContact CZ3-CZ2 4.15Å; W244-W351 AromaticContact CZ3-NE1 3.74Å; F246-W351 HydrophobicContact CE1-CB 3.8Å; F246-W351 HydrophobicContact CE1-CG 4.18Å; F246-W351 HydrophobicContact CZ-CB 4.45Å; V254-W351 HydrophobicContact CG1-CH2 4.08Å; V254-W351 HydrophobicContact CG1-CZ3 4.28Å; L315-W351 HydrophobicContact CB-CH2 4.36Å; L315-W351 HydrophobicContact CB-CZ2 3.93Å; L315-W351 HydrophobicContact CD1-CH2 4.02Å; L315-W351 HydrophobicContact CD1-CZ2 4.43Å; W324-W351 WeakPolarHBondContact CA-O 2.97Å; N325-W351 HydrophobicContact CB-CD2 3.8Å; N325-W351 HydrophobicContact CB-CE3 3.84Å; N325-W351 HydrophobicContact CB-CH2 3.47Å; N325-W351 VanDerWaalsContact CB-CH2 3.47Å; N325-W351 HydrophobicContact CB-CZ2 3.4Å; N325-W351 HydrophobicContact CB-CZ3 3.68Å; N325-W351 PolarHBondContact N-O 2.87Å; N325-W351 WeakPolarHBondContact ND2-CZ3 3.03Å; N325-W351 PolarHBondContact O-N 3.01Å; W351-A353 HydrophobicContact CZ3-CB 4.2Å; W351-I374 HydrophobicContact CD2-CG2 4.17Å; W351-I374 HydrophobicContact CE3-CG2 3.62Å; W351-I374 HydrophobicContact CZ3-CG2 4Å; W351-R375 CarbonylContact C-O 3.4Å; W351-R375 VanDerWaalsContact CA-O 3.25Å; W351-R375 WeakPolarHBondContact CA-O 3.5Å; W351-R375 VanDerWaalsContact CB-O 3.22Å; W351-R375 WeakPolarHBondContact CB-O 3.37Å
352	D	95.4	Very high	91.1	Very high	21 Å²	21	40.2 Å²	40.2	11%	0.112	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	132.5	-179	174.1	-33.6	0	0	0	108.2	G354 I374 R375 L377	D352-G354 WeakPolarHBondContact OD1-CA 3.4Å; D352-G354 PolarHBondContact OD1-N 3.33Å; D352-I374 WeakPolarHBondContact O-CA 3.44Å; D352-R375 HydrophobicContact CB-CG 3.89Å; D352-R375 PolarHBondContact N-O 2.95Å; D352-R375 PolarHBondContact O-N 2.91Å; D352-R375 IonicContact OD2-CZ 2.73Å; D352-R375 VanDerWaalsContact OD2-CZ 3.23Å; D352-R375 IonicContact OD2-NE 3.56Å; D352-R375 PolarHBondContact OD2-NE 2.85Å; D352-R375 VanDerWaalsContact OD2-NE 3.1Å; D352-R375 IonicContact OD2-NH2 3.48Å; D352-R375 PolarHBondContact OD2-NH2 2.87Å; D352-L377 HydrophobicContact CB-CD2 3.79Å
353	A	93.8	Very high	91.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.			trans	-84.7	-14	-176.6	0	0	0	0	0	113.4	A250 A258 D323 W351	A250-A353 HydrophobicContact CB-CB 4.46Å; A258-A353 HydrophobicContact CB-CB 3.75Å; D323-A353 HydrophobicContact CB-CB 4.03Å; D323-A353 WeakPolarHBondContact O-CB 3.46Å; D323-A353 PolarHBondContact O-N 2.85Å; D323-A353 PolarHBondContact OD2-N 3.2Å; W351-A353 HydrophobicContact CZ3-CB 4.2Å
354	G	92.8	Very high	91	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.01	21%	0.212	C	C	.	.	S	Bend	trans	79.6	23	-178.9	0	0	0	0	0	114	D323 D352 P371 D372	D323-G354 PolarHBondContact OD2-N 3.24Å; D352-G354 WeakPolarHBondContact OD1-CA 3.4Å; D352-G354 PolarHBondContact OD1-N 3.33Å; G354-P371 WeakPolarHBondContact O-CA 3.31Å; G354-D372 PolarHBondContact O-N 3.37Å
355	T	91.7	Very high	90.7	Very high	14 Å²	14	41 Å²	41	9%	0.086	24%	0.235	C	C	.	.	S	Bend	trans	-118.5	-24.6	-173.7	71.3	0	0	0	0	114.6	A250 K255 E259 D323 T368	A250-T355 HydrophobicContact CB-CG2 4.1Å; K255-T355 HydrophobicContact CB-CG2 4.31Å; K255-T355 HydrophobicContact CD-CG2 4.22Å; K255-T355 HydrophobicContact CG-CG2 3.99Å; E259-T355 WeakPolarHBondContact OE1-CB 3.28Å; E259-T355 PolarHBondContact OE1-OG1 3.2Å; D323-T355 PolarHBondContact OD2-N 3.25Å; T355-T368 VanDerWaalsContact C-OG1 3.32Å; T355-T368 PolarHBondContact O-N 2.92Å; T355-T368 PolarHBondContact O-OG1 2.89Å
356	D	91.4	Very high	90.5	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-131.6	121	172.5	-161.9	-65.1	0	0	0	112.2	P322 D323 G358 N365 N366 T368	P322-D356 HydrophobicContact CB-CB 3.92Å; D323-D356 HydrophobicContact CB-CB 4.2Å; D323-D356 PolarHBondContact OD2-N 2.89Å; D356-G358 PolarHBondContact O-N 3Å; D356-G358 PolarHBondContact OD1-N 2.66Å; D356-N365 WeakPolarHBondContact OD2-CA 3.48Å; D356-N365 WeakPolarHBondContact OD2-CB 3.49Å; D356-N366 PolarHBondContact OD1-N 2.76Å; D356-N366 PolarHBondContact OD2-N 2.8Å; D356-T368 PolarHBondContact N-OG1 3.11Å
357	S	90.3	Very high	90.4	Very high	53 Å²	53	42.6 Å²	42.6	37%	0.371	25%	0.249	S	C	.	.			trans	-79.9	30.6	-178.3	-58.4	0	0	0	0	113.8	N366 T368	S357-N366 WeakPolarHBondContact CB-ND2 3.03Å; S357-N366 WeakPolarHBondContact CB-O 3.07Å; S357-N366 PolarHBondContact N-O 2.99Å; S357-N366 PolarHBondContact O-ND2 2.85Å; S357-T368 PolarHBondContact N-OG1 2.87Å; S357-T368 PolarHBondContact OG-OG1 3.4Å
358	G	90.4	Very high	89.8	Confident	12 Å²	12	41.1 Å²	41.1	12%	0.124	24%	0.242	C	C	.	.			trans	-71.9	148.4	172.2	0	0	0	0	0	112.1	P322 D356	P322-G358 VanDerWaalsContact CG-C 3.48Å; P322-G358 WeakPolarHBondContact CG-O 3.37Å; D356-G358 PolarHBondContact O-N 3Å; D356-G358 PolarHBondContact OD1-N 2.66Å
359	V	89.2	Confident	88.7	Confident	48 Å²	48	46 Å²	46	29%	0.291	28%	0.284	S	S	.	.			trans	-111.2	-4.4	-173.4	-61.2	0	0	0	0	114.9	H382 Q384 S385	V359-H382 HydrophobicContact CG1-CB 4.41Å; V359-Q384 HydrophobicContact CG2-CB 4.12Å; V359-S385 VanDerWaalsContact O-CA 3.28Å; V359-S385 WeakPolarHBondContact O-CA 3.45Å
360	S	90.6	Very high	88	Confident	33 Å²	33	46 Å²	46	23%	0.231	29%	0.294	C	S	.	.	S	Bend	trans	-147.3	165	-179.1	68.2	0	0	0	0	110.9	E362 A363	S360-E362 VanDerWaalsContact C-N 3.29Å; S360-E362 PolarHBondContact O-N 2.96Å; S360-A363 VanDerWaalsContact O-CB 3.3Å; S360-A363 WeakPolarHBondContact O-CB 3.48Å; S360-A363 PolarHBondContact O-N 2.79Å; S360-A363 VanDerWaalsContact O-N 3.13Å
361	Y	89.9	Confident	87.4	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.02	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-41.8	-175.3	-61.3	-63.7	0	0	0	114.1	W213 D221 P223 M318 P320 S321 W324 P386 F387	W213-Y361 AromaticContact CE2-CE1 3.86Å; W213-Y361 AromaticContact CE2-CZ 3.94Å; W213-Y361 HydrophobicContact CH2-CE1 4.48Å; W213-Y361 AromaticContact CZ2-CD1 3.83Å; W213-Y361 HydrophobicContact CZ2-CD1 3.83Å; W213-Y361 AromaticContact CZ2-CE1 3.46Å; W213-Y361 HydrophobicContact CZ2-CE1 3.46Å; W213-Y361 VanDerWaalsContact CZ2-CE1 3.46Å; W213-Y361 HydrophobicContact CZ2-CE2 4.39Å; W213-Y361 HydrophobicContact CZ2-CG 4.46Å; W213-Y361 AromaticContact CZ2-CZ 3.77Å; W213-Y361 AromaticContact NE1-CE1 3.78Å; W213-Y361 AromaticContact NE1-CZ 3.5Å; W213-Y361 PolarHBondContact NE1-OH 2.64Å; D221-Y361 VanDerWaalsContact O-CD2 3.27Å; D221-Y361 WeakPolarHBondContact O-CD2 3.03Å; P223-Y361 HydrophobicContact CG-CD2 4.29Å; P223-Y361 HydrophobicContact CG-CG 4.17Å; M318-Y361 HydrophobicContact SD-CD1 4.5Å; M318-Y361 HydrophobicContact SD-CE1 3.73Å; P320-Y361 CarbonylContact C-O 3.51Å; P320-Y361 WeakPolarHBondContact CB-O 3.34Å; P320-Y361 WeakPolarHBondContact O-CA 3.38Å; P320-Y361 WeakPolarHBondContact O-CB 3.45Å; P320-Y361 WeakPolarHBondContact O-CD1 3.28Å; S321-Y361 WeakPolarHBondContact CA-O 3.25Å; S321-Y361 PolarHBondContact N-O 3.35Å; W324-Y361 HydrophobicContact CE3-CD1 4.16Å; W324-Y361 HydrophobicContact CE3-CE1 4.31Å; W324-Y361 AromaticContact CZ3-CD1 3.69Å; W324-Y361 HydrophobicContact CZ3-CD1 3.69Å; W324-Y361 AromaticContact CZ3-CE1 3.89Å; W324-Y361 HydrophobicContact CZ3-CE1 3.89Å; W324-Y361 HydrophobicContact CZ3-CG 4.4Å; Y361-P386 HydrophobicContact CD1-CG 4.17Å; Y361-P386 HydrophobicContact CD2-CB 3.81Å; Y361-P386 HydrophobicContact CD2-CG 3.76Å; Y361-P386 HydrophobicContact CE1-CB 4.38Å; Y361-P386 HydrophobicContact CE1-CG 3.76Å; Y361-P386 HydrophobicContact CE2-CB 3.14Å; Y361-P386 HydrophobicContact CE2-CG 3.36Å; Y361-P386 HydrophobicContact CG-CG 4.16Å; Y361-P386 VanDerWaalsContact CZ-CB 3.48Å; Y361-F387 HydrophobicContact CE1-CE2 4.2Å; Y361-F387 HydrophobicContact CE1-CZ 4.05Å; Y361-F387 WeakPolarHBondContact OH-CZ 3.44Å
362	E	88.5	Confident	87.1	Confident	128 Å²	128	55 Å²	55	60%	0.598	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	29.6	-177.5	-61.1	-171.8	147.8	0	0	111.5	P223 T226 P320 S360	P223-E362 HydrophobicContact CB-CG 4.49Å; T226-E362 PolarHBondContact OG1-OE1 3.06Å; P320-E362 HydrophobicContact CB-CG 4.35Å; P320-E362 HydrophobicContact CG-CG 3.64Å; S360-E362 VanDerWaalsContact C-N 3.29Å; S360-E362 PolarHBondContact O-N 2.96Å
363	A	88	Confident	86.9	Confident	23 Å²	23	60.2 Å²	60.2	19%	0.19	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-63.7	143.3	171.6	0	0	0	0	0	110.9	S360	S360-A363 VanDerWaalsContact O-CB 3.3Å; S360-A363 WeakPolarHBondContact O-CB 3.48Å; S360-A363 PolarHBondContact O-N 2.79Å; S360-A363 VanDerWaalsContact O-N 3.13Å
364	P	84.8	Confident	86.6	Confident	113 Å²	113	60.3 Å²	60.3	73%	0.734	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-68.7	140.7	172	30.3	-34.2	0	0	0	110	N366	P364-N366 PolarHBondContact O-N 3.48Å
365	N	83.2	Confident	86.4	Confident	118 Å²	118	64.5 Å²	64.5	63%	0.631	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-49.7	125.3	179.8	-61.7	63.3	0	0	0	111.8	D356	D356-N365 WeakPolarHBondContact OD2-CA 3.48Å; D356-N365 WeakPolarHBondContact OD2-CB 3.49Å
366	N	87.9	Confident	86.3	Confident	88 Å²	88	66.3 Å²	66.3	47%	0.471	40%	0.396	S	S	.	.			trans	-131.6	76.7	-178.5	-176.2	29.7	0	0	0	109.3	D356 S357 P364 T368	D356-N366 PolarHBondContact OD1-N 2.76Å; D356-N366 PolarHBondContact OD2-N 2.8Å; S357-N366 WeakPolarHBondContact CB-ND2 3.03Å; S357-N366 WeakPolarHBondContact CB-O 3.07Å; S357-N366 PolarHBondContact N-O 2.99Å; S357-N366 PolarHBondContact O-ND2 2.85Å; P364-N366 PolarHBondContact O-N 3.48Å; N366-T368 PolarHBondContact O-N 3.45Å
367	P	85.1	Confident	86	Confident	97 Å²	97	66.4 Å²	66.4	63%	0.63	40%	0.397	S	S	*	.	B	Isolated β-bridge	trans	-56.9	128.1	-169.7	-26.2	34.9	0	0	0	112.9	A369	P367-A369 PolarHBondContact O-N 3.21Å
368	T	79.3	Confident	85.9	Confident	28 Å²	28	66.9 Å²	66.9	17%	0.172	40%	0.398	C	S	.	.			trans	-67.8	123.8	-177.4	-48.5	0	0	0	0	109.8	T355 D356 S357 N366 A370	T355-T368 VanDerWaalsContact C-OG1 3.32Å; T355-T368 PolarHBondContact O-N 2.92Å; T355-T368 PolarHBondContact O-OG1 2.89Å; D356-T368 PolarHBondContact N-OG1 3.11Å; S357-T368 PolarHBondContact N-OG1 2.87Å; S357-T368 PolarHBondContact OG-OG1 3.4Å; N366-T368 PolarHBondContact O-N 3.45Å; T368-A370 WeakPolarHBondContact CG2-O 3.05Å; T368-A370 PolarHBondContact O-N 3.47Å; T368-A370 VanDerWaalsContact O-N 3.13Å
369	A	69.8	Low	85.5	Confident	112 Å²	112	66.7 Å²	66.7	93%	0.926	39%	0.394	S	S	*	.	S	Bend	trans	-64.3	-22.1	-168.3	0	0	0	0	0	114.4	P367	P367-A369 PolarHBondContact O-N 3.21Å
370	A	77.8	Confident	85.2	Confident	65 Å²	65	68 Å²	68	54%	0.537	40%	0.399	S	S	.	.	S	Bend	trans	-135.5	139	161.8	0	0	0	0	0	107.1	T368 D372	T368-A370 WeakPolarHBondContact CG2-O 3.05Å; T368-A370 PolarHBondContact O-N 3.47Å; T368-A370 VanDerWaalsContact O-N 3.13Å; A370-D372 PolarHBondContact O-N 3.35Å
371	P	81.9	Confident	84.6	Confident	90 Å²	90	69 Å²	69	58%	0.584	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-60.2	121.6	179	-24.3	34.4	0	0	0	111.2	G354	G354-P371 WeakPolarHBondContact O-CA 3.31Å
372	D	87.6	Confident	84.4	Confident	101 Å²	101	72.1 Å²	72.1	54%	0.54	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-79.7	171.6	173.7	-86.5	-41.7	0	0	0	110.8	L249 G354 A370	L249-D372 WeakPolarHBondContact CD2-O 3.28Å; G354-D372 PolarHBondContact O-N 3.37Å; A370-D372 PolarHBondContact O-N 3.35Å
373	K	90.1	Very high	84.3	Confident	131 Å²	131	69.8 Å²	69.8	57%	0.57	41%	0.412	S	S	*	.	B	Isolated β-bridge	trans	-85.2	139.7	-179.7	-71.1	178.5	165.6	-152.4	0	111.3	G247 G248 L249 R375	G247-K373 VanDerWaalsContact O-CD 3.23Å; G247-K373 WeakPolarHBondContact O-CD 3.33Å; G247-K373 WeakPolarHBondContact O-CE 3.38Å; G247-K373 PolarHBondContact O-NZ 3.23Å; G248-K373 CarbonylContact O-C 3.59Å; G248-K373 WeakPolarHBondContact O-CA 3.43Å; L249-K373 HydrophobicContact CD2-CG 4.15Å; K373-R375 PolarHBondContact O-N 2.91Å
374	I	88.7	Confident	84.3	Confident	3 Å²	3	74.7 Å²	74.7	2%	0.015	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-55.8	124.6	175.1	-62.1	170.7	0	0	0	109.5	W244 F246 G247 G248 A250 W351 D352	W244-I374 HydrophobicContact CB-CD1 4.03Å; W244-I374 HydrophobicContact CE3-CG2 4.15Å; W244-I374 HydrophobicContact CZ3-CG2 4.46Å; F246-I374 HydrophobicContact CD1-CG2 4.15Å; G247-I374 PolarHBondContact N-O 2.72Å; G248-I374 PolarHBondContact O-N 2.84Å; A250-I374 HydrophobicContact CB-CD1 4.38Å; A250-I374 HydrophobicContact CB-CG1 4.48Å; W351-I374 HydrophobicContact CD2-CG2 4.17Å; W351-I374 HydrophobicContact CE3-CG2 3.62Å; W351-I374 HydrophobicContact CZ3-CG2 4Å; D352-I374 WeakPolarHBondContact O-CA 3.44Å
375	R	88.4	Confident	84.6	Confident	89 Å²	89	69.5 Å²	69.5	34%	0.336	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.2	-174.7	64.3	178	-166.2	86.6	5.3	110.8	W351 D352 K373 D381	W351-R375 CarbonylContact C-O 3.4Å; W351-R375 VanDerWaalsContact CA-O 3.25Å; W351-R375 WeakPolarHBondContact CA-O 3.5Å; W351-R375 VanDerWaalsContact CB-O 3.22Å; W351-R375 WeakPolarHBondContact CB-O 3.37Å; D352-R375 HydrophobicContact CB-CG 3.89Å; D352-R375 PolarHBondContact N-O 2.95Å; D352-R375 PolarHBondContact O-N 2.91Å; D352-R375 IonicContact OD2-CZ 2.73Å; D352-R375 VanDerWaalsContact OD2-CZ 3.23Å; D352-R375 IonicContact OD2-NE 3.56Å; D352-R375 PolarHBondContact OD2-NE 2.85Å; D352-R375 VanDerWaalsContact OD2-NE 3.1Å; D352-R375 IonicContact OD2-NH2 3.48Å; D352-R375 PolarHBondContact OD2-NH2 2.87Å; K373-R375 PolarHBondContact O-N 2.91Å; R375-D381 IonicContact CZ-OD2 4Å; R375-D381 VanDerWaalsContact NH1-CG 3.31Å; R375-D381 IonicContact NH1-OD1 3.14Å; R375-D381 PolarHBondContact NH1-OD1 2.95Å; R375-D381 IonicContact NH1-OD2 3.96Å; R375-D381 PolarHBondContact NH1-OD2 3.13Å; R375-D381 IonicContact NH2-OD2 2.65Å; R375-D381 PolarHBondContact NH2-OD2 3.3Å; R375-D381 VanDerWaalsContact NH2-OD2 3.1Å
376	P	89.1	Confident	85	Confident	51 Å²	51	64.4 Å²	64.4	33%	0.331	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	146.3	167.3	29.8	-34.3	0	0	0	110.3	F246 I349	F246-P376 HydrophobicContact CE1-CB 4.26Å; F246-P376 HydrophobicContact CE1-CG 4.5Å; I349-P376 HydrophobicContact CD1-CB 3.9Å
377	L	85.9	Confident	85.2	Confident	7 Å²	7	61 Å²	61	4%	0.037	35%	0.352	C	S	.	.			trans	-68.5	148.1	166.3	-67.1	-172.8	0	0	0	110	W324 P350 D352 D381 F387 I395	W324-L377 HydrophobicContact CD2-CD1 3.82Å; W324-L377 HydrophobicContact CE3-CD1 4.16Å; W324-L377 HydrophobicContact CG-CD1 4.07Å; P350-L377 HydrophobicContact CB-CD1 3.81Å; P350-L377 HydrophobicContact CB-CG 4.25Å; P350-L377 HydrophobicContact CG-CD1 4.21Å; P350-L377 PolarHBondContact O-N 2.81Å; D352-L377 HydrophobicContact CB-CD2 3.79Å; L377-D381 WeakPolarHBondContact CA-OD2 3.47Å; L377-D381 WeakPolarHBondContact CD2-OD2 3.35Å; L377-F387 HydrophobicContact CD1-CD2 3.72Å; L377-F387 HydrophobicContact CD1-CE2 3.86Å; L377-I395 HydrophobicContact CB-CD1 3.78Å; L377-I395 VanDerWaalsContact O-CD1 3.3Å; L377-I395 WeakPolarHBondContact O-CD1 3.27Å
378	T	86.8	Confident	85.4	Confident	63 Å²	63	59.6 Å²	59.6	39%	0.387	34%	0.335	S	S	.	.			trans	-120.6	158.9	172.1	87.3	0	0	0	0	111.6	L380 D381	T378-L380 PolarHBondContact O-N 3.42Å; T378-L380 VanDerWaalsContact O-N 3.09Å; T378-L380 PolarHBondContact OG1-N 3.38Å; T378-D381 WeakPolarHBondContact CA-OD1 3.3Å; T378-D381 VanDerWaalsContact CB-OD1 3.25Å; T378-D381 WeakPolarHBondContact CB-OD1 3.34Å; T378-D381 WeakPolarHBondContact CG2-OD1 3.44Å; T378-D381 VanDerWaalsContact N-CG 3.32Å; T378-D381 PolarHBondContact N-OD1 2.8Å; T378-D381 VanDerWaalsContact N-OD1 3.09Å; T378-D381 PolarHBondContact N-OD2 3.3Å; T378-D381 VanDerWaalsContact N-OD2 3.13Å; T378-D381 PolarHBondContact O-N 2.88Å; T378-D381 PolarHBondContact OG1-N 2.83Å; T378-D381 PolarHBondContact OG1-OD1 2.92Å
379	S	83.4	Confident	85.7	Confident	7 Å²	7	61.8 Å²	61.8	5%	0.049	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-1.1	176.1	56.4	0	0	0	0	114.1	F387 Y388 D389 G393	S379-F387 WeakPolarHBondContact CA-O 3.38Å; S379-Y388 CarbonylContact O-C 3.53Å; S379-Y388 VanDerWaalsContact O-CA 3.23Å; S379-Y388 WeakPolarHBondContact O-CA 3.43Å; S379-Y388 WeakPolarHBondContact O-CD2 3.45Å; S379-D389 PolarHBondContact O-N 3.34Å; S379-G393 PolarHBondContact OG-N 2.99Å; S379-G393 PolarHBondContact OG-O 3.04Å
380	L	81.6	Confident	86.1	Confident	76 Å²	76	61.2 Å²	61.2	40%	0.398	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	2.2	-179.4	-63.6	175.9	0	0	0	113.3	T378 H382 Y388 D389	T378-L380 PolarHBondContact O-N 3.42Å; T378-L380 VanDerWaalsContact O-N 3.09Å; T378-L380 PolarHBondContact OG1-N 3.38Å; L380-H382 PolarHBondContact O-N 2.7Å; L380-Y388 HydrophobicContact CD2-CE2 4.38Å; L380-D389 WeakPolarHBondContact CD2-O 3.44Å
381	D	78.5	Confident	86.2	Confident	53 Å²	53	67 Å²	67	28%	0.283	35%	0.348	S	S	.	.	S	Bend	trans	-55.1	-48.2	-172.2	-76.4	6.6	0	0	0	113.5	R375 L377 T378	R375-D381 IonicContact CZ-OD2 4Å; R375-D381 VanDerWaalsContact NH1-CG 3.31Å; R375-D381 IonicContact NH1-OD1 3.14Å; R375-D381 PolarHBondContact NH1-OD1 2.95Å; R375-D381 IonicContact NH1-OD2 3.96Å; R375-D381 PolarHBondContact NH1-OD2 3.13Å; R375-D381 IonicContact NH2-OD2 2.65Å; R375-D381 PolarHBondContact NH2-OD2 3.3Å; R375-D381 VanDerWaalsContact NH2-OD2 3.1Å; L377-D381 WeakPolarHBondContact CA-OD2 3.47Å; L377-D381 WeakPolarHBondContact CD2-OD2 3.35Å; T378-D381 WeakPolarHBondContact CA-OD1 3.3Å; T378-D381 VanDerWaalsContact CB-OD1 3.25Å; T378-D381 WeakPolarHBondContact CB-OD1 3.34Å; T378-D381 WeakPolarHBondContact CG2-OD1 3.44Å; T378-D381 VanDerWaalsContact N-CG 3.32Å; T378-D381 PolarHBondContact N-OD1 2.8Å; T378-D381 VanDerWaalsContact N-OD1 3.09Å; T378-D381 PolarHBondContact N-OD2 3.3Å; T378-D381 VanDerWaalsContact N-OD2 3.13Å; T378-D381 PolarHBondContact O-N 2.88Å; T378-D381 PolarHBondContact OG1-N 2.83Å; T378-D381 PolarHBondContact OG1-OD1 2.92Å
382	H	86.1	Confident	85.9	Confident	72 Å²	72	63.6 Å²	63.6	33%	0.333	33%	0.329	S	S	.	.			trans	-159.7	140.1	177.4	-168.9	-111.7	0	0	0	111.1	V359 L380 Q384 S385 Y388	V359-H382 HydrophobicContact CG1-CB 4.41Å; L380-H382 PolarHBondContact O-N 2.7Å; H382-Q384 PolarHBondContact CE1-OE1 2.71Å; H382-Q384 PolarHBondContact ND1-N 2.84Å; H382-Q384 PolarHBondContact O-N 3.22Å; H382-S385 WeakPolarHBondContact O-CB 3.29Å; H382-S385 PolarHBondContact O-N 3.27Å; H382-Y388 WeakPolarHBondContact O-CB 3.4Å; H382-Y388 WeakPolarHBondContact O-CD2 3.49Å
383	P	86.7	Confident	85.3	Confident	78 Å²	78	61.6 Å²	61.6	51%	0.506	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.7	-178.4	-29.6	37.2	0	0	0	115.5	K220 S385 Y388	K220-P383 PolarHBondContact NZ-O 2.69Å; P383-S385 VanDerWaalsContact C-N 3.34Å; P383-Y388 HydrophobicContact CB-CE1 4.37Å; P383-Y388 HydrophobicContact CB-CE2 4.48Å; P383-Y388 HydrophobicContact CG-CE2 4.22Å
384	Q	87.5	Confident	84.9	Confident	126 Å²	126	60.1 Å²	60.1	59%	0.589	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-3.9	176.7	-59.4	178.9	-39.9	0	0	113.9	V359 H382	V359-Q384 HydrophobicContact CG2-CB 4.12Å; H382-Q384 PolarHBondContact CE1-OE1 2.71Å; H382-Q384 PolarHBondContact ND1-N 2.84Å; H382-Q384 PolarHBondContact O-N 3.22Å
385	S	91.1	Very high	84.8	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.028	35%	0.349	C	S	.	.	S	Bend	trans	-64.7	136.4	173.7	170.7	0	0	0	0	110.3	K220 V359 H382 P383 F387 Y388	K220-S385 VanDerWaalsContact CE-O 3.32Å; K220-S385 WeakPolarHBondContact CE-O 3.32Å; K220-S385 PolarHBondContact NZ-O 2.92Å; V359-S385 VanDerWaalsContact O-CA 3.28Å; V359-S385 WeakPolarHBondContact O-CA 3.45Å; H382-S385 WeakPolarHBondContact O-CB 3.29Å; H382-S385 PolarHBondContact O-N 3.27Å; P383-S385 VanDerWaalsContact C-N 3.34Å; S385-F387 PolarHBondContact O-N 3.31Å; S385-F387 PolarHBondContact OG-N 3.47Å; S385-Y388 VanDerWaalsContact O-CB 3.32Å; S385-Y388 WeakPolarHBondContact O-CB 3.42Å; S385-Y388 PolarHBondContact O-N 3.45Å
386	P	92.1	Very high	84.7	Confident	11 Å²	11	60.4 Å²	60.4	7%	0.071	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.9	176	28.7	-35.5	0	0	0	112.7	K220 W324 Y361	K220-P386 WeakPolarHBondContact O-CB 3.48Å; W324-P386 HydrophobicContact CH2-CG 3.95Å; W324-P386 HydrophobicContact CZ3-CG 3.74Å; Y361-P386 HydrophobicContact CD1-CG 4.17Å; Y361-P386 HydrophobicContact CD2-CB 3.81Å; Y361-P386 HydrophobicContact CD2-CG 3.76Å; Y361-P386 HydrophobicContact CE1-CB 4.38Å; Y361-P386 HydrophobicContact CE1-CG 3.76Å; Y361-P386 HydrophobicContact CE2-CB 3.14Å; Y361-P386 HydrophobicContact CE2-CG 3.36Å; Y361-P386 HydrophobicContact CG-CG 4.16Å; Y361-P386 VanDerWaalsContact CZ-CB 3.48Å
387	F	92.3	Very high	84.8	Confident	17 Å²	17	60.1 Å²	60.1	8%	0.075	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-0.3	174.6	-54.6	-69.5	0	0	0	113.5	H218 M318 W324 P350 Y361 L377 S379 S385 D389 I395 V398	H218-F387 AromaticContact CD2-CE1 3.78Å; M318-F387 HydrophobicContact CE-CZ 4.3Å; M318-F387 HydrophobicContact SD-CE2 4.4Å; M318-F387 HydrophobicContact SD-CZ 3.81Å; W324-F387 HydrophobicContact CE3-CE2 4.02Å; W324-F387 HydrophobicContact CZ3-CD2 4.45Å; W324-F387 AromaticContact CZ3-CE2 3.91Å; W324-F387 HydrophobicContact CZ3-CE2 3.91Å; P350-F387 HydrophobicContact CG-CD2 4.48Å; P350-F387 HydrophobicContact CG-CE1 4.2Å; P350-F387 HydrophobicContact CG-CE2 3.85Å; P350-F387 HydrophobicContact CG-CZ 3.69Å; Y361-F387 HydrophobicContact CE1-CE2 4.2Å; Y361-F387 HydrophobicContact CE1-CZ 4.05Å; Y361-F387 WeakPolarHBondContact OH-CZ 3.44Å; L377-F387 HydrophobicContact CD1-CD2 3.72Å; L377-F387 HydrophobicContact CD1-CE2 3.86Å; S379-F387 WeakPolarHBondContact CA-O 3.38Å; S385-F387 PolarHBondContact O-N 3.31Å; S385-F387 PolarHBondContact OG-N 3.47Å; F387-D389 PolarHBondContact O-N 2.92Å; F387-I395 HydrophobicContact CB-CD1 3.74Å; F387-I395 HydrophobicContact CB-CG1 4.13Å; F387-I395 HydrophobicContact CB-CG2 4.41Å; F387-I395 HydrophobicContact CD1-CG2 3.69Å; F387-I395 HydrophobicContact CE1-CG2 4.31Å; F387-I395 HydrophobicContact CG-CD1 4.11Å; F387-I395 HydrophobicContact CG-CG2 4.22Å; F387-V398 HydrophobicContact CE1-CG1 3.83Å; F387-V398 HydrophobicContact CZ-CG1 4.2Å
388	Y	89.7	Confident	85.3	Confident	68 Å²	68	59.8 Å²	59.8	27%	0.267	35%	0.352	S	S	.	.			trans	-72.9	126.3	-176.6	175.5	-85.3	0	0	0	113.1	K220 S379 L380 H382 P383 S385 P390	K220-Y388 PolarHBondContact NZ-O 3.5Å; S379-Y388 CarbonylContact O-C 3.53Å; S379-Y388 VanDerWaalsContact O-CA 3.23Å; S379-Y388 WeakPolarHBondContact O-CA 3.43Å; S379-Y388 WeakPolarHBondContact O-CD2 3.45Å; L380-Y388 HydrophobicContact CD2-CE2 4.38Å; H382-Y388 WeakPolarHBondContact O-CB 3.4Å; H382-Y388 WeakPolarHBondContact O-CD2 3.49Å; P383-Y388 HydrophobicContact CB-CE1 4.37Å; P383-Y388 HydrophobicContact CB-CE2 4.48Å; P383-Y388 HydrophobicContact CG-CE2 4.22Å; S385-Y388 VanDerWaalsContact O-CB 3.32Å; S385-Y388 WeakPolarHBondContact O-CB 3.42Å; S385-Y388 PolarHBondContact O-N 3.45Å; Y388-P390 HydrophobicContact CE1-CB 4.16Å
389	D	84.8	Confident	85.6	Confident	73 Å²	73	56.8 Å²	56.8	39%	0.39	33%	0.334	S	S	.	.			trans	-125.4	120.7	175.3	-167.1	-37.2	0	0	0	109.1	S379 L380 F387 E391 G392	S379-D389 PolarHBondContact O-N 3.34Å; L380-D389 WeakPolarHBondContact CD2-O 3.44Å; F387-D389 PolarHBondContact O-N 2.92Å; D389-E391 PolarHBondContact O-N 2.86Å; D389-E391 PolarHBondContact OD1-N 3.01Å; D389-G392 PolarHBondContact O-N 2.89Å
390	P	78.4	Confident	86	Confident	101 Å²	101	61.1 Å²	61.1	66%	0.656	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-18.4	179.8	29.8	-37.1	0	0	0	114.3	Y388 G392	Y388-P390 HydrophobicContact CE1-CB 4.16Å; P390-G392 VanDerWaalsContact C-N 3.29Å
391	E	79.9	Confident	86.6	Confident	186 Å²	186	57.6 Å²	57.6	87%	0.869	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-14.1	172.9	-59.3	-171.1	178.1	0	0	111.7	D389	D389-E391 PolarHBondContact O-N 2.86Å; D389-E391 PolarHBondContact OD1-N 3.01Å
392	G	74.7	Confident	87.3	Confident	18 Å²	18	55.9 Å²	55.9	19%	0.186	32%	0.322	C	S	.	.			trans	71.9	-172	-172	0	0	0	0	0	112.6	D389 P390	D389-G392 PolarHBondContact O-N 2.89Å; P390-G392 VanDerWaalsContact C-N 3.29Å
393	G	76.4	Confident	87.7	Confident	60 Å²	60	52.5 Å²	52.5	62%	0.619	31%	0.306	S	S	*	.			trans	124.4	-176.1	179.3	0	0	0	0	0	113.4	S379	S379-G393 PolarHBondContact OG-N 2.99Å; S379-G393 PolarHBondContact OG-O 3.04Å
394	A	80.3	Confident	87.9	Confident	100 Å²	100	51.9 Å²	51.9	83%	0.826	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-79.7	135.4	178.2	0	0	0	0	0	111.1	T396	A394-T396 PolarHBondContact O-N 3.03Å
395	I	86.4	Confident	88.1	Confident	17 Å²	17	46.2 Å²	46.2	9%	0.087	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-62.8	129.4	173.5	-62.8	178	0	0	0	109.3	I349 L377 F387	I349-I395 HydrophobicContact CG2-CB 4.34Å; L377-I395 HydrophobicContact CB-CD1 3.78Å; L377-I395 VanDerWaalsContact O-CD1 3.3Å; L377-I395 WeakPolarHBondContact O-CD1 3.27Å; F387-I395 HydrophobicContact CB-CD1 3.74Å; F387-I395 HydrophobicContact CB-CG1 4.13Å; F387-I395 HydrophobicContact CB-CG2 4.41Å; F387-I395 HydrophobicContact CD1-CG2 3.69Å; F387-I395 HydrophobicContact CE1-CG2 4.31Å; F387-I395 HydrophobicContact CG-CD1 4.11Å; F387-I395 HydrophobicContact CG-CG2 4.22Å
396	T	86.8	Confident	88.1	Confident	81 Å²	81	47.8 Å²	47.8	50%	0.497	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-55.7	124.1	172.5	-57.7	0	0	0	0	110.4	I217 H218 A394 V398	I217-T396 HydrophobicContact CG2-CG2 3.77Å; H218-T396 PolarHBondContact NE2-O 2.02Å; A394-T396 PolarHBondContact O-N 3.03Å; T396-V398 PolarHBondContact O-N 3.37Å
397	P	92	Very high	87.8	Confident	44 Å²	44	48.2 Å²	48.2	29%	0.286	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-52.2	128.6	-175.8	-30.7	36.1	0	0	0	113.8	D347 L348	D347-P397 HydrophobicContact CB-CB 3.91Å; D347-P397 HydrophobicContact CB-CG 3.87Å; L348-P397 CarbonylContact O-C 3.46Å; L348-P397 WeakPolarHBondContact O-CA 3.34Å
398	V	95.1	Very high	87.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.286	C	S	.	.	S	Bend	trans	-89	-19.5	-176.6	-69.4	0	0	0	0	112.4	N212 W213 W229 M318 V326 L348 P350 F387 T396	N212-V398 CarbonylContact C-O 3.56Å; N212-V398 WeakPolarHBondContact CA-O 3.37Å; N212-V398 PolarHBondContact N-O 3.2Å; W213-V398 HydrophobicContact CB-CB 4.2Å; W213-V398 PolarHBondContact N-O 3.23Å; W229-V398 HydrophobicContact CH2-CB 4.26Å; W229-V398 HydrophobicContact CH2-CG2 4.13Å; W229-V398 WeakPolarHBondContact CZ2-O 3.44Å; M318-V398 HydrophobicContact CE-CB 3.56Å; M318-V398 HydrophobicContact CE-CG1 3.63Å; M318-V398 HydrophobicContact CE-CG2 3.83Å; V326-V398 HydrophobicContact CG1-CG2 3.55Å; L348-V398 WeakPolarHBondContact O-CG2 3.07Å; L348-V398 PolarHBondContact O-N 2.81Å; P350-V398 HydrophobicContact CG-CG1 3.92Å; P350-V398 HydrophobicContact CG-CG2 3.85Å; F387-V398 HydrophobicContact CE1-CG1 3.83Å; F387-V398 HydrophobicContact CZ-CG1 4.2Å; T396-V398 PolarHBondContact O-N 3.37Å
399	A	94.2	Very high	87.4	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	163.9	172.3	0	0	0	0	0	110.8	F209 Y210 W229 L348	F209-A399 HydrophobicContact CD2-CB 4.38Å; F209-A399 HydrophobicContact CE1-CB 4.35Å; F209-A399 HydrophobicContact CE2-CB 3.48Å; F209-A399 VanDerWaalsContact CE2-CB 3.48Å; F209-A399 HydrophobicContact CZ-CB 3.47Å; F209-A399 VanDerWaalsContact CZ-CB 3.47Å; Y210-A399 CarbonylContact O-C 3.1Å; Y210-A399 VanDerWaalsContact O-CA 3.22Å; Y210-A399 WeakPolarHBondContact O-CA 3.43Å; W229-A399 HydrophobicContact CH2-CB 4.3Å; W229-A399 HydrophobicContact CZ2-CB 4.24Å; L348-A399 HydrophobicContact CB-CB 4.27Å; L348-A399 HydrophobicContact CD1-CB 4.29Å; L348-A399 PolarHBondContact N-O 3.07Å; L348-A399 PolarHBondContact O-N 2.84Å
400	R	92.4	Very high	87.2	Confident	99 Å²	99	53.2 Å²	53.2	37%	0.374	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.5	169	174.5	172.2	-68.4	177.1	-3.3	108.6	Y210 V345 Q346 D347 I402	Y210-R400 WeakPolarHBondContact CA-O 3.46Å; Y210-R400 WeakPolarHBondContact CB-O 3.27Å; Y210-R400 PolarHBondContact N-O 2.03Å; Y210-R400 PolarHBondContact O-N 2.82Å; V345-R400 HydrophobicContact CG1-CG 4.18Å; Q346-R400 WeakPolarHBondContact O-CA 3.28Å; D347-R400 VanDerWaalsContact CG-NH2 3.29Å; D347-R400 WeakPolarHBondContact OD1-CB 2.87Å; D347-R400 IonicContact OD1-CZ 3.68Å; D347-R400 VanDerWaalsContact OD1-CZ 3.25Å; D347-R400 IonicContact OD1-NE 3.4Å; D347-R400 PolarHBondContact OD1-NE 3.18Å; D347-R400 IonicContact OD1-NH2 3.71Å; D347-R400 PolarHBondContact OD1-NH2 2.74Å; D347-R400 IonicContact OD2-CZ 3.07Å; D347-R400 IonicContact OD2-NE 2.72Å; D347-R400 IonicContact OD2-NH2 2.74Å; D347-R400 PolarHBondContact OD2-NH2 2.73Å; R400-I402 HydrophobicContact CG-CG1 4.36Å
401	V	94.1	Very high	87.3	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	138.4	171.4	62.2	0	0	0	0	109.9	V207 F314 L328 V345 Q346 L348 V403	V207-V401 HydrophobicContact CG2-CG2 3.48Å; V207-V401 VanDerWaalsContact CG2-CG2 3.48Å; F314-V401 HydrophobicContact CE1-CB 4.4Å; F314-V401 HydrophobicContact CE1-CG1 4.39Å; F314-V401 HydrophobicContact CE1-CG2 3.89Å; F314-V401 HydrophobicContact CZ-CB 4.03Å; F314-V401 HydrophobicContact CZ-CG1 4.28Å; F314-V401 HydrophobicContact CZ-CG2 3.84Å; L328-V401 HydrophobicContact CD1-CG1 3.75Å; L328-V401 HydrophobicContact CD2-CG1 4.25Å; L328-V401 HydrophobicContact CG-CG1 3.98Å; V345-V401 WeakPolarHBondContact CA-O 3.13Å; Q346-V401 HydrophobicContact CB-CG1 3.93Å; Q346-V401 PolarHBondContact N-O 3.34Å; Q346-V401 PolarHBondContact O-N 2.96Å; L348-V401 HydrophobicContact CD1-CB 4.29Å; L348-V401 HydrophobicContact CD1-CG1 4.13Å; L348-V401 HydrophobicContact CD2-CG1 4.23Å; L348-V401 HydrophobicContact CG-CG1 4.3Å; V401-V403 HydrophobicContact CG2-CG2 4.23Å
402	I	93.1	Very high	87.4	Confident	18 Å²	18	50.6 Å²	50.6	9%	0.092	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.1	173.6	-58.7	-173	0	0	0	107.5	V207 T208 Y210 V344 V345 R400 E404	V207-I402 CarbonylContact C-O 3.55Å; V207-I402 WeakPolarHBondContact CA-O 3.45Å; T208-I402 PolarHBondContact N-O 3.32Å; T208-I402 PolarHBondContact O-N 3.08Å; Y210-I402 HydrophobicContact CD2-CD1 4.24Å; Y210-I402 HydrophobicContact CD2-CG1 4.16Å; Y210-I402 HydrophobicContact CE2-CB 4.13Å; Y210-I402 HydrophobicContact CE2-CD1 3.62Å; Y210-I402 HydrophobicContact CE2-CG1 3.79Å; V344-I402 WeakPolarHBondContact O-CA 3.2Å; V345-I402 HydrophobicContact CG1-CG1 4.28Å; V345-I402 HydrophobicContact CG2-CG1 4.25Å; V345-I402 HydrophobicContact CG2-CG2 4.35Å; R400-I402 HydrophobicContact CG-CG1 4.36Å; I402-E404 HydrophobicContact CG2-CG 3.75Å; I402-E404 VanDerWaalsContact CG2-OE1 3.31Å; I402-E404 WeakPolarHBondContact CG2-OE1 3.44Å
403	V	93.8	Very high	87.9	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.4	175.9	-168.9	0	0	0	0	107.2	Y205 V207 F303 M312 L333 R343 V344 V401	Y205-V403 HydrophobicContact CD1-CG1 3.74Å; Y205-V403 HydrophobicContact CE1-CG1 4.48Å; Y205-V403 HydrophobicContact CG-CG1 4.22Å; V207-V403 HydrophobicContact CB-CG2 4.33Å; V207-V403 HydrophobicContact CG2-CG2 4.17Å; F303-V403 HydrophobicContact CE1-CG1 4Å; F303-V403 HydrophobicContact CZ-CG1 3.74Å; M312-V403 HydrophobicContact CE-CG1 4.44Å; M312-V403 HydrophobicContact CE-CG2 3.65Å; L333-V403 HydrophobicContact CD1-CG1 4.31Å; L333-V403 HydrophobicContact CD2-CG1 4.26Å; R343-V403 CarbonylContact C-O 3.57Å; R343-V403 VanDerWaalsContact CA-O 3.31Å; R343-V403 WeakPolarHBondContact CA-O 3.17Å; V344-V403 HydrophobicContact CB-CB 4.19Å; V344-V403 PolarHBondContact N-O 2.99Å; V344-V403 PolarHBondContact O-N 3.48Å; V401-V403 HydrophobicContact CG2-CG2 4.23Å
404	E	91.6	Very high	88.1	Confident	64 Å²	64	51.2 Å²	51.2	30%	0.299	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.4	-176	-82.2	166.6	-178.5	0	0	110.4	Y205 R206 R343 I402	Y205-E404 CarbonylContact C-O 3.4Å; Y205-E404 WeakPolarHBondContact CA-O 3Å; R206-E404 PolarHBondContact N-O 2.81Å; R206-E404 PolarHBondContact O-N 2.88Å; R343-E404 HydrophobicContact CB-CG 4.46Å; R343-E404 HydrophobicContact CG-CG 3.82Å; R343-E404 IonicContact CZ-OE1 2.73Å; R343-E404 IonicContact NE-OE1 3.41Å; R343-E404 PolarHBondContact NE-OE1 2.9Å; R343-E404 IonicContact NH2-OE1 2.73Å; R343-E404 PolarHBondContact NH2-OE1 3.14Å; I402-E404 HydrophobicContact CG2-CG 3.75Å; I402-E404 VanDerWaalsContact CG2-OE1 3.31Å; I402-E404 WeakPolarHBondContact CG2-OE1 3.44Å
405	R	91.9	Very high	88	Confident	8 Å²	8	52.5 Å²	52.5	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	129.2	174.1	-162.9	180	73.8	-159.5	0.3	109	A203 Y205 W340 Q342 R408 D418 D422	A203-R405 HydrophobicContact CB-CG 4.38Å; Y205-R405 HydrophobicContact CD1-CB 4Å; Y205-R405 HydrophobicContact CD1-CG 4.47Å; Y205-R405 HydrophobicContact CE1-CB 3.63Å; Y205-R405 HydrophobicContact CE1-CG 4.05Å; Y205-R405 HydrophobicContact CE2-CG 4.42Å; W340-R405 PolarHBondContact O-NH1 3.38Å; Q342-R405 PolarHBondContact O-N 2.85Å; R405-R408 VanDerWaalsContact CZ-NE 3.34Å; R405-D418 IonicContact CZ-OD2 2.71Å; R405-D418 IonicContact NH1-OD2 2.66Å; R405-D418 PolarHBondContact NH1-OD2 2.82Å; R405-D418 VanDerWaalsContact NH2-CG 3.3Å; R405-D418 IonicContact NH2-OD1 3.12Å; R405-D418 PolarHBondContact NH2-OD1 2.93Å; R405-D418 IonicContact NH2-OD2 2.69Å; R405-D418 PolarHBondContact NH2-OD2 2.88Å; R405-D422 IonicContact CZ-OD1 2.68Å; R405-D422 IonicContact CZ-OD2 3.23Å; R405-D422 IonicContact NE-OD1 3.17Å; R405-D422 PolarHBondContact NE-OD1 2.94Å; R405-D422 IonicContact NE-OD2 3.1Å; R405-D422 PolarHBondContact NE-OD2 2.9Å; R405-D422 VanDerWaalsContact NH2-CG 3.34Å; R405-D422 IonicContact NH2-OD1 2.74Å; R405-D422 PolarHBondContact NH2-OD1 2.82Å; R405-D422 IonicContact NH2-OD2 2.69Å; R405-D422 PolarHBondContact NH2-OD2 3.35Å
406	I	90.6	Very high	87.5	Confident	36 Å²	36	55.7 Å²	55.7	19%	0.185	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-23.9	-177.4	59.2	168.3	0	0	0	113.5	K204 R206 E302	K204-I406 HydrophobicContact CB-CG1 4.12Å; K204-I406 HydrophobicContact CD-CD1 3.94Å; K204-I406 HydrophobicContact CD-CG1 4.35Å; K204-I406 HydrophobicContact CG-CD1 3.99Å; K204-I406 HydrophobicContact CG-CG1 4.06Å; K204-I406 VanDerWaalsContact O-CG1 3.24Å; K204-I406 WeakPolarHBondContact O-CG1 3.1Å; K204-I406 PolarHBondContact O-N 3.25Å; R206-I406 HydrophobicContact CB-CD1 4.49Å; R206-I406 HydrophobicContact CB-CG2 3.8Å; E302-I406 HydrophobicContact CB-CD1 4.46Å; E302-I406 VanDerWaalsContact CD-CD1 3.44Å; E302-I406 HydrophobicContact CG-CD1 3.98Å; E302-I406 WeakPolarHBondContact OE1-CD1 3.44Å
407	A	86.1	Confident	86.5	Confident	20 Å²	20	56.5 Å²	56.5	17%	0.165	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	159.5	174.7	0	0	0	0	0	111.4	K204	K204-A407 HydrophobicContact CB-CB 4.27Å; K204-A407 PolarHBondContact N-O 2.82Å; K204-A407 PolarHBondContact O-N 3.33Å
408	R	87.6	Confident	85.2	Confident	45 Å²	45	56.8 Å²	56.8	17%	0.17	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	149	165.8	-69.1	-179.6	-73.3	162.6	-7.9	109.1	T202 A203 R405 D418 D422	T202-R408 CarbonylContact O-C 3.54Å; T202-R408 WeakPolarHBondContact O-CA 3.15Å; A203-R408 HydrophobicContact CB-CG 4.23Å; R405-R408 VanDerWaalsContact CZ-NE 3.34Å; R408-D418 IonicContact CZ-OD2 2.76Å; R408-D418 IonicContact NH1-OD2 3.93Å; R408-D418 IonicContact NH2-OD2 3.99Å; R408-D422 IonicContact CZ-OD2 3.16Å; R408-D422 IonicContact NE-OD2 2.73Å; R408-D422 PolarHBondContact NE-OD2 2.03Å; R408-D422 IonicContact NH2-OD2 2.74Å; R408-D422 PolarHBondContact NH2-OD2 3.5Å
409	K	84.9	Confident	83.5	Confident	162 Å²	162	64 Å²	64	70%	0.704	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.9	-178.9	-174.2	174.5	-177.8	174.1	0	111.2	G201 T202	G201-K409 CarbonylContact C-O 3.59Å; G201-K409 WeakPolarHBondContact CA-O 3.14Å; T202-K409 PolarHBondContact N-O 3.07Å; T202-K409 PolarHBondContact O-N 2.83Å
410	G	81.5	Confident	81.9	Confident	57 Å²	57	67 Å²	67	59%	0.588	36%	0.358	S	S	*	.	S	Bend	trans	82.4	172.9	-175.6	0	0	0	0	0	112.8	Q412	G410-Q412 PolarHBondContact O-N 2.96Å; G410-Q412 PolarHBondContact O-NE2 2.86Å
411	E	81.1	Confident	79.9	Confident	177 Å²	177	70.2 Å²	70.2	83%	0.827	38%	0.383	S	S	*	.			trans	-56	130.4	180	-66.4	-179.9	168.5	0	0	111.3	C200 G201	C200-E411 CarbonylContact C-O 3.56Å; C200-E411 WeakPolarHBondContact CB-O 2.99Å; G201-E411 PolarHBondContact N-O 2.95Å
412	Q	81.8	Confident	77.8	Confident	55 Å²	55	71.2 Å²	71.2	26%	0.257	39%	0.388	S	S	.	.			trans	-101.1	139.3	178.9	-58.3	-59	-63.1	0	0	109.5	C200 G410 N414	C200-Q412 PolarHBondContact O-NE2 2.85Å; G410-Q412 PolarHBondContact O-N 2.96Å; G410-Q412 PolarHBondContact O-NE2 2.86Å; Q412-N414 VanDerWaalsContact CB-OD1 3.32Å; Q412-N414 WeakPolarHBondContact CB-OD1 3.43Å
413	C	84.7	Confident	75.6	Confident	50 Å²	50	76.5 Å²	76.5	34%	0.338	42%	0.415	S	S	.	.			trans	-123.9	25	-177.2	63.3	0	0	0	0	112.8	C198 C200 I415	C198-C413 PolarHBondContact O-SG 3.11Å; C200-C413 HydrophobicContact CB-CB 3.82Å; C200-C413 WeakPolarHBondContact CB-SG 3.42Å; C200-C413 PolarHBondContact N-SG 3.31Å; C200-C413 WeakPolarHBondContact SG-CB 3.19Å; C200-C413 CovalentContact SG-SG 2.04Å; C200-C413 PolarHBondContact SG-SG 2.89Å; C413-I415 PolarHBondContact O-N 2.83Å
414	N	81.3	Confident	73.2	Confident	40 Å²	40	81.3 Å²	81.3	21%	0.214	44%	0.444	C	S	.	.			trans	-61.9	127.6	176.3	51.2	-69.5	0	0	0	111.1	E337 C338 Q412 V416	E337-N414 CarbonylContact O-C 3.53Å; E337-N414 WeakPolarHBondContact O-CA 3.37Å; C338-N414 WeakPolarHBondContact O-CA 3.35Å; C338-N414 PolarHBondContact O-N 3.18Å; Q412-N414 VanDerWaalsContact CB-OD1 3.32Å; Q412-N414 WeakPolarHBondContact CB-OD1 3.43Å; N414-V416 VanDerWaalsContact C-N 3.3Å; N414-V416 PolarHBondContact ND2-O 3.12Å; N414-V416 PolarHBondContact O-N 2.92Å
415	I	78.1	Confident	70.8	Confident	127 Å²	127	82.2 Å²	82.2	65%	0.651	46%	0.462	S	S	*	.	S	Bend	trans	-69.3	-31.9	-176.2	-58.9	171.7	0	0	0	111.2	E337 C413	E337-I415 PolarHBondContact O-N 3.47Å; C413-I415 PolarHBondContact O-N 2.83Å
416	V	74.9	Confident	68.1	Low	84 Å²	84	88.1 Å²	88.1	51%	0.509	49%	0.494	S	S	.	.	S	Bend	trans	-100.9	132	176.7	-176.9	0	0	0	0	109	E337 N414 D418	E337-V416 HydrophobicContact CB-CG2 4.41Å; E337-V416 HydrophobicContact CG-CG2 4.14Å; N414-V416 VanDerWaalsContact C-N 3.3Å; N414-V416 PolarHBondContact ND2-O 3.12Å; N414-V416 PolarHBondContact O-N 2.92Å; V416-D418 PolarHBondContact O-N 3.4Å
417	P	65.3	Low	65.5	Low	98 Å²	98	92.6 Å²	92.6	64%	0.636	52%	0.518	S	S	*	.			trans	-57.1	122.8	172.6	-24.2	34.2	0	0	0	111.1	N419	P417-N419 PolarHBondContact O-N 2.95Å
418	D	65.6	Low	62.9	Low	51 Å²	51	96.5 Å²	96.5	27%	0.273	55%	0.55	S	S	.	.			trans	-90.4	101.1	179.7	-164.7	-27.9	0	0	0	108.7	R405 R408 V416 V420	R405-D418 IonicContact CZ-OD2 2.71Å; R405-D418 IonicContact NH1-OD2 2.66Å; R405-D418 PolarHBondContact NH1-OD2 2.82Å; R405-D418 VanDerWaalsContact NH2-CG 3.3Å; R405-D418 IonicContact NH2-OD1 3.12Å; R405-D418 PolarHBondContact NH2-OD1 2.93Å; R405-D418 IonicContact NH2-OD2 2.69Å; R405-D418 PolarHBondContact NH2-OD2 2.88Å; R408-D418 IonicContact CZ-OD2 2.76Å; R408-D418 IonicContact NH1-OD2 3.93Å; R408-D418 IonicContact NH2-OD2 3.99Å; V416-D418 PolarHBondContact O-N 3.4Å; D418-V420 PolarHBondContact O-N 2.81Å
419	N	59.6	Low	60.3	Low	150 Å²	150	102.7 Å²	102.7	80%	0.802	58%	0.581	S	S	*	*			trans	-82.2	15.3	-170.8	-61	-38.2	0	0	0	113.6	P417	P417-N419 PolarHBondContact O-N 2.95Å
420	V	60.7	Low	58.2	Low	64 Å²	64	103.7 Å²	103.7	39%	0.388	59%	0.588	S	S	.	*	S	Bend	trans	-92.1	123.6	174.8	-174.8	0	0	0	0	108.9	Q342 D418 D422	Q342-V420 HydrophobicContact CG-CG2 4.29Å; D418-V420 PolarHBondContact O-N 2.81Å; V420-D422 PolarHBondContact O-N 3.43Å
421	D	49.8	Very low	55.9	Low	167 Å²	167	110.3 Å²	110.3	89%	0.893	60%	0.603	S	S	*	*			trans	-67.2	74.6	168.8	-65	-45.1	0	0	0	109.9
422	D	49.9	Very low	53.7	Low	21 Å²	21	111.2 Å²	111.2	11%	0.112	61%	0.605	C	S	.	*			trans	-58.7	151.5	161.6	-58	-66.3	0	0	0	108.4	R405 R408 V420 V424	R405-D422 IonicContact CZ-OD1 2.68Å; R405-D422 IonicContact CZ-OD2 3.23Å; R405-D422 IonicContact NE-OD1 3.17Å; R405-D422 PolarHBondContact NE-OD1 2.94Å; R405-D422 IonicContact NE-OD2 3.1Å; R405-D422 PolarHBondContact NE-OD2 2.9Å; R405-D422 VanDerWaalsContact NH2-CG 3.34Å; R405-D422 IonicContact NH2-OD1 2.74Å; R405-D422 PolarHBondContact NH2-OD1 2.82Å; R405-D422 IonicContact NH2-OD2 2.69Å; R405-D422 PolarHBondContact NH2-OD2 3.35Å; R408-D422 IonicContact CZ-OD2 3.16Å; R408-D422 IonicContact NE-OD2 2.73Å; R408-D422 PolarHBondContact NE-OD2 2.03Å; R408-D422 IonicContact NH2-OD2 2.74Å; R408-D422 PolarHBondContact NH2-OD2 3.5Å; V420-D422 PolarHBondContact O-N 3.43Å; D422-V424 VanDerWaalsContact C-N 3.27Å; D422-V424 PolarHBondContact O-N 3.38Å
423	I	47.3	Very low	51.7	Low	129 Å²	129	117.5 Å²	117.5	66%	0.662	63%	0.634	S	S	*	*			trans	-67.7	94.9	167.3	-57.2	174.1	0	0	0	107.4	A425	I423-A425 VanDerWaalsContact C-N 3.3Å; I423-A425 PolarHBondContact O-N 3.37Å
424	V	43.8	Very low	49.4	Very low	102 Å²	102	124.6 Å²	124.6	62%	0.618	66%	0.662	S	S	*	*			trans	-61.4	101.2	158.6	-176.6	0	0	0	0	105.2	D422 D426	D422-V424 VanDerWaalsContact C-N 3.27Å; D422-V424 PolarHBondContact O-N 3.38Å; V424-D426 PolarHBondContact O-N 2.79Å
425	A	39.5	Very low	47.4	Very low	83 Å²	83	128.1 Å²	128.1	69%	0.686	68%	0.681	S	S	*	*			trans	-75.2	66.7	176.5	0	0	0	0	0	109.3	I423 I427	I423-A425 VanDerWaalsContact C-N 3.3Å; I423-A425 PolarHBondContact O-N 3.37Å; A425-I427 PolarHBondContact O-N 2.92Å
426	D	35.9	Very low	45.9	Very low	132 Å²	132	130 Å²	130	71%	0.706	69%	0.692	S	S	*	*			trans	-67.2	89.5	165.7	-79.7	-23.4	0	0	0	108.3	V424	V424-D426 PolarHBondContact O-N 2.79Å
427	I	37.1	Very low	44.9	Very low	131 Å²	131	128.8 Å²	128.8	67%	0.672	69%	0.686	S	S	*	*			trans	52.7	78.7	150.4	-42.6	176.1	0	0	0	114	A425 Q429	A425-I427 PolarHBondContact O-N 2.92Å; I427-Q429 HydrophobicContact CG2-CB 4.49Å; I427-Q429 HydrophobicContact CG2-CG 3.71Å; I427-Q429 PolarHBondContact O-N 2.86Å
428	A	30.4	Very low	44.4	Very low	102 Å²	102	128 Å²	128	84%	0.843	68%	0.68	S	S	*	*			trans	-65.4	115.6	134.9	0	0	0	0	0	106.4	E430	A428-E430 PolarHBondContact O-N 2.97Å
429	Q	33.6	Very low	43.9	Very low	175 Å²	175	134.7 Å²	134.7	82%	0.818	71%	0.71	S	S	*	*			trans	-66.1	107	177.1	-68.5	174.1	-50.9	0	0	108.6	I427	I427-Q429 HydrophobicContact CG2-CB 4.49Å; I427-Q429 HydrophobicContact CG2-CG 3.71Å; I427-Q429 PolarHBondContact O-N 2.86Å
430	E	39.9	Very low	44	Very low	182 Å²	182	129.6 Å²	129.6	85%	0.85	68%	0.684	S	S	*	*			trans	-63.7	127.8	145.7	-73.7	179.6	155.6	0	0	106.3	A428 K432	A428-E430 PolarHBondContact O-N 2.97Å; E430-K432 PolarHBondContact O-N 2.89Å
431	E	33	Very low	44.3	Very low	196 Å²	196	127.1 Å²	127.1	92%	0.916	67%	0.67	S	S	*	*			trans	-59.7	102.4	179.1	-66.7	177.8	147.3	0	0	109	E433	E431-E433 PolarHBondContact O-N 2.91Å
432	K	36	Very low	45.3	Very low	196 Å²	196	123.2 Å²	123.2	85%	0.852	65%	0.648	S	S	*	*			trans	-73.3	122.7	165.7	-86.5	-172.2	171.7	-174.7	0	108.1	E430 E434	E430-K432 PolarHBondContact O-N 2.89Å; K432-E434 PolarHBondContact O-N 3.42Å
433	E	39.8	Very low	46.3	Very low	188 Å²	188	124 Å²	124	88%	0.879	65%	0.65	S	S	*	*			trans	-50.3	134	158	-60.9	177.4	138.3	0	0	108.9	E431 D435	E431-E433 PolarHBondContact O-N 2.91Å; E433-D435 PolarHBondContact O-N 2.83Å
434	E	35.4	Very low	47.5	Very low	199 Å²	199	119.2 Å²	119.2	93%	0.93	63%	0.628	S	S	*	*			trans	-64.1	114.8	176.5	-70.2	178.3	128.2	0	0	109.6	K432	K432-E434 PolarHBondContact O-N 3.42Å
435	D	40.3	Very low	48.8	Very low	113 Å²	113	121.4 Å²	121.4	60%	0.604	64%	0.636	S	S	*	*			trans	-108.2	106.8	171.8	-174	12.8	0	0	0	108.6	E433 T437	E433-D435 PolarHBondContact O-N 2.83Å; D435-T437 PolarHBondContact O-N 2.69Å; D435-T437 PolarHBondContact O-OG1 3.1Å
436	D	46.7	Very low	50.3	Low	166 Å²	166	120.5 Å²	120.5	89%	0.888	62%	0.615	S	S	*	*			trans	-64.2	63.5	-176.4	-84.9	-40.5	0	0	0	112.9
437	T	53.6	Low	51.6	Low	60 Å²	60	116.3 Å²	116.3	37%	0.368	60%	0.595	S	S	.	*			trans	-115.8	119	177.9	53.9	0	0	0	0	111.2	D435	D435-T437 PolarHBondContact O-N 2.69Å; D435-T437 PolarHBondContact O-OG1 3.1Å
438	P	54.2	Low	53.3	Low	80 Å²	80	115.6 Å²	115.6	52%	0.519	60%	0.6	S	S	.	*			trans	-69.9	139.3	-175.7	26.4	-33.7	0	0	0	112.3	T440 C441	P438-T440 PolarHBondContact O-N 3.04Å; P438-C441 PolarHBondContact O-N 2.8Å
439	E	55.6	Low	55.5	Low	192 Å²	192	114.1 Å²	114.1	90%	0.897	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-8.8	-171.9	-58.5	-176.3	145.1	0	0	115.4
440	T	62.1	Low	57.2	Low	43 Å²	43	108.5 Å²	108.5	26%	0.264	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.5	-9.7	-176.8	55.4	0	0	0	0	114.5	P438 L472	P438-T440 PolarHBondContact O-N 3.04Å; T440-L472 PolarHBondContact O-N 2.84Å
441	C	66.6	Low	58.6	Low	13 Å²	13	104 Å²	104	9%	0.088	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	106.6	-174.5	-58.3	0	0	0	0	111.5	P438 Y443 L468 C478	P438-C441 PolarHBondContact O-N 2.8Å; C441-Y443 HydrophobicContact CB-CD2 4.44Å; C441-Y443 HydrophobicContact CB-CE2 3.64Å; C441-Y443 WeakPolarHBondContact O-CD2 3.42Å; C441-Y443 PolarHBondContact O-N 3.39Å; C441-L468 HydrophobicContact CB-CD1 4.03Å; C441-C478 HydrophobicContact CB-CB 3.84Å; C441-C478 WeakPolarHBondContact CB-SG 3.4Å; C441-C478 WeakPolarHBondContact SG-CB 3.22Å; C441-C478 CovalentContact SG-SG 2.04Å; C441-C478 PolarHBondContact SG-SG 3.33Å
442	I	69.8	Low	60.7	Low	85 Å²	85	96.4 Å²	96.4	44%	0.436	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	110.3	177.1	-58.1	179.3	0	0	0	109.5	K469 A470 L472	I442-K469 HydrophobicContact CG2-CB 4.28Å; I442-K469 WeakPolarHBondContact O-CA 3.48Å; I442-K469 WeakPolarHBondContact O-CB 3.17Å; I442-K469 PolarHBondContact O-N 2.88Å; I442-A470 HydrophobicContact CB-CB 4.25Å; I442-A470 HydrophobicContact CD1-CB 4.39Å; I442-A470 PolarHBondContact N-O 2.86Å; I442-A470 PolarHBondContact O-N 2.96Å; I442-A470 VanDerWaalsContact O-N 3.11Å; I442-L472 HydrophobicContact CD1-CD1 3.81Å; I442-L472 HydrophobicContact CG1-CD1 3.85Å
443	Y	72.9	Confident	62.1	Low	37 Å²	37	91.6 Å²	91.6	15%	0.145	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	166.2	173.6	-58.7	-81.3	0	0	0	113	C441 R466 M467 L468 C478 P479 T481	C441-Y443 HydrophobicContact CB-CD2 4.44Å; C441-Y443 HydrophobicContact CB-CE2 3.64Å; C441-Y443 WeakPolarHBondContact O-CD2 3.42Å; C441-Y443 PolarHBondContact O-N 3.39Å; Y443-R466 HydrophobicContact CD1-CG 4.13Å; Y443-R466 HydrophobicContact CG-CG 4.31Å; Y443-M467 CarbonylContact C-O 3.45Å; Y443-M467 WeakPolarHBondContact CA-O 3.3Å; Y443-L468 HydrophobicContact CD1-CB 4.17Å; Y443-L468 HydrophobicContact CD1-CD1 3.86Å; Y443-L468 HydrophobicContact CE1-CB 4.2Å; Y443-L468 HydrophobicContact CE1-CD1 3.62Å; Y443-L468 HydrophobicContact CE1-CG 4.47Å; Y443-L468 HydrophobicContact CG-CD1 4.45Å; Y443-C478 VanDerWaalsContact OH-C 3.31Å; Y443-C478 WeakPolarHBondContact OH-CA 3.49Å; Y443-C478 WeakPolarHBondContact OH-CB 3.4Å; Y443-C478 PolarHBondContact OH-O 3.28Å; Y443-P479 PolarHBondContact OH-O 3.02Å; Y443-T481 HydrophobicContact CE1-CG2 4.21Å
444	S	70.6	Confident	63.2	Low	29 Å²	29	83.4 Å²	83.4	20%	0.203	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-72.3	165.9	158.9	74.3	0	0	0	0	110.6	M467	S444-M467 PolarHBondContact N-O 2.91Å; S444-M467 PolarHBondContact OG-N 2.86Å
445	N	72.6	Confident	64.1	Low	147 Å²	147	79.2 Å²	79.2	79%	0.786	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-54.9	149.6	160	-61.9	5.5	0	0	0	109.3
446	W	69.4	Low	64.9	Low	65 Å²	65	77.9 Å²	77.9	25%	0.246	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-61.3	143.7	169.7	-71.8	110.1	0	0	0	110.8	R464 Q465 R466 D483	W446-R464 HydrophobicContact CD2-CG 4.09Å; W446-R464 HydrophobicContact CE3-CB 4.28Å; W446-R464 HydrophobicContact CE3-CG 3.64Å; W446-R464 HydrophobicContact CZ3-CG 4.11Å; W446-Q465 VanDerWaalsContact CE3-C 3.47Å; W446-R466 HydrophobicContact CD2-CB 3.99Å; W446-R466 HydrophobicContact CD2-CG 3.98Å; W446-R466 VanDerWaalsContact CE2-CD 3.48Å; W446-R466 HydrophobicContact CE3-CB 3.72Å; W446-R466 HydrophobicContact CE3-CG 3.74Å; W446-R466 HydrophobicContact CG-CB 4.48Å; W446-R466 HydrophobicContact CH2-CG 3.85Å; W446-R466 HydrophobicContact CZ2-CG 4.09Å; W446-R466 VanDerWaalsContact CZ2-CZ 3.4Å; W446-R466 VanDerWaalsContact CZ2-NE 3.28Å; W446-R466 HydrophobicContact CZ3-CB 4.12Å; W446-R466 HydrophobicContact CZ3-CG 3.68Å; W446-D483 HydrophobicContact CH2-CB 3.53Å; W446-D483 HydrophobicContact CZ2-CB 4.07Å; W446-D483 HydrophobicContact CZ3-CB 3.78Å
447	S	64.3	Low	65.5	Low	43 Å²	43	74.1 Å²	74.1	30%	0.301	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-60.1	158.7	163.3	72.5	0	0	0	0	110.4	Q465	S447-Q465 WeakPolarHBondContact CB-O 3.44Å; S447-Q465 PolarHBondContact N-O 2.85Å; S447-Q465 PolarHBondContact OG-N 2.92Å; S447-Q465 PolarHBondContact OG-O 2.92Å
448	P	73.1	Confident	65.7	Low	117 Å²	117	78.1 Å²	78.1	76%	0.76	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-50.6	150.7	159.4	-23.7	34.4	0	0	0	110.7
449	W	75.3	Confident	66.1	Low	71 Å²	71	83.7 Å²	83.7	27%	0.269	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-61.7	139.4	171.1	-74.4	114.6	0	0	0	110.6	R462 M463 R464 D483 E485	W449-R462 HydrophobicContact CB-CG 4.39Å; W449-R462 HydrophobicContact CD2-CG 4Å; W449-R462 HydrophobicContact CE3-CB 4.18Å; W449-R462 HydrophobicContact CE3-CG 3.7Å; W449-R462 HydrophobicContact CG-CG 4.33Å; W449-R462 HydrophobicContact CZ3-CG 4.26Å; W449-R462 VanDerWaalsContact CZ3-O 3.3Å; W449-R462 WeakPolarHBondContact CZ3-O 3.37Å; W449-M463 VanDerWaalsContact CE3-C 3.44Å; W449-R464 HydrophobicContact CD2-CB 4.08Å; W449-R464 HydrophobicContact CD2-CG 4.07Å; W449-R464 HydrophobicContact CE3-CB 3.72Å; W449-R464 HydrophobicContact CE3-CG 3.73Å; W449-R464 HydrophobicContact CH2-CG 3.69Å; W449-R464 VanDerWaalsContact CZ2-CD 3.5Å; W449-R464 HydrophobicContact CZ2-CG 4.05Å; W449-R464 HydrophobicContact CZ3-CB 4.01Å; W449-R464 HydrophobicContact CZ3-CG 3.54Å; W449-D483 HydrophobicContact CH2-CB 4.38Å; W449-D483 WeakPolarHBondContact CH2-OD2 3.28Å; W449-D483 WeakPolarHBondContact CZ3-O 3.16Å; W449-E485 VanDerWaalsContact CE2-OE2 3.23Å; W449-E485 HydrophobicContact CH2-CB 3.47Å; W449-E485 VanDerWaalsContact CH2-CB 3.47Å; W449-E485 HydrophobicContact CZ2-CB 3.82Å; W449-E485 WeakPolarHBondContact CZ2-OE2 3.38Å; W449-E485 HydrophobicContact CZ3-CB 3.86Å; W449-E485 PolarHBondContact NE1-OE2 3.31Å
450	S	70.7	Confident	66.8	Low	56 Å²	56	74.7 Å²	74.7	39%	0.392	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-61.7	162.8	170.8	75.1	0	0	0	0	111.4	R462 M463	S450-R462 WeakPolarHBondContact O-CB 3.4Å; S450-M463 WeakPolarHBondContact CB-O 3.35Å; S450-M463 PolarHBondContact N-O 2.92Å; S450-M463 PolarHBondContact OG-N 2.81Å
451	A	68.4	Low	67.5	Low	89 Å²	89	78.8 Å²	78.8	74%	0.736	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-52.4	149.9	159.2	0	0	0	0	0	110.2	S453	A451-S453 PolarHBondContact O-N 2.88Å
452	C	76.5	Confident	67.9	Low	35 Å²	35	82.1 Å²	82.1	24%	0.236	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-62.8	135.1	178.2	-163.9	0	0	0	0	109.9	S454 C487	C452-S454 PolarHBondContact O-N 3.09Å; C452-C487 WeakPolarHBondContact CA-SG 3.44Å; C452-C487 HydrophobicContact CB-CB 3.98Å; C452-C487 WeakPolarHBondContact CB-SG 3.39Å; C452-C487 WeakPolarHBondContact SG-CB 3.29Å; C452-C487 PolarHBondContact SG-O 2.81Å; C452-C487 CovalentContact SG-SG 2.04Å; C452-C487 PolarHBondContact SG-SG 3.01Å
453	S	66.8	Low	68.3	Low	95 Å²	95	80.8 Å²	80.8	66%	0.664	46%	0.457	S	S	*	.	S	Bend	trans	-64.9	-11.4	-177.8	72.3	0	0	0	0	114.2	A451 K461	A451-S453 PolarHBondContact O-N 2.88Å; S453-K461 WeakPolarHBondContact CB-O 3.45Å; S453-K461 PolarHBondContact N-O 3.24Å; S453-K461 PolarHBondContact OG-N 3.03Å; S453-K461 PolarHBondContact OG-O 3.23Å
454	S	62.4	Low	68.3	Low	17 Å²	17	82.3 Å²	82.3	12%	0.119	46%	0.462	C	S	.	.			trans	-107.8	128.3	172.4	-174.7	0	0	0	0	110	C452 T456 E458	C452-S454 PolarHBondContact O-N 3.09Å; S454-T456 PolarHBondContact OG-N 3.06Å; S454-T456 PolarHBondContact OG-O 3.17Å; S454-T456 PolarHBondContact OG-OG1 2.86Å; S454-E458 WeakPolarHBondContact CB-O 3.12Å; S454-E458 PolarHBondContact OG-O 2.85Å
455	A	55	Low	68.6	Low	110 Å²	110	85.8 Å²	85.8	91%	0.909	48%	0.475	S	S	*	.	S	Bend	trans	-91.1	-2.1	170.6	0	0	0	0	0	112.8
456	T	57	Low	68.6	Low	85 Å²	85	80 Å²	80	52%	0.521	44%	0.442	S	S	.	.	S	Bend	trans	-119.4	171.3	177.4	49.3	0	0	0	0	110.1	S454 E458	S454-T456 PolarHBondContact OG-N 3.06Å; S454-T456 PolarHBondContact OG-O 3.17Å; S454-T456 PolarHBondContact OG-OG1 2.86Å; T456-E458 PolarHBondContact O-N 2.76Å
457	C	58.1	Low	68.3	Low	87 Å²	87	83.6 Å²	83.6	59%	0.588	46%	0.464	S	S	*	.	S	Bend	trans	-67.6	14	-179.1	-57.2	0	0	0	0	115.3	C492	C457-C492 WeakPolarHBondContact CA-SG 3.05Å; C457-C492 HydrophobicContact CB-CB 3.86Å; C457-C492 WeakPolarHBondContact CB-SG 3.39Å; C457-C492 WeakPolarHBondContact SG-CB 3.43Å; C457-C492 CovalentContact SG-SG 2.04Å; C457-C492 PolarHBondContact SG-SG 2.82Å
458	E	58.4	Low	68.7	Low	144 Å²	144	84.6 Å²	84.6	67%	0.673	47%	0.465	S	S	*	.	S	Bend	trans	-75.1	154.5	169.1	-65.4	-178.7	-160.7	0	0	111.3	S454 T456 G460	S454-E458 WeakPolarHBondContact CB-O 3.12Å; S454-E458 PolarHBondContact OG-O 2.85Å; T456-E458 PolarHBondContact O-N 2.76Å; E458-G460 PolarHBondContact O-N 3.07Å
459	K	62.1	Low	68.5	Low	197 Å²	197	86.3 Å²	86.3	86%	0.857	46%	0.461	S	S	*	.			trans	-66.7	96.4	-178.8	-67.8	-176	179.4	-178.3	0	110.9
460	G	70.9	Confident	68.1	Low	3 Å²	3	85.1 Å²	85.1	3%	0.031	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	172.9	173.2	0	0	0	0	0	112.7	E458 C487	E458-G460 PolarHBondContact O-N 3.07Å; G460-C487 PolarHBondContact N-O 2.93Å; G460-C487 PolarHBondContact O-N 2.83Å
461	K	75.8	Confident	68.1	Low	129 Å²	129	85.7 Å²	85.7	56%	0.561	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.1	166.3	-63.9	-174.7	-179.6	-174.5	0	109.4	S453 E485	S453-K461 WeakPolarHBondContact CB-O 3.45Å; S453-K461 PolarHBondContact N-O 3.24Å; S453-K461 PolarHBondContact OG-N 3.03Å; S453-K461 PolarHBondContact OG-O 3.23Å; K461-E485 CarbonylContact C-O 3.57Å; K461-E485 VanDerWaalsContact CA-O 3.3Å; K461-E485 WeakPolarHBondContact CA-O 3.46Å
462	R	75	Confident	68	Low	84 Å²	84	87.6 Å²	87.6	32%	0.317	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.7	167.8	58.9	-175.6	-170	-169.4	-3.7	108.7	W449 S450 F484 E485 C487	W449-R462 HydrophobicContact CB-CG 4.39Å; W449-R462 HydrophobicContact CD2-CG 4Å; W449-R462 HydrophobicContact CE3-CB 4.18Å; W449-R462 HydrophobicContact CE3-CG 3.7Å; W449-R462 HydrophobicContact CG-CG 4.33Å; W449-R462 HydrophobicContact CZ3-CG 4.26Å; W449-R462 VanDerWaalsContact CZ3-O 3.3Å; W449-R462 WeakPolarHBondContact CZ3-O 3.37Å; S450-R462 WeakPolarHBondContact O-CB 3.4Å; R462-F484 WeakPolarHBondContact O-CA 3.17Å; R462-E485 HydrophobicContact CG-CB 4.08Å; R462-E485 IonicContact CZ-OE2 2.73Å; R462-E485 PolarHBondContact N-O 3.23Å; R462-E485 IonicContact NE-OE2 2.64Å; R462-E485 PolarHBondContact NE-OE2 3.39Å; R462-E485 IonicContact NH2-OE1 3.1Å; R462-E485 PolarHBondContact NH2-OE1 2.87Å; R462-E485 IonicContact NH2-OE2 3.63Å; R462-E485 PolarHBondContact NH2-OE2 2.91Å; R462-E485 PolarHBondContact O-N 3.42Å; R462-C487 HydrophobicContact CB-CB 4.48Å; R462-C487 HydrophobicContact CG-CB 4.14Å; R462-C487 PolarHBondContact N-SG 2.04Å
463	M	78.6	Confident	67.6	Low	57 Å²	57	89.1 Å²	89.1	28%	0.281	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.9	-174.1	-179.7	-174.7	176.1	0	0	110	W449 S450 Q482 D483 F484	W449-M463 VanDerWaalsContact CE3-C 3.44Å; S450-M463 WeakPolarHBondContact CB-O 3.35Å; S450-M463 PolarHBondContact N-O 2.92Å; S450-M463 PolarHBondContact OG-N 2.81Å; M463-Q482 HydrophobicContact CE-CB 4.04Å; M463-Q482 HydrophobicContact CE-CG 3.66Å; M463-D483 WeakPolarHBondContact CA-O 3.25Å; M463-F484 HydrophobicContact CB-CD1 3.86Å; M463-F484 HydrophobicContact CB-CE1 3.75Å; M463-F484 HydrophobicContact CE-CE1 4.32Å; M463-F484 HydrophobicContact CE-CZ 3.88Å; M463-F484 HydrophobicContact CG-CD1 3.92Å; M463-F484 HydrophobicContact CG-CE1 3.46Å; M463-F484 VanDerWaalsContact CG-CE1 3.46Å; M463-F484 HydrophobicContact CG-CZ 3.84Å; M463-F484 HydrophobicContact SD-CE1 3.57Å; M463-F484 VanDerWaalsContact SD-CE1 3.57Å; M463-F484 HydrophobicContact SD-CZ 3.74Å
464	R	73.1	Confident	67.4	Low	69 Å²	69	92.5 Å²	92.5	26%	0.26	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.8	164.8	64.5	-177.2	175.3	175.9	-3.6	110	W446 W449 Q482 D483	W446-R464 HydrophobicContact CD2-CG 4.09Å; W446-R464 HydrophobicContact CE3-CB 4.28Å; W446-R464 HydrophobicContact CE3-CG 3.64Å; W446-R464 HydrophobicContact CZ3-CG 4.11Å; W449-R464 HydrophobicContact CD2-CB 4.08Å; W449-R464 HydrophobicContact CD2-CG 4.07Å; W449-R464 HydrophobicContact CE3-CB 3.72Å; W449-R464 HydrophobicContact CE3-CG 3.73Å; W449-R464 HydrophobicContact CH2-CG 3.69Å; W449-R464 VanDerWaalsContact CZ2-CD 3.5Å; W449-R464 HydrophobicContact CZ2-CG 4.05Å; W449-R464 HydrophobicContact CZ3-CB 4.01Å; W449-R464 HydrophobicContact CZ3-CG 3.54Å; R464-Q482 WeakPolarHBondContact O-CA 3.27Å; R464-D483 HydrophobicContact CG-CB 3.89Å; R464-D483 IonicContact CZ-OD2 3.89Å; R464-D483 PolarHBondContact N-O 3.31Å; R464-D483 IonicContact NE-OD2 2.8Å; R464-D483 PolarHBondContact NE-OD2 2.95Å; R464-D483 IonicContact NH2-OD2 2.7Å; R464-D483 PolarHBondContact NH2-OD2 2.93Å; R464-D483 PolarHBondContact O-N 2.83Å
465	Q	76.2	Confident	67.8	Low	102 Å²	102	96.1 Å²	96.1	48%	0.477	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.1	179.7	61.4	-178.7	-5.6	0	0	112.3	W446 S447 T481 Q482	W446-Q465 VanDerWaalsContact CE3-C 3.47Å; S447-Q465 WeakPolarHBondContact CB-O 3.44Å; S447-Q465 PolarHBondContact N-O 2.85Å; S447-Q465 PolarHBondContact OG-N 2.92Å; S447-Q465 PolarHBondContact OG-O 2.92Å; Q465-T481 CarbonylContact C-O 3.51Å; Q465-T481 VanDerWaalsContact CA-O 3.24Å; Q465-T481 WeakPolarHBondContact CA-O 3.47Å; Q465-Q482 HydrophobicContact CB-CG 4.14Å
466	R	72.3	Confident	68.3	Low	25 Å²	25	93.4 Å²	93.4	9%	0.094	47%	0.472	C	S	.	.			trans	-130.3	144.6	172.3	65.8	-176.8	175.9	-171.3	-3.2	109.5	Y443 W446 H480 T481	Y443-R466 HydrophobicContact CD1-CG 4.13Å; Y443-R466 HydrophobicContact CG-CG 4.31Å; W446-R466 HydrophobicContact CD2-CB 3.99Å; W446-R466 HydrophobicContact CD2-CG 3.98Å; W446-R466 VanDerWaalsContact CE2-CD 3.48Å; W446-R466 HydrophobicContact CE3-CB 3.72Å; W446-R466 HydrophobicContact CE3-CG 3.74Å; W446-R466 HydrophobicContact CG-CB 4.48Å; W446-R466 HydrophobicContact CH2-CG 3.85Å; W446-R466 HydrophobicContact CZ2-CG 4.09Å; W446-R466 VanDerWaalsContact CZ2-CZ 3.4Å; W446-R466 VanDerWaalsContact CZ2-NE 3.28Å; W446-R466 HydrophobicContact CZ3-CB 4.12Å; W446-R466 HydrophobicContact CZ3-CG 3.68Å; R466-H480 PolarHBondContact NE-O 2.77Å; R466-H480 PolarHBondContact NH2-O 2.97Å; R466-T481 PolarHBondContact N-O 2.69Å; R466-T481 WeakPolarHBondContact O-CA 3.48Å; R466-T481 WeakPolarHBondContact O-CB 3.41Å; R466-T481 WeakPolarHBondContact O-CG2 3.45Å; R466-T481 VanDerWaalsContact O-O 3.12Å
467	M	63.5	Low	68.5	Low	141 Å²	141	94.4 Å²	94.4	70%	0.695	48%	0.48	S	S	*	.			trans	-95	140.1	178.4	-65.5	-176.4	175.6	0	0	110.1	Y443 S444 K469	Y443-M467 CarbonylContact C-O 3.45Å; Y443-M467 WeakPolarHBondContact CA-O 3.3Å; S444-M467 PolarHBondContact N-O 2.91Å; S444-M467 PolarHBondContact OG-N 2.86Å; M467-K469 PolarHBondContact O-N 3.44Å
468	L	73.7	Confident	69	Low	64 Å²	64	91.1 Å²	91.1	34%	0.335	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	114.5	168.1	-175.2	66.7	0	0	0	108.1	C441 Y443 Q471 C478	C441-L468 HydrophobicContact CB-CD1 4.03Å; Y443-L468 HydrophobicContact CD1-CB 4.17Å; Y443-L468 HydrophobicContact CD1-CD1 3.86Å; Y443-L468 HydrophobicContact CE1-CB 4.2Å; Y443-L468 HydrophobicContact CE1-CD1 3.62Å; Y443-L468 HydrophobicContact CE1-CG 4.47Å; Y443-L468 HydrophobicContact CG-CD1 4.45Å; L468-Q471 HydrophobicContact CD2-CB 4.23Å; L468-C478 HydrophobicContact CD1-CB 3.92Å; L468-C478 HydrophobicContact CD2-CB 3.75Å
469	K	69	Low	69.4	Low	153 Å²	153	88 Å²	88	67%	0.665	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	-39	-179.9	-75.8	-178.1	169.1	-179.1	0	112	I442 M467	I442-K469 HydrophobicContact CG2-CB 4.28Å; I442-K469 WeakPolarHBondContact O-CA 3.48Å; I442-K469 WeakPolarHBondContact O-CB 3.17Å; I442-K469 PolarHBondContact O-N 2.88Å; M467-K469 PolarHBondContact O-N 3.44Å
470	A	66	Low	69.5	Low	45 Å²	45	84.8 Å²	84.8	37%	0.372	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	149.6	175.1	0	0	0	0	0	110.8	I442	I442-A470 HydrophobicContact CB-CB 4.25Å; I442-A470 HydrophobicContact CD1-CB 4.39Å; I442-A470 PolarHBondContact N-O 2.86Å; I442-A470 PolarHBondContact O-N 2.96Å; I442-A470 VanDerWaalsContact O-N 3.11Å
471	Q	70.6	Confident	69.3	Low	69 Å²	69	87.5 Å²	87.5	32%	0.322	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.6	173.5	175.3	172.4	-10.3	0	0	107	L468 D473 V476	L468-Q471 HydrophobicContact CD2-CB 4.23Å; Q471-D473 VanDerWaalsContact CG-O 3.24Å; Q471-D473 WeakPolarHBondContact CG-O 3.48Å; Q471-D473 PolarHBondContact NE2-O 2.86Å; Q471-V476 PolarHBondContact NE2-O 3.23Å
472	L	67.3	Low	69.1	Low	128 Å²	128	85.9 Å²	85.9	67%	0.67	45%	0.449	S	S	*	.	S	Bend	trans	-79	-26.6	-175.5	-71.4	102.7	0	0	0	112.6	T440 I442	T440-L472 PolarHBondContact O-N 2.84Å; I442-L472 HydrophobicContact CD1-CD1 3.81Å; I442-L472 HydrophobicContact CG1-CD1 3.85Å
473	D	67.4	Low	68.8	Low	68 Å²	68	84.3 Å²	84.3	36%	0.364	45%	0.446	S	S	.	.			trans	-125.6	116.2	176.5	-169.9	-18.4	0	0	0	110.9	Q471 S475	Q471-D473 VanDerWaalsContact CG-O 3.24Å; Q471-D473 WeakPolarHBondContact CG-O 3.48Å; Q471-D473 PolarHBondContact NE2-O 2.86Å; D473-S475 PolarHBondContact O-N 3.28Å; D473-S475 VanDerWaalsContact OD1-CB 3.29Å; D473-S475 WeakPolarHBondContact OD1-CB 3.19Å; D473-S475 PolarHBondContact OD1-N 3.42Å; D473-S475 PolarHBondContact OD1-OG 2.93Å; D473-S475 PolarHBondContact OD2-OG 2.77Å
474	L	62.4	Low	68.6	Low	166 Å²	166	86.8 Å²	86.8	87%	0.869	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-11.9	178.8	-79.9	143.4	0	0	0	113.8
475	S	70.8	Confident	68.6	Low	93 Å²	93	86.7 Å²	86.7	65%	0.65	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-19.1	179	72.9	0	0	0	0	113.9	D473	D473-S475 PolarHBondContact O-N 3.28Å; D473-S475 VanDerWaalsContact OD1-CB 3.29Å; D473-S475 WeakPolarHBondContact OD1-CB 3.19Å; D473-S475 PolarHBondContact OD1-N 3.42Å; D473-S475 PolarHBondContact OD1-OG 2.93Å; D473-S475 PolarHBondContact OD2-OG 2.77Å
476	V	65.8	Low	68.3	Low	52 Å²	52	86.8 Å²	86.8	32%	0.315	47%	0.468	S	S	.	.	S	Bend	trans	-102.8	114.2	-179.1	-177.9	0	0	0	0	109.8	Q471	Q471-V476 PolarHBondContact NE2-O 3.23Å
477	P	62.2	Low	67.9	Low	106 Å²	106	86.5 Å²	86.5	69%	0.688	47%	0.469	S	S	*	.			trans	-62.2	138.9	175.1	-21.2	33.2	0	0	0	111.6	P479	P477-P479 WeakPolarHBondContact O-CD 3.32Å
478	C	68.1	Low	67.6	Low	19 Å²	19	85.7 Å²	85.7	13%	0.128	47%	0.465	C	S	.	.			trans	-106.7	76.9	178	-64.8	0	0	0	0	112.2	C441 Y443 L468	C441-C478 HydrophobicContact CB-CB 3.84Å; C441-C478 WeakPolarHBondContact CB-SG 3.4Å; C441-C478 WeakPolarHBondContact SG-CB 3.22Å; C441-C478 CovalentContact SG-SG 2.04Å; C441-C478 PolarHBondContact SG-SG 3.33Å; Y443-C478 VanDerWaalsContact OH-C 3.31Å; Y443-C478 WeakPolarHBondContact OH-CA 3.49Å; Y443-C478 WeakPolarHBondContact OH-CB 3.4Å; Y443-C478 PolarHBondContact OH-O 3.28Å; L468-C478 HydrophobicContact CD1-CB 3.92Å; L468-C478 HydrophobicContact CD2-CB 3.75Å
479	P	66.8	Low	66.9	Low	77 Å²	77	83.2 Å²	83.2	50%	0.5	46%	0.455	S	S	.	.			trans	-78	176.4	174.4	32.4	-34.3	0	0	0	112.8	Y443 P477	Y443-P479 PolarHBondContact OH-O 3.02Å; P477-P479 WeakPolarHBondContact O-CD 3.32Å
480	H	63.3	Low	66.1	Low	131 Å²	131	82.5 Å²	82.5	61%	0.606	47%	0.466	S	S	*	.			trans	74.2	53.4	-177.6	-49.5	-87.3	0	0	0	115.5	R466	R466-H480 PolarHBondContact NE-O 2.77Å; R466-H480 PolarHBondContact NH2-O 2.97Å
481	T	67.8	Low	65.6	Low	59 Å²	59	84.4 Å²	84.4	36%	0.362	49%	0.49	S	S	.	.	S	Bend	trans	-87.1	-9.4	164.6	50.8	0	0	0	0	113.7	Y443 Q465 R466	Y443-T481 HydrophobicContact CE1-CG2 4.21Å; Q465-T481 CarbonylContact C-O 3.51Å; Q465-T481 VanDerWaalsContact CA-O 3.24Å; Q465-T481 WeakPolarHBondContact CA-O 3.47Å; R466-T481 PolarHBondContact N-O 2.69Å; R466-T481 WeakPolarHBondContact O-CA 3.48Å; R466-T481 WeakPolarHBondContact O-CB 3.41Å; R466-T481 WeakPolarHBondContact O-CG2 3.45Å; R466-T481 VanDerWaalsContact O-O 3.12Å
482	Q	70.6	Confident	64.6	Low	96 Å²	96	83.3 Å²	83.3	45%	0.449	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.4	-179.1	-65.7	-176.8	-12.1	0	0	109.8	M463 R464 Q465 F484	M463-Q482 HydrophobicContact CE-CB 4.04Å; M463-Q482 HydrophobicContact CE-CG 3.66Å; R464-Q482 WeakPolarHBondContact O-CA 3.27Å; Q465-Q482 HydrophobicContact CB-CG 4.14Å; Q482-F484 HydrophobicContact CB-CE2 4.12Å
483	D	70.3	Confident	63.7	Low	51 Å²	51	82.2 Å²	82.2	27%	0.273	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	146.6	-176.9	-179.5	24.8	0	0	0	110.1	W446 W449 M463 R464	W446-D483 HydrophobicContact CH2-CB 3.53Å; W446-D483 HydrophobicContact CZ2-CB 4.07Å; W446-D483 HydrophobicContact CZ3-CB 3.78Å; W449-D483 HydrophobicContact CH2-CB 4.38Å; W449-D483 WeakPolarHBondContact CH2-OD2 3.28Å; W449-D483 WeakPolarHBondContact CZ3-O 3.16Å; M463-D483 WeakPolarHBondContact CA-O 3.25Å; R464-D483 HydrophobicContact CG-CB 3.89Å; R464-D483 IonicContact CZ-OD2 3.89Å; R464-D483 PolarHBondContact N-O 3.31Å; R464-D483 IonicContact NE-OD2 2.8Å; R464-D483 PolarHBondContact NE-OD2 2.95Å; R464-D483 IonicContact NH2-OD2 2.7Å; R464-D483 PolarHBondContact NH2-OD2 2.93Å; R464-D483 PolarHBondContact O-N 2.83Å
484	F	72.9	Confident	62.7	Low	108 Å²	108	87 Å²	87	47%	0.474	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	114.1	-167.6	-65.9	-88.3	0	0	0	111.4	R462 M463 Q482	R462-F484 WeakPolarHBondContact O-CA 3.17Å; M463-F484 HydrophobicContact CB-CD1 3.86Å; M463-F484 HydrophobicContact CB-CE1 3.75Å; M463-F484 HydrophobicContact CE-CE1 4.32Å; M463-F484 HydrophobicContact CE-CZ 3.88Å; M463-F484 HydrophobicContact CG-CD1 3.92Å; M463-F484 HydrophobicContact CG-CE1 3.46Å; M463-F484 VanDerWaalsContact CG-CE1 3.46Å; M463-F484 HydrophobicContact CG-CZ 3.84Å; M463-F484 HydrophobicContact SD-CE1 3.57Å; M463-F484 VanDerWaalsContact SD-CE1 3.57Å; M463-F484 HydrophobicContact SD-CZ 3.74Å; Q482-F484 HydrophobicContact CB-CE2 4.12Å
485	E	72.8	Confident	62	Low	67 Å²	67	88 Å²	88	31%	0.313	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.8	-177.9	-169.9	-173.1	-176.4	0	0	110.8	W449 K461 R462	W449-E485 VanDerWaalsContact CE2-OE2 3.23Å; W449-E485 HydrophobicContact CH2-CB 3.47Å; W449-E485 VanDerWaalsContact CH2-CB 3.47Å; W449-E485 HydrophobicContact CZ2-CB 3.82Å; W449-E485 WeakPolarHBondContact CZ2-OE2 3.38Å; W449-E485 HydrophobicContact CZ3-CB 3.86Å; W449-E485 PolarHBondContact NE1-OE2 3.31Å; K461-E485 CarbonylContact C-O 3.57Å; K461-E485 VanDerWaalsContact CA-O 3.3Å; K461-E485 WeakPolarHBondContact CA-O 3.46Å; R462-E485 HydrophobicContact CG-CB 4.08Å; R462-E485 IonicContact CZ-OE2 2.73Å; R462-E485 PolarHBondContact N-O 3.23Å; R462-E485 IonicContact NE-OE2 2.64Å; R462-E485 PolarHBondContact NE-OE2 3.39Å; R462-E485 IonicContact NH2-OE1 3.1Å; R462-E485 PolarHBondContact NH2-OE1 2.87Å; R462-E485 IonicContact NH2-OE2 3.63Å; R462-E485 PolarHBondContact NH2-OE2 2.91Å; R462-E485 PolarHBondContact O-N 3.42Å
486	P	70.4	Confident	60.5	Low	105 Å²	105	90.3 Å²	90.3	68%	0.682	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.1	140.6	170.5	-19.3	32.1	0	0	0	111.7
487	C	64.6	Low	59.5	Low	18 Å²	18	93.2 Å²	93.2	12%	0.122	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-144	159.5	175.3	55.7	0	0	0	0	111.4	C452 G460 R462	C452-C487 WeakPolarHBondContact CA-SG 3.44Å; C452-C487 HydrophobicContact CB-CB 3.98Å; C452-C487 WeakPolarHBondContact CB-SG 3.39Å; C452-C487 WeakPolarHBondContact SG-CB 3.29Å; C452-C487 PolarHBondContact SG-O 2.81Å; C452-C487 CovalentContact SG-SG 2.04Å; C452-C487 PolarHBondContact SG-SG 3.01Å; G460-C487 PolarHBondContact N-O 2.93Å; G460-C487 PolarHBondContact O-N 2.83Å; R462-C487 HydrophobicContact CB-CB 4.48Å; R462-C487 HydrophobicContact CG-CB 4.14Å; R462-C487 PolarHBondContact N-SG 2.04Å
488	M	57.7	Low	59	Low	125 Å²	125	93.3 Å²	93.3	62%	0.616	56%	0.556	S	S	*	*			trans	-120.8	153.5	170.4	-59.6	-170.2	-61.7	0	0	108.9
489	G	58.9	Low	58.2	Low	11 Å²	11	97.4 Å²	97.4	11%	0.113	58%	0.58	C	S	.	*			trans	-64.2	152.4	177.9	0	0	0	0	0	112.4	G491	G489-G491 PolarHBondContact O-N 2.86Å
490	P	51.7	Low	57.9	Low	139 Å²	139	94.7 Å²	94.7	90%	0.903	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	123.9	176.5	-16.6	30.2	0	0	0	110.8
491	G	56.2	Low	57.8	Low	85 Å²	85	93.9 Å²	93.9	88%	0.876	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.7	7.1	173.2	0	0	0	0	0	116.8	G489	G489-G491 PolarHBondContact O-N 2.86Å
492	C	49.3	Very low	57.9	Low	45 Å²	45	92.2 Å²	92.2	30%	0.304	55%	0.55	S	S	.	.			trans	-98.9	111	174.7	-45.6	0	0	0	0	110.9	C457	C457-C492 WeakPolarHBondContact CA-SG 3.05Å; C457-C492 HydrophobicContact CB-CB 3.86Å; C457-C492 WeakPolarHBondContact CB-SG 3.39Å; C457-C492 WeakPolarHBondContact SG-CB 3.43Å; C457-C492 CovalentContact SG-SG 2.04Å; C457-C492 PolarHBondContact SG-SG 2.82Å
493	S	47.5	Very low	57.9	Low	105 Å²	105	88 Å²	88	73%	0.734	53%	0.531	S	S	*	.			trans	-119.2	133.6	159.6	54.8	0	0	0	0	108.2	E495	S493-E495 PolarHBondContact O-N 2.81Å
494	D	46.6	Very low	58	Low	169 Å²	169	93.5 Å²	93.5	90%	0.904	56%	0.555	S	S	*	*	S	Bend	trans	-66.7	93.6	174.9	-68.6	-49.5	0	0	0	110.3
495	E	47.2	Very low	58	Low	187 Å²	187	91.3 Å²	91.3	87%	0.874	54%	0.543	S	S	*	.	S	Bend	trans	-159.9	158.2	144.7	-75.6	-143.7	149.4	0	0	109.5	S493	S493-E495 PolarHBondContact O-N 2.81Å
496	D	41.1	Very low	57.9	Low	142 Å²	142	92.6 Å²	92.6	76%	0.759	55%	0.551	S	S	*	*			trans	-65.2	135.7	-154.3	-68	-74.6	0	0	0	117.7	S498	D496-S498 VanDerWaalsContact C-N 3.3Å; D496-S498 PolarHBondContact O-N 2.95Å
497	A	43.7	Very low	58	Low	112 Å²	112	93.4 Å²	93.4	93%	0.926	56%	0.555	S	S	*	*	S	Bend	trans	-76.4	68.4	176.1	0	0	0	0	0	113.2
498	S	51.3	Low	58.6	Low	108 Å²	108	95.6 Å²	95.6	76%	0.755	56%	0.56	S	S	*	*			trans	-154.3	37.4	164.2	57.6	0	0	0	0	114.6	D496	D496-S498 VanDerWaalsContact C-N 3.3Å; D496-S498 PolarHBondContact O-N 2.95Å
499	T	52.6	Low	59.4	Low	105 Å²	105	91.6 Å²	91.6	64%	0.644	55%	0.545	S	S	*	.	S	Bend	trans	-136.4	146.4	-179.9	-43.9	0	0	0	0	112.9	M501 L538	T499-M501 PolarHBondContact O-N 3.14Å; T499-L538 HydrophobicContact CG2-CD1 4.01Å
500	C	59	Low	60	Low	20 Å²	20	96.7 Å²	96.7	14%	0.135	58%	0.576	C	S	.	*			trans	-52.8	126.9	177.5	-69.6	0	0	0	0	113.2	M502 P530 C536 L538	C500-M502 HydrophobicContact CB-SD 4.45Å; C500-M502 PolarHBondContact O-N 2.71Å; C500-M502 VanDerWaalsContact O-N 3.16Å; C500-P530 VanDerWaalsContact SG-CD 3.53Å; C500-P530 VanDerWaalsContact SG-CG 3.59Å; C500-C536 HydrophobicContact CB-CB 3.79Å; C500-C536 WeakPolarHBondContact CB-SG 3.41Å; C500-C536 WeakPolarHBondContact SG-CA 3.46Å; C500-C536 WeakPolarHBondContact SG-CB 3.36Å; C500-C536 CovalentContact SG-SG 2.03Å; C500-C536 PolarHBondContact SG-SG 3.23Å; C500-L538 HydrophobicContact CB-CD1 4.29Å
501	M	61.8	Low	61.4	Low	114 Å²	114	91.5 Å²	91.5	56%	0.562	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	106.1	176.1	-171.7	177.6	-77.7	0	0	109.9	T499 K527 Q528	T499-M501 PolarHBondContact O-N 3.14Å; M501-K527 HydrophobicContact CG-CB 4.49Å; M501-K527 WeakPolarHBondContact O-CA 3.39Å; M501-K527 WeakPolarHBondContact O-CB 3.32Å; M501-K527 PolarHBondContact O-N 2.79Å; M501-Q528 HydrophobicContact CB-CB 4.16Å; M501-Q528 PolarHBondContact N-O 2.87Å; M501-Q528 PolarHBondContact O-N 3.44Å; M501-Q528 VanDerWaalsContact O-N 3.11Å
502	M	69.2	Low	62.3	Low	25 Å²	25	91.2 Å²	91.2	12%	0.123	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	159.5	174.5	-54.2	-58.7	-71.3	0	0	111.1	C500 R524 V526 L538 T540	C500-M502 HydrophobicContact CB-SD 4.45Å; C500-M502 PolarHBondContact O-N 2.71Å; C500-M502 VanDerWaalsContact O-N 3.16Å; M502-R524 HydrophobicContact CE-CG 3.87Å; M502-V526 HydrophobicContact CE-CG2 3.97Å; M502-V526 HydrophobicContact SD-CB 4.44Å; M502-V526 HydrophobicContact SD-CG2 3.87Å; M502-L538 HydrophobicContact CE-CB 4.48Å; M502-L538 HydrophobicContact CG-CD1 3.82Å; M502-L538 HydrophobicContact SD-CB 4.17Å; M502-L538 HydrophobicContact SD-CD1 4.05Å; M502-T540 HydrophobicContact CE-CG2 4.12Å
503	S	70.3	Confident	63	Low	8 Å²	8	91.6 Å²	91.6	6%	0.056	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-66.9	159.6	159.4	49.3	0	0	0	0	111.1	Y525	S503-Y525 WeakPolarHBondContact CB-O 3.29Å; S503-Y525 PolarHBondContact N-O 2.84Å; S503-Y525 WeakPolarHBondContact OG-CD1 3.29Å; S503-Y525 PolarHBondContact OG-N 2.88Å; S503-Y525 PolarHBondContact OG-O 2.87Å
504	E	73.8	Confident	63.6	Low	166 Å²	166	90.2 Å²	90.2	78%	0.776	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-58.9	145.2	162.9	-63.5	-175.7	160.2	0	0	108.9	I506	E504-I506 PolarHBondContact O-N 2.99Å
505	W	72.9	Confident	64.4	Low	61 Å²	61	85 Å²	85	23%	0.231	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-60.5	134.1	174.9	-70.3	107.5	0	0	0	110.5	R522 R524 E542	W505-R522 HydrophobicContact CB-CG 4.41Å; W505-R522 HydrophobicContact CD2-CG 4.05Å; W505-R522 HydrophobicContact CE3-CB 4.37Å; W505-R522 HydrophobicContact CE3-CG 3.66Å; W505-R522 HydrophobicContact CG-CG 4.42Å; W505-R522 HydrophobicContact CZ3-CG 4.2Å; W505-R522 WeakPolarHBondContact CZ3-O 3.48Å; W505-R524 HydrophobicContact CD2-CB 4.07Å; W505-R524 HydrophobicContact CD2-CG 3.97Å; W505-R524 VanDerWaalsContact CE2-CD 3.5Å; W505-R524 HydrophobicContact CE3-CB 3.68Å; W505-R524 HydrophobicContact CE3-CG 3.61Å; W505-R524 HydrophobicContact CH2-CG 3.88Å; W505-R524 HydrophobicContact CZ2-CG 4.23Å; W505-R524 HydrophobicContact CZ3-CB 4.09Å; W505-R524 HydrophobicContact CZ3-CG 3.57Å; W505-E542 HydrophobicContact CH2-CB 3.45Å; W505-E542 VanDerWaalsContact CH2-CB 3.45Å; W505-E542 HydrophobicContact CZ2-CB 3.88Å; W505-E542 HydrophobicContact CZ3-CB 3.83Å
506	I	70.1	Confident	65.4	Low	94 Å²	94	77.2 Å²	77.2	48%	0.482	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-57.1	146.9	164.3	-62	169	0	0	0	107.9	E504 W508 R522 E523	E504-I506 PolarHBondContact O-N 2.99Å; I506-W508 PolarHBondContact O-N 2.58Å; I506-R522 WeakPolarHBondContact O-CB 3.25Å; I506-E523 WeakPolarHBondContact CB-O 3.33Å; I506-E523 HydrophobicContact CD1-CB 4.4Å; I506-E523 VanDerWaalsContact CG1-O 3.31Å; I506-E523 WeakPolarHBondContact CG1-O 3.3Å; I506-E523 PolarHBondContact N-O 2.82Å
507	T	71.8	Confident	67.1	Low	123 Å²	123	75.1 Å²	75.1	76%	0.755	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-53.1	139	175.7	50	0	0	0	0	110.8	S509	T507-S509 PolarHBondContact O-N 2.92Å
508	W	77.8	Confident	68.8	Low	63 Å²	63	70.3 Å²	70.3	24%	0.239	42%	0.422	C	S	.	.			trans	-45.9	133.1	176.3	-73.6	112.5	0	0	0	112.3	I506 R520 R522 E542 E544	I506-W508 PolarHBondContact O-N 2.58Å; W508-R520 HydrophobicContact CD2-CG 4.1Å; W508-R520 HydrophobicContact CE3-CB 4.21Å; W508-R520 HydrophobicContact CE3-CG 3.68Å; W508-R520 HydrophobicContact CZ3-CG 4.18Å; W508-R520 WeakPolarHBondContact CZ3-O 3.42Å; W508-R522 HydrophobicContact CD2-CB 4.2Å; W508-R522 HydrophobicContact CD2-CG 4Å; W508-R522 VanDerWaalsContact CE2-CD 3.49Å; W508-R522 HydrophobicContact CE3-CB 3.79Å; W508-R522 HydrophobicContact CE3-CG 3.67Å; W508-R522 HydrophobicContact CH2-CG 3.83Å; W508-R522 HydrophobicContact CZ2-CG 4.16Å; W508-R522 VanDerWaalsContact CZ2-NE 3.35Å; W508-R522 HydrophobicContact CZ3-CB 4.14Å; W508-R522 HydrophobicContact CZ3-CG 3.59Å; W508-E542 HydrophobicContact CH2-CB 4.43Å; W508-E542 HydrophobicContact CH2-CG 3.95Å; W508-E542 WeakPolarHBondContact CZ3-O 3.47Å; W508-E544 HydrophobicContact CH2-CB 3.42Å; W508-E544 VanDerWaalsContact CH2-CB 3.42Å; W508-E544 HydrophobicContact CH2-CG 4.47Å; W508-E544 HydrophobicContact CZ2-CB 3.94Å; W508-E544 WeakPolarHBondContact CZ2-OE2 3.47Å; W508-E544 HydrophobicContact CZ3-CB 3.79Å
509	S	74.4	Confident	70.1	Confident	41 Å²	41	68.8 Å²	68.8	29%	0.287	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-62	158.1	169	65	0	0	0	0	110.6	T507 R520 S521	T507-S509 PolarHBondContact O-N 2.92Å; S509-R520 WeakPolarHBondContact O-CB 3.5Å; S509-S521 WeakPolarHBondContact CB-O 3.33Å; S509-S521 PolarHBondContact N-O 2.81Å; S509-S521 PolarHBondContact OG-N 3.09Å; S509-S521 PolarHBondContact OG-O 3.38Å; S509-S521 PolarHBondContact OG-OG 3.04Å
510	P	72.4	Confident	71.4	Confident	118 Å²	118	67.8 Å²	67.8	77%	0.766	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-53.8	148.1	169.8	-24	34.6	0	0	0	110.6	S512	P510-S512 PolarHBondContact O-N 2.91Å
511	C	79.9	Confident	72.4	Confident	30 Å²	30	68.7 Å²	68.7	20%	0.203	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-56.7	136.6	175.3	-162.6	0	0	0	0	110	V513 C546 V548	C511-V513 WeakPolarHBondContact CB-O 3.25Å; C511-V513 PolarHBondContact O-N 3.09Å; C511-C546 WeakPolarHBondContact CA-SG 3.47Å; C511-C546 HydrophobicContact CB-CB 3.94Å; C511-C546 WeakPolarHBondContact CB-SG 3.23Å; C511-C546 WeakPolarHBondContact SG-CB 3.32Å; C511-C546 PolarHBondContact SG-O 2.87Å; C511-C546 VanDerWaalsContact SG-O 3.38Å; C511-C546 CovalentContact SG-SG 2.03Å; C511-C546 PolarHBondContact SG-SG 2.71Å; C511-V548 HydrophobicContact CB-CG2 3.82Å
512	S	75.5	Confident	73.1	Confident	80 Å²	80	66.1 Å²	66.1	56%	0.559	38%	0.383	S	S	*	.	S	Bend	trans	-61	-13.7	-177.5	60.2	0	0	0	0	114.2	P510 T519	P510-S512 PolarHBondContact O-N 2.91Å; S512-T519 WeakPolarHBondContact CB-O 3.49Å; S512-T519 PolarHBondContact N-O 3.25Å; S512-T519 PolarHBondContact OG-N 3.47Å; S512-T519 PolarHBondContact OG-O 2.56Å; S512-T519 PolarHBondContact OG-OG1 3.13Å
513	V	64.4	Low	73.4	Confident	53 Å²	53	69.7 Å²	69.7	32%	0.321	40%	0.399	S	S	.	.	S	Bend	trans	-124.8	148.6	169.7	-51.1	0	0	0	0	110.1	C511 C515 G516	C511-V513 WeakPolarHBondContact CB-O 3.25Å; C511-V513 PolarHBondContact O-N 3.09Å; V513-C515 VanDerWaalsContact CG2-O 3.29Å; V513-C515 WeakPolarHBondContact CG2-O 3.13Å; V513-G516 WeakPolarHBondContact CG2-O 3.49Å
514	S	60.5	Low	73.4	Confident	76 Å²	76	71.7 Å²	71.7	53%	0.531	41%	0.406	S	S	.	.	S	Bend	trans	-89.9	-0.8	177.4	50.3	0	0	0	0	114	V548	S514-V548 WeakPolarHBondContact O-CG1 3.36Å
515	C	62.7	Low	73	Confident	60 Å²	60	70.8 Å²	70.8	41%	0.405	40%	0.396	S	S	.	.	S	Bend	trans	-164.5	135.3	-176.1	149.1	0	0	0	0	108.7	V513 V548 C552	V513-C515 VanDerWaalsContact CG2-O 3.29Å; V513-C515 WeakPolarHBondContact CG2-O 3.13Å; C515-V548 CarbonylContact C-O 3.55Å; C515-V548 VanDerWaalsContact CA-O 3.29Å; C515-V548 WeakPolarHBondContact CA-O 3.35Å; C515-C552 WeakPolarHBondContact CB-SG 3.36Å; C515-C552 WeakPolarHBondContact SG-CB 3.49Å; C515-C552 CovalentContact SG-SG 2.03Å; C515-C552 PolarHBondContact SG-SG 3.33Å
516	G	67.9	Low	72.9	Confident	22 Å²	22	69.3 Å²	69.3	23%	0.227	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.1	-163.4	-173.5	0	0	0	0	0	114.2	V513 V548	V513-G516 WeakPolarHBondContact CG2-O 3.49Å; G516-V548 PolarHBondContact N-O 3.11Å; G516-V548 PolarHBondContact O-N 2.87Å
517	S	78.1	Confident	72.7	Confident	99 Å²	99	70.5 Å²	70.5	69%	0.692	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	113.6	-177	-55	0	0	0	0	112.1
518	G	77.9	Confident	72.3	Confident	11 Å²	11	69.7 Å²	69.7	11%	0.113	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	-158.8	170.2	0	0	0	0	0	112.4	N545 C546	G518-N545 WeakPolarHBondContact O-CA 3.16Å; G518-C546 CarbonylContact C-O 3.49Å; G518-C546 VanDerWaalsContact C-SG 3.59Å; G518-C546 PolarHBondContact N-O 2.58Å; G518-C546 PolarHBondContact O-N 3.36Å
519	T	79.3	Confident	71.4	Confident	75 Å²	75	72.6 Å²	72.6	46%	0.46	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.3	-180	29.7	0	0	0	0	110.2	S512 E544 C546	S512-T519 WeakPolarHBondContact CB-O 3.49Å; S512-T519 PolarHBondContact N-O 3.25Å; S512-T519 PolarHBondContact OG-N 3.47Å; S512-T519 PolarHBondContact OG-O 2.56Å; S512-T519 PolarHBondContact OG-OG1 3.13Å; T519-E544 CarbonylContact C-O 3.58Å; T519-E544 VanDerWaalsContact CA-O 3.28Å; T519-E544 WeakPolarHBondContact CA-O 3.36Å; T519-C546 PolarHBondContact N-SG 3.18Å
520	R	79.1	Confident	70.9	Confident	84 Å²	84	72.7 Å²	72.7	32%	0.317	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	148	171.3	57.9	-176.5	-169.7	-174.2	-2.4	109.2	W508 S509 N543 E544 C546	W508-R520 HydrophobicContact CD2-CG 4.1Å; W508-R520 HydrophobicContact CE3-CB 4.21Å; W508-R520 HydrophobicContact CE3-CG 3.68Å; W508-R520 HydrophobicContact CZ3-CG 4.18Å; W508-R520 WeakPolarHBondContact CZ3-O 3.42Å; S509-R520 WeakPolarHBondContact O-CB 3.5Å; R520-N543 CarbonylContact O-C 3.52Å; R520-N543 WeakPolarHBondContact O-CA 3.41Å; R520-E544 HydrophobicContact CG-CB 4.27Å; R520-E544 IonicContact CZ-OE2 3.66Å; R520-E544 PolarHBondContact N-O 2.87Å; R520-E544 IonicContact NE-OE2 3.21Å; R520-E544 PolarHBondContact NE-OE2 3.1Å; R520-E544 IonicContact NH2-OE1 2.96Å; R520-E544 IonicContact NH2-OE2 3.67Å; R520-E544 PolarHBondContact NH2-OE2 2.76Å; R520-E544 PolarHBondContact O-N 3.44Å; R520-C546 HydrophobicContact CG-CB 4.16Å; R520-C546 PolarHBondContact N-SG 3.06Å; R520-C546 VanDerWaalsContact N-SG 3.37Å
521	S	81	Confident	70.2	Confident	39 Å²	39	74.8 Å²	74.8	27%	0.273	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	149.7	-177.2	59.6	0	0	0	0	110.9	S509 E542 N543	S509-S521 WeakPolarHBondContact CB-O 3.33Å; S509-S521 PolarHBondContact N-O 2.81Å; S509-S521 PolarHBondContact OG-N 3.09Å; S509-S521 PolarHBondContact OG-O 3.38Å; S509-S521 PolarHBondContact OG-OG 3.04Å; S521-E542 CarbonylContact C-O 3.52Å; S521-E542 WeakPolarHBondContact CA-O 3.17Å; S521-N543 WeakPolarHBondContact CB-OD1 3.46Å
522	R	76.1	Confident	69.2	Low	61 Å²	61	80.6 Å²	80.6	23%	0.23	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	155.5	166.1	63.9	-177	-174.7	179.2	-7.1	110.8	W505 I506 W508 Q541 E542	W505-R522 HydrophobicContact CB-CG 4.41Å; W505-R522 HydrophobicContact CD2-CG 4.05Å; W505-R522 HydrophobicContact CE3-CB 4.37Å; W505-R522 HydrophobicContact CE3-CG 3.66Å; W505-R522 HydrophobicContact CG-CG 4.42Å; W505-R522 HydrophobicContact CZ3-CG 4.2Å; W505-R522 WeakPolarHBondContact CZ3-O 3.48Å; I506-R522 WeakPolarHBondContact O-CB 3.25Å; W508-R522 HydrophobicContact CD2-CB 4.2Å; W508-R522 HydrophobicContact CD2-CG 4Å; W508-R522 VanDerWaalsContact CE2-CD 3.49Å; W508-R522 HydrophobicContact CE3-CB 3.79Å; W508-R522 HydrophobicContact CE3-CG 3.67Å; W508-R522 HydrophobicContact CH2-CG 3.83Å; W508-R522 HydrophobicContact CZ2-CG 4.16Å; W508-R522 VanDerWaalsContact CZ2-NE 3.35Å; W508-R522 HydrophobicContact CZ3-CB 4.14Å; W508-R522 HydrophobicContact CZ3-CG 3.59Å; R522-Q541 WeakPolarHBondContact O-CA 3.36Å; R522-E542 HydrophobicContact CG-CB 4.21Å; R522-E542 IonicContact CZ-OE2 2.69Å; R522-E542 PolarHBondContact N-O 3.35Å; R522-E542 IonicContact NE-OE2 3.44Å; R522-E542 PolarHBondContact NE-OE2 2.95Å; R522-E542 IonicContact NH2-OE1 3.17Å; R522-E542 IonicContact NH2-OE2 3.28Å; R522-E542 PolarHBondContact NH2-OE2 3.04Å; R522-E542 PolarHBondContact O-N 2.67Å
523	E	75.4	Confident	68.4	Low	99 Å²	99	80.1 Å²	80.1	46%	0.463	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.3	-174	-68.9	179.5	-173	0	0	111.2	I506 T540 Q541	I506-E523 WeakPolarHBondContact CB-O 3.33Å; I506-E523 HydrophobicContact CD1-CB 4.4Å; I506-E523 VanDerWaalsContact CG1-O 3.31Å; I506-E523 WeakPolarHBondContact CG1-O 3.3Å; I506-E523 PolarHBondContact N-O 2.82Å; E523-T540 CarbonylContact C-O 3.55Å; E523-T540 VanDerWaalsContact CA-O 3.25Å; E523-T540 WeakPolarHBondContact CA-O 3.36Å; E523-Q541 HydrophobicContact CG-CB 4.17Å; E523-Q541 HydrophobicContact CG-CG 3.92Å; E523-Q541 PolarHBondContact OE1-NE2 3.38Å
524	R	71.1	Confident	68.3	Low	50 Å²	50	80.7 Å²	80.7	19%	0.189	45%	0.446	C	S	.	.			trans	-143.6	141.5	171.8	67.8	-178.5	175.3	-178.8	-3.4	109.4	M502 W505 P539 T540	M502-R524 HydrophobicContact CE-CG 3.87Å; W505-R524 HydrophobicContact CD2-CB 4.07Å; W505-R524 HydrophobicContact CD2-CG 3.97Å; W505-R524 VanDerWaalsContact CE2-CD 3.5Å; W505-R524 HydrophobicContact CE3-CB 3.68Å; W505-R524 HydrophobicContact CE3-CG 3.61Å; W505-R524 HydrophobicContact CH2-CG 3.88Å; W505-R524 HydrophobicContact CZ2-CG 4.23Å; W505-R524 HydrophobicContact CZ3-CB 4.09Å; W505-R524 HydrophobicContact CZ3-CG 3.57Å; R524-P539 PolarHBondContact NE-O 2.96Å; R524-P539 PolarHBondContact NH2-O 2.81Å; R524-T540 PolarHBondContact N-O 3.42Å; R524-T540 WeakPolarHBondContact O-CA 3.33Å; R524-T540 VanDerWaalsContact O-CB 3.31Å; R524-T540 WeakPolarHBondContact O-CB 3.49Å
525	Y	65.5	Low	68.3	Low	147 Å²	147	83 Å²	83	58%	0.576	46%	0.456	S	S	*	.			trans	-100	160.1	173.7	56.3	-87.4	0	0	0	111.3	S503 K527	S503-Y525 WeakPolarHBondContact CB-O 3.29Å; S503-Y525 PolarHBondContact N-O 2.84Å; S503-Y525 WeakPolarHBondContact OG-CD1 3.29Å; S503-Y525 PolarHBondContact OG-N 2.88Å; S503-Y525 PolarHBondContact OG-O 2.87Å; Y525-K527 HydrophobicContact CE2-CG 4.03Å
526	V	71.3	Confident	68.4	Low	31 Å²	31	81.1 Å²	81.1	19%	0.188	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	125.3	172.9	-175.5	0	0	0	0	108.6	M502 Q528 F529 C536	M502-V526 HydrophobicContact CE-CG2 3.97Å; M502-V526 HydrophobicContact SD-CB 4.44Å; M502-V526 HydrophobicContact SD-CG2 3.87Å; V526-Q528 WeakPolarHBondContact CG1-O 3.31Å; V526-F529 HydrophobicContact CB-CE1 4.25Å; V526-F529 HydrophobicContact CB-CE2 4.32Å; V526-F529 HydrophobicContact CB-CZ 4Å; V526-F529 HydrophobicContact CG1-CD1 4.09Å; V526-F529 HydrophobicContact CG1-CD2 4.22Å; V526-F529 HydrophobicContact CG1-CE1 4.03Å; V526-F529 HydrophobicContact CG1-CE2 4.16Å; V526-F529 HydrophobicContact CG1-CG 4.18Å; V526-F529 HydrophobicContact CG1-CZ 4.06Å; V526-F529 HydrophobicContact CG2-CE1 4.22Å; V526-F529 HydrophobicContact CG2-CZ 4.29Å; V526-C536 HydrophobicContact CG2-CB 4.1Å
527	K	64.5	Low	68.4	Low	119 Å²	119	86.7 Å²	86.7	52%	0.517	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-38	173.9	-84.3	-179.9	175.2	172.5	0	111.7	M501 Y525	M501-K527 HydrophobicContact CG-CB 4.49Å; M501-K527 WeakPolarHBondContact O-CA 3.39Å; M501-K527 WeakPolarHBondContact O-CB 3.32Å; M501-K527 PolarHBondContact O-N 2.79Å; Y525-K527 HydrophobicContact CE2-CG 4.03Å
528	Q	63	Low	68.1	Low	106 Å²	106	84.9 Å²	84.9	50%	0.495	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	130.3	178.4	-167.5	173	-4.8	0	0	110.6	M501 V526	M501-Q528 HydrophobicContact CB-CB 4.16Å; M501-Q528 PolarHBondContact N-O 2.87Å; M501-Q528 PolarHBondContact O-N 3.44Å; M501-Q528 VanDerWaalsContact O-N 3.11Å; V526-Q528 WeakPolarHBondContact CG1-O 3.31Å
529	F	59	Low	67.6	Low	124 Å²	124	88 Å²	88	54%	0.544	47%	0.474	S	S	.	.			trans	-82.6	151.3	171.6	-66.2	-88	0	0	0	110	V526	V526-F529 HydrophobicContact CB-CE1 4.25Å; V526-F529 HydrophobicContact CB-CE2 4.32Å; V526-F529 HydrophobicContact CB-CZ 4Å; V526-F529 HydrophobicContact CG1-CD1 4.09Å; V526-F529 HydrophobicContact CG1-CD2 4.22Å; V526-F529 HydrophobicContact CG1-CE1 4.03Å; V526-F529 HydrophobicContact CG1-CE2 4.16Å; V526-F529 HydrophobicContact CG1-CG 4.18Å; V526-F529 HydrophobicContact CG1-CZ 4.06Å; V526-F529 HydrophobicContact CG2-CE1 4.22Å; V526-F529 HydrophobicContact CG2-CZ 4.29Å
530	P	64.1	Low	67.3	Low	43 Å²	43	88.1 Å²	88.1	28%	0.279	48%	0.475	S	S	.	.			trans	-63.9	140.7	174.1	-18.5	32.2	0	0	0	111.3	C500 D532 G533	C500-P530 VanDerWaalsContact SG-CD 3.53Å; C500-P530 VanDerWaalsContact SG-CG 3.59Å; P530-D532 PolarHBondContact O-N 3.31Å; P530-G533 PolarHBondContact O-N 2.99Å; P530-G533 VanDerWaalsContact O-N 3.15Å
531	D	58.1	Low	67.2	Low	162 Å²	162	88.8 Å²	88.8	87%	0.866	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.5	-178.5	-66	-48.3	0	0	0	113.7	G533	D531-G533 PolarHBondContact O-N 3.33Å
532	D	60.1	Low	67.3	Low	151 Å²	151	90.5 Å²	90.5	81%	0.807	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	8.5	177.3	-155.5	32	0	0	0	113.5	P530 S534	P530-D532 PolarHBondContact O-N 3.31Å; D532-S534 PolarHBondContact O-N 2.88Å; D532-S534 VanDerWaalsContact O-N 3.17Å
533	G	58	Low	67.6	Low	70 Å²	70	92.4 Å²	92.4	72%	0.722	50%	0.5	S	S	*	.			trans	71	10.8	171.5	0	0	0	0	0	115.9	P530 D531	P530-G533 PolarHBondContact O-N 2.99Å; P530-G533 VanDerWaalsContact O-N 3.15Å; D531-G533 PolarHBondContact O-N 3.33Å
534	S	62	Low	67.9	Low	66 Å²	66	91.2 Å²	91.2	46%	0.462	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-78.5	141.7	176.9	53.9	0	0	0	0	112.2	D532	D532-S534 PolarHBondContact O-N 2.88Å; D532-S534 VanDerWaalsContact O-N 3.17Å
535	V	60.2	Low	68.3	Low	123 Å²	123	95 Å²	95	75%	0.745	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-80.1	128	-179.5	-177.3	0	0	0	0	110	T537	V535-T537 PolarHBondContact O-N 3.01Å
536	C	64.8	Low	68.7	Low	21 Å²	21	88.7 Å²	88.7	14%	0.142	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-62.8	116.1	177.1	-60.2	0	0	0	0	111.9	C500 V526 L538	C500-C536 HydrophobicContact CB-CB 3.79Å; C500-C536 WeakPolarHBondContact CB-SG 3.41Å; C500-C536 WeakPolarHBondContact SG-CA 3.46Å; C500-C536 WeakPolarHBondContact SG-CB 3.36Å; C500-C536 CovalentContact SG-SG 2.03Å; C500-C536 PolarHBondContact SG-SG 3.23Å; V526-C536 HydrophobicContact CG2-CB 4.1Å; C536-L538 VanDerWaalsContact C-N 3.35Å
537	T	67.5	Low	68.9	Low	140 Å²	140	91.1 Å²	91.1	86%	0.859	51%	0.51	S	S	*	.			trans	-89.6	3.8	178.7	52.1	0	0	0	0	113.9	V535	V535-T537 PolarHBondContact O-N 3.01Å
538	L	71.4	Confident	68.6	Low	61 Å²	61	87.7 Å²	87.7	32%	0.319	50%	0.499	S	S	.	.	S	Bend	trans	-70.8	142.4	-179.9	-65.1	-178.9	0	0	0	111.7	T499 C500 M502 C536 T540	T499-L538 HydrophobicContact CG2-CD1 4.01Å; C500-L538 HydrophobicContact CB-CD1 4.29Å; M502-L538 HydrophobicContact CE-CB 4.48Å; M502-L538 HydrophobicContact CG-CD1 3.82Å; M502-L538 HydrophobicContact SD-CB 4.17Å; M502-L538 HydrophobicContact SD-CD1 4.05Å; C536-L538 VanDerWaalsContact C-N 3.35Å; L538-T540 PolarHBondContact O-N 2.81Å
539	P	68.6	Low	68.2	Low	77 Å²	77	88.4 Å²	88.4	50%	0.5	51%	0.506	S	S	.	.			trans	-65.1	128.5	179.9	25.3	-33	0	0	0	111.1	R524	R524-P539 PolarHBondContact NE-O 2.96Å; R524-P539 PolarHBondContact NH2-O 2.81Å
540	T	73.3	Confident	67.9	Low	77 Å²	77	91.2 Å²	91.2	47%	0.472	52%	0.521	S	S	.	.	S	Bend	trans	-91.2	-14.6	175.7	48.7	0	0	0	0	113	M502 E523 R524 L538	M502-T540 HydrophobicContact CE-CG2 4.12Å; E523-T540 CarbonylContact C-O 3.55Å; E523-T540 VanDerWaalsContact CA-O 3.25Å; E523-T540 WeakPolarHBondContact CA-O 3.36Å; R524-T540 PolarHBondContact N-O 3.42Å; R524-T540 WeakPolarHBondContact O-CA 3.33Å; R524-T540 VanDerWaalsContact O-CB 3.31Å; R524-T540 WeakPolarHBondContact O-CB 3.49Å; L538-T540 PolarHBondContact O-N 2.81Å
541	Q	75.8	Confident	67.4	Low	98 Å²	98	96.9 Å²	96.9	46%	0.458	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139	174.6	-172.2	179.6	73.3	0	0	108.9	R522 E523	R522-Q541 WeakPolarHBondContact O-CA 3.36Å; E523-Q541 HydrophobicContact CG-CB 4.17Å; E523-Q541 HydrophobicContact CG-CG 3.92Å; E523-Q541 PolarHBondContact OE1-NE2 3.38Å
542	E	82.9	Confident	67	Low	74 Å²	74	91.5 Å²	91.5	35%	0.346	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	133.4	176.8	-175.7	-178.1	-150.9	0	0	108.7	W505 W508 S521 R522	W505-E542 HydrophobicContact CH2-CB 3.45Å; W505-E542 VanDerWaalsContact CH2-CB 3.45Å; W505-E542 HydrophobicContact CZ2-CB 3.88Å; W505-E542 HydrophobicContact CZ3-CB 3.83Å; W508-E542 HydrophobicContact CH2-CB 4.43Å; W508-E542 HydrophobicContact CH2-CG 3.95Å; W508-E542 WeakPolarHBondContact CZ3-O 3.47Å; S521-E542 CarbonylContact C-O 3.52Å; S521-E542 WeakPolarHBondContact CA-O 3.17Å; R522-E542 HydrophobicContact CG-CB 4.21Å; R522-E542 IonicContact CZ-OE2 2.69Å; R522-E542 PolarHBondContact N-O 3.35Å; R522-E542 IonicContact NE-OE2 3.44Å; R522-E542 PolarHBondContact NE-OE2 2.95Å; R522-E542 IonicContact NH2-OE1 3.17Å; R522-E542 IonicContact NH2-OE2 3.28Å; R522-E542 PolarHBondContact NH2-OE2 3.04Å; R522-E542 PolarHBondContact O-N 2.67Å
543	N	82.4	Confident	66.7	Low	102 Å²	102	88.2 Å²	88.2	55%	0.545	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.8	179.8	-66.2	-15.5	0	0	0	109.3	R520 S521	R520-N543 CarbonylContact O-C 3.52Å; R520-N543 WeakPolarHBondContact O-CA 3.41Å; S521-N543 WeakPolarHBondContact CB-OD1 3.46Å
544	E	82.9	Confident	66.3	Low	73 Å²	73	91.7 Å²	91.7	34%	0.341	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	143.7	-179.7	-175.1	-173.4	-146.5	0	0	109.6	W508 T519 R520	W508-E544 HydrophobicContact CH2-CB 3.42Å; W508-E544 VanDerWaalsContact CH2-CB 3.42Å; W508-E544 HydrophobicContact CH2-CG 4.47Å; W508-E544 HydrophobicContact CZ2-CB 3.94Å; W508-E544 WeakPolarHBondContact CZ2-OE2 3.47Å; W508-E544 HydrophobicContact CZ3-CB 3.79Å; T519-E544 CarbonylContact C-O 3.58Å; T519-E544 VanDerWaalsContact CA-O 3.28Å; T519-E544 WeakPolarHBondContact CA-O 3.36Å; R520-E544 HydrophobicContact CG-CB 4.27Å; R520-E544 IonicContact CZ-OE2 3.66Å; R520-E544 PolarHBondContact N-O 2.87Å; R520-E544 IonicContact NE-OE2 3.21Å; R520-E544 PolarHBondContact NE-OE2 3.1Å; R520-E544 IonicContact NH2-OE1 2.96Å; R520-E544 IonicContact NH2-OE2 3.67Å; R520-E544 PolarHBondContact NH2-OE2 2.76Å; R520-E544 PolarHBondContact O-N 3.44Å
545	N	78.9	Confident	65.6	Low	130 Å²	130	93.2 Å²	93.2	70%	0.695	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	131.7	172.3	57.1	-36	0	0	0	110.6	G518	G518-N545 WeakPolarHBondContact O-CA 3.16Å
546	C	74.9	Confident	65.2	Low	14 Å²	14	91.7 Å²	91.7	10%	0.095	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.4	178.8	44.3	0	0	0	0	109.3	C511 G518 T519 R520	C511-C546 WeakPolarHBondContact CA-SG 3.47Å; C511-C546 HydrophobicContact CB-CB 3.94Å; C511-C546 WeakPolarHBondContact CB-SG 3.23Å; C511-C546 WeakPolarHBondContact SG-CB 3.32Å; C511-C546 PolarHBondContact SG-O 2.87Å; C511-C546 VanDerWaalsContact SG-O 3.38Å; C511-C546 CovalentContact SG-SG 2.03Å; C511-C546 PolarHBondContact SG-SG 2.71Å; G518-C546 CarbonylContact C-O 3.49Å; G518-C546 VanDerWaalsContact C-SG 3.59Å; G518-C546 PolarHBondContact N-O 2.58Å; G518-C546 PolarHBondContact O-N 3.36Å; T519-C546 PolarHBondContact N-SG 3.18Å; R520-C546 HydrophobicContact CG-CB 4.16Å; R520-C546 PolarHBondContact N-SG 3.06Å; R520-C546 VanDerWaalsContact N-SG 3.37Å
547	V	74.3	Confident	65.1	Low	82 Å²	82	91.3 Å²	91.3	50%	0.497	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.8	175.1	-173.4	0	0	0	0	107.9	E550	V547-E550 HydrophobicContact CG1-CG 4.47Å
548	V	59.3	Low	65	Low	47 Å²	47	88.8 Å²	88.8	29%	0.285	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	102.3	179.4	-175.8	0	0	0	0	108.1	C511 S514 C515 G516	C511-V548 HydrophobicContact CB-CG2 3.82Å; S514-V548 WeakPolarHBondContact O-CG1 3.36Å; C515-V548 CarbonylContact C-O 3.55Å; C515-V548 VanDerWaalsContact CA-O 3.29Å; C515-V548 WeakPolarHBondContact CA-O 3.35Å; G516-V548 PolarHBondContact N-O 3.11Å; G516-V548 PolarHBondContact O-N 2.87Å
549	N	53.1	Low	65.2	Low	121 Å²	121	87.7 Å²	87.7	65%	0.647	50%	0.502	S	S	*	.			trans	61.1	120.7	-174.2	-56.3	-25.4	0	0	0	114.5
550	E	53.1	Low	65.4	Low	184 Å²	184	86.7 Å²	86.7	86%	0.86	49%	0.494	S	S	*	.	S	Bend	trans	-72.9	-30.7	176.6	-69.1	-168.5	127.3	0	0	112.9	V547 C552	V547-E550 HydrophobicContact CG1-CG 4.47Å; E550-C552 PolarHBondContact O-N 3.1Å
551	D	53.4	Low	65.6	Low	162 Å²	162	91.6 Å²	91.6	87%	0.866	51%	0.512	S	S	*	.			trans	-91.5	54.3	-175.8	-71.8	-52.4	0	0	0	114.3	S553	D551-S553 PolarHBondContact O-N 3.39Å
552	C	50.5	Low	65.8	Low	49 Å²	49	89.9 Å²	89.9	33%	0.331	50%	0.501	S	S	.	.			trans	-84.9	89	174.1	-84.3	0	0	0	0	112.6	C515 E550	C515-C552 WeakPolarHBondContact CB-SG 3.36Å; C515-C552 WeakPolarHBondContact SG-CB 3.49Å; C515-C552 CovalentContact SG-SG 2.03Å; C515-C552 PolarHBondContact SG-SG 3.33Å; E550-C552 PolarHBondContact O-N 3.1Å
553	S	54	Low	65.4	Low	82 Å²	82	88.1 Å²	88.1	57%	0.573	50%	0.502	S	S	*	.			trans	-73.4	129.9	167.7	-75.3	0	0	0	0	111.4	D551 S555	D551-S553 PolarHBondContact O-N 3.39Å; S553-S555 PolarHBondContact O-N 3.39Å
554	P	49.4	Very low	65.2	Low	142 Å²	142	92.1 Å²	92.1	92%	0.922	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	40.4	-167.8	34.6	-38.9	0	0	0	114.2
555	S	46.4	Very low	65.3	Low	98 Å²	98	92 Å²	92	69%	0.685	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.1	-3.1	-176.1	57.5	0	0	0	0	114.6	S553	S553-S555 PolarHBondContact O-N 3.39Å
556	S	52.6	Low	65.4	Low	92 Å²	92	89 Å²	89	64%	0.643	50%	0.498	S	S	*	.			trans	-96.3	119.4	176.6	52.5	0	0	0	0	112
557	C	63.3	Low	65.7	Low	12 Å²	12	94.7 Å²	94.7	8%	0.081	53%	0.532	C	S	.	.			trans	-70.5	140.3	165.7	37.2	0	0	0	0	110.5	V559 V583 P587 C593	C557-V559 PolarHBondContact O-N 2.86Å; C557-V583 HydrophobicContact CB-CG1 4.22Å; C557-P587 HydrophobicContact CB-CG 4.17Å; C557-C593 HydrophobicContact CB-CB 3.64Å; C557-C593 WeakPolarHBondContact CB-SG 3.36Å; C557-C593 WeakPolarHBondContact SG-CA 3.44Å; C557-C593 WeakPolarHBondContact SG-CB 3.28Å; C557-C593 CovalentContact SG-SG 2.02Å; C557-C593 PolarHBondContact SG-SG 3.22Å
558	L	63.9	Low	66.2	Low	87 Å²	87	92 Å²	92	46%	0.455	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	111.9	174.2	-78.2	163.7	0	0	0	109	K584 M585	L558-K584 WeakPolarHBondContact O-CA 3.31Å; L558-K584 VanDerWaalsContact O-CB 3.3Å; L558-K584 WeakPolarHBondContact O-CB 3.32Å; L558-K584 PolarHBondContact O-N 3.05Å; L558-M585 HydrophobicContact CD1-CE 3.6Å; L558-M585 PolarHBondContact N-O 2.75Å; L558-M585 PolarHBondContact O-N 3.25Å
559	V	76.2	Confident	67.4	Low	39 Å²	39	94.1 Å²	94.1	24%	0.236	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	160.6	171.8	-67.9	0	0	0	0	111	C557 R581 M582 V583 A595	C557-V559 PolarHBondContact O-N 2.86Å; V559-R581 HydrophobicContact CB-CG 4.32Å; V559-M582 CarbonylContact C-O 3.54Å; V559-M582 VanDerWaalsContact CA-O 3.32Å; V559-M582 WeakPolarHBondContact CA-O 3.33Å; V559-V583 HydrophobicContact CG1-CG2 4.44Å; V559-A595 HydrophobicContact CG1-CB 3.65Å
560	T	73.6	Confident	68.4	Low	55 Å²	55	89.6 Å²	89.6	34%	0.337	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-68.5	167.5	165.1	64.3	0	0	0	0	110.3	M582 K584	T560-M582 HydrophobicContact CG2-CB 4.17Å; T560-M582 PolarHBondContact N-O 3.17Å; T560-M582 PolarHBondContact OG1-N 3Å; T560-K584 HydrophobicContact CG2-CB 4.27Å
561	E	76.3	Confident	69.3	Low	181 Å²	181	86.7 Å²	86.7	85%	0.846	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-56.4	156.3	158.8	-64.3	-177.5	174.9	0	0	110
562	W	81.1	Confident	70.3	Confident	62 Å²	62	80.5 Å²	80.5	24%	0.235	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-64.6	136.1	174.3	-74.1	113.3	0	0	0	110.7	R579 R581 E596 E599	W562-R579 HydrophobicContact CD2-CG 4.16Å; W562-R579 HydrophobicContact CE3-CB 4.5Å; W562-R579 HydrophobicContact CE3-CG 3.75Å; W562-R579 HydrophobicContact CZ3-CG 4.29Å; W562-R579 WeakPolarHBondContact CZ3-O 2.97Å; W562-R581 HydrophobicContact CD2-CB 4.11Å; W562-R581 HydrophobicContact CD2-CG 4.02Å; W562-R581 HydrophobicContact CE3-CB 3.64Å; W562-R581 HydrophobicContact CE3-CG 3.64Å; W562-R581 HydrophobicContact CH2-CG 4.02Å; W562-R581 HydrophobicContact CZ2-CG 4.39Å; W562-R581 VanDerWaalsContact CZ2-NE 3.28Å; W562-R581 HydrophobicContact CZ3-CB 4.08Å; W562-R581 HydrophobicContact CZ3-CG 3.63Å; W562-E596 WeakPolarHBondContact CH2-O 3.1Å; W562-E599 VanDerWaalsContact CE2-OE2 3.24Å; W562-E599 HydrophobicContact CH2-CB 3.55Å; W562-E599 HydrophobicContact CZ2-CB 3.87Å; W562-E599 WeakPolarHBondContact CZ2-OE2 3.28Å; W562-E599 HydrophobicContact CZ3-CB 3.89Å; W562-E599 PolarHBondContact NE1-OE2 2.83Å
563	G	73.9	Confident	71.5	Confident	36 Å²	36	79.1 Å²	79.1	37%	0.371	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-59	163.5	162.6	0	0	0	0	0	111.3	E580	G563-E580 PolarHBondContact N-O 2.96Å
564	E	78.7	Confident	72.9	Confident	186 Å²	186	81.6 Å²	81.6	87%	0.869	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-59.5	155.3	171.8	-62.7	-168	157.1	0	0	110.8	D566	E564-D566 PolarHBondContact O-N 2.97Å
565	W	83.5	Confident	74.6	Confident	70 Å²	70	75.1 Å²	75.1	27%	0.265	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-68.3	128.9	176.4	-73.5	102.8	0	0	0	110.6	K577 R578 R579 E599 E601	W565-K577 HydrophobicContact CB-CD 3.99Å; W565-K577 HydrophobicContact CD2-CD 3.65Å; W565-K577 HydrophobicContact CD2-CG 4.11Å; W565-K577 VanDerWaalsContact CE2-NZ 3.35Å; W565-K577 HydrophobicContact CE3-CB 4.01Å; W565-K577 HydrophobicContact CE3-CD 3.73Å; W565-K577 HydrophobicContact CE3-CG 3.64Å; W565-K577 HydrophobicContact CG-CD 3.79Å; W565-K577 HydrophobicContact CZ3-CD 4.43Å; W565-K577 HydrophobicContact CZ3-CG 4.08Å; W565-K577 WeakPolarHBondContact CZ3-O 3.23Å; W565-R578 VanDerWaalsContact CE3-C 3.49Å; W565-R579 HydrophobicContact CD2-CB 4.17Å; W565-R579 HydrophobicContact CD2-CG 3.98Å; W565-R579 VanDerWaalsContact CE2-CD 3.47Å; W565-R579 HydrophobicContact CE3-CB 3.92Å; W565-R579 HydrophobicContact CE3-CG 3.77Å; W565-R579 HydrophobicContact CH2-CG 3.97Å; W565-R579 HydrophobicContact CZ2-CG 4.17Å; W565-R579 VanDerWaalsContact CZ2-NE 3.35Å; W565-R579 HydrophobicContact CZ3-CB 4.33Å; W565-R579 HydrophobicContact CZ3-CG 3.77Å; W565-E599 HydrophobicContact CH2-CB 4.28Å; W565-E599 HydrophobicContact CH2-CG 3.84Å; W565-E601 HydrophobicContact CH2-CB 3.47Å; W565-E601 VanDerWaalsContact CH2-CB 3.47Å; W565-E601 HydrophobicContact CZ2-CB 4.09Å; W565-E601 WeakPolarHBondContact CZ2-OE2 3.45Å; W565-E601 HydrophobicContact CZ3-CB 3.86Å
566	D	81.9	Confident	76.5	Confident	68 Å²	68	75.5 Å²	75.5	36%	0.364	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-53.1	152.5	164.4	-86	-6.1	0	0	0	110.2	E564 K577 R578	E564-D566 PolarHBondContact O-N 2.97Å; D566-K577 WeakPolarHBondContact O-CB 3.36Å; D566-R578 HydrophobicContact CB-CG 3.95Å; D566-R578 VanDerWaalsContact CB-O 3.32Å; D566-R578 WeakPolarHBondContact CB-O 3.32Å; D566-R578 PolarHBondContact N-O 3.02Å; D566-R578 VanDerWaalsContact OD2-CG 3.31Å; D566-R578 WeakPolarHBondContact OD2-CG 3.38Å; D566-R578 IonicContact OD2-CZ 3.91Å; D566-R578 IonicContact OD2-NE 2.91Å; D566-R578 PolarHBondContact OD2-NE 3.3Å; D566-R578 IonicContact OD2-NH2 3.88Å; D566-R578 PolarHBondContact OD2-NH2 2.8Å
567	V	80.3	Confident	78.1	Confident	133 Å²	133	73.2 Å²	73.2	81%	0.806	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-51.5	143.4	170.8	-65	0	0	0	0	111.1	S569	V567-S569 PolarHBondContact O-N 2.03Å
568	C	86.4	Confident	79.2	Confident	25 Å²	25	79.6 Å²	79.6	17%	0.169	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-56	131.8	176.5	-168	0	0	0	0	110.1	A570 C603 M605	C568-A570 PolarHBondContact O-N 3.19Å; C568-C603 WeakPolarHBondContact CA-SG 3.32Å; C568-C603 HydrophobicContact CB-CB 3.92Å; C568-C603 WeakPolarHBondContact CB-SG 3.32Å; C568-C603 WeakPolarHBondContact SG-CB 3.45Å; C568-C603 CovalentContact SG-SG 2.03Å; C568-C603 PolarHBondContact SG-SG 3.44Å; C568-M605 HydrophobicContact CB-CG 4Å; C568-M605 HydrophobicContact CB-SD 3.95Å; C568-M605 VanDerWaalsContact SG-CG 3.55Å
569	S	84.8	Confident	80.1	Confident	92 Å²	92	78.2 Å²	78.2	64%	0.643	42%	0.419	S	S	*	.	S	Bend	trans	-64.1	-12.3	-177	72	0	0	0	0	114.3	V567 M576	V567-S569 PolarHBondContact O-N 2.03Å; S569-M576 WeakPolarHBondContact CB-O 3.4Å; S569-M576 PolarHBondContact N-O 2.91Å; S569-M576 PolarHBondContact OG-N 3.27Å; S569-M576 PolarHBondContact OG-O 3.46Å
570	A	73.1	Confident	80.5	Confident	26 Å²	26	82.3 Å²	82.3	22%	0.215	44%	0.435	C	S	.	.			trans	-120.2	147.2	172.2	0	0	0	0	0	109.3	C568 M605	C568-A570 PolarHBondContact O-N 3.19Å; A570-M605 WeakPolarHBondContact O-CG 3.37Å
571	T	72.8	Confident	80.8	Confident	124 Å²	124	82.1 Å²	82.1	76%	0.761	43%	0.428	S	S	*	.	S	Bend	trans	-90.5	-20.2	177.9	47.4	0	0	0	0	113.3	M605	T571-M605 WeakPolarHBondContact O-CE 3.4Å
572	C	72.6	Confident	80.6	Confident	31 Å²	31	79.6 Å²	79.6	21%	0.209	42%	0.418	C	S	.	.	S	Bend	trans	-145.2	155.4	173.3	70.5	0	0	0	0	109.2	P606 C608	C572-P606 CarbonylContact C-O 3.55Å; C572-P606 VanDerWaalsContact CA-O 3.31Å; C572-P606 WeakPolarHBondContact CA-O 2.84Å; C572-P606 VanDerWaalsContact CB-O 3.26Å; C572-P606 WeakPolarHBondContact CB-O 3.46Å; C572-C608 HydrophobicContact CB-CB 4Å; C572-C608 WeakPolarHBondContact CB-SG 3.26Å; C572-C608 WeakPolarHBondContact SG-CB 3.37Å; C572-C608 CovalentContact SG-SG 2.04Å; C572-C608 PolarHBondContact SG-SG 2.88Å
573	G	77.1	Confident	80.3	Confident	21 Å²	21	79.5 Å²	79.5	22%	0.216	42%	0.424	C	S	.	.	S	Bend	trans	69.7	-151.5	-176.9	0	0	0	0	0	114.5	M605 P606	G573-M605 PolarHBondContact N-O 3.24Å; G573-M605 WeakPolarHBondContact O-CB 3.3Å; G573-M605 PolarHBondContact O-N 3.08Å; G573-P606 PolarHBondContact N-O 2.86Å
574	L	83.6	Confident	79.9	Confident	134 Å²	134	85.3 Å²	85.3	70%	0.702	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.8	-177.5	-85.4	154.3	0	0	0	111.6
575	G	84.5	Confident	79.1	Confident	6 Å²	6	80.7 Å²	80.7	6%	0.062	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-173.9	171.4	0	0	0	0	0	112.8	K602 C603	G575-K602 WeakPolarHBondContact O-CA 3.19Å; G575-C603 PolarHBondContact N-O 2.77Å; G575-C603 PolarHBondContact O-N 3.29Å
576	M	86.4	Confident	78.1	Confident	105 Å²	105	82.2 Å²	82.2	52%	0.517	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	133.9	173.7	-62.5	-179.3	-175.7	0	0	109.7	S569 V600 E601 C603	S569-M576 WeakPolarHBondContact CB-O 3.4Å; S569-M576 PolarHBondContact N-O 2.91Å; S569-M576 PolarHBondContact OG-N 3.27Å; S569-M576 PolarHBondContact OG-O 3.46Å; M576-V600 HydrophobicContact CB-CG1 4.02Å; M576-V600 HydrophobicContact CG-CG1 4.48Å; M576-V600 HydrophobicContact SD-CG1 4.23Å; M576-E601 WeakPolarHBondContact CA-O 3.3Å; M576-C603 PolarHBondContact N-SG 2.84Å; M576-C603 VanDerWaalsContact N-SG 3.45Å
577	K	85.3	Confident	77.3	Confident	44 Å²	44	80 Å²	80	19%	0.191	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.2	167.8	53.7	171.7	-169.4	161.3	0	108	W565 D566 V600 E601 C603	W565-K577 HydrophobicContact CB-CD 3.99Å; W565-K577 HydrophobicContact CD2-CD 3.65Å; W565-K577 HydrophobicContact CD2-CG 4.11Å; W565-K577 VanDerWaalsContact CE2-NZ 3.35Å; W565-K577 HydrophobicContact CE3-CB 4.01Å; W565-K577 HydrophobicContact CE3-CD 3.73Å; W565-K577 HydrophobicContact CE3-CG 3.64Å; W565-K577 HydrophobicContact CG-CD 3.79Å; W565-K577 HydrophobicContact CZ3-CD 4.43Å; W565-K577 HydrophobicContact CZ3-CG 4.08Å; W565-K577 WeakPolarHBondContact CZ3-O 3.23Å; D566-K577 WeakPolarHBondContact O-CB 3.36Å; K577-V600 WeakPolarHBondContact O-CA 3.2Å; K577-E601 WeakPolarHBondContact CE-OE2 3.32Å; K577-E601 HydrophobicContact CG-CB 4.34Å; K577-E601 WeakPolarHBondContact CG-O 3.42Å; K577-E601 PolarHBondContact N-O 3.02Å; K577-E601 IonicContact NZ-OE2 2.71Å; K577-E601 PolarHBondContact NZ-OE2 2.8Å; K577-E601 PolarHBondContact O-N 2.98Å; K577-C603 HydrophobicContact CD-CB 4.43Å; K577-C603 HydrophobicContact CG-CB 4.21Å; K577-C603 PolarHBondContact N-SG 3.45Å; K577-C603 VanDerWaalsContact N-SG 3.38Å
578	R	87.7	Confident	76.2	Confident	146 Å²	146	79.4 Å²	79.4	55%	0.551	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.2	178.5	66.7	-176	-177.7	-136.4	-16	110.2	W565 D566 L598 E599 V600	W565-R578 VanDerWaalsContact CE3-C 3.49Å; D566-R578 HydrophobicContact CB-CG 3.95Å; D566-R578 VanDerWaalsContact CB-O 3.32Å; D566-R578 WeakPolarHBondContact CB-O 3.32Å; D566-R578 PolarHBondContact N-O 3.02Å; D566-R578 VanDerWaalsContact OD2-CG 3.31Å; D566-R578 WeakPolarHBondContact OD2-CG 3.38Å; D566-R578 IonicContact OD2-CZ 3.91Å; D566-R578 IonicContact OD2-NE 2.91Å; D566-R578 PolarHBondContact OD2-NE 3.3Å; D566-R578 IonicContact OD2-NH2 3.88Å; D566-R578 PolarHBondContact OD2-NH2 2.8Å; R578-L598 HydrophobicContact CB-CD1 4.26Å; R578-E599 CarbonylContact C-O 3.57Å; R578-E599 WeakPolarHBondContact CA-O 3.19Å; R578-V600 HydrophobicContact CB-CG2 4.05Å
579	R	82.9	Confident	75.1	Confident	59 Å²	59	85.2 Å²	85.2	22%	0.223	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	151.4	169.1	62.1	-177.8	-177.3	-174	-9.9	110	W562 W565 E599	W562-R579 HydrophobicContact CD2-CG 4.16Å; W562-R579 HydrophobicContact CE3-CB 4.5Å; W562-R579 HydrophobicContact CE3-CG 3.75Å; W562-R579 HydrophobicContact CZ3-CG 4.29Å; W562-R579 WeakPolarHBondContact CZ3-O 2.97Å; W565-R579 HydrophobicContact CD2-CB 4.17Å; W565-R579 HydrophobicContact CD2-CG 3.98Å; W565-R579 VanDerWaalsContact CE2-CD 3.47Å; W565-R579 HydrophobicContact CE3-CB 3.92Å; W565-R579 HydrophobicContact CE3-CG 3.77Å; W565-R579 HydrophobicContact CH2-CG 3.97Å; W565-R579 HydrophobicContact CZ2-CG 4.17Å; W565-R579 VanDerWaalsContact CZ2-NE 3.35Å; W565-R579 HydrophobicContact CZ3-CB 4.33Å; W565-R579 HydrophobicContact CZ3-CG 3.77Å; R579-E599 HydrophobicContact CG-CB 4.04Å; R579-E599 IonicContact CZ-OE1 2.75Å; R579-E599 IonicContact CZ-OE2 3.77Å; R579-E599 PolarHBondContact N-O 2.92Å; R579-E599 IonicContact NE-OE1 3.74Å; R579-E599 IonicContact NE-OE2 2.71Å; R579-E599 PolarHBondContact NE-OE2 3.19Å; R579-E599 VanDerWaalsContact NH2-CD 3.31Å; R579-E599 IonicContact NH2-OE1 3.21Å; R579-E599 PolarHBondContact NH2-OE1 2.91Å; R579-E599 VanDerWaalsContact NH2-OE1 3.14Å; R579-E599 IonicContact NH2-OE2 2.98Å; R579-E599 PolarHBondContact NH2-OE2 2.87Å; R579-E599 PolarHBondContact O-N 3Å
580	E	84.2	Confident	73.9	Confident	125 Å²	125	84.1 Å²	84.1	58%	0.584	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	153.6	-179.6	58.6	179.8	-154.5	0	0	111.9	G563 V597	G563-E580 PolarHBondContact N-O 2.96Å; E580-V597 CarbonylContact C-O 3.52Å; E580-V597 VanDerWaalsContact CA-O 3.26Å; E580-V597 WeakPolarHBondContact CA-O 3.39Å
581	R	80.7	Confident	73.5	Confident	50 Å²	50	85.8 Å²	85.8	19%	0.189	48%	0.478	C	S	.	.			trans	-141.1	144.6	171.8	69.2	-178.1	167.9	-175.9	-8.1	110	V559 W562 E596 V597	V559-R581 HydrophobicContact CB-CG 4.32Å; W562-R581 HydrophobicContact CD2-CB 4.11Å; W562-R581 HydrophobicContact CD2-CG 4.02Å; W562-R581 HydrophobicContact CE3-CB 3.64Å; W562-R581 HydrophobicContact CE3-CG 3.64Å; W562-R581 HydrophobicContact CH2-CG 4.02Å; W562-R581 HydrophobicContact CZ2-CG 4.39Å; W562-R581 VanDerWaalsContact CZ2-NE 3.28Å; W562-R581 HydrophobicContact CZ3-CB 4.08Å; W562-R581 HydrophobicContact CZ3-CG 3.63Å; R581-E596 VanDerWaalsContact CZ-O 3.25Å; R581-E596 PolarHBondContact NE-O 3.17Å; R581-E596 PolarHBondContact NH2-O 3.38Å; R581-V597 PolarHBondContact N-O 3.23Å; R581-V597 WeakPolarHBondContact O-CG1 3.32Å
582	M	70.8	Confident	72.9	Confident	129 Å²	129	87.8 Å²	87.8	64%	0.635	48%	0.483	S	S	*	.			trans	-94.5	151.5	-174.2	-61.3	-174.3	-176.9	0	0	111.2	V559 T560 K584	V559-M582 CarbonylContact C-O 3.54Å; V559-M582 VanDerWaalsContact CA-O 3.32Å; V559-M582 WeakPolarHBondContact CA-O 3.33Å; T560-M582 HydrophobicContact CG2-CB 4.17Å; T560-M582 PolarHBondContact N-O 3.17Å; T560-M582 PolarHBondContact OG1-N 3Å; M582-K584 PolarHBondContact O-N 2.75Å
583	V	75.8	Confident	72.5	Confident	59 Å²	59	87.6 Å²	87.6	36%	0.358	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	109.7	170.3	-176.5	0	0	0	0	107.9	C557 V559 M585 C593 V597	C557-V583 HydrophobicContact CB-CG1 4.22Å; V559-V583 HydrophobicContact CG1-CG2 4.44Å; V583-M585 WeakPolarHBondContact CG1-O 3.27Å; V583-C593 HydrophobicContact CG1-CB 4.25Å; V583-C593 HydrophobicContact CG2-CB 4.12Å; V583-C593 VanDerWaalsContact CG2-SG 3.53Å; V583-V597 HydrophobicContact CG2-CG2 3.99Å
584	K	64.4	Low	71.9	Confident	158 Å²	158	90.4 Å²	90.4	69%	0.687	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	-36.8	-178.5	-169.1	176.5	-178.4	178	0	111.6	L558 T560 M582	L558-K584 WeakPolarHBondContact O-CA 3.31Å; L558-K584 VanDerWaalsContact O-CB 3.3Å; L558-K584 WeakPolarHBondContact O-CB 3.32Å; L558-K584 PolarHBondContact O-N 3.05Å; T560-K584 HydrophobicContact CG2-CB 4.27Å; M582-K584 PolarHBondContact O-N 2.75Å
585	M	61.5	Low	71.3	Confident	89 Å²	89	85.4 Å²	85.4	44%	0.438	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	134.1	167.8	-70	-171.4	-70.2	0	0	111.4	L558 V583	L558-M585 HydrophobicContact CD1-CE 3.6Å; L558-M585 PolarHBondContact N-O 2.75Å; L558-M585 PolarHBondContact O-N 3.25Å; V583-M585 WeakPolarHBondContact CG1-O 3.27Å
586	P	63.5	Low	70.6	Confident	102 Å²	102	91.6 Å²	91.6	66%	0.662	52%	0.516	S	S	*	.			trans	-71.9	161.8	173.4	32	-35.3	0	0	0	111.6
587	P	64.6	Low	70.3	Confident	23 Å²	23	89.8 Å²	89.8	15%	0.149	51%	0.511	C	S	.	.			trans	-59.4	142.8	174.6	-21.3	33.7	0	0	0	112.3	C557 D589 G590 S591	C557-P587 HydrophobicContact CB-CG 4.17Å; P587-D589 PolarHBondContact O-N 2.92Å; P587-D589 VanDerWaalsContact O-N 3.14Å; P587-G590 PolarHBondContact O-N 3.24Å; P587-S591 WeakPolarHBondContact CD-O 3.39Å; P587-S591 WeakPolarHBondContact CG-O 3.43Å
588	A	57.1	Low	70.1	Confident	119 Å²	119	92.4 Å²	92.4	98%	0.983	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.2	-178	0	0	0	0	0	114.2	G590	A588-G590 VanDerWaalsContact C-N 3.27Å; A588-G590 PolarHBondContact O-N 3.07Å
589	D	64.1	Low	70.1	Confident	147 Å²	147	88 Å²	88	79%	0.786	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	3.7	176.8	-164.7	38.3	0	0	0	113.1	P587 S591	P587-D589 PolarHBondContact O-N 2.92Å; P587-D589 VanDerWaalsContact O-N 3.14Å; D589-S591 PolarHBondContact O-N 3.44Å; D589-S591 VanDerWaalsContact O-N 3.14Å
590	G	59.1	Low	70.2	Confident	70 Å²	70	89.2 Å²	89.2	72%	0.722	53%	0.525	S	S	*	.			trans	69.9	6.8	179.9	0	0	0	0	0	115	P587 A588	P587-G590 PolarHBondContact O-N 3.24Å; A588-G590 VanDerWaalsContact C-N 3.27Å; A588-G590 PolarHBondContact O-N 3.07Å
591	S	64.5	Low	70.4	Confident	60 Å²	60	87.6 Å²	87.6	42%	0.42	52%	0.518	S	S	.	.			trans	-72.1	155.1	177.3	51.4	0	0	0	0	112.5	P587 D589 C593	P587-S591 WeakPolarHBondContact CD-O 3.39Å; P587-S591 WeakPolarHBondContact CG-O 3.43Å; D589-S591 PolarHBondContact O-N 3.44Å; D589-S591 VanDerWaalsContact O-N 3.14Å; S591-C593 PolarHBondContact O-N 2.84Å
592	I	59.7	Low	70.5	Confident	167 Å²	167	92.9 Å²	92.9	86%	0.856	54%	0.542	S	S	*	.			trans	-68.6	127.3	-179.2	-59.5	172.8	0	0	0	109.2	G594	I592-G594 PolarHBondContact O-N 2.72Å
593	C	65.2	Low	71.1	Confident	27 Å²	27	87.5 Å²	87.5	18%	0.182	52%	0.517	C	S	.	.			trans	-57.9	115.8	176.3	172.2	0	0	0	0	111.3	C557 V583 S591 A595	C557-C593 HydrophobicContact CB-CB 3.64Å; C557-C593 WeakPolarHBondContact CB-SG 3.36Å; C557-C593 WeakPolarHBondContact SG-CA 3.44Å; C557-C593 WeakPolarHBondContact SG-CB 3.28Å; C557-C593 CovalentContact SG-SG 2.02Å; C557-C593 PolarHBondContact SG-SG 3.22Å; V583-C593 HydrophobicContact CG1-CB 4.25Å; V583-C593 HydrophobicContact CG2-CB 4.12Å; V583-C593 VanDerWaalsContact CG2-SG 3.53Å; S591-C593 PolarHBondContact O-N 2.84Å; C593-A595 VanDerWaalsContact C-N 3.27Å; C593-A595 PolarHBondContact O-N 3.13Å
594	G	65.3	Low	71.3	Confident	79 Å²	79	92.1 Å²	92.1	81%	0.814	54%	0.537	S	S	*	.			trans	-82.1	6.6	179.1	0	0	0	0	0	115.2	I592	I592-G594 PolarHBondContact O-N 2.72Å
595	A	69.1	Low	71.8	Confident	30 Å²	30	87.9 Å²	87.9	25%	0.248	52%	0.52	C	S	.	.	S	Bend	trans	-79	136.3	177.6	0	0	0	0	0	111.1	V559 C593 V597	V559-A595 HydrophobicContact CG1-CB 3.65Å; C593-A595 VanDerWaalsContact C-N 3.27Å; C593-A595 PolarHBondContact O-N 3.13Å; A595-V597 PolarHBondContact O-N 2.93Å
596	E	71	Confident	72.4	Confident	135 Å²	135	88.2 Å²	88.2	63%	0.631	53%	0.529	S	S	*	.			trans	-63.7	117.1	177	-63.6	177.1	167.2	0	0	110.3	W562 R581	W562-E596 WeakPolarHBondContact CH2-O 3.1Å; R581-E596 VanDerWaalsContact CZ-O 3.25Å; R581-E596 PolarHBondContact NE-O 3.17Å; R581-E596 PolarHBondContact NH2-O 3.38Å
597	V	79.9	Confident	72.2	Confident	68 Å²	68	90.9 Å²	90.9	41%	0.412	53%	0.533	S	S	.	.	S	Bend	trans	-89.4	-19.7	-179.1	159.2	0	0	0	0	112.4	E580 R581 V583 A595	E580-V597 CarbonylContact C-O 3.52Å; E580-V597 VanDerWaalsContact CA-O 3.26Å; E580-V597 WeakPolarHBondContact CA-O 3.39Å; R581-V597 PolarHBondContact N-O 3.23Å; R581-V597 WeakPolarHBondContact O-CG1 3.32Å; V583-V597 HydrophobicContact CG2-CG2 3.99Å; A595-V597 PolarHBondContact O-N 2.93Å
598	L	81.8	Confident	71.8	Confident	98 Å²	98	93.1 Å²	93.1	51%	0.513	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.2	-179.4	179.8	72	0	0	0	109.2	R578 V600	R578-L598 HydrophobicContact CB-CD1 4.26Å; L598-V600 HydrophobicContact CD2-CG2 4.47Å; L598-V600 HydrophobicContact CG-CG2 4.31Å
599	E	85.9	Confident	71.5	Confident	55 Å²	55	94.8 Å²	94.8	26%	0.257	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139	174.7	-168.4	-175.2	162	0	0	109.3	W562 W565 R578 R579	W562-E599 VanDerWaalsContact CE2-OE2 3.24Å; W562-E599 HydrophobicContact CH2-CB 3.55Å; W562-E599 HydrophobicContact CZ2-CB 3.87Å; W562-E599 WeakPolarHBondContact CZ2-OE2 3.28Å; W562-E599 HydrophobicContact CZ3-CB 3.89Å; W562-E599 PolarHBondContact NE1-OE2 2.83Å; W565-E599 HydrophobicContact CH2-CB 4.28Å; W565-E599 HydrophobicContact CH2-CG 3.84Å; R578-E599 CarbonylContact C-O 3.57Å; R578-E599 WeakPolarHBondContact CA-O 3.19Å; R579-E599 HydrophobicContact CG-CB 4.04Å; R579-E599 IonicContact CZ-OE1 2.75Å; R579-E599 IonicContact CZ-OE2 3.77Å; R579-E599 PolarHBondContact N-O 2.92Å; R579-E599 IonicContact NE-OE1 3.74Å; R579-E599 IonicContact NE-OE2 2.71Å; R579-E599 PolarHBondContact NE-OE2 3.19Å; R579-E599 VanDerWaalsContact NH2-CD 3.31Å; R579-E599 IonicContact NH2-OE1 3.21Å; R579-E599 PolarHBondContact NH2-OE1 2.91Å; R579-E599 VanDerWaalsContact NH2-OE1 3.14Å; R579-E599 IonicContact NH2-OE2 2.98Å; R579-E599 PolarHBondContact NH2-OE2 2.87Å; R579-E599 PolarHBondContact O-N 3Å
600	V	86.2	Confident	70.7	Confident	83 Å²	83	94.6 Å²	94.6	50%	0.503	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.7	-179	-174.9	0	0	0	0	109.3	M576 K577 R578 L598	M576-V600 HydrophobicContact CB-CG1 4.02Å; M576-V600 HydrophobicContact CG-CG1 4.48Å; M576-V600 HydrophobicContact SD-CG1 4.23Å; K577-V600 WeakPolarHBondContact O-CA 3.2Å; R578-V600 HydrophobicContact CB-CG2 4.05Å; L598-V600 HydrophobicContact CD2-CG2 4.47Å; L598-V600 HydrophobicContact CG-CG2 4.31Å
601	E	87.5	Confident	70.1	Confident	92 Å²	92	97.1 Å²	97.1	43%	0.43	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.1	-177.8	-176.7	179.1	-152.9	0	0	110.5	W565 M576 K577 C603	W565-E601 HydrophobicContact CH2-CB 3.47Å; W565-E601 VanDerWaalsContact CH2-CB 3.47Å; W565-E601 HydrophobicContact CZ2-CB 4.09Å; W565-E601 WeakPolarHBondContact CZ2-OE2 3.45Å; W565-E601 HydrophobicContact CZ3-CB 3.86Å; M576-E601 WeakPolarHBondContact CA-O 3.3Å; K577-E601 WeakPolarHBondContact CE-OE2 3.32Å; K577-E601 HydrophobicContact CG-CB 4.34Å; K577-E601 WeakPolarHBondContact CG-O 3.42Å; K577-E601 PolarHBondContact N-O 3.02Å; K577-E601 IonicContact NZ-OE2 2.71Å; K577-E601 PolarHBondContact NZ-OE2 2.8Å; K577-E601 PolarHBondContact O-N 2.98Å; E601-C603 PolarHBondContact O-N 3.07Å
602	K	84.5	Confident	69.5	Low	160 Å²	160	99.1 Å²	99.1	70%	0.696	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	126.7	175.2	-65	178.9	-176.8	175.7	0	109.8	G575	G575-K602 WeakPolarHBondContact O-CA 3.19Å
603	C	83.3	Confident	69.6	Low	16 Å²	16	93.7 Å²	93.7	11%	0.108	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136	172.2	38.8	0	0	0	0	109.5	C568 G575 M576 K577 E601	C568-C603 WeakPolarHBondContact CA-SG 3.32Å; C568-C603 HydrophobicContact CB-CB 3.92Å; C568-C603 WeakPolarHBondContact CB-SG 3.32Å; C568-C603 WeakPolarHBondContact SG-CB 3.45Å; C568-C603 CovalentContact SG-SG 2.03Å; C568-C603 PolarHBondContact SG-SG 3.44Å; G575-C603 PolarHBondContact N-O 2.77Å; G575-C603 PolarHBondContact O-N 3.29Å; M576-C603 PolarHBondContact N-SG 2.84Å; M576-C603 VanDerWaalsContact N-SG 3.45Å; K577-C603 HydrophobicContact CD-CB 4.43Å; K577-C603 HydrophobicContact CG-CB 4.21Å; K577-C603 PolarHBondContact N-SG 3.45Å; K577-C603 VanDerWaalsContact N-SG 3.38Å; E601-C603 PolarHBondContact O-N 3.07Å
604	M	78.3	Confident	69.4	Low	156 Å²	156	97.6 Å²	97.6	77%	0.768	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	103.3	177.3	-171.1	165	172.3	0	0	108.3
605	M	75.6	Confident	69.9	Low	70 Å²	70	95.7 Å²	95.7	35%	0.345	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-87.6	166.4	177.3	-64.8	-66.4	-70.5	0	0	110	C568 A570 T571 G573	C568-M605 HydrophobicContact CB-CG 4Å; C568-M605 HydrophobicContact CB-SD 3.95Å; C568-M605 VanDerWaalsContact SG-CG 3.55Å; A570-M605 WeakPolarHBondContact O-CG 3.37Å; T571-M605 WeakPolarHBondContact O-CE 3.4Å; G573-M605 PolarHBondContact N-O 3.24Å; G573-M605 WeakPolarHBondContact O-CB 3.3Å; G573-M605 PolarHBondContact O-N 3.08Å
606	P	74.1	Confident	70.3	Confident	95 Å²	95	96.1 Å²	96.1	62%	0.617	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-52.6	148.7	-177.5	-27.5	36.2	0	0	0	113	C572 G573 C608	C572-P606 CarbonylContact C-O 3.55Å; C572-P606 VanDerWaalsContact CA-O 3.31Å; C572-P606 WeakPolarHBondContact CA-O 2.84Å; C572-P606 VanDerWaalsContact CB-O 3.26Å; C572-P606 WeakPolarHBondContact CB-O 3.46Å; G573-P606 PolarHBondContact N-O 2.86Å; P606-C608 PolarHBondContact O-N 3.02Å
607	E	59.1	Low	70.8	Confident	159 Å²	159	95.2 Å²	95.2	74%	0.743	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-59	133.7	178.9	-65	-175.1	161.9	0	0	110.9	H609	E607-H609 PolarHBondContact O-N 2.99Å
608	C	56.1	Low	71	Confident	70 Å²	70	95 Å²	95	47%	0.473	51%	0.509	S	S	.	.	S	Bend	trans	-74	50.8	-175.8	-57.3	0	0	0	0	113.4	C572 P606	C572-C608 HydrophobicContact CB-CB 4Å; C572-C608 WeakPolarHBondContact CB-SG 3.26Å; C572-C608 WeakPolarHBondContact SG-CB 3.37Å; C572-C608 CovalentContact SG-SG 2.04Å; C572-C608 PolarHBondContact SG-SG 2.88Å; P606-C608 PolarHBondContact O-N 3.02Å
609	H	50.8	Low	71.2	Confident	153 Å²	153	93.7 Å²	93.7	71%	0.708	51%	0.508	S	S	*	.	S	Bend	trans	-128.6	124	175.6	-69.9	78.2	0	0	0	110	E607	E607-H609 PolarHBondContact O-N 2.99Å
610	T	47.9	Very low	71.1	Confident	143 Å²	143	99.2 Å²	99.2	88%	0.877	53%	0.534	S	S	*	.			trans	64.2	57.7	-179.7	64.4	0	0	0	0	116.6	P612	T610-P612 WeakPolarHBondContact O-CD 3.43Å
611	I	45.8	Very low	71.2	Confident	124 Å²	124	97.9 Å²	97.9	64%	0.636	52%	0.52	S	S	*	.			trans	-76.2	119.7	151.2	-58.7	176.2	0	0	0	106.8
612	P	52.6	Low	71.2	Confident	101 Å²	101	95.9 Å²	95.9	66%	0.656	52%	0.516	S	S	*	.			trans	-66.8	137.9	179.7	26.8	-33.7	0	0	0	110.9	T610 L614	T610-P612 WeakPolarHBondContact O-CD 3.43Å; P612-L614 PolarHBondContact O-N 3.14Å
613	C	60.7	Low	71.3	Confident	53 Å²	53	95.6 Å²	95.6	36%	0.358	52%	0.522	S	S	.	.			trans	-57.5	112	-179.7	-60.3	0	0	0	0	110.4	L615 L639 C648	C613-L615 PolarHBondContact O-N 3.43Å; C613-L639 HydrophobicContact CB-CD2 4.16Å; C613-C648 HydrophobicContact CB-CB 4.05Å; C613-C648 WeakPolarHBondContact CB-SG 3.21Å; C613-C648 WeakPolarHBondContact SG-CB 3.44Å; C613-C648 CovalentContact SG-SG 2.05Å; C613-C648 PolarHBondContact SG-SG 2.65Å
614	L	62.7	Low	71.6	Confident	110 Å²	110	96.1 Å²	96.1	58%	0.576	53%	0.526	S	S	*	.			trans	-76.4	96.2	-179	-75.9	167	0	0	0	109.9	P612 K640	P612-L614 PolarHBondContact O-N 3.14Å; L614-K640 HydrophobicContact CB-CB 4.34Å; L614-K640 WeakPolarHBondContact O-CB 3.49Å; L614-K640 PolarHBondContact O-N 3.01Å
615	L	74.9	Confident	72.1	Confident	38 Å²	38	92.7 Å²	92.7	20%	0.199	52%	0.517	C	S	.	.	B	Isolated β-bridge	trans	-87.1	150.1	176.5	-61.5	165.2	0	0	0	110.5	C613 R637 M638 L639 E650 L652	C613-L615 PolarHBondContact O-N 3.43Å; L615-R637 VanDerWaalsContact CD1-CZ 3.41Å; L615-M638 CarbonylContact C-O 3.57Å; L615-M638 WeakPolarHBondContact CA-O 3.04Å; L615-L639 HydrophobicContact CD2-CD2 3.87Å; L615-L639 HydrophobicContact CD2-CG 3.89Å; L615-E650 HydrophobicContact CD1-CB 3.8Å; L615-E650 HydrophobicContact CD1-CG 4.04Å; L615-L652 HydrophobicContact CD2-CD2 3.7Å
616	T	78.3	Confident	72.6	Confident	40 Å²	40	91.7 Å²	91.7	25%	0.245	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-66.9	161.2	166.8	66.1	0	0	0	0	110.1	M638	T616-M638 HydrophobicContact CG2-CB 4.12Å; T616-M638 PolarHBondContact N-O 2.82Å; T616-M638 PolarHBondContact OG1-N 3.14Å; T616-M638 PolarHBondContact OG1-O 2.7Å
617	P	81.8	Confident	73	Confident	115 Å²	115	93.7 Å²	93.7	75%	0.747	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-49.7	152.1	156.4	-23.8	34.8	0	0	0	110.6
618	W	84.2	Confident	74.1	Confident	63 Å²	63	87.6 Å²	87.6	24%	0.239	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-62.6	141.8	168.1	-68.8	102.8	0	0	0	110	R635 Q636 R637 E651 L652 Q654	W618-R635 HydrophobicContact CD2-CG 4.19Å; W618-R635 HydrophobicContact CE3-CB 4.47Å; W618-R635 HydrophobicContact CE3-CG 3.71Å; W618-R635 HydrophobicContact CZ3-CG 4.28Å; W618-R635 WeakPolarHBondContact CZ3-O 3.49Å; W618-Q636 VanDerWaalsContact CE3-C 3.5Å; W618-R637 HydrophobicContact CD2-CB 4.06Å; W618-R637 HydrophobicContact CD2-CG 4.03Å; W618-R637 HydrophobicContact CE3-CB 3.78Å; W618-R637 HydrophobicContact CE3-CG 3.76Å; W618-R637 HydrophobicContact CH2-CG 3.87Å; W618-R637 HydrophobicContact CZ2-CG 4.15Å; W618-R637 HydrophobicContact CZ3-CB 4.16Å; W618-R637 HydrophobicContact CZ3-CG 3.68Å; W618-E651 WeakPolarHBondContact CH2-O 3.08Å; W618-L652 WeakPolarHBondContact CZ3-O 3.44Å; W618-Q654 HydrophobicContact CH2-CB 3.63Å; W618-Q654 HydrophobicContact CZ2-CB 4.09Å; W618-Q654 HydrophobicContact CZ3-CB 3.85Å
619	C	84.1	Confident	75.4	Confident	72 Å²	72	85.1 Å²	85.1	49%	0.486	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-61.6	163.2	161.5	-65.7	0	0	0	0	110.6	Q636	C619-Q636 PolarHBondContact N-O 2.76Å
620	E	85.9	Confident	77.2	Confident	170 Å²	170	86.5 Å²	86.5	79%	0.794	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-55.6	152.3	167.1	-71.4	-55.5	143.5	0	0	111.4
621	W	88.1	Confident	79.2	Confident	55 Å²	55	80.1 Å²	80.1	21%	0.208	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-64.4	140.7	175.2	-74	105	0	0	0	111.1	R633 R635 Q654 E656	W621-R633 HydrophobicContact CD2-CG 4.04Å; W621-R633 HydrophobicContact CE3-CB 4.17Å; W621-R633 HydrophobicContact CE3-CG 3.63Å; W621-R633 HydrophobicContact CG-CG 4.46Å; W621-R633 HydrophobicContact CZ3-CG 4.15Å; W621-R633 WeakPolarHBondContact CZ3-O 3.46Å; W621-R635 HydrophobicContact CD2-CB 4.16Å; W621-R635 HydrophobicContact CD2-CG 3.97Å; W621-R635 VanDerWaalsContact CE2-CD 3.48Å; W621-R635 HydrophobicContact CE3-CB 3.82Å; W621-R635 HydrophobicContact CE3-CG 3.7Å; W621-R635 HydrophobicContact CH2-CG 3.85Å; W621-R635 HydrophobicContact CZ2-CG 4.12Å; W621-R635 VanDerWaalsContact CZ2-NE 3.33Å; W621-R635 HydrophobicContact CZ3-CB 4.18Å; W621-R635 HydrophobicContact CZ3-CG 3.64Å; W621-Q654 HydrophobicContact CH2-CB 4.2Å; W621-Q654 HydrophobicContact CH2-CG 3.99Å; W621-Q654 WeakPolarHBondContact CZ3-O 3.05Å; W621-E656 HydrophobicContact CH2-CB 3.42Å; W621-E656 VanDerWaalsContact CH2-CB 3.42Å; W621-E656 HydrophobicContact CZ2-CB 3.92Å; W621-E656 WeakPolarHBondContact CZ2-OE2 3.47Å; W621-E656 HydrophobicContact CZ3-CB 3.78Å
622	S	86.6	Confident	81.3	Confident	51 Å²	51	78.3 Å²	78.3	36%	0.357	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-57.4	160	166.1	78.8	0	0	0	0	111.2	R633 T634	S622-R633 WeakPolarHBondContact O-CB 3.48Å; S622-R633 WeakPolarHBondContact OG-CA 3.24Å; S622-T634 WeakPolarHBondContact CB-O 3.38Å; S622-T634 PolarHBondContact N-O 2.02Å; S622-T634 PolarHBondContact OG-N 3.27Å; S622-T634 PolarHBondContact OG-O 3.46Å
623	D	86.8	Confident	83	Confident	153 Å²	153	77.4 Å²	77.4	82%	0.818	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-52.7	153	159.2	-70.9	-49.4	0	0	0	110.8
624	C	89.5	Confident	84.3	Confident	28 Å²	28	77.3 Å²	77.3	19%	0.189	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-64.8	137.7	175.4	-168.3	0	0	0	0	109.8	V626 C658 L660	C624-V626 PolarHBondContact O-N 2.97Å; C624-C658 WeakPolarHBondContact CA-SG 3.42Å; C624-C658 HydrophobicContact CB-CB 3.85Å; C624-C658 WeakPolarHBondContact CB-SG 3.31Å; C624-C658 WeakPolarHBondContact SG-CB 3.48Å; C624-C658 CovalentContact SG-SG 2.03Å; C624-C658 PolarHBondContact SG-SG 3.32Å; C624-L660 HydrophobicContact CB-CD1 3.9Å; C624-L660 HydrophobicContact CB-CG 4.26Å
625	S	89.3	Confident	85.5	Confident	83 Å²	83	75 Å²	75	58%	0.58	41%	0.409	S	S	*	.	S	Bend	trans	-62.8	-4.2	-177.9	72.6	0	0	0	0	115.1	L632	S625-L632 VanDerWaalsContact CB-O 3.25Å; S625-L632 WeakPolarHBondContact CB-O 3.47Å; S625-L632 PolarHBondContact N-O 2.71Å; S625-L632 PolarHBondContact OG-N 2.87Å; S625-L632 PolarHBondContact OG-O 2.75Å
626	V	85.4	Confident	86.1	Confident	50 Å²	50	78.4 Å²	78.4	30%	0.303	42%	0.424	S	S	.	.	S	Bend	trans	-134.3	155.1	177.2	-58	0	0	0	0	108.3	C624 C628 L660	C624-V626 PolarHBondContact O-N 2.97Å; V626-C628 WeakPolarHBondContact CG2-O 3.34Å; V626-L660 WeakPolarHBondContact O-CD1 3.32Å
627	T	82.9	Confident	86.4	Confident	137 Å²	137	78.6 Å²	78.6	84%	0.84	42%	0.42	S	S	*	.	S	Bend	trans	-88.5	-12.3	174.6	49.9	0	0	0	0	113.4
628	C	81.6	Confident	86.1	Confident	30 Å²	30	79.2 Å²	79.2	20%	0.203	41%	0.414	C	S	.	.	S	Bend	trans	-154.3	154.8	178.7	58.7	0	0	0	0	110.7	V626 P661 C663	V626-C628 WeakPolarHBondContact CG2-O 3.34Å; C628-P661 CarbonylContact C-O 3.56Å; C628-P661 WeakPolarHBondContact CA-O 3.2Å; C628-P661 WeakPolarHBondContact CB-O 3.4Å; C628-C663 HydrophobicContact CB-CB 3.89Å; C628-C663 WeakPolarHBondContact CB-SG 3Å; C628-C663 PolarHBondContact O-SG 2.77Å; C628-C663 VanDerWaalsContact O-SG 3.36Å; C628-C663 WeakPolarHBondContact SG-CA 3.46Å; C628-C663 WeakPolarHBondContact SG-CB 3.02Å; C628-C663 CovalentContact SG-SG 2.04Å; C628-C663 PolarHBondContact SG-SG 2.93Å
629	G	84.4	Confident	85.6	Confident	18 Å²	18	78.7 Å²	78.7	19%	0.186	42%	0.416	C	S	.	.	S	Bend	trans	72.3	-144.1	179.5	0	0	0	0	0	114.2	L660 P661	G629-L660 PolarHBondContact O-N 2.68Å; G629-P661 PolarHBondContact N-O 2.93Å
630	K	88.4	Confident	84.7	Confident	183 Å²	183	83.1 Å²	83.1	80%	0.796	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.4	-173.1	-63.2	175.5	-176.2	172.6	0	110.5
631	G	88.6	Confident	83.4	Confident	9 Å²	9	78.1 Å²	78.1	9%	0.093	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	-168.9	175	0	0	0	0	0	112.7	K657 C658	G631-K657 WeakPolarHBondContact O-CA 3.4Å; G631-C658 PolarHBondContact N-O 2.89Å; G631-C658 PolarHBondContact O-N 3.04Å; G631-C658 PolarHBondContact O-SG 2.92Å
632	L	89.8	Confident	81.6	Confident	85 Å²	85	81.4 Å²	81.4	45%	0.445	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.1	173.1	-59.3	174.5	0	0	0	109.5	S625 V655 E656 K657 C658	S625-L632 VanDerWaalsContact CB-O 3.25Å; S625-L632 WeakPolarHBondContact CB-O 3.47Å; S625-L632 PolarHBondContact N-O 2.71Å; S625-L632 PolarHBondContact OG-N 2.87Å; S625-L632 PolarHBondContact OG-O 2.75Å; L632-V655 HydrophobicContact CB-CG1 4.06Å; L632-V655 HydrophobicContact CD1-CG1 4.17Å; L632-V655 HydrophobicContact CD2-CG1 4.17Å; L632-V655 HydrophobicContact CG-CG1 4.36Å; L632-E656 CarbonylContact C-O 3.56Å; L632-E656 VanDerWaalsContact CA-O 3.31Å; L632-E656 WeakPolarHBondContact CA-O 3.34Å; L632-K657 HydrophobicContact CD2-CG 3.86Å; L632-C658 PolarHBondContact N-SG 2.84Å; L632-C658 VanDerWaalsContact N-SG 3.43Å
633	R	88.9	Confident	80.1	Confident	83 Å²	83	84 Å²	84	31%	0.313	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.6	166.1	59.6	-179.5	-168.4	173.5	-1.8	109	W621 S622 V655 E656 C658	W621-R633 HydrophobicContact CD2-CG 4.04Å; W621-R633 HydrophobicContact CE3-CB 4.17Å; W621-R633 HydrophobicContact CE3-CG 3.63Å; W621-R633 HydrophobicContact CG-CG 4.46Å; W621-R633 HydrophobicContact CZ3-CG 4.15Å; W621-R633 WeakPolarHBondContact CZ3-O 3.46Å; S622-R633 WeakPolarHBondContact O-CB 3.48Å; S622-R633 WeakPolarHBondContact OG-CA 3.24Å; R633-V655 WeakPolarHBondContact O-CA 3.49Å; R633-E656 HydrophobicContact CG-CB 4.17Å; R633-E656 IonicContact CZ-OE2 2.68Å; R633-E656 PolarHBondContact N-O 2.88Å; R633-E656 IonicContact NE-OE2 2.71Å; R633-E656 PolarHBondContact NE-OE2 3.5Å; R633-E656 IonicContact NH2-OE2 3.37Å; R633-E656 PolarHBondContact NH2-OE2 2.93Å; R633-E656 PolarHBondContact O-N 2.71Å; R633-C658 HydrophobicContact CG-CB 4.38Å
634	T	88.6	Confident	78.5	Confident	51 Å²	51	85.5 Å²	85.5	31%	0.313	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	153.7	-178.7	64.7	0	0	0	0	111	S622 Q654 V655	S622-T634 WeakPolarHBondContact CB-O 3.38Å; S622-T634 PolarHBondContact N-O 2.02Å; S622-T634 PolarHBondContact OG-N 3.27Å; S622-T634 PolarHBondContact OG-O 3.46Å; T634-Q654 VanDerWaalsContact CA-O 3.31Å; T634-Q654 WeakPolarHBondContact CA-O 3.45Å; T634-V655 HydrophobicContact CG2-CG1 4.24Å; T634-V655 HydrophobicContact CG2-CG2 4Å
635	R	88.6	Confident	76.6	Confident	62 Å²	62	93.1 Å²	93.1	23%	0.234	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.2	167.8	65.8	-179.6	-176.8	173.4	-1.8	110.1	W618 W621 E653 Q654	W618-R635 HydrophobicContact CD2-CG 4.19Å; W618-R635 HydrophobicContact CE3-CB 4.47Å; W618-R635 HydrophobicContact CE3-CG 3.71Å; W618-R635 HydrophobicContact CZ3-CG 4.28Å; W618-R635 WeakPolarHBondContact CZ3-O 3.49Å; W621-R635 HydrophobicContact CD2-CB 4.16Å; W621-R635 HydrophobicContact CD2-CG 3.97Å; W621-R635 VanDerWaalsContact CE2-CD 3.48Å; W621-R635 HydrophobicContact CE3-CB 3.82Å; W621-R635 HydrophobicContact CE3-CG 3.7Å; W621-R635 HydrophobicContact CH2-CG 3.85Å; W621-R635 HydrophobicContact CZ2-CG 4.12Å; W621-R635 VanDerWaalsContact CZ2-NE 3.33Å; W621-R635 HydrophobicContact CZ3-CB 4.18Å; W621-R635 HydrophobicContact CZ3-CG 3.64Å; R635-E653 WeakPolarHBondContact O-CA 3.42Å; R635-Q654 HydrophobicContact CG-CB 4.14Å; R635-Q654 VanDerWaalsContact CZ-OE1 3.29Å; R635-Q654 PolarHBondContact N-O 3.38Å; R635-Q654 PolarHBondContact O-N 3.45Å
636	Q	86.8	Confident	74.7	Confident	109 Å²	109	91.5 Å²	91.5	51%	0.509	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	154	-174.5	-66.1	179	-9.7	0	0	110.9	W618 C619 L652 E653	W618-Q636 VanDerWaalsContact CE3-C 3.5Å; C619-Q636 PolarHBondContact N-O 2.76Å; Q636-L652 CarbonylContact C-O 3.57Å; Q636-L652 WeakPolarHBondContact CA-O 3.01Å; Q636-E653 HydrophobicContact CG-CB 4.27Å; Q636-E653 HydrophobicContact CG-CG 4.2Å; Q636-E653 PolarHBondContact NE2-OE1 2.03Å
637	R	84	Confident	73.3	Confident	44 Å²	44	96.5 Å²	96.5	17%	0.166	51%	0.514	C	S	.	.			trans	-135.5	156	171.2	63.2	-178.1	171.9	165.3	5.2	109.3	L615 W618 E650 E651 L652	L615-R637 VanDerWaalsContact CD1-CZ 3.41Å; W618-R637 HydrophobicContact CD2-CB 4.06Å; W618-R637 HydrophobicContact CD2-CG 4.03Å; W618-R637 HydrophobicContact CE3-CB 3.78Å; W618-R637 HydrophobicContact CE3-CG 3.76Å; W618-R637 HydrophobicContact CH2-CG 3.87Å; W618-R637 HydrophobicContact CZ2-CG 4.15Å; W618-R637 HydrophobicContact CZ3-CB 4.16Å; W618-R637 HydrophobicContact CZ3-CG 3.68Å; R637-E650 IonicContact CZ-OE2 3.12Å; R637-E650 IonicContact NH2-OE2 2.68Å; R637-E650 PolarHBondContact NH2-OE2 3.49Å; R637-E651 PolarHBondContact NE-O 2.94Å; R637-E651 PolarHBondContact NH2-O 2.82Å; R637-L652 HydrophobicContact CG-CD2 4.49Å; R637-L652 PolarHBondContact N-O 3.02Å
638	M	76.4	Confident	72.1	Confident	127 Å²	127	92.1 Å²	92.1	63%	0.626	49%	0.488	S	S	*	.			trans	-115.3	157.4	-176.7	-70.1	-178.7	-84.8	0	0	111.6	L615 T616	L615-M638 CarbonylContact C-O 3.57Å; L615-M638 WeakPolarHBondContact CA-O 3.04Å; T616-M638 HydrophobicContact CG2-CB 4.12Å; T616-M638 PolarHBondContact N-O 2.82Å; T616-M638 PolarHBondContact OG1-N 3.14Å; T616-M638 PolarHBondContact OG1-O 2.7Å
639	L	73	Confident	71.4	Confident	52 Å²	52	97 Å²	97	27%	0.272	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-74.9	131.8	166	-85.3	152.4	0	0	0	109.5	C613 L615 V643 L652	C613-L639 HydrophobicContact CB-CD2 4.16Å; L615-L639 HydrophobicContact CD2-CD2 3.87Å; L615-L639 HydrophobicContact CD2-CG 3.89Å; L639-V643 HydrophobicContact CD1-CG2 4.11Å; L639-L652 HydrophobicContact CG-CD2 4.47Å
640	K	65.3	Low	70.7	Confident	165 Å²	165	101.2 Å²	101.2	72%	0.717	53%	0.532	S	S	*	.	S	Bend	trans	-82.6	-14.7	-176.5	-165.7	175.5	177	-177.5	0	113.4	L614	L614-K640 HydrophobicContact CB-CB 4.34Å; L614-K640 WeakPolarHBondContact O-CB 3.49Å; L614-K640 PolarHBondContact O-N 3.01Å
641	S	58.7	Low	70.1	Confident	66 Å²	66	99 Å²	99	46%	0.462	52%	0.524	S	S	.	.	S	Bend	trans	-119.6	146.4	175.4	56.2	0	0	0	0	111.2
642	P	50.6	Low	69.7	Low	123 Å²	123	102.2 Å²	102.2	80%	0.799	54%	0.539	S	S	*	.			trans	-58.1	144.2	169.8	-21.5	33.4	0	0	0	111.5	E644	P642-E644 PolarHBondContact O-N 2.85Å; P642-E644 VanDerWaalsContact O-N 3.11Å
643	V	54.5	Low	69.4	Low	106 Å²	106	102.9 Å²	102.9	64%	0.642	54%	0.54	S	S	*	.			trans	-80.7	89.6	-179.2	-178.3	0	0	0	0	109.9	L639	L639-V643 HydrophobicContact CD1-CG2 4.11Å
644	E	53.6	Low	69.4	Low	185 Å²	185	102.1 Å²	102.1	86%	0.864	54%	0.54	S	S	*	.	S	Bend	trans	-126.1	126.6	150.5	-69.4	-160.1	172.7	0	0	109	P642	P642-E644 PolarHBondContact O-N 2.85Å; P642-E644 VanDerWaalsContact O-N 3.11Å
645	L	48.4	Very low	69.5	Low	188 Å²	188	103.6 Å²	103.6	98%	0.984	55%	0.549	S	S	*	.	S	Bend	trans	74.7	47.6	175.8	-117.9	72.6	0	0	0	118.9
646	G	49.9	Very low	69.6	Low	48 Å²	48	104.5 Å²	104.5	50%	0.495	56%	0.556	S	S	.	*			trans	-175.2	130.5	161.9	0	0	0	0	0	115.1	C648	G646-C648 PolarHBondContact O-N 2.67Å
647	D	55.5	Low	69.7	Low	156 Å²	156	107.7 Å²	107.7	83%	0.834	57%	0.568	S	S	*	*			trans	-84.5	88.4	176	-163	19.1	0	0	0	109.8	T649	D647-T649 PolarHBondContact O-N 2.83Å
648	C	59.4	Low	69.8	Low	45 Å²	45	106.3 Å²	106.3	30%	0.304	57%	0.565	S	S	.	*			trans	-77.6	105.3	-179.1	-69.2	0	0	0	0	110.9	C613 G646 E650	C613-C648 HydrophobicContact CB-CB 4.05Å; C613-C648 WeakPolarHBondContact CB-SG 3.21Å; C613-C648 WeakPolarHBondContact SG-CB 3.44Å; C613-C648 CovalentContact SG-SG 2.05Å; C613-C648 PolarHBondContact SG-SG 2.65Å; G646-C648 PolarHBondContact O-N 2.67Å; C648-E650 PolarHBondContact O-N 3.42Å
649	T	65.5	Low	70.2	Confident	132 Å²	132	107.9 Å²	107.9	81%	0.81	57%	0.573	S	S	*	*			trans	-82.5	19.1	-179.7	45	0	0	0	0	115	D647	D647-T649 PolarHBondContact O-N 2.83Å
650	E	71.1	Confident	70.7	Confident	107 Å²	107	108.5 Å²	108.5	50%	0.5	58%	0.576	S	S	.	*			trans	-89.2	138.5	-175	-80.4	-71.9	145.4	0	0	113.3	L615 R637 C648 L652	L615-E650 HydrophobicContact CD1-CB 3.8Å; L615-E650 HydrophobicContact CD1-CG 4.04Å; R637-E650 IonicContact CZ-OE2 3.12Å; R637-E650 IonicContact NH2-OE2 2.68Å; R637-E650 PolarHBondContact NH2-OE2 3.49Å; C648-E650 PolarHBondContact O-N 3.42Å; E650-L652 PolarHBondContact O-N 2.81Å
651	E	74	Confident	71.3	Confident	135 Å²	135	105.7 Å²	105.7	63%	0.631	58%	0.575	S	S	*	*			trans	-66.4	119.1	-178.7	-65.1	-178.1	165.6	0	0	111.9	W618 R637	W618-E651 WeakPolarHBondContact CH2-O 3.08Å; R637-E651 PolarHBondContact NE-O 2.94Å; R637-E651 PolarHBondContact NH2-O 2.82Å
652	L	81.5	Confident	72.4	Confident	77 Å²	77	108.6 Å²	108.6	40%	0.403	58%	0.581	S	S	.	*	S	Bend	trans	-89.8	-16.1	177.8	-62.4	179.1	0	0	0	113.7	L615 W618 Q636 R637 L639 E650	L615-L652 HydrophobicContact CD2-CD2 3.7Å; W618-L652 WeakPolarHBondContact CZ3-O 3.44Å; Q636-L652 CarbonylContact C-O 3.57Å; Q636-L652 WeakPolarHBondContact CA-O 3.01Å; R637-L652 HydrophobicContact CG-CD2 4.49Å; R637-L652 PolarHBondContact N-O 3.02Å; L639-L652 HydrophobicContact CG-CD2 4.47Å; E650-L652 PolarHBondContact O-N 2.81Å
653	E	83.5	Confident	73.8	Confident	100 Å²	100	105.2 Å²	105.2	47%	0.467	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.9	136.7	177.9	177.8	166.2	-143.9	0	0	109.4	R635 Q636	R635-E653 WeakPolarHBondContact O-CA 3.42Å; Q636-E653 HydrophobicContact CG-CB 4.27Å; Q636-E653 HydrophobicContact CG-CG 4.2Å; Q636-E653 PolarHBondContact NE2-OE1 2.03Å
654	Q	89.3	Confident	75.2	Confident	66 Å²	66	103.8 Å²	103.8	31%	0.308	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	137.8	175.7	-163.6	178.3	27.3	0	0	110.1	W618 W621 T634 R635	W618-Q654 HydrophobicContact CH2-CB 3.63Å; W618-Q654 HydrophobicContact CZ2-CB 4.09Å; W618-Q654 HydrophobicContact CZ3-CB 3.85Å; W621-Q654 HydrophobicContact CH2-CB 4.2Å; W621-Q654 HydrophobicContact CH2-CG 3.99Å; W621-Q654 WeakPolarHBondContact CZ3-O 3.05Å; T634-Q654 VanDerWaalsContact CA-O 3.31Å; T634-Q654 WeakPolarHBondContact CA-O 3.45Å; R635-Q654 HydrophobicContact CG-CB 4.14Å; R635-Q654 VanDerWaalsContact CZ-OE1 3.29Å; R635-Q654 PolarHBondContact N-O 3.38Å; R635-Q654 PolarHBondContact O-N 3.45Å
655	V	90.3	Very high	76.6	Confident	83 Å²	83	97.8 Å²	97.8	50%	0.503	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.5	179.1	-172	0	0	0	0	109.6	L632 R633 T634	L632-V655 HydrophobicContact CB-CG1 4.06Å; L632-V655 HydrophobicContact CD1-CG1 4.17Å; L632-V655 HydrophobicContact CD2-CG1 4.17Å; L632-V655 HydrophobicContact CG-CG1 4.36Å; R633-V655 WeakPolarHBondContact O-CA 3.49Å; T634-V655 HydrophobicContact CG2-CG1 4.24Å; T634-V655 HydrophobicContact CG2-CG2 4Å
656	E	90.3	Very high	78.2	Confident	81 Å²	81	93.1 Å²	93.1	38%	0.379	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.2	178	-174.7	-179.8	-145.4	0	0	111.3	W621 L632 R633	W621-E656 HydrophobicContact CH2-CB 3.42Å; W621-E656 VanDerWaalsContact CH2-CB 3.42Å; W621-E656 HydrophobicContact CZ2-CB 3.92Å; W621-E656 WeakPolarHBondContact CZ2-OE2 3.47Å; W621-E656 HydrophobicContact CZ3-CB 3.78Å; L632-E656 CarbonylContact C-O 3.56Å; L632-E656 VanDerWaalsContact CA-O 3.31Å; L632-E656 WeakPolarHBondContact CA-O 3.34Å; R633-E656 HydrophobicContact CG-CB 4.17Å; R633-E656 IonicContact CZ-OE2 2.68Å; R633-E656 PolarHBondContact N-O 2.88Å; R633-E656 IonicContact NE-OE2 2.71Å; R633-E656 PolarHBondContact NE-OE2 3.5Å; R633-E656 IonicContact NH2-OE2 3.37Å; R633-E656 PolarHBondContact NH2-OE2 2.93Å; R633-E656 PolarHBondContact O-N 2.71Å
657	K	88.4	Confident	80	Confident	176 Å²	176	91.6 Å²	91.6	77%	0.765	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	116.5	175.5	-65.5	172.6	-175.5	170.3	0	110.2	G631 L632	G631-K657 WeakPolarHBondContact O-CA 3.4Å; L632-K657 HydrophobicContact CD2-CG 3.86Å
658	C	87.6	Confident	81.5	Confident	15 Å²	15	88.5 Å²	88.5	10%	0.101	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	142.5	170.8	44.9	0	0	0	0	110.9	C624 G631 L632 R633	C624-C658 WeakPolarHBondContact CA-SG 3.42Å; C624-C658 HydrophobicContact CB-CB 3.85Å; C624-C658 WeakPolarHBondContact CB-SG 3.31Å; C624-C658 WeakPolarHBondContact SG-CB 3.48Å; C624-C658 CovalentContact SG-SG 2.03Å; C624-C658 PolarHBondContact SG-SG 3.32Å; G631-C658 PolarHBondContact N-O 2.89Å; G631-C658 PolarHBondContact O-N 3.04Å; G631-C658 PolarHBondContact O-SG 2.92Å; L632-C658 PolarHBondContact N-SG 2.84Å; L632-C658 VanDerWaalsContact N-SG 3.43Å; R633-C658 HydrophobicContact CG-CB 4.38Å
659	M	84.8	Confident	82.9	Confident	160 Å²	160	88.5 Å²	88.5	79%	0.788	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	105.1	175.2	-64.8	-170.7	-65.4	0	0	108.7
660	L	82	Confident	84	Confident	65 Å²	65	84 Å²	84	34%	0.34	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-93.2	167.4	172.1	-68.2	-175.8	0	0	0	110.4	C624 V626 G629	C624-L660 HydrophobicContact CB-CD1 3.9Å; C624-L660 HydrophobicContact CB-CG 4.26Å; V626-L660 WeakPolarHBondContact O-CD1 3.32Å; G629-L660 PolarHBondContact O-N 2.68Å
661	P	79.2	Confident	84.9	Confident	106 Å²	106	86.2 Å²	86.2	69%	0.688	45%	0.451	S	S	*	.	S	Bend	trans	-50.1	145.3	174	-27.9	36.5	0	0	0	112.1	C628 G629	C628-P661 CarbonylContact C-O 3.56Å; C628-P661 WeakPolarHBondContact CA-O 3.2Å; C628-P661 WeakPolarHBondContact CB-O 3.4Å; G629-P661 PolarHBondContact N-O 2.93Å
662	E	81.1	Confident	85.6	Confident	127 Å²	127	82.8 Å²	82.8	59%	0.593	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-56.3	142.4	-178.8	-65.9	-172.4	-134.7	0	0	111.4	F699	E662-F699 HydrophobicContact CB-CB 4.44Å; E662-F699 HydrophobicContact CB-CD1 3.8Å; E662-F699 HydrophobicContact CB-CD2 3.84Å; E662-F699 HydrophobicContact CB-CE1 3.94Å; E662-F699 HydrophobicContact CB-CE2 3.99Å; E662-F699 HydrophobicContact CB-CG 3.74Å; E662-F699 HydrophobicContact CB-CZ 4.03Å; E662-F699 HydrophobicContact CG-CE1 4.32Å; E662-F699 HydrophobicContact CG-CZ 4.32Å; E662-F699 WeakPolarHBondContact O-CB 3.43Å; E662-F699 WeakPolarHBondContact OE2-CE2 3.5Å; E662-F699 VanDerWaalsContact OE2-CZ 3.24Å; E662-F699 WeakPolarHBondContact OE2-CZ 3.43Å
663	C	79.9	Confident	86.1	Confident	52 Å²	52	82.4 Å²	82.4	35%	0.351	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-64.8	145	-176.6	-68.3	0	0	0	0	111.6	C628 I665	C628-C663 HydrophobicContact CB-CB 3.89Å; C628-C663 WeakPolarHBondContact CB-SG 3Å; C628-C663 PolarHBondContact O-SG 2.77Å; C628-C663 VanDerWaalsContact O-SG 3.36Å; C628-C663 WeakPolarHBondContact SG-CA 3.46Å; C628-C663 WeakPolarHBondContact SG-CB 3.02Å; C628-C663 CovalentContact SG-SG 2.04Å; C628-C663 PolarHBondContact SG-SG 2.93Å; C663-I665 PolarHBondContact O-N 3.18Å
664	P	83.7	Confident	86.4	Confident	75 Å²	75	86.2 Å²	86.2	49%	0.487	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-57.2	130.3	174	24.4	-33.4	0	0	0	110
665	I	82.3	Confident	86.4	Confident	60 Å²	60	87.3 Å²	87.3	31%	0.308	45%	0.452	S	S	.	.	B	Isolated β-bridge	trans	-110.1	112	174.8	-59.1	175.5	0	0	0	106.7	C663 M695 P697 Q698 F699	C663-I665 PolarHBondContact O-N 3.18Å; I665-M695 HydrophobicContact CG2-SD 3.72Å; I665-P697 CarbonylContact O-C 3.59Å; I665-P697 VanDerWaalsContact O-CA 3.29Å; I665-P697 WeakPolarHBondContact O-CA 3.33Å; I665-Q698 HydrophobicContact CB-CB 4.24Å; I665-Q698 HydrophobicContact CD1-CB 4.49Å; I665-Q698 PolarHBondContact N-O 3.04Å; I665-Q698 PolarHBondContact O-N 2.92Å; I665-F699 HydrophobicContact CD1-CD2 4.15Å; I665-F699 HydrophobicContact CD1-CE2 4.19Å; I665-F699 HydrophobicContact CG1-CD2 4.36Å
666	D	82.9	Confident	86.2	Confident	90 Å²	90	85.8 Å²	85.8	48%	0.481	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-71	155.1	178.8	-60.1	-35.3	0	0	0	111.9	I668 G701 D702	D666-I668 PolarHBondContact O-N 3.4Å; D666-G701 WeakPolarHBondContact OD1-CA 3.46Å; D666-D702 PolarHBondContact OD1-N 2.85Å
667	C	87.4	Confident	86.1	Confident	16 Å²	16	90.5 Å²	90.5	11%	0.108	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-64.5	120.5	177.4	177	0	0	0	0	113.1	M695 P697 D702 C704	C667-M695 WeakPolarHBondContact CA-O 3.4Å; C667-M695 PolarHBondContact SG-O 2.98Å; C667-P697 HydrophobicContact CB-CB 4.39Å; C667-D702 WeakPolarHBondContact CB-O 3.11Å; C667-D702 PolarHBondContact N-O 2.94Å; C667-D702 VanDerWaalsContact N-O 3.11Å; C667-C704 HydrophobicContact CB-CB 3.85Å; C667-C704 WeakPolarHBondContact CB-SG 3.26Å; C667-C704 WeakPolarHBondContact SG-CA 3.06Å; C667-C704 WeakPolarHBondContact SG-CB 3.02Å; C667-C704 CovalentContact SG-SG 2.02Å; C667-C704 PolarHBondContact SG-SG 2.88Å
668	I	86.8	Confident	86	Confident	91 Å²	91	83.1 Å²	83.1	47%	0.467	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.1	172.6	-52.1	179	0	0	0	108.9	D666 T694 M695	D666-I668 PolarHBondContact O-N 3.4Å; I668-T694 PolarHBondContact O-N 2.83Å; I668-T694 PolarHBondContact O-OG1 3.18Å; I668-M695 HydrophobicContact CB-CB 3.93Å; I668-M695 HydrophobicContact CD1-CB 4.48Å; I668-M695 HydrophobicContact CD1-CE 4.22Å; I668-M695 HydrophobicContact CD1-SD 4.14Å; I668-M695 HydrophobicContact CG1-CB 4.26Å; I668-M695 PolarHBondContact N-O 2.84Å; I668-M695 PolarHBondContact O-N 3.48Å
669	M	89.1	Confident	85.8	Confident	44 Å²	44	89 Å²	89	22%	0.217	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	154.8	177	-65.2	158.4	-79.1	0	0	110.6	R691 I692 V693 T694 C704	M669-R691 PolarHBondContact SD-NH1 3.37Å; M669-I692 CarbonylContact C-O 3.54Å; M669-I692 WeakPolarHBondContact CA-O 3.46Å; M669-V693 HydrophobicContact CG-CG2 4.23Å; M669-T694 VanDerWaalsContact C-OG1 3.24Å; M669-C704 HydrophobicContact SD-CB 4.26Å
670	S	89.8	Confident	85.6	Confident	38 Å²	38	86.9 Å²	86.9	27%	0.266	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-65	163.7	171.1	76.6	0	0	0	0	111.5	R691 I692 T694	S670-R691 WeakPolarHBondContact O-CB 3.08Å; S670-I692 PolarHBondContact N-O 3.39Å; S670-I692 PolarHBondContact OG-N 3.4Å; S670-T694 PolarHBondContact N-OG1 2.96Å
671	D	88.9	Confident	85.4	Confident	153 Å²	153	89.4 Å²	89.4	82%	0.818	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-54.5	154.1	158.4	-77.3	-45.3	0	0	0	111.1
672	W	89.4	Confident	85.3	Confident	63 Å²	63	86.1 Å²	86.1	24%	0.239	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-70.8	138.5	175.3	-71.5	96.4	0	0	0	111.1	R689 T690 R691 E706 T707 Q709	W672-R689 HydrophobicContact CD2-CG 4.19Å; W672-R689 HydrophobicContact CE3-CB 4.32Å; W672-R689 HydrophobicContact CE3-CG 3.63Å; W672-R689 HydrophobicContact CZ3-CG 4.18Å; W672-R689 WeakPolarHBondContact CZ3-O 3.42Å; W672-T690 VanDerWaalsContact CE3-C 3.44Å; W672-R691 HydrophobicContact CD2-CB 4.14Å; W672-R691 HydrophobicContact CD2-CG 4.04Å; W672-R691 HydrophobicContact CE3-CB 3.97Å; W672-R691 HydrophobicContact CE3-CG 3.88Å; W672-R691 HydrophobicContact CH2-CG 3.97Å; W672-R691 HydrophobicContact CZ2-CG 4.13Å; W672-R691 HydrophobicContact CZ3-CB 4.36Å; W672-R691 HydrophobicContact CZ3-CG 3.85Å; W672-E706 VanDerWaalsContact CH2-O 3.27Å; W672-E706 WeakPolarHBondContact CH2-O 3.31Å; W672-T707 WeakPolarHBondContact CZ3-O 3.12Å; W672-Q709 HydrophobicContact CH2-CB 3.66Å; W672-Q709 HydrophobicContact CZ2-CB 4.22Å; W672-Q709 HydrophobicContact CZ3-CB 3.83Å
673	T	90.6	Very high	85.2	Confident	69 Å²	69	81.1 Å²	81.1	42%	0.423	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-57.1	161.4	164	66.3	0	0	0	0	110.8	R689 T690	T673-R689 WeakPolarHBondContact O-CB 3.44Å; T673-T690 WeakPolarHBondContact CG2-O 3.36Å; T673-T690 PolarHBondContact N-O 2.91Å; T673-T690 PolarHBondContact OG1-N 2.85Å; T673-T690 PolarHBondContact OG1-O 2.81Å; T673-T690 PolarHBondContact OG1-OG1 2.77Å
674	E	90.3	Very high	85.4	Confident	181 Å²	181	86.8 Å²	86.8	85%	0.846	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-56.4	159.1	163.6	-61.2	-160.9	149.9	0	0	111.4
675	W	89.3	Confident	85.4	Confident	88 Å²	88	83.3 Å²	83.3	33%	0.333	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-71.8	130.1	177.1	-73.5	97.5	0	0	0	110.3	T687 R689 Q709 K711	W675-T687 VanDerWaalsContact CE3-OG1 3.28Å; W675-R689 HydrophobicContact CD2-CB 4.1Å; W675-R689 HydrophobicContact CD2-CG 3.98Å; W675-R689 VanDerWaalsContact CE2-CD 3.43Å; W675-R689 HydrophobicContact CE3-CB 3.95Å; W675-R689 HydrophobicContact CE3-CG 3.86Å; W675-R689 HydrophobicContact CH2-CG 3.71Å; W675-R689 VanDerWaalsContact CZ2-CD 3.48Å; W675-R689 HydrophobicContact CZ2-CG 3.84Å; W675-R689 VanDerWaalsContact CZ2-NE 3.28Å; W675-R689 HydrophobicContact CZ3-CB 4.25Å; W675-R689 HydrophobicContact CZ3-CG 3.73Å; W675-Q709 HydrophobicContact CH2-CB 4.22Å; W675-Q709 HydrophobicContact CH2-CG 4.13Å; W675-Q709 WeakPolarHBondContact CZ3-O 3.19Å; W675-K711 HydrophobicContact CE3-CB 4.16Å; W675-K711 HydrophobicContact CH2-CB 3.46Å; W675-K711 VanDerWaalsContact CH2-CB 3.46Å; W675-K711 HydrophobicContact CH2-CD 4.31Å; W675-K711 HydrophobicContact CH2-CG 4.5Å; W675-K711 HydrophobicContact CZ2-CB 4.02Å; W675-K711 HydrophobicContact CZ2-CD 3.99Å; W675-K711 HydrophobicContact CZ3-CB 3.53Å
676	S	87.4	Confident	85.6	Confident	52 Å²	52	84.8 Å²	84.8	36%	0.364	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-54.4	158.4	168.9	80.8	0	0	0	0	111.4	T687 I688	S676-T687 WeakPolarHBondContact O-CB 3.4Å; S676-T687 WeakPolarHBondContact O-CG2 3.29Å; S676-I688 WeakPolarHBondContact CB-O 3.35Å; S676-I688 PolarHBondContact N-O 2.99Å; S676-I688 PolarHBondContact OG-N 3.14Å; S676-I688 PolarHBondContact OG-O 2.71Å
677	E	86.4	Confident	85.9	Confident	179 Å²	179	81.4 Å²	81.4	84%	0.836	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-55.5	157.6	161.9	-62.7	-165.7	164.1	0	0	111.6	N679	E677-N679 PolarHBondContact O-N 3.32Å
678	C	87.1	Confident	86	Confident	22 Å²	22	83.4 Å²	83.4	15%	0.149	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-72	125	-179.7	-171.4	0	0	0	0	109.6	K680 T687 C713 I715	C678-K680 PolarHBondContact O-N 2.02Å; C678-T687 HydrophobicContact CB-CG2 4.16Å; C678-C713 VanDerWaalsContact CA-SG 3.6Å; C678-C713 HydrophobicContact CB-CB 3.9Å; C678-C713 WeakPolarHBondContact CB-SG 3.03Å; C678-C713 WeakPolarHBondContact SG-CB 3.44Å; C678-C713 CovalentContact SG-SG 2.03Å; C678-C713 PolarHBondContact SG-SG 3.11Å; C678-I715 HydrophobicContact CB-CD1 3.44Å; C678-I715 VanDerWaalsContact CB-CD1 3.44Å; C678-I715 HydrophobicContact CB-CG1 4.1Å
679	N	84.3	Confident	86.1	Confident	137 Å²	137	82 Å²	82	73%	0.733	42%	0.423	S	S	*	.	S	Bend	trans	-68.6	22.7	-175	-165.4	13.5	0	0	0	115.2	E677 H686	E677-N679 PolarHBondContact O-N 3.32Å; N679-H686 PolarHBondContact N-O 3.03Å
680	K	80.4	Confident	86	Confident	117 Å²	117	82.9 Å²	82.9	51%	0.509	43%	0.43	S	S	.	.			trans	-149.8	130.2	169.9	-65.1	-169.2	-168.6	163.2	0	110.2	C678 C682 K684	C678-K680 PolarHBondContact O-N 2.02Å; K680-C682 PolarHBondContact O-N 2.94Å; K680-K684 WeakPolarHBondContact CD-O 3.39Å; K680-K684 WeakPolarHBondContact CE-O 3.39Å; K680-K684 PolarHBondContact NZ-O 2.94Å
681	S	76.5	Confident	86	Confident	117 Å²	117	83 Å²	83	82%	0.818	43%	0.425	S	S	*	.	S	Bend	trans	-65.9	-13.2	174.8	51.6	0	0	0	0	114.5	I715	S681-I715 VanDerWaalsContact O-CG2 3.26Å; S681-I715 WeakPolarHBondContact O-CG2 3.35Å
682	C	77	Confident	85.9	Confident	38 Å²	38	81.2 Å²	81.2	26%	0.257	41%	0.414	S	S	.	.	S	Bend	trans	-155.3	152.5	174.3	66.4	0	0	0	0	113	K680 R716 C718	K680-C682 PolarHBondContact O-N 2.94Å; C682-R716 WeakPolarHBondContact CA-O 3.09Å; C682-R716 VanDerWaalsContact CB-O 3.31Å; C682-R716 WeakPolarHBondContact CB-O 3.03Å; C682-C718 VanDerWaalsContact C-SG 3.55Å; C682-C718 HydrophobicContact CB-CB 3.84Å; C682-C718 WeakPolarHBondContact CB-SG 3.47Å; C682-C718 VanDerWaalsContact SG-CA 3.56Å; C682-C718 WeakPolarHBondContact SG-CB 3.08Å; C682-C718 CovalentContact SG-SG 2.03Å; C682-C718 PolarHBondContact SG-SG 3.31Å
683	G	79.3	Confident	85.8	Confident	22 Å²	22	80.2 Å²	80.2	23%	0.227	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.6	-148.6	177	0	0	0	0	0	115.6	I715 R716	G683-I715 PolarHBondContact N-O 3.04Å; G683-I715 PolarHBondContact O-N 2.8Å; G683-R716 PolarHBondContact N-O 3.44Å
684	K	84	Confident	85.6	Confident	170 Å²	170	81.2 Å²	81.2	74%	0.739	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	115.5	-178.6	-64.3	179.6	-175.9	175.4	0	110.8	K680	K680-K684 WeakPolarHBondContact CD-O 3.39Å; K680-K684 WeakPolarHBondContact CE-O 3.39Å; K680-K684 PolarHBondContact NZ-O 2.94Å
685	G	84.7	Confident	85.2	Confident	3 Å²	3	76.4 Å²	76.4	3%	0.031	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	-168.4	177.3	0	0	0	0	0	112.6	C713	G685-C713 PolarHBondContact N-O 3.36Å; G685-C713 PolarHBondContact O-N 3.5Å; G685-C713 PolarHBondContact O-SG 2.85Å
686	H	86.9	Confident	85	Confident	90 Å²	90	77.9 Å²	77.9	42%	0.417	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145.9	172.3	-64.7	-101.2	0	0	0	110.9	N679 K711 C713	N679-H686 PolarHBondContact N-O 3.03Å; H686-K711 CarbonylContact C-O 3.53Å; H686-K711 WeakPolarHBondContact CA-O 3.31Å; H686-C713 WeakPolarHBondContact CA-SG 3.5Å; H686-C713 PolarHBondContact N-SG 3.43Å
687	T	88.4	Confident	84.9	Confident	19 Å²	19	77.6 Å²	77.6	12%	0.117	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	153.8	163.4	57.5	0	0	0	0	108.9	W675 S676 C678 K711 C713	W675-T687 VanDerWaalsContact CE3-OG1 3.28Å; S676-T687 WeakPolarHBondContact O-CB 3.4Å; S676-T687 WeakPolarHBondContact O-CG2 3.29Å; C678-T687 HydrophobicContact CB-CG2 4.16Å; T687-K711 PolarHBondContact N-O 2.03Å; T687-K711 PolarHBondContact O-N 2.96Å; T687-C713 HydrophobicContact CG2-CB 4.04Å
688	I	88.4	Confident	84.5	Confident	59 Å²	59	73.2 Å²	73.2	30%	0.303	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.6	-179.2	-54.8	-177.1	0	0	0	108.3	S676 I708 Q709 R710	S676-I688 WeakPolarHBondContact CB-O 3.35Å; S676-I688 PolarHBondContact N-O 2.99Å; S676-I688 PolarHBondContact OG-N 3.14Å; S676-I688 PolarHBondContact OG-O 2.71Å; I688-I708 HydrophobicContact CG2-CG2 3.58Å; I688-Q709 WeakPolarHBondContact CA-O 3.4Å; I688-R710 HydrophobicContact CG1-CG 4.36Å
689	R	90.1	Very high	84.1	Confident	62 Å²	62	77 Å²	77	23%	0.234	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.1	161.9	63.5	178	-175.5	159.8	2.4	109.6	W672 T673 W675 Q709	W672-R689 HydrophobicContact CD2-CG 4.19Å; W672-R689 HydrophobicContact CE3-CB 4.32Å; W672-R689 HydrophobicContact CE3-CG 3.63Å; W672-R689 HydrophobicContact CZ3-CG 4.18Å; W672-R689 WeakPolarHBondContact CZ3-O 3.42Å; T673-R689 WeakPolarHBondContact O-CB 3.44Å; W675-R689 HydrophobicContact CD2-CB 4.1Å; W675-R689 HydrophobicContact CD2-CG 3.98Å; W675-R689 VanDerWaalsContact CE2-CD 3.43Å; W675-R689 HydrophobicContact CE3-CB 3.95Å; W675-R689 HydrophobicContact CE3-CG 3.86Å; W675-R689 HydrophobicContact CH2-CG 3.71Å; W675-R689 VanDerWaalsContact CZ2-CD 3.48Å; W675-R689 HydrophobicContact CZ2-CG 3.84Å; W675-R689 VanDerWaalsContact CZ2-NE 3.28Å; W675-R689 HydrophobicContact CZ3-CB 4.25Å; W675-R689 HydrophobicContact CZ3-CG 3.73Å; R689-Q709 HydrophobicContact CG-CB 4.14Å; R689-Q709 PolarHBondContact N-O 2.85Å; R689-Q709 PolarHBondContact O-N 3.47Å
690	T	86.5	Confident	83.6	Confident	61 Å²	61	74.1 Å²	74.1	37%	0.374	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	155.1	-175.6	49	0	0	0	0	110.7	W672 T673 T707 I708	W672-T690 VanDerWaalsContact CE3-C 3.44Å; T673-T690 WeakPolarHBondContact CG2-O 3.36Å; T673-T690 PolarHBondContact N-O 2.91Å; T673-T690 PolarHBondContact OG1-N 2.85Å; T673-T690 PolarHBondContact OG1-O 2.81Å; T673-T690 PolarHBondContact OG1-OG1 2.77Å; T690-T707 CarbonylContact C-O 3.57Å; T690-T707 VanDerWaalsContact CA-O 3.3Å; T690-T707 WeakPolarHBondContact CA-O 3.43Å; T690-I708 HydrophobicContact CG2-CG1 4.21Å; T690-I708 HydrophobicContact CG2-CG2 4.38Å
691	R	90.1	Very high	83.6	Confident	42 Å²	42	69.2 Å²	69.2	16%	0.158	39%	0.386	C	S	.	.			trans	-138.3	154.1	164.9	60.6	-178.7	170.6	166.1	2.4	108.2	M669 S670 W672 T705 E706 T707	M669-R691 PolarHBondContact SD-NH1 3.37Å; S670-R691 WeakPolarHBondContact O-CB 3.08Å; W672-R691 HydrophobicContact CD2-CB 4.14Å; W672-R691 HydrophobicContact CD2-CG 4.04Å; W672-R691 HydrophobicContact CE3-CB 3.97Å; W672-R691 HydrophobicContact CE3-CG 3.88Å; W672-R691 HydrophobicContact CH2-CG 3.97Å; W672-R691 HydrophobicContact CZ2-CG 4.13Å; W672-R691 HydrophobicContact CZ3-CB 4.36Å; W672-R691 HydrophobicContact CZ3-CG 3.85Å; R691-T705 PolarHBondContact NH2-O 3.25Å; R691-T705 PolarHBondContact NH2-OG1 2.79Å; R691-E706 PolarHBondContact NE-O 2.83Å; R691-E706 VanDerWaalsContact NE-O 3.07Å; R691-E706 PolarHBondContact NH2-O 2.96Å; R691-T707 PolarHBondContact N-O 2.91Å; R691-T707 WeakPolarHBondContact O-CB 3.48Å
692	I	86.1	Confident	83.6	Confident	115 Å²	115	69.6 Å²	69.6	59%	0.59	38%	0.379	S	S	*	.			trans	-101.5	151.6	177.8	59.3	173.3	0	0	0	110.2	M669 S670 T694	M669-I692 CarbonylContact C-O 3.54Å; M669-I692 WeakPolarHBondContact CA-O 3.46Å; S670-I692 PolarHBondContact N-O 3.39Å; S670-I692 PolarHBondContact OG-N 3.4Å; I692-T694 PolarHBondContact O-N 2.9Å
693	V	88.4	Confident	84	Confident	41 Å²	41	72.5 Å²	72.5	25%	0.248	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	120.1	165.8	177.3	0	0	0	0	106.9	M669 M695 E696 C704 T707	M669-V693 HydrophobicContact CG-CG2 4.23Å; V693-M695 VanDerWaalsContact CG1-C 3.49Å; V693-M695 WeakPolarHBondContact CG1-O 3.31Å; V693-E696 HydrophobicContact CG1-CG 4.11Å; V693-C704 HydrophobicContact CG2-CB 3.95Å; V693-C704 VanDerWaalsContact CG2-SG 3.5Å; V693-T707 HydrophobicContact CG2-CG2 4.04Å
694	T	85.4	Confident	84.3	Confident	91 Å²	91	73.2 Å²	73.2	56%	0.558	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	-27.9	176.6	-3.4	0	0	0	0	111.1	I668 M669 S670 I692	I668-T694 PolarHBondContact O-N 2.83Å; I668-T694 PolarHBondContact O-OG1 3.18Å; M669-T694 VanDerWaalsContact C-OG1 3.24Å; S670-T694 PolarHBondContact N-OG1 2.96Å; I692-T694 PolarHBondContact O-N 2.9Å
695	M	83	Confident	84.4	Confident	80 Å²	80	69.2 Å²	69.2	39%	0.394	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	119.4	174.4	-163.6	175.5	-63.9	0	0	109.3	I665 C667 I668 V693	I665-M695 HydrophobicContact CG2-SD 3.72Å; C667-M695 WeakPolarHBondContact CA-O 3.4Å; C667-M695 PolarHBondContact SG-O 2.98Å; I668-M695 HydrophobicContact CB-CB 3.93Å; I668-M695 HydrophobicContact CD1-CB 4.48Å; I668-M695 HydrophobicContact CD1-CE 4.22Å; I668-M695 HydrophobicContact CD1-SD 4.14Å; I668-M695 HydrophobicContact CG1-CB 4.26Å; I668-M695 PolarHBondContact N-O 2.84Å; I668-M695 PolarHBondContact O-N 3.48Å; V693-M695 VanDerWaalsContact CG1-C 3.49Å; V693-M695 WeakPolarHBondContact CG1-O 3.31Å
696	E	84.6	Confident	84.3	Confident	119 Å²	119	76.2 Å²	76.2	56%	0.556	42%	0.422	S	S	*	.			trans	-69.9	151.1	172.8	-68.5	-68.2	165.7	0	0	110.5	V693	V693-E696 HydrophobicContact CG1-CG 4.11Å
697	P	86.1	Confident	84.3	Confident	45 Å²	45	74.6 Å²	74.6	29%	0.292	42%	0.419	S	S	.	.			trans	-67.6	139.7	-178.5	30.2	-35.8	0	0	0	111.5	I665 C667	I665-P697 CarbonylContact O-C 3.59Å; I665-P697 VanDerWaalsContact O-CA 3.29Å; I665-P697 WeakPolarHBondContact O-CA 3.33Å; C667-P697 HydrophobicContact CB-CB 4.39Å
698	Q	78.1	Confident	84.2	Confident	88 Å²	88	77.7 Å²	77.7	41%	0.411	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-131.7	157.4	-179.8	-60	177.6	48.6	0	0	110.9	I665 G700 G701	I665-Q698 HydrophobicContact CB-CB 4.24Å; I665-Q698 HydrophobicContact CD1-CB 4.49Å; I665-Q698 PolarHBondContact N-O 3.04Å; I665-Q698 PolarHBondContact O-N 2.92Å; Q698-G700 PolarHBondContact O-N 3.03Å; Q698-G701 PolarHBondContact O-N 2.04Å
699	F	77.6	Confident	84.3	Confident	101 Å²	101	78.4 Å²	78.4	44%	0.443	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	28.7	175.2	-46.6	-69.2	0	0	0	115.6	E662 I665	E662-F699 HydrophobicContact CB-CB 4.44Å; E662-F699 HydrophobicContact CB-CD1 3.8Å; E662-F699 HydrophobicContact CB-CD2 3.84Å; E662-F699 HydrophobicContact CB-CE1 3.94Å; E662-F699 HydrophobicContact CB-CE2 3.99Å; E662-F699 HydrophobicContact CB-CG 3.74Å; E662-F699 HydrophobicContact CB-CZ 4.03Å; E662-F699 HydrophobicContact CG-CE1 4.32Å; E662-F699 HydrophobicContact CG-CZ 4.32Å; E662-F699 WeakPolarHBondContact O-CB 3.43Å; E662-F699 WeakPolarHBondContact OE2-CE2 3.5Å; E662-F699 VanDerWaalsContact OE2-CZ 3.24Å; E662-F699 WeakPolarHBondContact OE2-CZ 3.43Å; I665-F699 HydrophobicContact CD1-CD2 4.15Å; I665-F699 HydrophobicContact CD1-CE2 4.19Å; I665-F699 HydrophobicContact CG1-CD2 4.36Å
700	G	73.5	Confident	84.2	Confident	77 Å²	77	84.4 Å²	84.4	79%	0.794	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	10.8	178.7	0	0	0	0	0	115.7	Q698	Q698-G700 PolarHBondContact O-N 3.03Å
701	G	79.9	Confident	84.4	Confident	14 Å²	14	87.2 Å²	87.2	14%	0.144	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-67.6	165.8	172.6	0	0	0	0	0	114.6	D666 Q698	D666-G701 WeakPolarHBondContact OD1-CA 3.46Å; Q698-G701 PolarHBondContact O-N 2.04Å
702	D	78	Confident	84.3	Confident	125 Å²	125	93.7 Å²	93.7	67%	0.668	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-68.1	136.2	-170.4	-95.3	-22.8	0	0	0	113.7	D666 C667	D666-D702 PolarHBondContact OD1-N 2.85Å; C667-D702 WeakPolarHBondContact CB-O 3.11Å; C667-D702 PolarHBondContact N-O 2.94Å; C667-D702 VanDerWaalsContact N-O 3.11Å
703	S	85.1	Confident	84.2	Confident	98 Å²	98	89.2 Å²	89.2	69%	0.685	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-68.4	142.6	-178.3	67.4	0	0	0	0	113.3	T705	S703-T705 PolarHBondContact O-N 3.46Å
704	C	85.5	Confident	83.8	Confident	38 Å²	38	96 Å²	96	26%	0.257	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-52.8	131.1	178.6	-50.2	0	0	0	0	113.3	C667 M669 V693	C667-C704 HydrophobicContact CB-CB 3.85Å; C667-C704 WeakPolarHBondContact CB-SG 3.26Å; C667-C704 WeakPolarHBondContact SG-CA 3.06Å; C667-C704 WeakPolarHBondContact SG-CB 3.02Å; C667-C704 CovalentContact SG-SG 2.02Å; C667-C704 PolarHBondContact SG-SG 2.88Å; M669-C704 HydrophobicContact SD-CB 4.26Å; V693-C704 HydrophobicContact CG2-CB 3.95Å; V693-C704 VanDerWaalsContact CG2-SG 3.5Å
705	T	85.4	Confident	83.2	Confident	86 Å²	86	95.2 Å²	95.2	53%	0.528	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-76.9	165.3	170.2	49.8	0	0	0	0	111.3	R691 S703 T707	R691-T705 PolarHBondContact NH2-O 3.25Å; R691-T705 PolarHBondContact NH2-OG1 2.79Å; S703-T705 PolarHBondContact O-N 3.46Å; T705-T707 PolarHBondContact O-N 3.38Å
706	E	84.1	Confident	82.8	Confident	149 Å²	149	101.9 Å²	101.9	70%	0.696	51%	0.512	S	S	*	.			trans	-44.2	131.9	-170.1	-62.3	-176	165.7	0	0	114.6	W672 R691	W672-E706 VanDerWaalsContact CH2-O 3.27Å; W672-E706 WeakPolarHBondContact CH2-O 3.31Å; R691-E706 PolarHBondContact NE-O 2.83Å; R691-E706 VanDerWaalsContact NE-O 3.07Å; R691-E706 PolarHBondContact NH2-O 2.96Å
707	T	86.3	Confident	81.9	Confident	56 Å²	56	105.8 Å²	105.8	34%	0.344	53%	0.527	S	S	.	.	S	Bend	trans	-87.7	-10.3	179.6	50.4	0	0	0	0	113.7	W672 T690 R691 V693 T705	W672-T707 WeakPolarHBondContact CZ3-O 3.12Å; T690-T707 CarbonylContact C-O 3.57Å; T690-T707 VanDerWaalsContact CA-O 3.3Å; T690-T707 WeakPolarHBondContact CA-O 3.43Å; R691-T707 PolarHBondContact N-O 2.91Å; R691-T707 WeakPolarHBondContact O-CB 3.48Å; V693-T707 HydrophobicContact CG2-CG2 4.04Å; T705-T707 PolarHBondContact O-N 3.38Å
708	I	86.6	Confident	80.9	Confident	85 Å²	85	107.1 Å²	107.1	44%	0.436	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	116.3	-176.5	-51.3	-178.9	0	0	0	109.6	I688 T690	I688-I708 HydrophobicContact CG2-CG2 3.58Å; T690-I708 HydrophobicContact CG2-CG1 4.21Å; T690-I708 HydrophobicContact CG2-CG2 4.38Å
709	Q	89.4	Confident	80.4	Confident	73 Å²	73	108.6 Å²	108.6	34%	0.341	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.7	138.8	178.1	-160.3	176	52.5	0	0	111.6	W672 W675 I688 R689	W672-Q709 HydrophobicContact CH2-CB 3.66Å; W672-Q709 HydrophobicContact CZ2-CB 4.22Å; W672-Q709 HydrophobicContact CZ3-CB 3.83Å; W675-Q709 HydrophobicContact CH2-CB 4.22Å; W675-Q709 HydrophobicContact CH2-CG 4.13Å; W675-Q709 WeakPolarHBondContact CZ3-O 3.19Å; I688-Q709 WeakPolarHBondContact CA-O 3.4Å; R689-Q709 HydrophobicContact CG-CB 4.14Å; R689-Q709 PolarHBondContact N-O 2.85Å; R689-Q709 PolarHBondContact O-N 3.47Å
710	R	89	Confident	79.4	Confident	188 Å²	188	115.7 Å²	115.7	71%	0.709	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.9	123.7	-177.9	-59	-175.5	178.9	-168.9	-0.7	111.6	I688	I688-R710 HydrophobicContact CG1-CG 4.36Å
711	K	90	Very high	78	Confident	120 Å²	120	115.5 Å²	115.5	52%	0.522	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	142.9	177	-172.4	175.2	-176.7	178.8	0	110.6	W675 H686 T687	W675-K711 HydrophobicContact CE3-CB 4.16Å; W675-K711 HydrophobicContact CH2-CB 3.46Å; W675-K711 VanDerWaalsContact CH2-CB 3.46Å; W675-K711 HydrophobicContact CH2-CD 4.31Å; W675-K711 HydrophobicContact CH2-CG 4.5Å; W675-K711 HydrophobicContact CZ2-CB 4.02Å; W675-K711 HydrophobicContact CZ2-CD 3.99Å; W675-K711 HydrophobicContact CZ3-CB 3.53Å; H686-K711 CarbonylContact C-O 3.53Å; H686-K711 WeakPolarHBondContact CA-O 3.31Å; T687-K711 PolarHBondContact N-O 2.03Å; T687-K711 PolarHBondContact O-N 2.96Å
712	K	87.7	Confident	76.3	Confident	178 Å²	178	124.6 Å²	124.6	77%	0.774	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.8	126.7	178	-71.6	168.7	-177	168.7	0	109.7
713	C	84.3	Confident	74.5	Confident	21 Å²	21	122.1 Å²	122.1	14%	0.142	62%	0.621	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	151.5	172.9	48.8	0	0	0	0	111.3	C678 G685 H686 T687	C678-C713 VanDerWaalsContact CA-SG 3.6Å; C678-C713 HydrophobicContact CB-CB 3.9Å; C678-C713 WeakPolarHBondContact CB-SG 3.03Å; C678-C713 WeakPolarHBondContact SG-CB 3.44Å; C678-C713 CovalentContact SG-SG 2.03Å; C678-C713 PolarHBondContact SG-SG 3.11Å; G685-C713 PolarHBondContact N-O 3.36Å; G685-C713 PolarHBondContact O-N 3.5Å; G685-C713 PolarHBondContact O-SG 2.85Å; H686-C713 WeakPolarHBondContact CA-SG 3.5Å; H686-C713 PolarHBondContact N-SG 3.43Å; T687-C713 HydrophobicContact CG2-CB 4.04Å
714	K	79.8	Confident	72.3	Confident	185 Å²	185	124.8 Å²	124.8	80%	0.804	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-124.4	112.5	175.5	-66.1	176.2	-175.4	170.4	0	108
715	I	73.9	Confident	70.7	Confident	73 Å²	73	127.3 Å²	127.3	37%	0.374	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	163.7	171.8	-66.8	-168	0	0	0	109.1	C678 S681 G683	C678-I715 HydrophobicContact CB-CD1 3.44Å; C678-I715 VanDerWaalsContact CB-CD1 3.44Å; C678-I715 HydrophobicContact CB-CG1 4.1Å; S681-I715 VanDerWaalsContact O-CG2 3.26Å; S681-I715 WeakPolarHBondContact O-CG2 3.35Å; G683-I715 PolarHBondContact N-O 3.04Å; G683-I715 PolarHBondContact O-N 2.8Å
716	R	74.1	Confident	69	Low	221 Å²	221	129.2 Å²	129.2	83%	0.834	65%	0.653	S	S	*	*			trans	-42.6	146.5	-177.5	-63.8	-177.1	178.4	-171.9	-0.2	112.1	C682 G683 C718	C682-R716 WeakPolarHBondContact CA-O 3.09Å; C682-R716 VanDerWaalsContact CB-O 3.31Å; C682-R716 WeakPolarHBondContact CB-O 3.03Å; G683-R716 PolarHBondContact N-O 3.44Å; R716-C718 PolarHBondContact O-N 2.95Å
717	K	65.4	Low	67.2	Low	201 Å²	201	128.1 Å²	128.1	87%	0.874	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-58.7	130.9	-179.4	-66.3	-179.6	-179.1	176.1	0	109.6	S719	K717-S719 PolarHBondContact O-N 3.29Å
718	C	65.3	Low	65.3	Low	73 Å²	73	134.5 Å²	134.5	49%	0.493	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-59.9	121.9	175.8	-54.8	0	0	0	0	110.3	C682 R716 R720	C682-C718 VanDerWaalsContact C-SG 3.55Å; C682-C718 HydrophobicContact CB-CB 3.84Å; C682-C718 WeakPolarHBondContact CB-SG 3.47Å; C682-C718 VanDerWaalsContact SG-CA 3.56Å; C682-C718 WeakPolarHBondContact SG-CB 3.08Å; C682-C718 CovalentContact SG-SG 2.03Å; C682-C718 PolarHBondContact SG-SG 3.31Å; R716-C718 PolarHBondContact O-N 2.95Å; C718-R720 PolarHBondContact O-N 3.39Å
719	S	68.3	Low	63.4	Low	118 Å²	118	141 Å²	141	83%	0.825	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-71	121.6	171.1	35.1	0	0	0	0	109.8	K717 G721	K717-S719 PolarHBondContact O-N 3.29Å; S719-G721 PolarHBondContact O-N 2.85Å; S719-G721 VanDerWaalsContact O-N 3.13Å
720	R	54.9	Low	61.5	Low	251 Å²	251	148.2 Å²	148.2	95%	0.947	71%	0.714	S	S	*	*			trans	-73.7	99.6	167.1	-81.3	-179	169.4	170.7	-3.9	108.1	C718 Q722	C718-R720 PolarHBondContact O-N 3.39Å; R720-Q722 PolarHBondContact O-N 3.07Å
721	G	45	Very low	59.5	Low	73 Å²	73	148.6 Å²	148.6	75%	0.753	72%	0.715	S	S	*	*			trans	-61.9	126.8	171.1	0	0	0	0	0	110.9	S719	S719-G721 PolarHBondContact O-N 2.85Å; S719-G721 VanDerWaalsContact O-N 3.13Å
722	Q	45.2	Very low	57.4	Low	204 Å²	204	152 Å²	152	95%	0.953	73%	0.73	S	S	*	*			trans	-65.9	130	160.3	-71.5	164.8	-60.5	0	0	107.9	R720	R720-Q722 PolarHBondContact O-N 3.07Å
723	G	39.8	Very low	55.5	Low	73 Å²	73	152.4 Å²	152.4	75%	0.753	74%	0.735	S	S	*	*			trans	-149.5	132.6	179.5	0	0	0	0	0	109.1
724	N	39.1	Very low	53.8	Low	155 Å²	155	160 Å²	160	83%	0.829	77%	0.768	S	S	*	*			trans	-60.3	157.7	-154.6	-113	-17.9	0	0	0	117.1	D726	N724-D726 PolarHBondContact O-N 3.36Å
725	S	51	Low	52.1	Low	91 Å²	91	162.6 Å²	162.6	64%	0.636	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-2.3	-166.1	36.6	0	0	0	0	117.3
726	D	48.9	Very low	51	Low	126 Å²	126	168 Å²	168	67%	0.674	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-16.3	-161.3	-70.5	-67.2	0	0	0	117.2	N724 K728	N724-D726 PolarHBondContact O-N 3.36Å; D726-K728 VanDerWaalsContact C-N 3.31Å
727	E	47.3	Very low	49.5	Very low	125 Å²	125	167.4 Å²	167.4	58%	0.584	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-83.5	-11.2	174.4	-140.3	-174.9	138.9	0	0	113	R729 R731	E727-R729 VanDerWaalsContact C-N 3.26Å; E727-R729 PolarHBondContact O-N 2.81Å; E727-R731 IonicContact OE1-CZ 2.72Å; E727-R731 IonicContact OE1-NE 2.83Å; E727-R731 IonicContact OE1-NH1 3.24Å; E727-R731 PolarHBondContact OE1-NH1 3.48Å
728	K	46.3	Very low	47.9	Very low	190 Å²	190	167.3 Å²	167.3	83%	0.826	80%	0.803	S	S	*	*	G	3₁₀ helix	trans	-77	-8.8	-177.2	-137.6	172.2	-171.8	174.7	0	114	D726	D726-K728 VanDerWaalsContact C-N 3.31Å
729	R	47.1	Very low	46.5	Very low	223 Å²	223	175.4 Å²	175.4	84%	0.842	82%	0.823	S	S	*	*	G	3₁₀ helix	trans	-103.3	-4.8	179.9	-141.7	174.9	98.1	175.6	6	114.8	E727	E727-R729 VanDerWaalsContact C-N 3.26Å; E727-R729 PolarHBondContact O-N 2.81Å
730	R	49.1	Very low	44.8	Very low	224 Å²	224	175.1 Å²	175.1	85%	0.845	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-6.7	-179	-85.8	-176	167.5	175.7	-3	116
731	R	47.6	Very low	43.7	Very low	195 Å²	195	171.5 Å²	171.5	74%	0.736	81%	0.812	S	S	*	*	S	Bend	trans	-112.8	5.9	-178.5	-81.6	177.2	164.8	163.1	-9.9	115.5	E727	E727-R731 IonicContact OE1-CZ 2.72Å; E727-R731 IonicContact OE1-NE 2.83Å; E727-R731 IonicContact OE1-NH1 3.24Å; E727-R731 PolarHBondContact OE1-NH1 3.48Å
732	K	46.1	Very low	43	Very low	191 Å²	191	176.6 Å²	176.6	83%	0.83	82%	0.816	S	S	*	*	S	Bend	trans	-97.7	-10.4	-177.5	-152.5	-178.5	175.7	-168.7	0	114.9
733	E	47.7	Very low	42.1	Very low	188 Å²	188	170 Å²	170	88%	0.879	80%	0.803	S	S	*	*	S	Bend	trans	-104.6	9.3	-176.7	-69.2	-178.9	147.4	0	0	114.4
734	Q	48.2	Very low	41.4	Very low	179 Å²	179	178.5 Å²	178.5	84%	0.836	81%	0.812	S	S	*	*	S	Bend	trans	-130.1	22.6	-172.9	-137.3	178.2	15.1	0	0	114.7
735	R	44.4	Very low	40.9	Very low	241 Å²	241	176 Å²	176	91%	0.909	80%	0.802	S	S	*	*	S	Bend	trans	-137.5	23.1	178.4	-101.3	-170.9	179.7	-159.7	-0.8	116.7
736	E	50.5	Low	39.8	Very low	186 Å²	186	180.6 Å²	180.6	87%	0.869	81%	0.814	S	S	*	*	S	Bend	trans	-112.3	138.1	152.3	-70.8	-168.8	155.8	0	0	109.1
737	K	41.4	Very low	38.7	Very low	208 Å²	208	178.3 Å²	178.3	90%	0.904	82%	0.82	S	S	*	*	S	Bend	trans	68.2	68.3	-173	-54.5	-179.6	-177.4	175.3	0	116.9
738	Q	33.8	Very low	37.9	Very low	199 Å²	199	177.6 Å²	177.6	93%	0.93	84%	0.835	S	S	*	*				-146.2	88.9	128.5	-115.3	177.6	14.6	0	0	111.5
739	R	35.4	Very low	37.1	Very low	243 Å²	243	173.4 Å²	173.4	92%	0.917	83%	0.83	S	S	*	*			trans	-78.3	123.2	152.3	-92.4	179.4	164.7	179.8	-4.2	107
740	S	31.3	Very low	36.5	Very low	112 Å²	112	171.5 Å²	171.5	78%	0.783	83%	0.83	S	S	*	*				153.1	143.9	125.8	59.9	0	0	0	0	115.3
741	K	32.3	Very low	35.9	Very low	176 Å²	176	169.7 Å²	169.7	77%	0.765	83%	0.831	S	S	*	*			trans	63.2	112.7	155.3	-84.8	-176.9	169	-179.2	0	122.3
742	H	29.7	Very low	35.9	Very low	180 Å²	180	166.4 Å²	166.4	83%	0.833	84%	0.835	S	S	*	*			trans	64.1	139.1	141.1	-60.2	-13.2	0	0	0	119
743	G	26.2	Very low	35.7	Very low	66 Å²	66	161 Å²	161	68%	0.68	83%	0.833	S	S	*	*			cis	168.2	171.6	-5.9	0	0	0	0	0	112.3
744	R	27.1	Very low	35.9	Very low	250 Å²	250	155.2 Å²	155.2	94%	0.943	81%	0.813	S	S	*	*			trans	67.4	141.8	176.8	-101.3	-176.8	172.3	168.9	-3.5	114.4
745	V	28.4	Very low	36.4	Very low	103 Å²	103	156 Å²	156	62%	0.624	81%	0.808	S	S	*	*			cis	-139.1	162.7	11.3	167	0	0	0	0	110.2
746	E	27.9	Very low	37.4	Very low	188 Å²	188	147 Å²	147	88%	0.879	78%	0.777	S	S	*	*			trans	-6.6	156	164.8	-61.1	133.5	-155	0	0	120.8
747	G	26	Very low	38.4	Very low	77 Å²	77	145.2 Å²	145.2	79%	0.794	76%	0.762	S	S	*	*			cis	-179.7	177.2	4	0	0	0	0	0	108.3
748	A	28.5	Very low	39.8	Very low	111 Å²	111	140.7 Å²	140.7	92%	0.917	76%	0.755	S	S	*	*			cis	-141	162.4	1.6	0	0	0	0	0	110
749	S	30.2	Very low	41.8	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	73%	0.726	S	S	*	*			trans	-102	165.7	-162.5	58.1	0	0	0	0	116.1
750	E	35.7	Very low	44	Very low	183 Å²	183	126.2 Å²	126.2	86%	0.855	70%	0.699	S	S	*	*			trans	-44.9	146.7	158.7	-60.3	167.8	132.1	0	0	111.8	P752	E750-P752 WeakPolarHBondContact O-CD 3.34Å
751	H	35.1	Very low	46.3	Very low	186 Å²	186	125.9 Å²	125.9	86%	0.861	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-91.8	121.4	-178.8	-76.8	35.5	0	0	0	112.2
752	P	47.2	Very low	48.8	Very low	127 Å²	127	120.4 Å²	120.4	83%	0.825	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-94.1	116.4	168.2	33.5	-28.3	0	0	0	111.3	E750	E750-P752 WeakPolarHBondContact O-CD 3.34Å
753	G	42.2	Very low	51.3	Low	76 Å²	76	114.2 Å²	114.2	78%	0.784	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-85.9	140.9	177.6	0	0	0	0	0	114.1
754	C	53.1	Low	54	Low	67 Å²	67	119.5 Å²	119.5	45%	0.453	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-59.7	134.1	176.5	-80.7	0	0	0	0	113	M756 C792	C754-M756 PolarHBondContact O-N 3.24Å; C754-C792 HydrophobicContact CB-CB 4.07Å; C754-C792 WeakPolarHBondContact CB-SG 3.38Å; C754-C792 WeakPolarHBondContact SG-CB 3.2Å; C754-C792 CovalentContact SG-SG 2.04Å; C754-C792 PolarHBondContact SG-SG 2.94Å
755	R	57.1	Low	56.7	Low	196 Å²	196	108.9 Å²	108.9	74%	0.74	62%	0.62	S	S	*	*			trans	-81.4	107.9	170.9	-103.5	178.9	168.9	177.9	-2.7	110.9	K781	R755-K781 VanDerWaalsContact O-CB 3.28Å; R755-K781 WeakPolarHBondContact O-CB 3.4Å; R755-K781 PolarHBondContact O-N 2.9Å
756	M	67.2	Low	59.3	Low	53 Å²	53	108.9 Å²	108.9	26%	0.261	62%	0.62	S	S	.	*	B	Isolated β-bridge	trans	-82	161.3	168.1	-54.9	-57.2	-73.4	0	0	111.1	C754 M778 V780	C754-M756 PolarHBondContact O-N 3.24Å; M756-M778 HydrophobicContact CB-CG 3.92Å; M756-M778 HydrophobicContact CB-SD 3.82Å; M756-M778 HydrophobicContact CE-CG 3.87Å; M756-M778 WeakPolarHBondContact CE-O 3.39Å; M756-M778 HydrophobicContact CE-SD 4.4Å; M756-M778 HydrophobicContact CG-CG 4.43Å; M756-M778 HydrophobicContact CG-SD 4.08Å; M756-V780 HydrophobicContact CE-CG2 3.85Å; M756-V780 HydrophobicContact SD-CB 4.35Å; M756-V780 HydrophobicContact SD-CG2 3.77Å
757	R	70.4	Confident	61.7	Low	147 Å²	147	105.2 Å²	105.2	56%	0.555	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-75.2	163.6	158	-66.5	-169.4	177.5	-143.5	1.5	109.8	M778 T779 K781	R757-M778 WeakPolarHBondContact O-CE 3.47Å; R757-M778 VanDerWaalsContact O-CG 3.3Å; R757-M778 WeakPolarHBondContact O-CG 3.35Å; R757-T779 PolarHBondContact N-O 3.01Å; R757-K781 HydrophobicContact CG-CB 4.05Å; R757-K781 HydrophobicContact CG-CD 4.48Å; R757-K781 HydrophobicContact CG-CG 4.25Å
758	P	71.3	Confident	63.9	Low	114 Å²	114	109.4 Å²	109.4	74%	0.74	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-58	161.9	163.2	-21	33.9	0	0	0	111.4
759	W	76.3	Confident	66	Low	85 Å²	85	106.4 Å²	106.4	32%	0.322	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-58.7	144.9	169.6	-73.8	110.9	0	0	0	111.1	R776 M778 R795 E797	W759-R776 HydrophobicContact CD2-CG 4.39Å; W759-R776 HydrophobicContact CE3-CB 4.5Å; W759-R776 HydrophobicContact CE3-CG 3.73Å; W759-R776 HydrophobicContact CZ3-CG 4.18Å; W759-M778 HydrophobicContact CB-CE 4.47Å; W759-M778 VanDerWaalsContact CD1-CE 3.44Å; W759-M778 HydrophobicContact CD2-CB 3.76Å; W759-M778 HydrophobicContact CD2-CE 3.84Å; W759-M778 HydrophobicContact CE3-CB 3.47Å; W759-M778 VanDerWaalsContact CE3-CB 3.47Å; W759-M778 HydrophobicContact CG-CB 4.48Å; W759-M778 HydrophobicContact CG-CE 3.67Å; W759-M778 HydrophobicContact CH2-CB 4.01Å; W759-M778 HydrophobicContact CZ2-CB 4.28Å; W759-M778 HydrophobicContact CZ2-CE 4.43Å; W759-M778 HydrophobicContact CZ2-SD 4.48Å; W759-M778 HydrophobicContact CZ3-CB 3.6Å; W759-R795 HydrophobicContact CH2-CB 3.74Å; W759-R795 HydrophobicContact CZ3-CB 4.33Å; W759-E797 HydrophobicContact CH2-CB 3.8Å; W759-E797 HydrophobicContact CZ2-CB 4.49Å; W759-E797 WeakPolarHBondContact CZ2-OE2 3.31Å; W759-E797 HydrophobicContact CZ3-CB 3.88Å
760	S	81.4	Confident	68	Low	52 Å²	52	103.5 Å²	103.5	36%	0.364	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-64.8	165.1	163	69.3	0	0	0	0	111.2	R776 L777	S760-R776 WeakPolarHBondContact OG-CB 3.42Å; S760-L777 PolarHBondContact N-O 3.2Å; S760-L777 PolarHBondContact OG-N 2.95Å
761	S	78.9	Confident	69.8	Low	105 Å²	105	96.1 Å²	96.1	73%	0.734	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-54.8	157.7	156.6	41.9	0	0	0	0	110.7
762	W	84.3	Confident	72.1	Confident	61 Å²	61	87.3 Å²	87.3	23%	0.231	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-68.2	144.4	169.1	-68.7	103.7	0	0	0	110	Q774 R776 E797 R799	W762-Q774 HydrophobicContact CB-CB 4.49Å; W762-Q774 HydrophobicContact CE3-CB 3.99Å; W762-R776 HydrophobicContact CD2-CB 4.16Å; W762-R776 HydrophobicContact CD2-CG 4.04Å; W762-R776 HydrophobicContact CE3-CB 3.91Å; W762-R776 HydrophobicContact CE3-CG 3.82Å; W762-R776 HydrophobicContact CH2-CG 3.87Å; W762-R776 HydrophobicContact CZ2-CG 4.06Å; W762-R776 HydrophobicContact CZ3-CB 4.26Å; W762-R776 HydrophobicContact CZ3-CG 3.74Å; W762-E797 HydrophobicContact CH2-CB 4.23Å; W762-E797 HydrophobicContact CH2-CG 3.91Å; W762-R799 HydrophobicContact CD2-CG 4.38Å; W762-R799 HydrophobicContact CE3-CG 3.98Å; W762-R799 HydrophobicContact CH2-CB 4.01Å; W762-R799 HydrophobicContact CH2-CG 3.84Å; W762-R799 HydrophobicContact CZ2-CG 4.25Å; W762-R799 HydrophobicContact CZ3-CB 4.16Å; W762-R799 HydrophobicContact CZ3-CG 3.69Å
763	S	83.4	Confident	73.8	Confident	50 Å²	50	85 Å²	85	35%	0.35	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-61.4	166.6	166.1	71	0	0	0	0	111.3	Q774 E775	S763-Q774 WeakPolarHBondContact O-CG 3.5Å; S763-Q774 PolarHBondContact O-NE2 2.04Å; S763-Q774 WeakPolarHBondContact OG-CA 3.27Å; S763-E775 PolarHBondContact N-O 2.85Å; S763-E775 PolarHBondContact OG-N 3.25Å
764	E	81.6	Confident	75.6	Confident	177 Å²	177	82.9 Å²	82.9	83%	0.827	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-62.7	159.4	162.8	-64.9	-175.7	170.1	0	0	111
765	C	84.1	Confident	77.2	Confident	28 Å²	28	83.2 Å²	83.2	19%	0.189	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-76.6	129.6	-178.7	-170.3	0	0	0	0	110.2	K767 Q774 C801 N802	C765-K767 PolarHBondContact O-N 3.29Å; C765-K767 PolarHBondContact SG-O 3Å; C765-Q774 HydrophobicContact CB-CG 4.18Å; C765-C801 VanDerWaalsContact CA-SG 3.56Å; C765-C801 HydrophobicContact CB-CB 3.91Å; C765-C801 WeakPolarHBondContact CB-SG 3.07Å; C765-C801 WeakPolarHBondContact SG-CB 3.1Å; C765-C801 CovalentContact SG-SG 2.02Å; C765-C801 PolarHBondContact SG-SG 2.9Å; C765-N802 VanDerWaalsContact SG-CG 3.59Å; C765-N802 PolarHBondContact SG-ND2 3.28Å; C765-N802 VanDerWaalsContact SG-ND2 3.37Å
766	T	82.9	Confident	78.4	Confident	102 Å²	102	76.6 Å²	76.6	63%	0.626	41%	0.414	S	S	*	.	S	Bend	trans	-64.7	-9.8	-176.3	55.1	0	0	0	0	115.6	I773	T766-I773 WeakPolarHBondContact CG2-O 3.25Å; T766-I773 PolarHBondContact N-O 3.5Å; T766-I773 PolarHBondContact OG1-N 3.38Å; T766-I773 PolarHBondContact OG1-O 3.22Å
767	K	77.6	Confident	79.1	Confident	112 Å²	112	78.5 Å²	78.5	49%	0.487	43%	0.425	S	S	.	.			trans	-144.3	149.5	174	-59.5	-170	-165.1	160.4	0	110.4	C765 G771 N802	C765-K767 PolarHBondContact O-N 3.29Å; C765-K767 PolarHBondContact SG-O 3Å; K767-G771 WeakPolarHBondContact CD-O 3.32Å; K767-G771 PolarHBondContact NZ-O 3.25Å; K767-N802 PolarHBondContact O-ND2 3.01Å
768	L	73.8	Confident	79.5	Confident	164 Å²	164	73 Å²	73	86%	0.859	41%	0.406	S	S	*	.	S	Bend	trans	-78.3	-29.3	179.4	-63.8	172.8	0	0	0	113.2	N802	L768-N802 WeakPolarHBondContact O-CB 3.36Å; L768-N802 PolarHBondContact O-ND2 3.28Å
769	C	71.8	Confident	79.6	Confident	48 Å²	48	70.4 Å²	70.4	32%	0.324	39%	0.388	S	S	.	.	S	Bend	trans	-150.9	173.8	175	53.9	0	0	0	0	110	G771 N802 C806	C769-G771 PolarHBondContact O-N 2.05Å; C769-N802 CarbonylContact C-O 3.54Å; C769-C806 HydrophobicContact CB-CB 4Å; C769-C806 WeakPolarHBondContact CB-SG 3.03Å; C769-C806 WeakPolarHBondContact SG-CB 3.12Å; C769-C806 CovalentContact SG-SG 2.03Å; C769-C806 PolarHBondContact SG-SG 2.91Å
770	G	73.1	Confident	79.6	Confident	41 Å²	41	67.4 Å²	67.4	42%	0.423	38%	0.379	S	S	.	.	S	Bend	trans	71.1	27.2	173.8	0	0	0	0	0	115.3	N802 Q804	G770-N802 PolarHBondContact N-O 2.92Å; G770-Q804 PolarHBondContact N-O 3.41Å
771	G	73.9	Confident	78.6	Confident	27 Å²	27	71.7 Å²	71.7	28%	0.278	39%	0.391	S	S	.	.			trans	81	94.9	176.6	0	0	0	0	0	113.7	K767 C769 N802	K767-G771 WeakPolarHBondContact CD-O 3.32Å; K767-G771 PolarHBondContact NZ-O 3.25Å; C769-G771 PolarHBondContact O-N 2.05Å; G771-N802 WeakPolarHBondContact CA-O 3.3Å; G771-N802 PolarHBondContact N-O 2.81Å
772	G	82.2	Confident	77.6	Confident	2 Å²	2	72.7 Å²	72.7	2%	0.021	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-179.4	167.8	0	0	0	0	0	112.7	C801	G772-C801 PolarHBondContact N-O 3.37Å; G772-C801 PolarHBondContact O-N 3.11Å; G772-C801 PolarHBondContact O-SG 2.96Å
773	I	82.3	Confident	76.1	Confident	79 Å²	79	77.3 Å²	77.3	41%	0.405	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.9	-178.1	-63	177.8	0	0	0	110	T766 E775 I798 R799 C801	T766-I773 WeakPolarHBondContact CG2-O 3.25Å; T766-I773 PolarHBondContact N-O 3.5Å; T766-I773 PolarHBondContact OG1-N 3.38Å; T766-I773 PolarHBondContact OG1-O 3.22Å; I773-E775 HydrophobicContact CG2-CG 4.28Å; I773-I798 HydrophobicContact CG2-CG2 3.28Å; I773-R799 WeakPolarHBondContact CA-O 3.36Å; I773-C801 PolarHBondContact N-SG 2.81Å
774	Q	81.3	Confident	74.5	Confident	31 Å²	31	83.2 Å²	83.2	15%	0.145	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.6	167.6	-76.7	-179.2	-17.8	0	0	110.8	W762 S763 C765 I798 R799 C801	W762-Q774 HydrophobicContact CB-CB 4.49Å; W762-Q774 HydrophobicContact CE3-CB 3.99Å; S763-Q774 WeakPolarHBondContact O-CG 3.5Å; S763-Q774 PolarHBondContact O-NE2 2.04Å; S763-Q774 WeakPolarHBondContact OG-CA 3.27Å; C765-Q774 HydrophobicContact CB-CG 4.18Å; Q774-I798 WeakPolarHBondContact O-CA 3.26Å; Q774-R799 HydrophobicContact CB-CG 3.98Å; Q774-R799 PolarHBondContact N-O 3.47Å; Q774-R799 PolarHBondContact O-N 2.03Å; Q774-R799 VanDerWaalsContact OE1-CZ 3.25Å; Q774-C801 HydrophobicContact CG-CB 4.22Å
775	E	85.4	Confident	73	Confident	73 Å²	73	84.8 Å²	84.8	34%	0.341	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.3	-176.8	-48.3	-166.7	136.4	0	0	111.6	S763 I773 K796 E797 I798	S763-E775 PolarHBondContact N-O 2.85Å; S763-E775 PolarHBondContact OG-N 3.25Å; I773-E775 HydrophobicContact CG2-CG 4.28Å; E775-K796 WeakPolarHBondContact OE1-CE 3.46Å; E775-K796 IonicContact OE1-NZ 3.15Å; E775-K796 PolarHBondContact OE1-NZ 3.39Å; E775-K796 WeakPolarHBondContact OE2-CE 3.02Å; E775-K796 IonicContact OE2-NZ 2.79Å; E775-K796 PolarHBondContact OE2-NZ 3.13Å; E775-E797 CarbonylContact C-O 3.54Å; E775-E797 WeakPolarHBondContact CA-O 3.01Å; E775-I798 HydrophobicContact CG-CG1 4.31Å
776	R	83.6	Confident	70.9	Confident	57 Å²	57	90.1 Å²	90.1	22%	0.215	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	157.5	168.3	68.4	174.8	-175.3	-169	-8.1	112.2	W759 S760 W762 K796 E797	W759-R776 HydrophobicContact CD2-CG 4.39Å; W759-R776 HydrophobicContact CE3-CB 4.5Å; W759-R776 HydrophobicContact CE3-CG 3.73Å; W759-R776 HydrophobicContact CZ3-CG 4.18Å; S760-R776 WeakPolarHBondContact OG-CB 3.42Å; W762-R776 HydrophobicContact CD2-CB 4.16Å; W762-R776 HydrophobicContact CD2-CG 4.04Å; W762-R776 HydrophobicContact CE3-CB 3.91Å; W762-R776 HydrophobicContact CE3-CG 3.82Å; W762-R776 HydrophobicContact CH2-CG 3.87Å; W762-R776 HydrophobicContact CZ2-CG 4.06Å; W762-R776 HydrophobicContact CZ3-CB 4.26Å; W762-R776 HydrophobicContact CZ3-CG 3.74Å; R776-K796 WeakPolarHBondContact O-CA 3.33Å; R776-E797 HydrophobicContact CG-CB 3.97Å; R776-E797 IonicContact CZ-OE1 2.72Å; R776-E797 IonicContact CZ-OE2 3.97Å; R776-E797 PolarHBondContact N-O 2.03Å; R776-E797 IonicContact NE-OE2 3.19Å; R776-E797 PolarHBondContact NE-OE2 3.06Å; R776-E797 VanDerWaalsContact NH2-CD 3.31Å; R776-E797 IonicContact NH2-OE1 3.53Å; R776-E797 PolarHBondContact NH2-OE1 3.05Å; R776-E797 IonicContact NH2-OE2 3.13Å; R776-E797 PolarHBondContact NH2-OE2 3.18Å; R776-E797 PolarHBondContact O-N 3.25Å
777	L	81.8	Confident	69.2	Low	93 Å²	93	89.7 Å²	89.7	49%	0.487	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.5	-171.2	-67.8	164.8	0	0	0	111.7	S760 R795 K796	S760-L777 PolarHBondContact N-O 3.2Å; S760-L777 PolarHBondContact OG-N 2.95Å; L777-R795 WeakPolarHBondContact CA-O 3.13Å; L777-K796 HydrophobicContact CD2-CB 3.81Å; L777-K796 HydrophobicContact CD2-CD 4.31Å; L777-K796 HydrophobicContact CD2-CG 3.89Å
778	M	78	Confident	67.8	Low	31 Å²	31	93.4 Å²	93.4	15%	0.153	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	111.2	172.1	174.3	178.8	-79.3	0	0	109.2	M756 R757 W759 D794 R795	M756-M778 HydrophobicContact CB-CG 3.92Å; M756-M778 HydrophobicContact CB-SD 3.82Å; M756-M778 HydrophobicContact CE-CG 3.87Å; M756-M778 WeakPolarHBondContact CE-O 3.39Å; M756-M778 HydrophobicContact CE-SD 4.4Å; M756-M778 HydrophobicContact CG-CG 4.43Å; M756-M778 HydrophobicContact CG-SD 4.08Å; R757-M778 WeakPolarHBondContact O-CE 3.47Å; R757-M778 VanDerWaalsContact O-CG 3.3Å; R757-M778 WeakPolarHBondContact O-CG 3.35Å; W759-M778 HydrophobicContact CB-CE 4.47Å; W759-M778 VanDerWaalsContact CD1-CE 3.44Å; W759-M778 HydrophobicContact CD2-CB 3.76Å; W759-M778 HydrophobicContact CD2-CE 3.84Å; W759-M778 HydrophobicContact CE3-CB 3.47Å; W759-M778 VanDerWaalsContact CE3-CB 3.47Å; W759-M778 HydrophobicContact CG-CB 4.48Å; W759-M778 HydrophobicContact CG-CE 3.67Å; W759-M778 HydrophobicContact CH2-CB 4.01Å; W759-M778 HydrophobicContact CZ2-CB 4.28Å; W759-M778 HydrophobicContact CZ2-CE 4.43Å; W759-M778 HydrophobicContact CZ2-SD 4.48Å; W759-M778 HydrophobicContact CZ3-CB 3.6Å; M778-D794 WeakPolarHBondContact O-CA 3.42Å; M778-R795 HydrophobicContact CB-CB 4.37Å; M778-R795 PolarHBondContact N-O 3.42Å; M778-R795 PolarHBondContact O-N 2.74Å
779	T	74.3	Confident	66.3	Low	60 Å²	60	93.4 Å²	93.4	37%	0.368	49%	0.488	S	S	.	.			trans	-102.1	149.2	-172.9	52.9	0	0	0	0	113.6	R757 K781 D794	R757-T779 PolarHBondContact N-O 3.01Å; T779-K781 PolarHBondContact O-N 3.21Å; T779-D794 WeakPolarHBondContact CA-OD1 3.4Å; T779-D794 HydrophobicContact CG2-CB 4.35Å
780	V	75.1	Confident	65.2	Low	22 Å²	22	96.5 Å²	96.5	13%	0.133	51%	0.51	C	S	.	.	B	Isolated β-bridge	trans	-69.7	127	-179.9	-177.8	0	0	0	0	110.6	M756 K783 D794	M756-V780 HydrophobicContact CE-CG2 3.85Å; M756-V780 HydrophobicContact SD-CB 4.35Å; M756-V780 HydrophobicContact SD-CG2 3.77Å; V780-K783 HydrophobicContact CG1-CG 4.12Å; V780-D794 PolarHBondContact N-OD1 2.97Å
781	K	60.7	Low	64.2	Low	142 Å²	142	99 Å²	99	62%	0.617	52%	0.521	S	S	*	.	S	Bend	trans	-80.2	-26.1	-175.2	-167.1	172	178.2	173.8	0	113.9	R755 R757 T779	R755-K781 VanDerWaalsContact O-CB 3.28Å; R755-K781 WeakPolarHBondContact O-CB 3.4Å; R755-K781 PolarHBondContact O-N 2.9Å; R757-K781 HydrophobicContact CG-CB 4.05Å; R757-K781 HydrophobicContact CG-CD 4.48Å; R757-K781 HydrophobicContact CG-CG 4.25Å; T779-K781 PolarHBondContact O-N 3.21Å
782	Q	57.4	Low	63.3	Low	126 Å²	126	100.4 Å²	100.4	59%	0.589	53%	0.526	S	S	*	.			trans	-156.2	129.5	179.1	-152.8	170.1	14.2	0	0	111.2	F784	Q782-F784 HydrophobicContact CG-CE2 4.46Å
783	K	53.8	Low	62.4	Low	159 Å²	159	107.9 Å²	107.9	69%	0.691	56%	0.558	S	S	*	*			trans	-107.6	119.1	175.6	-71.2	180	179.1	172.6	0	109.9	V780	V780-K783 HydrophobicContact CG1-CG 4.12Å
784	F	50.8	Low	61.9	Low	173 Å²	173	108.1 Å²	108.1	76%	0.759	56%	0.56	S	S	*	*			trans	-86.6	132.6	169.4	-80.4	-87.7	0	0	0	110.3	Q782 T786	Q782-F784 HydrophobicContact CG-CE2 4.46Å; F784-T786 PolarHBondContact O-N 3.07Å
785	K	48.9	Very low	61.7	Low	211 Å²	211	114.2 Å²	114.2	92%	0.917	58%	0.581	S	S	*	*			trans	-86.8	86.6	-179.6	-77.3	-173.2	176.6	-179.1	0	111.7
786	T	40.5	Very low	61.5	Low	139 Å²	139	116 Å²	116	85%	0.853	59%	0.588	S	S	*	*			trans	-148.2	142	149.2	8.4	0	0	0	0	108.9	F784	F784-T786 PolarHBondContact O-N 3.07Å
787	A	46.2	Very low	61.5	Low	94 Å²	94	116.7 Å²	116.7	78%	0.777	59%	0.594	S	S	*	*			trans	-77	164.3	-163.5	0	0	0	0	0	114
788	Q	49.6	Very low	61.7	Low	189 Å²	189	116.8 Å²	116.8	88%	0.883	59%	0.594	S	S	*	*			trans	77.4	64.8	170.1	-57.1	-173.7	-20.4	0	0	117.5
789	L	42	Very low	61.9	Low	165 Å²	165	120.9 Å²	120.9	86%	0.864	61%	0.607	S	S	*	*			trans	-155.5	120.1	141	-104.3	148.4	0	0	0	109.1	S791	L789-S791 VanDerWaalsContact C-N 3.28Å; L789-S791 PolarHBondContact O-N 2.95Å
790	S	49.1	Very low	62.2	Low	113 Å²	113	121.5 Å²	121.5	79%	0.79	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	10.5	-165.8	48.3	0	0	0	0	115.6
791	S	50.5	Low	62.4	Low	93 Å²	93	121.1 Å²	121.1	65%	0.65	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	-13.9	-159.1	-158.7	0	0	0	0	116.4	L789 K793	L789-S791 VanDerWaalsContact C-N 3.28Å; L789-S791 PolarHBondContact O-N 2.95Å; S791-K793 PolarHBondContact O-N 2.96Å
792	C	55.6	Low	63.2	Low	56 Å²	56	117.7 Å²	117.7	38%	0.378	61%	0.605	S	S	.	*			trans	-94.3	74	177.8	-57.4	0	0	0	0	111.8	C754	C754-C792 HydrophobicContact CB-CB 4.07Å; C754-C792 WeakPolarHBondContact CB-SG 3.38Å; C754-C792 WeakPolarHBondContact SG-CB 3.2Å; C754-C792 CovalentContact SG-SG 2.04Å; C754-C792 PolarHBondContact SG-SG 2.94Å
793	K	64.1	Low	64	Low	159 Å²	159	117 Å²	117	69%	0.691	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-100.9	153.7	168.6	-63.5	-175.8	-178	-179	0	110.4	S791	S791-K793 PolarHBondContact O-N 2.96Å
794	D	71.9	Confident	64.4	Low	84 Å²	84	116.6 Å²	116.6	45%	0.449	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-63.6	140.9	171.1	-53.1	-56	0	0	0	109.4	M778 T779 V780	M778-D794 WeakPolarHBondContact O-CA 3.42Å; T779-D794 WeakPolarHBondContact CA-OD1 3.4Å; T779-D794 HydrophobicContact CG2-CB 4.35Å; V780-D794 PolarHBondContact N-OD1 2.97Å
795	R	76.3	Confident	64.8	Low	159 Å²	159	113.4 Å²	113.4	60%	0.6	61%	0.607	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.2	138.2	-178.2	-62.2	-175.7	177.9	-166.7	-2.2	109.9	W759 L777 M778	W759-R795 HydrophobicContact CH2-CB 3.74Å; W759-R795 HydrophobicContact CZ3-CB 4.33Å; L777-R795 WeakPolarHBondContact CA-O 3.13Å; M778-R795 HydrophobicContact CB-CB 4.37Å; M778-R795 PolarHBondContact N-O 3.42Å; M778-R795 PolarHBondContact O-N 2.74Å
796	K	81.4	Confident	65.1	Low	112 Å²	112	110 Å²	110	49%	0.487	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119	133	174.4	-177.6	176.2	174.6	177.7	0	108.2	E775 R776 L777 I798	E775-K796 WeakPolarHBondContact OE1-CE 3.46Å; E775-K796 IonicContact OE1-NZ 3.15Å; E775-K796 PolarHBondContact OE1-NZ 3.39Å; E775-K796 WeakPolarHBondContact OE2-CE 3.02Å; E775-K796 IonicContact OE2-NZ 2.79Å; E775-K796 PolarHBondContact OE2-NZ 3.13Å; R776-K796 WeakPolarHBondContact O-CA 3.33Å; L777-K796 HydrophobicContact CD2-CB 3.81Å; L777-K796 HydrophobicContact CD2-CD 4.31Å; L777-K796 HydrophobicContact CD2-CG 3.89Å; K796-I798 HydrophobicContact CD-CD1 4.43Å; K796-I798 HydrophobicContact CG-CG1 4.26Å
797	E	83.2	Confident	66.4	Low	70 Å²	70	108.6 Å²	108.6	33%	0.327	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.3	141.9	177.3	-164	-176.5	163.7	0	0	108.4	W759 W762 E775 R776	W759-E797 HydrophobicContact CH2-CB 3.8Å; W759-E797 HydrophobicContact CZ2-CB 4.49Å; W759-E797 WeakPolarHBondContact CZ2-OE2 3.31Å; W759-E797 HydrophobicContact CZ3-CB 3.88Å; W762-E797 HydrophobicContact CH2-CB 4.23Å; W762-E797 HydrophobicContact CH2-CG 3.91Å; E775-E797 CarbonylContact C-O 3.54Å; E775-E797 WeakPolarHBondContact CA-O 3.01Å; R776-E797 HydrophobicContact CG-CB 3.97Å; R776-E797 IonicContact CZ-OE1 2.72Å; R776-E797 IonicContact CZ-OE2 3.97Å; R776-E797 PolarHBondContact N-O 2.03Å; R776-E797 IonicContact NE-OE2 3.19Å; R776-E797 PolarHBondContact NE-OE2 3.06Å; R776-E797 VanDerWaalsContact NH2-CD 3.31Å; R776-E797 IonicContact NH2-OE1 3.53Å; R776-E797 PolarHBondContact NH2-OE1 3.05Å; R776-E797 IonicContact NH2-OE2 3.13Å; R776-E797 PolarHBondContact NH2-OE2 3.18Å; R776-E797 PolarHBondContact O-N 3.25Å
798	I	85.8	Confident	67.4	Low	96 Å²	96	109.3 Å²	109.3	49%	0.492	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.1	133.5	-169.4	-57.6	179.7	0	0	0	107.6	I773 Q774 E775 K796	I773-I798 HydrophobicContact CG2-CG2 3.28Å; Q774-I798 WeakPolarHBondContact O-CA 3.26Å; E775-I798 HydrophobicContact CG-CG1 4.31Å; K796-I798 HydrophobicContact CD-CD1 4.43Å; K796-I798 HydrophobicContact CG-CG1 4.26Å
799	R	82.8	Confident	68.4	Low	116 Å²	116	104.9 Å²	104.9	44%	0.438	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.7	152.4	175.3	71.1	178.7	-176.3	171.4	2.4	111.7	W762 I773 Q774	W762-R799 HydrophobicContact CD2-CG 4.38Å; W762-R799 HydrophobicContact CE3-CG 3.98Å; W762-R799 HydrophobicContact CH2-CB 4.01Å; W762-R799 HydrophobicContact CH2-CG 3.84Å; W762-R799 HydrophobicContact CZ2-CG 4.25Å; W762-R799 HydrophobicContact CZ3-CB 4.16Å; W762-R799 HydrophobicContact CZ3-CG 3.69Å; I773-R799 WeakPolarHBondContact CA-O 3.36Å; Q774-R799 HydrophobicContact CB-CG 3.98Å; Q774-R799 PolarHBondContact N-O 3.47Å; Q774-R799 PolarHBondContact O-N 2.03Å; Q774-R799 VanDerWaalsContact OE1-CZ 3.25Å
800	A	80	Confident	70	Confident	74 Å²	74	101.4 Å²	101.4	61%	0.612	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.5	149.9	169.4	0	0	0	0	0	111	V803	A800-V803 HydrophobicContact CB-CG2 4.39Å
801	C	79.3	Confident	71.3	Confident	13 Å²	13	100.6 Å²	100.6	9%	0.088	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	161.9	175.2	51.2	0	0	0	0	109.5	C765 G772 I773 Q774 V803	C765-C801 VanDerWaalsContact CA-SG 3.56Å; C765-C801 HydrophobicContact CB-CB 3.91Å; C765-C801 WeakPolarHBondContact CB-SG 3.07Å; C765-C801 WeakPolarHBondContact SG-CB 3.1Å; C765-C801 CovalentContact SG-SG 2.02Å; C765-C801 PolarHBondContact SG-SG 2.9Å; G772-C801 PolarHBondContact N-O 3.37Å; G772-C801 PolarHBondContact O-N 3.11Å; G772-C801 PolarHBondContact O-SG 2.96Å; I773-C801 PolarHBondContact N-SG 2.81Å; Q774-C801 HydrophobicContact CG-CB 4.22Å; C801-V803 VanDerWaalsContact C-N 3.3Å; C801-V803 PolarHBondContact O-N 3.43Å
802	N	77.8	Confident	72.7	Confident	70 Å²	70	101.1 Å²	101.1	37%	0.374	53%	0.53	S	S	.	.			trans	51.1	45.9	175	-59.3	-5.4	0	0	0	113.5	C765 K767 L768 C769 G770 G771 Q804	C765-N802 VanDerWaalsContact SG-CG 3.59Å; C765-N802 PolarHBondContact SG-ND2 3.28Å; C765-N802 VanDerWaalsContact SG-ND2 3.37Å; K767-N802 PolarHBondContact O-ND2 3.01Å; L768-N802 WeakPolarHBondContact O-CB 3.36Å; L768-N802 PolarHBondContact O-ND2 3.28Å; C769-N802 CarbonylContact C-O 3.54Å; G770-N802 PolarHBondContact N-O 2.92Å; G771-N802 WeakPolarHBondContact CA-O 3.3Å; G771-N802 PolarHBondContact N-O 2.81Å; N802-Q804 PolarHBondContact O-N 3.37Å
803	V	74.6	Confident	73.9	Confident	113 Å²	113	104.4 Å²	104.4	69%	0.685	54%	0.541	S	S	*	.			trans	-78.4	-1.2	-175.1	-145.6	0	0	0	0	113.4	A800 C801	A800-V803 HydrophobicContact CB-CG2 4.39Å; C801-V803 VanDerWaalsContact C-N 3.3Å; C801-V803 PolarHBondContact O-N 3.43Å
804	Q	62.8	Low	74.6	Confident	150 Å²	150	100.2 Å²	100.2	70%	0.701	53%	0.529	S	S	*	.	S	Bend	trans	-68.6	146.9	169.9	-66	-68.3	-6.9	0	0	109.9	G770 N802	G770-Q804 PolarHBondContact N-O 3.41Å; N802-Q804 PolarHBondContact O-N 3.37Å
805	P	59.4	Low	74.9	Confident	105 Å²	105	101.5 Å²	101.5	68%	0.682	54%	0.536	S	S	*	.			trans	-60.2	148.2	174.8	26.2	-33.5	0	0	0	111.6
806	C	55.1	Low	74.7	Confident	140 Å²	140	96.3 Å²	96.3	95%	0.946	53%	0.53	S	S	*	.			trans	-79.7	0	153.7	-53.6	0	0	0	0	108	C769	C769-C806 HydrophobicContact CB-CB 4Å; C769-C806 WeakPolarHBondContact CB-SG 3.03Å; C769-C806 WeakPolarHBondContact SG-CB 3.12Å; C769-C806 CovalentContact SG-SG 2.03Å; C769-C806 PolarHBondContact SG-SG 2.91Å

Retrieved 806 of 806 residues in 823.7 ms (Link to these results)

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