A0A077ZKH1_TRITR Loading...

Trypsin domain containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A077ZKH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,171 aa.

						>A0A077ZKH1_TRITR|A0A077ZKH1
MLYANKELRNSIPIKRENRSPEAQNAQNVYTSSLGSMLLAIMPLFSPTITSQCGEPAKYGGQSIQAYLDSKSEVLPWTVAIRGKFGNFKCLGSIIPENDPDGRHRNFSRLILTAGSCFRHVLQKRWGTPSSYTVFARLDRFRLFGIRGQSGQPKGIRIMPYNAVNEKIWNGVALVTLKKPFVFNKELSPVCVKTVYAIPPDTSKCFVSTYHKKRMDEELVRMVPGSVCNFGHFPELAKTKGICSTHDRAETEKSLGGPLVCLVGGRAYQFGIYLSELITREAFSFQKQSLHFYGHVATVLDKSPANAFRFIELGLSQKPSSSKKSSGSSEEKPHQDCKPSPGGKPQKPGKPARPPCSGPTKPAQPAPPAQRKPVYCGDTATFGRTVESYVTGNNAQDMFPWNVIITSKIMGSTKCIGSLVHRGGYQQIANTSDFIITAADCFANLYGLRWGNNETRRGIAILKLERPLSREDNVVPVCLAERGSVPPPFASCYVTHYDKREHRMDEEIVMITRNAHCLAAGSKAPEYRGVCAIEEKKKQYIQLGAPMICLVKGRAYQYGVYLNQLSLKINEKVKQNLGFYSEINVVHDVFSGKKVQTLSEKVGRQPGVKPLKPIQASSSSSSSASREIDKRRSGLFPDLYIPLATIPPSISRPGQKRSKSSSSSSSSSDSSSAYVTASREVRNNTKSAEEADDSTRVIRLNVKVVKTRLASLLRSYKAKQPHHSGSSSSSLGEEIKPYPPPGEPKRPVICPKPGQKPTKPAPGSSSGVLICPTPDNAIEIVPLPTPLPTAEYPSSSLEAVNMVILPSLPKYDMSNQTIADHEHILVRDNIVGESAIAKGHTASCDIIGAGNSMHSLLPGKSSGEIIGNEIDSRIPDATGALITEPCKGRNSTEHHQYEHLPGASGVHIFMISGSSIEPLCTGTLYAKRGQAYSDEVVTASRCVPPSGGSNYRVYVGSLLPRRMAVDQLNRTLIEVGSIYTTPFYEGYDELKEVGMTVLKLKHRVKVISGVQSFPLPYSGTGASSRMXCYVSGVCQHGMPVRIQYQLLTPTECKQHLGDKFLPSVMYCGVGRKNVLQYPVGSPLLCQSSGSWVQFGIYDHSFTARHSYATGESENELPPEDVALFVKLEGDNAGQMALAGALAERKNADRFNFEQRLISSPDMEMLEGTTIL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	34.9	Very low	34	Very low	250 Å²	250	171.3 Å²	171.3	100%	1.232	85%	0.848	S	S	*	*				0	113.1	0	-72.6	-161	-158.4	0	0	107.7
2	L	26.5	Very low	34	Very low	163 Å²	163	170.8 Å²	170.8	85%	0.853	85%	0.848	S	S	*	*			trans	-108.3	169.4	-169.5	-85.2	153.8	0	0	0	109.9
3	Y	32.3	Very low	34.1	Very low	230 Å²	230	165.4 Å²	165.4	90%	0.902	83%	0.833	S	S	*	*			trans	86.4	127	-178.5	-63.8	-85.5	0	0	0	114.7
4	A	35.1	Very low	34	Very low	77 Å²	77	164.6 Å²	164.6	64%	0.636	83%	0.83	S	S	*	*			cis	-171.5	139.1	-11.4	0	0	0	0	0	105.2
5	N	40.9	Very low	34.1	Very low	172 Å²	172	167.1 Å²	167.1	92%	0.92	83%	0.833	S	S	*	*			trans	-167.9	109.9	131.3	-102.3	-39.9	0	0	0	110.4
6	K	33.8	Very low	33.9	Very low	176 Å²	176	170.8 Å²	170.8	77%	0.765	84%	0.835	S	S	*	*			trans	-100	146	170.3	-155.5	-166.2	178.8	-161.1	0	106.2
7	E	35.1	Very low	34.1	Very low	152 Å²	152	172.1 Å²	172.1	71%	0.71	84%	0.839	S	S	*	*			trans	86.5	96.6	159.1	-49.2	-158.3	177.4	0	0	119.2
8	L	32.8	Very low	34	Very low	184 Å²	184	170.2 Å²	170.2	96%	0.963	83%	0.833	S	S	*	*				-154.8	86.5	122.2	-105.3	144	0	0	0	108.4
9	R	30.9	Very low	34.1	Very low	236 Å²	236	173.9 Å²	173.9	89%	0.891	84%	0.837	S	S	*	*			trans	-105.8	126.4	160.8	-92.3	-170.9	-171.8	-164.6	3.4	107.7
10	N	36.5	Very low	34.2	Very low	151 Å²	151	171.3 Å²	171.3	81%	0.807	84%	0.838	S	S	*	*			trans	-170.7	96.4	139.2	-93.6	-10.3	0	0	0	105
11	S	34.9	Very low	34.3	Very low	93 Å²	93	168.4 Å²	168.4	65%	0.65	83%	0.832	S	S	*	*				94.4	115.8	81.5	57.5	0	0	0	0	110.6
12	I	34.8	Very low	34.4	Very low	165 Å²	165	165.9 Å²	165.9	85%	0.846	82%	0.817	S	S	*	*				-170.9	134.8	116.8	-83.7	147.2	0	0	0	108.8
13	P	35.2	Very low	34.7	Very low	101 Å²	101	161.6 Å²	161.6	66%	0.656	81%	0.805	S	S	*	*			trans	-110.1	158.2	-166.6	11.7	13.2	0	0	0	115
14	I	32	Very low	34.9	Very low	154 Å²	154	159.4 Å²	159.4	79%	0.79	80%	0.803	S	S	*	*			trans	60.2	119.7	134.9	-54.9	163.2	0	0	0	119
15	K	36.2	Very low	34.9	Very low	202 Å²	202	163.4 Å²	163.4	88%	0.878	81%	0.814	S	S	*	*				-161.3	121.3	110.2	-106	-179.5	-177.8	-174.7	0	113
16	R	30.6	Very low	34.6	Very low	226 Å²	226	158.7 Å²	158.7	85%	0.853	80%	0.799	S	S	*	*			trans	-71.8	146.3	161.3	-79	173.5	166.4	163.3	-5.2	109.1
17	E	37.4	Very low	34.7	Very low	194 Å²	194	158.5 Å²	158.5	91%	0.907	80%	0.801	S	S	*	*			trans	-147.9	131.2	139.4	-159.1	118.3	-146.3	0	0	109.9
18	N	32.3	Very low	34.7	Very low	137 Å²	137	157.5 Å²	157.5	73%	0.733	80%	0.8	S	S	*	*			trans	-81.1	151.9	-179.5	-72.4	-39.2	0	0	0	111.3
19	R	36.3	Very low	34.8	Very low	242 Å²	242	153.9 Å²	153.9	91%	0.913	79%	0.786	S	S	*	*				157.3	113.9	113.1	-90.4	-177.6	177.5	173.2	-0	112.6
20	S	34.8	Very low	35.1	Very low	121 Å²	121	152.4 Å²	152.4	85%	0.846	78%	0.782	S	S	*	*				44.2	147	128.8	-146.3	0	0	0	0	123.6
21	P	38.2	Very low	35.1	Very low	110 Å²	110	150.5 Å²	150.5	71%	0.714	78%	0.776	S	S	*	*			trans	-111.7	168.2	-168.3	41.9	-28.2	0	0	0	114.5
22	E	35	Very low	35.1	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	78%	0.782	S	S	*	*			trans	173.5	159.9	159.9	-104	175.5	171.2	0	0	106.5
23	A	33.3	Very low	35.3	Very low	74 Å²	74	148 Å²	148	61%	0.612	77%	0.773	S	S	*	*			cis	-169.4	169.3	-37.5	0	0	0	0	0	104.8
24	Q	36.8	Very low	35.5	Very low	183 Å²	183	151.3 Å²	151.3	86%	0.855	78%	0.784	S	S	*	*			trans	80.8	104.8	152.8	-63.4	170.9	5.9	0	0	120.9
25	N	34.7	Very low	35.9	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	79%	0.786	S	S	*	*				66.9	138.1	110.7	-112.8	3.5	0	0	0	123.7
26	A	36.2	Very low	36.1	Very low	73 Å²	73	143.8 Å²	143.8	60%	0.603	78%	0.783	S	S	*	*			trans	85.1	103.3	139.5	0	0	0	0	0	121.1
27	Q	34.7	Very low	36.7	Very low	173 Å²	173	141.1 Å²	141.1	81%	0.808	78%	0.782	S	S	*	*				61.1	133.9	117.7	-77.9	170.5	-22.1	0	0	122.4
28	N	35.2	Very low	36.9	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	78%	0.78	S	S	*	*			trans	90.7	101.1	138.9	-73.1	-5.5	0	0	0	121.4
29	V	35.9	Very low	37.3	Very low	109 Å²	109	140.6 Å²	140.6	66%	0.661	78%	0.784	S	S	*	*				70.2	130	98.5	170.4	0	0	0	0	120.1
30	Y	35.9	Very low	37.5	Very low	205 Å²	205	133.1 Å²	133.1	80%	0.804	77%	0.774	S	S	*	*			trans	90.6	108	150.5	-81.4	-48.1	0	0	0	123.1
31	T	36.4	Very low	38.1	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	78%	0.775	S	S	*	*				68.3	127.7	126.4	46.9	0	0	0	0	125
32	S	35.3	Very low	38	Very low	113 Å²	113	138.1 Å²	138.1	79%	0.79	78%	0.78	S	S	*	*			trans	65.5	140.9	135.8	74.9	0	0	0	0	117.4
33	S	39	Very low	38.3	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	77%	0.773	S	S	*	*			cis	-176.8	140.7	41.6	-179.9	0	0	0	0	110.3
34	L	39.4	Very low	38.6	Very low	171 Å²	171	138.2 Å²	138.2	90%	0.895	78%	0.782	S	S	*	*			trans	52.3	127.1	143	-64.8	166.6	0	0	0	123.1
35	G	40.3	Very low	38.5	Very low	81 Å²	81	139.2 Å²	139.2	84%	0.835	78%	0.784	S	S	*	*			trans	-166.7	119.4	157	0	0	0	0	0	111.6
36	S	41	Very low	38.4	Very low	116 Å²	116	136.5 Å²	136.5	81%	0.811	78%	0.778	S	S	*	*			trans	-81.6	165.2	-160.5	-86.4	0	0	0	0	118.9
37	M	42.3	Very low	38.3	Very low	170 Å²	170	138.6 Å²	138.6	84%	0.837	79%	0.786	S	S	*	*			trans	81.1	112.8	143.6	-91.9	-173.9	173.3	0	0	120.6
38	L	41.7	Very low	38.3	Very low	166 Å²	166	136.5 Å²	136.5	87%	0.869	78%	0.784	S	S	*	*				-173.6	163	97.7	-113.6	122.2	0	0	0	113.2
39	L	41.9	Very low	38.5	Very low	155 Å²	155	138 Å²	138	81%	0.812	79%	0.791	S	S	*	*			trans	-84.3	153.9	-150.8	-83.6	138.3	0	0	0	118.4
40	A	39.9	Very low	38.9	Very low	85 Å²	85	137 Å²	137	70%	0.702	79%	0.785	S	S	*	*			trans	74.4	107.1	138.3	0	0	0	0	0	120.8
41	I	47.1	Very low	39.9	Very low	167 Å²	167	129.1 Å²	129.1	86%	0.856	76%	0.76	S	S	*	*				-169.7	115	118.6	-83	145.4	0	0	0	107.5
42	M	37	Very low	41.8	Very low	169 Å²	169	127.6 Å²	127.6	83%	0.833	75%	0.745	S	S	*	*			trans	-80.1	143.7	172.3	-87.3	-111.9	175.8	0	0	110.9
43	P	41.4	Very low	44.3	Very low	119 Å²	119	123 Å²	123	77%	0.773	71%	0.712	S	S	*	*				-124.2	121.8	128.7	32.8	-22.7	0	0	0	111.1
44	L	39	Very low	46.7	Very low	153 Å²	153	118.6 Å²	118.6	80%	0.801	68%	0.682	S	S	*	*			trans	-13	121.7	159.9	-69	150.3	0	0	0	116.5	S46	L44-S46 PolarHBondContact O-N 3.5Å
45	F	33.6	Very low	49.1	Very low	204 Å²	204	112.6 Å²	112.6	90%	0.895	65%	0.649	S	S	*	*			trans	-44.1	118.7	156.2	-80.3	-103.4	0	0	0	111.3
46	S	33.4	Very low	51.5	Low	105 Å²	105	108.9 Å²	108.9	73%	0.734	61%	0.61	S	S	*	*			trans	-108.8	126.8	156	-75.3	0	0	0	0	108.3	L44 T48	L44-S46 PolarHBondContact O-N 3.5Å; S46-T48 PolarHBondContact O-N 3.26Å
47	P	34.7	Very low	53.8	Low	117 Å²	117	106.3 Å²	106.3	76%	0.76	60%	0.596	S	S	*	*			trans	-68.1	124	175.3	28.9	-30.4	0	0	0	108.1	I49	P47-I49 PolarHBondContact O-N 3.28Å
48	T	34.9	Very low	55.9	Low	128 Å²	128	103.9 Å²	103.9	79%	0.785	58%	0.581	S	S	*	*			trans	-58.5	108.8	170.6	35.8	0	0	0	0	108.9	S46 T50	S46-T48 PolarHBondContact O-N 3.26Å; T48-T50 PolarHBondContact O-N 2.74Å
49	I	38.8	Very low	58	Low	161 Å²	161	97.7 Å²	97.7	83%	0.826	55%	0.546	S	S	*	.			trans	-64.4	100.8	179	-63.6	171.8	0	0	0	107.7	P47	P47-I49 PolarHBondContact O-N 3.28Å
50	T	45.1	Very low	60.1	Low	90 Å²	90	93 Å²	93	55%	0.552	54%	0.536	S	S	*	.			trans	-78.2	131.2	-177.9	40.2	0	0	0	0	110.6	T48 Q52	T48-T50 PolarHBondContact O-N 2.74Å; T50-Q52 PolarHBondContact O-N 3.33Å
51	S	55.5	Low	62.4	Low	38 Å²	38	89.8 Å²	89.8	27%	0.266	51%	0.511	S	S	.	.			trans	-53.6	124.8	178.5	61.2	0	0	0	0	112.5	C53 H104 R266	S51-C53 VanDerWaalsContact C-N 3.32Å; S51-C53 PolarHBondContact O-N 3.35Å; S51-H104 WeakPolarHBondContact CA-NE2 3.38Å; S51-H104 WeakPolarHBondContact CB-NE2 3.48Å; S51-R266 PolarHBondContact O-NH1 2.76Å; S51-R266 VanDerWaalsContact O-NH1 3.14Å; S51-R266 PolarHBondContact O-NH2 2.87Å; S51-R266 PolarHBondContact OG-NH1 3.3Å
52	Q	76.1	Confident	64.4	Low	80 Å²	80	85.7 Å²	85.7	37%	0.374	49%	0.488	S	S	.	.			trans	-85	19.5	-172.4	-61.9	-176.1	1.6	0	0	115.2	T50 K58 Y59	T50-Q52 PolarHBondContact O-N 3.33Å; Q52-K58 HydrophobicContact CB-CB 4.41Å; Q52-Y59 HydrophobicContact CB-CE2 4.47Å; Q52-Y59 WeakPolarHBondContact O-CE2 3.28Å; Q52-Y59 PolarHBondContact O-OH 3.46Å
53	C	89.2	Confident	66.9	Low	15 Å²	15	80.8 Å²	80.8	10%	0.101	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	161.7	175	58.7	0	0	0	0	111.3	S51 E55 P96 P189 C191	S51-C53 VanDerWaalsContact C-N 3.32Å; S51-C53 PolarHBondContact O-N 3.35Å; C53-E55 PolarHBondContact O-N 3.26Å; C53-E55 VanDerWaalsContact O-N 3.1Å; C53-P96 HydrophobicContact CB-CG 4.36Å; C53-P189 HydrophobicContact CB-CG 4.31Å; C53-C191 VanDerWaalsContact CA-SG 3.56Å; C53-C191 HydrophobicContact CB-CB 4.01Å; C53-C191 WeakPolarHBondContact CB-SG 3.48Å; C53-C191 PolarHBondContact O-SG 3.17Å; C53-C191 WeakPolarHBondContact SG-CA 3.32Å; C53-C191 WeakPolarHBondContact SG-CB 3.29Å; C53-C191 CovalentContact SG-SG 2.03Å; C53-C191 PolarHBondContact SG-SG 2.69Å
54	G	88.5	Confident	69.1	Low	0 Å²	0	75.8 Å²	75.8	0%	0	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	11.3	170.6	0	0	0	0	0	115.2	I64 P189 A267	G54-I64 VanDerWaalsContact O-CD1 3.26Å; G54-I64 WeakPolarHBondContact O-CD1 3.42Å; G54-P189 PolarHBondContact N-O 3.32Å; G54-A267 WeakPolarHBondContact CA-O 3.23Å; G54-A267 PolarHBondContact O-N 2.68Å
55	E	90.8	Very high	71.3	Confident	46 Å²	46	72.8 Å²	72.8	22%	0.215	42%	0.419	C	S	.	.			trans	-135.4	88.4	178.5	-72.5	176.5	-126.1	0	0	109.4	C53 A57 K58 R266	C53-E55 PolarHBondContact O-N 3.26Å; C53-E55 VanDerWaalsContact O-N 3.1Å; E55-A57 PolarHBondContact O-N 2.99Å; E55-A57 VanDerWaalsContact O-N 3.16Å; E55-K58 HydrophobicContact CB-CG 3.82Å; E55-K58 WeakPolarHBondContact O-CB 3.47Å; E55-K58 PolarHBondContact O-N 3.2Å; E55-K58 WeakPolarHBondContact OE2-CE 3.42Å; E55-R266 HydrophobicContact CG-CB 4.36Å; E55-R266 HydrophobicContact CG-CG 4.22Å; E55-R266 IonicContact OE1-CZ 2.7Å; E55-R266 IonicContact OE1-NE 2.7Å; E55-R266 PolarHBondContact OE1-NE 3.42Å; E55-R266 IonicContact OE1-NH2 2.94Å; E55-R266 PolarHBondContact OE1-NH2 3.29Å
56	P	90.4	Very high	73.9	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.013	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29.2	-175.7	-23.2	33.2	0	0	0	113.9	K58 Y59 G60 G61 Q62 I64 Y67 P76 W77	P56-K58 PolarHBondContact O-N 3.17Å; P56-K58 VanDerWaalsContact O-N 3.16Å; P56-Y59 PolarHBondContact O-N 3.26Å; P56-G60 PolarHBondContact O-N 3.39Å; P56-G61 WeakPolarHBondContact O-CA 3.24Å; P56-G61 PolarHBondContact O-N 2.92Å; P56-Q62 WeakPolarHBondContact CB-O 3.41Å; P56-I64 HydrophobicContact CG-CG1 4.26Å; P56-Y67 HydrophobicContact CB-CE2 3.76Å; P56-Y67 HydrophobicContact CG-CD2 4.36Å; P56-Y67 HydrophobicContact CG-CE2 3.99Å; P56-P76 HydrophobicContact CB-CG 3.87Å; P56-P76 HydrophobicContact CG-CG 3.58Å; P56-W77 HydrophobicContact CG-CH2 4.47Å; P56-W77 HydrophobicContact CG-CZ3 3.84Å
57	A	88.4	Confident	76.5	Confident	63 Å²	63	59.9 Å²	59.9	52%	0.521	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-55.7	-29.4	175.1	0	0	0	0	0	113.2	E55 Y59 G60 G61	E55-A57 PolarHBondContact O-N 2.99Å; E55-A57 VanDerWaalsContact O-N 3.16Å; A57-Y59 PolarHBondContact O-N 3.3Å; A57-G60 PolarHBondContact O-N 3.19Å; A57-G61 WeakPolarHBondContact CA-O 3.23Å
58	K	86.6	Confident	78.9	Confident	119 Å²	119	56.4 Å²	56.4	52%	0.517	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-68.2	-19.5	176.3	-61.9	-65.1	-177.1	-177.7	0	113.3	Q52 E55 P56	Q52-K58 HydrophobicContact CB-CB 4.41Å; E55-K58 HydrophobicContact CB-CG 3.82Å; E55-K58 WeakPolarHBondContact O-CB 3.47Å; E55-K58 PolarHBondContact O-N 3.2Å; E55-K58 WeakPolarHBondContact OE2-CE 3.42Å; P56-K58 PolarHBondContact O-N 3.17Å; P56-K58 VanDerWaalsContact O-N 3.16Å
59	Y	86.3	Confident	81.3	Confident	35 Å²	35	55.7 Å²	55.7	14%	0.137	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-105.3	12.5	175.7	-57.1	-86	0	0	0	112.8	Q52 P56 A57 F183 N184 K185 S188 P189	Q52-Y59 HydrophobicContact CB-CE2 4.47Å; Q52-Y59 WeakPolarHBondContact O-CE2 3.28Å; Q52-Y59 PolarHBondContact O-OH 3.46Å; P56-Y59 PolarHBondContact O-N 3.26Å; A57-Y59 PolarHBondContact O-N 3.3Å; Y59-F183 HydrophobicContact CD1-CB 3.61Å; Y59-F183 HydrophobicContact CD1-CG 4.47Å; Y59-F183 HydrophobicContact CE1-CB 3.72Å; Y59-F183 AromaticContact CE1-CD2 3.81Å; Y59-F183 HydrophobicContact CE1-CD2 3.81Å; Y59-F183 HydrophobicContact CE1-CG 4.14Å; Y59-F183 HydrophobicContact CG-CB 4.33Å; Y59-N184 CarbonylContact O-C 3.5Å; Y59-N184 VanDerWaalsContact O-C 3.26Å; Y59-K185 WeakPolarHBondContact O-CA 3.5Å; Y59-K185 PolarHBondContact O-N 3.36Å; Y59-K185 VanDerWaalsContact O-N 3.08Å; Y59-S188 VanDerWaalsContact CD2-CB 3.43Å; Y59-P189 HydrophobicContact CE2-CG 4.49Å
60	G	85.9	Confident	83.4	Confident	57 Å²	57	49.3 Å²	49.3	59%	0.588	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	12.5	-176.5	0	0	0	0	0	114.6	P56 A57 K185	P56-G60 PolarHBondContact O-N 3.39Å; A57-G60 PolarHBondContact O-N 3.19Å; G60-K185 WeakPolarHBondContact O-CB 3.47Å
61	G	87	Confident	84.9	Confident	17 Å²	17	53.3 Å²	53.3	18%	0.175	30%	0.299	C	S	.	.			trans	-81.9	-178.8	173.2	0	0	0	0	0	113	P56 A57 K185	P56-G61 WeakPolarHBondContact O-CA 3.24Å; P56-G61 PolarHBondContact O-N 2.92Å; A57-G61 WeakPolarHBondContact CA-O 3.23Å; G61-K185 WeakPolarHBondContact CA-O 3.02Å
62	Q	88.9	Confident	85.9	Confident	82 Å²	82	54.5 Å²	54.5	38%	0.383	31%	0.308	S	S	.	.			trans	-76.2	170.3	177.8	-47.9	-164.1	32.2	0	0	111.8	P56 A66 Y67 E73	P56-Q62 WeakPolarHBondContact CB-O 3.41Å; Q62-A66 HydrophobicContact CB-CB 3.83Å; Q62-Y67 HydrophobicContact CB-CD2 4.16Å; Q62-Y67 HydrophobicContact CB-CE2 3.74Å; Q62-Y67 HydrophobicContact CG-CE2 4.44Å; Q62-Y67 PolarHBondContact N-OH 2.7Å; Q62-Y67 WeakPolarHBondContact O-CE2 3.14Å; Q62-E73 PolarHBondContact NE2-OE1 2.85Å; Q62-E73 PolarHBondContact NE2-OE2 2.86Å
63	S	89.5	Confident	86.2	Confident	66 Å²	66	54.3 Å²	54.3	46%	0.462	31%	0.307	S	S	.	.			trans	-64.1	154.1	168	74.1	0	0	0	0	109.9	Q65 A66 Y67	S63-Q65 PolarHBondContact O-N 2.91Å; S63-A66 WeakPolarHBondContact O-CB 3.3Å; S63-A66 PolarHBondContact O-N 3.23Å; S63-A66 WeakPolarHBondContact OG-CB 3.35Å; S63-A66 PolarHBondContact OG-N 2.87Å; S63-Y67 VanDerWaalsContact O-CD2 3.28Å; S63-Y67 WeakPolarHBondContact O-CD2 3.01Å; S63-Y67 PolarHBondContact O-N 3.12Å
64	I	88.1	Confident	86.1	Confident	14 Å²	14	54 Å²	54	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-58.7	-39	178.7	-55.6	165.1	0	0	0	110.4	G54 P56 A66 Y67 L68 L75 W77 L262 A267	G54-I64 VanDerWaalsContact O-CD1 3.26Å; G54-I64 WeakPolarHBondContact O-CD1 3.42Å; P56-I64 HydrophobicContact CG-CG1 4.26Å; I64-A66 VanDerWaalsContact C-N 3.32Å; I64-A66 PolarHBondContact O-N 2.85Å; I64-Y67 PolarHBondContact O-N 3.15Å; I64-L68 HydrophobicContact CG2-CD1 4.26Å; I64-L68 HydrophobicContact CG2-CG 4.47Å; I64-L68 WeakPolarHBondContact O-CG 3.23Å; I64-L68 PolarHBondContact O-N 3.48Å; I64-L68 VanDerWaalsContact O-N 3.07Å; I64-L75 HydrophobicContact CG2-CD2 4.27Å; I64-W77 HydrophobicContact CG1-CH2 4.47Å; I64-L262 HydrophobicContact CD1-CD2 3.92Å; I64-L262 HydrophobicContact CG2-CD2 3.9Å; I64-A267 HydrophobicContact CD1-CB 3.95Å
65	Q	86.2	Confident	86.3	Confident	90 Å²	90	54.1 Å²	54.1	42%	0.421	31%	0.305	S	S	.	.	H	α-helix	trans	-59.8	-41.5	176.8	-170.3	57.2	49.8	0	0	111.8	S63 Y67 L68 D69	S63-Q65 PolarHBondContact O-N 2.91Å; Q65-Y67 VanDerWaalsContact C-N 3.34Å; Q65-Y67 PolarHBondContact O-N 3.38Å; Q65-L68 PolarHBondContact O-N 3.2Å; Q65-L68 VanDerWaalsContact O-N 3.14Å; Q65-D69 WeakPolarHBondContact CG-OD2 3.48Å; Q65-D69 VanDerWaalsContact NE2-CG 3.25Å; Q65-D69 PolarHBondContact NE2-OD1 2.94Å; Q65-D69 PolarHBondContact NE2-OD2 3.08Å; Q65-D69 WeakPolarHBondContact O-CB 3.02Å; Q65-D69 VanDerWaalsContact O-CG 3.26Å; Q65-D69 PolarHBondContact O-N 2.88Å
66	A	88.1	Confident	86.4	Confident	27 Å²	27	52.2 Å²	52.2	22%	0.223	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-36.4	176.7	0	0	0	0	0	113	Q62 S63 I64 S70	Q62-A66 HydrophobicContact CB-CB 3.83Å; S63-A66 WeakPolarHBondContact O-CB 3.3Å; S63-A66 PolarHBondContact O-N 3.23Å; S63-A66 WeakPolarHBondContact OG-CB 3.35Å; S63-A66 PolarHBondContact OG-N 2.87Å; I64-A66 VanDerWaalsContact C-N 3.32Å; I64-A66 PolarHBondContact O-N 2.85Å; A66-S70 VanDerWaalsContact O-CB 3.24Å; A66-S70 WeakPolarHBondContact O-CB 3.4Å; A66-S70 PolarHBondContact O-N 2.82Å
67	Y	87.7	Confident	86.5	Confident	10 Å²	10	52.1 Å²	52.1	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-39.8	172.4	-74.1	-75.2	0	0	0	112.6	P56 Q62 S63 I64 Q65 D69 S70 E73 V74 L75 P76 R140 K185	P56-Y67 HydrophobicContact CB-CE2 3.76Å; P56-Y67 HydrophobicContact CG-CD2 4.36Å; P56-Y67 HydrophobicContact CG-CE2 3.99Å; Q62-Y67 HydrophobicContact CB-CD2 4.16Å; Q62-Y67 HydrophobicContact CB-CE2 3.74Å; Q62-Y67 HydrophobicContact CG-CE2 4.44Å; Q62-Y67 PolarHBondContact N-OH 2.7Å; Q62-Y67 WeakPolarHBondContact O-CE2 3.14Å; S63-Y67 VanDerWaalsContact O-CD2 3.28Å; S63-Y67 WeakPolarHBondContact O-CD2 3.01Å; S63-Y67 PolarHBondContact O-N 3.12Å; I64-Y67 PolarHBondContact O-N 3.15Å; Q65-Y67 VanDerWaalsContact C-N 3.34Å; Q65-Y67 PolarHBondContact O-N 3.38Å; Y67-D69 VanDerWaalsContact C-N 3.35Å; Y67-S70 PolarHBondContact O-N 3.09Å; Y67-E73 HydrophobicContact CD1-CB 3.99Å; Y67-E73 HydrophobicContact CE1-CB 4.32Å; Y67-E73 VanDerWaalsContact CE1-OE2 3.27Å; Y67-E73 WeakPolarHBondContact CE1-OE2 3.45Å; Y67-V74 WeakPolarHBondContact CD1-O 3.27Å; Y67-L75 HydrophobicContact CG-CD2 4.45Å; Y67-P76 HydrophobicContact CE2-CG 4.17Å; Y67-R140 PolarHBondContact O-NH2 2.93Å; Y67-K185 PolarHBondContact OH-O 2.9Å
68	L	85.9	Confident	86.8	Confident	45 Å²	45	49.2 Å²	49.2	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-38.6	177.9	-66.3	173.9	0	0	0	111.5	I64 Q65 L75 F206 E217	I64-L68 HydrophobicContact CG2-CD1 4.26Å; I64-L68 HydrophobicContact CG2-CG 4.47Å; I64-L68 WeakPolarHBondContact O-CG 3.23Å; I64-L68 PolarHBondContact O-N 3.48Å; I64-L68 VanDerWaalsContact O-N 3.07Å; Q65-L68 PolarHBondContact O-N 3.2Å; Q65-L68 VanDerWaalsContact O-N 3.14Å; L68-L75 HydrophobicContact CD2-CD2 4.41Å; L68-F206 HydrophobicContact CD1-CD1 4.37Å; L68-F206 HydrophobicContact CD1-CE1 4.19Å; L68-F206 HydrophobicContact CD2-CD1 4.19Å; L68-F206 HydrophobicContact CD2-CD2 4.38Å; L68-F206 HydrophobicContact CD2-CE1 4.32Å; L68-F206 HydrophobicContact CD2-CG 4.22Å; L68-F206 HydrophobicContact CD2-CZ 4.49Å; L68-E217 HydrophobicContact CD2-CB 3.93Å; L68-E217 HydrophobicContact CD2-CG 4.23Å
69	D	85.2	Confident	87.1	Confident	112 Å²	112	43.5 Å²	43.5	60%	0.599	25%	0.247	S	C	*	.	H	α-helix	trans	-82	-18.9	179.8	-62.6	-26.9	0	0	0	113.2	Q65 Y67	Q65-D69 WeakPolarHBondContact CG-OD2 3.48Å; Q65-D69 VanDerWaalsContact NE2-CG 3.25Å; Q65-D69 PolarHBondContact NE2-OD1 2.94Å; Q65-D69 PolarHBondContact NE2-OD2 3.08Å; Q65-D69 WeakPolarHBondContact O-CB 3.02Å; Q65-D69 VanDerWaalsContact O-CG 3.26Å; Q65-D69 PolarHBondContact O-N 2.88Å; Y67-D69 VanDerWaalsContact C-N 3.35Å
70	S	82.6	Confident	87.5	Confident	27 Å²	27	41.9 Å²	41.9	19%	0.189	24%	0.241	C	C	.	.			trans	-65.6	134.7	-178.5	-179.8	0	0	0	0	112.2	A66 Y67 S72 E73 R140	A66-S70 VanDerWaalsContact O-CB 3.24Å; A66-S70 WeakPolarHBondContact O-CB 3.4Å; A66-S70 PolarHBondContact O-N 2.82Å; Y67-S70 PolarHBondContact O-N 3.09Å; S70-S72 VanDerWaalsContact C-N 3.31Å; S70-S72 PolarHBondContact O-N 3.37Å; S70-S72 PolarHBondContact OG-N 3.4Å; S70-E73 WeakPolarHBondContact OG-CB 3.47Å; S70-E73 PolarHBondContact OG-N 2.97Å; S70-R140 PolarHBondContact O-NE 3.33Å; S70-R140 PolarHBondContact O-NH2 3.01Å
71	K	75.1	Confident	87.8	Confident	174 Å²	174	39.1 Å²	39.1	76%	0.757	21%	0.213	S	C	*	.	S	Bend	trans	-80.3	-9.7	175.3	-69.1	-177.3	-179.7	176.5	0	114.2	R140	K71-R140 VanDerWaalsContact O-CD 3.3Å; K71-R140 WeakPolarHBondContact O-CD 3.44Å
72	S	78	Confident	87.9	Confident	64 Å²	64	42.3 Å²	42.3	45%	0.448	22%	0.22	S	C	.	.	S	Bend	trans	-127.9	-29.8	-169.8	-56.7	0	0	0	0	113.4	S70 R140	S70-S72 VanDerWaalsContact C-N 3.31Å; S70-S72 PolarHBondContact O-N 3.37Å; S70-S72 PolarHBondContact OG-N 3.4Å; S72-R140 WeakPolarHBondContact O-CG 3.39Å; S72-R140 PolarHBondContact O-N 2.88Å
73	E	82.8	Confident	87.8	Confident	75 Å²	75	38.8 Å²	38.8	35%	0.35	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-93.6	146	-175.5	-59.5	-174.2	-176.3	0	0	111.4	Q62 Y67 S70 R140	Q62-E73 PolarHBondContact NE2-OE1 2.85Å; Q62-E73 PolarHBondContact NE2-OE2 2.86Å; Y67-E73 HydrophobicContact CD1-CB 3.99Å; Y67-E73 HydrophobicContact CE1-CB 4.32Å; Y67-E73 VanDerWaalsContact CE1-OE2 3.27Å; Y67-E73 WeakPolarHBondContact CE1-OE2 3.45Å; S70-E73 WeakPolarHBondContact OG-CB 3.47Å; S70-E73 PolarHBondContact OG-N 2.97Å; E73-R140 PolarHBondContact O-NE 2.96Å; E73-R140 PolarHBondContact O-NH2 3.14Å; E73-R140 VanDerWaalsContact O-NH2 3.14Å
74	V	86.6	Confident	87.4	Confident	10 Å²	10	43.8 Å²	43.8	6%	0.061	22%	0.218	C	C	.	.			trans	-107.3	165.6	173	-56.8	0	0	0	0	109.2	Y67 L138 R140 M215	Y67-V74 WeakPolarHBondContact CD1-O 3.27Å; V74-L138 HydrophobicContact CG2-CB 3.94Å; V74-L138 WeakPolarHBondContact CG2-O 3.4Å; V74-R140 HydrophobicContact CG1-CB 4.4Å; V74-R140 HydrophobicContact CG1-CG 3.53Å; V74-M215 HydrophobicContact CB-SD 3.81Å; V74-M215 HydrophobicContact CG1-CB 3.93Å; V74-M215 HydrophobicContact CG1-CG 3.93Å; V74-M215 HydrophobicContact CG1-SD 3.49Å; V74-M215 WeakPolarHBondContact CG1-SD 3.09Å; V74-M215 HydrophobicContact CG2-SD 4.25Å
75	L	91.7	Very high	87	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.254	C	S	.	.			trans	-60.7	137.4	176.9	-67.5	168.3	0	0	0	111.4	I64 Y67 L68 W77 T78 F206 E217	I64-L75 HydrophobicContact CG2-CD2 4.27Å; Y67-L75 HydrophobicContact CG-CD2 4.45Å; L68-L75 HydrophobicContact CD2-CD2 4.41Å; L75-W77 HydrophobicContact CB-CD2 4.32Å; L75-W77 HydrophobicContact CB-CZ2 3.99Å; L75-W77 HydrophobicContact CD1-CZ2 3.81Å; L75-W77 HydrophobicContact CD2-CH2 4.17Å; L75-W77 HydrophobicContact CD2-CZ2 3.76Å; L75-W77 HydrophobicContact CG-CZ2 4.09Å; L75-W77 PolarHBondContact O-N 2.86Å; L75-W77 VanDerWaalsContact O-N 3.09Å; L75-T78 WeakPolarHBondContact O-CB 3.09Å; L75-T78 PolarHBondContact O-N 3.24Å; L75-F206 HydrophobicContact CD1-CD2 3.7Å; L75-F206 HydrophobicContact CD1-CE2 3.16Å; L75-F206 HydrophobicContact CD1-CZ 4.03Å; L75-F206 HydrophobicContact CG-CE2 4.49Å; L75-E217 HydrophobicContact CD1-CG 3.81Å; L75-E217 WeakPolarHBondContact CD1-OE2 3.33Å; L75-E217 HydrophobicContact CG-CG 3.95Å
76	P	92.4	Very high	86.5	Confident	7 Å²	7	48.9 Å²	48.9	5%	0.045	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.5	-166.1	26.4	-36	0	0	0	114.7	P56 Y67 E186 L187 S188	P56-P76 HydrophobicContact CB-CG 3.87Å; P56-P76 HydrophobicContact CG-CG 3.58Å; Y67-P76 HydrophobicContact CE2-CG 4.17Å; P76-E186 WeakPolarHBondContact CB-O 3.23Å; P76-L187 WeakPolarHBondContact O-CD2 3.45Å; P76-S188 CarbonylContact C-O 3.52Å; P76-S188 WeakPolarHBondContact CG-OG 3.29Å
77	W	94.3	Very high	86.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-13.9	173.4	43.8	76.7	0	0	0	113.3	P56 I64 L75 S93 I94 S188 V190 F206 V260 A267	P56-W77 HydrophobicContact CG-CH2 4.47Å; P56-W77 HydrophobicContact CG-CZ3 3.84Å; I64-W77 HydrophobicContact CG1-CH2 4.47Å; L75-W77 HydrophobicContact CB-CD2 4.32Å; L75-W77 HydrophobicContact CB-CZ2 3.99Å; L75-W77 HydrophobicContact CD1-CZ2 3.81Å; L75-W77 HydrophobicContact CD2-CH2 4.17Å; L75-W77 HydrophobicContact CD2-CZ2 3.76Å; L75-W77 HydrophobicContact CG-CZ2 4.09Å; L75-W77 PolarHBondContact O-N 2.86Å; L75-W77 VanDerWaalsContact O-N 3.09Å; W77-S93 CarbonylContact O-C 3.53Å; W77-S93 VanDerWaalsContact O-CA 3.3Å; W77-S93 WeakPolarHBondContact O-CA 3.04Å; W77-I94 HydrophobicContact CB-CB 4.5Å; W77-I94 WeakPolarHBondContact O-CG1 3.19Å; W77-I94 PolarHBondContact O-N 3.04Å; W77-S188 VanDerWaalsContact CA-O 3.3Å; W77-S188 WeakPolarHBondContact CA-O 3.22Å; W77-S188 VanDerWaalsContact CB-O 3.31Å; W77-S188 WeakPolarHBondContact CB-O 3.18Å; W77-S188 PolarHBondContact N-O 2.88Å; W77-V190 HydrophobicContact CB-CB 4.04Å; W77-V190 HydrophobicContact CB-CG1 4.37Å; W77-V190 HydrophobicContact CD2-CB 3.69Å; W77-V190 HydrophobicContact CD2-CG2 4.16Å; W77-V190 HydrophobicContact CE3-CB 4.06Å; W77-V190 HydrophobicContact CG-CB 3.69Å; W77-V190 HydrophobicContact CG-CG1 4.28Å; W77-V190 HydrophobicContact CG-CG2 4.49Å; W77-V190 HydrophobicContact CZ2-CG2 4.43Å; W77-F206 HydrophobicContact CZ2-CE2 4.43Å; W77-F206 HydrophobicContact CZ2-CZ 4.46Å; W77-V260 HydrophobicContact CZ2-CG1 4.15Å; W77-A267 HydrophobicContact CH2-CB 3.4Å; W77-A267 HydrophobicContact CZ2-CB 3.81Å; W77-A267 HydrophobicContact CZ3-CB 4.16Å
78	T	93.7	Very high	86.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.6	-172.7	-58.9	0	0	0	0	111	L75 L138 S208 M215	L75-T78 WeakPolarHBondContact O-CB 3.09Å; L75-T78 PolarHBondContact O-N 3.24Å; T78-L138 HydrophobicContact CG2-CD1 4.5Å; T78-S208 PolarHBondContact OG1-OG 2.72Å; T78-M215 HydrophobicContact CG2-CE 4.08Å; T78-M215 HydrophobicContact CG2-SD 3.59Å; T78-M215 VanDerWaalsContact CG2-SD 3.59Å
79	V	93.9	Very high	86.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	157	179.5	-61.2	0	0	0	0	112	L91 G92 I94 I111 V134 F135 A136 F181	V79-L91 CarbonylContact O-C 3.54Å; V79-L91 VanDerWaalsContact O-CA 3.31Å; V79-L91 WeakPolarHBondContact O-CA 3.49Å; V79-G92 VanDerWaalsContact CG2-C 3.42Å; V79-G92 WeakPolarHBondContact CG2-O 3.46Å; V79-G92 PolarHBondContact N-O 2.88Å; V79-G92 PolarHBondContact O-N 2.98Å; V79-I94 HydrophobicContact CG1-CD1 3.81Å; V79-I94 HydrophobicContact CG1-CG1 3.58Å; V79-I111 HydrophobicContact CG1-CD1 4.31Å; V79-I111 HydrophobicContact CG2-CD1 4.26Å; V79-I111 HydrophobicContact CG2-CG2 3.48Å; V79-I111 VanDerWaalsContact CG2-CG2 3.48Å; V79-V134 HydrophobicContact CB-CG1 3.8Å; V79-V134 HydrophobicContact CG1-CG1 4.29Å; V79-V134 HydrophobicContact CG2-CG1 3.83Å; V79-F135 CarbonylContact C-O 3.59Å; V79-F135 VanDerWaalsContact CA-O 3.22Å; V79-F135 WeakPolarHBondContact CA-O 3.41Å; V79-F135 VanDerWaalsContact CB-O 3.23Å; V79-F135 WeakPolarHBondContact CB-O 3.4Å; V79-A136 HydrophobicContact CG1-CB 3.78Å; V79-F181 HydrophobicContact CG1-CE2 4.36Å
80	A	93	Very high	86.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.7	177.9	0	0	0	0	0	110.4	F88 V134 F135 L138 L143 F144	A80-F88 HydrophobicContact CB-CD2 4.4Å; A80-F88 HydrophobicContact CB-CE2 4.13Å; A80-V134 CarbonylContact O-C 3.36Å; A80-F135 PolarHBondContact N-O 3.39Å; A80-F135 PolarHBondContact O-N 2.78Å; A80-L138 HydrophobicContact CB-CD1 3.84Å; A80-L138 HydrophobicContact CB-CD2 3.96Å; A80-L143 HydrophobicContact CB-CD1 4.27Å; A80-F144 HydrophobicContact CB-CE1 4.28Å
81	I	92.4	Very high	87.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.4	178.7	-53.3	179.8	0	0	0	108.7	K89 C90 T113 F118 Y132 V134	I81-K89 WeakPolarHBondContact O-CB 2.89Å; I81-K89 PolarHBondContact O-N 3.05Å; I81-C90 HydrophobicContact CB-CB 4.46Å; I81-C90 HydrophobicContact CD1-CB 4.46Å; I81-C90 PolarHBondContact N-O 3.39Å; I81-C90 PolarHBondContact O-N 2.83Å; I81-T113 HydrophobicContact CD1-CG2 3.68Å; I81-F118 HydrophobicContact CD1-CZ 4.04Å; I81-F118 HydrophobicContact CG2-CE1 4.33Å; I81-Y132 HydrophobicContact CG2-CD1 4.3Å; I81-V134 HydrophobicContact CG1-CG2 4.37Å
82	R	89.7	Confident	88.2	Confident	84 Å²	84	39.3 Å²	39.3	32%	0.317	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.7	-180	-162.1	177.6	-172.2	-154.6	-12.9	109.9	G86 Y132 T133 F135 F144	R82-G86 VanDerWaalsContact CZ-CA 3.41Å; R82-G86 PolarHBondContact NE-O 3.3Å; R82-G86 PolarHBondContact NH2-O 3.15Å; R82-G86 VanDerWaalsContact NH2-O 3.12Å; R82-Y132 CarbonylContact O-C 3.54Å; R82-Y132 VanDerWaalsContact O-CA 3.27Å; R82-Y132 WeakPolarHBondContact O-CA 3.5Å; R82-T133 PolarHBondContact N-O 3.48Å; R82-T133 PolarHBondContact O-N 3.22Å; R82-F135 HydrophobicContact CB-CD2 4.12Å; R82-F135 HydrophobicContact CB-CE2 3.72Å; R82-F135 HydrophobicContact CG-CE2 4.35Å; R82-F144 HydrophobicContact CB-CE1 3.98Å; R82-F144 HydrophobicContact CB-CZ 4.23Å; R82-F144 HydrophobicContact CG-CE1 4.13Å; R82-F144 HydrophobicContact CG-CZ 4.06Å
83	G	87.4	Confident	89.1	Confident	7 Å²	7	36.3 Å²	36.3	7%	0.072	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	169.3	171.4	0	0	0	0	0	112.6	F85 G86 N87 S131	G83-F85 PolarHBondContact O-N 2.85Å; G83-F85 VanDerWaalsContact O-N 3.16Å; G83-G86 PolarHBondContact O-N 2.77Å; G83-N87 PolarHBondContact N-O 2.72Å; G83-S131 CarbonylContact C-O 3.56Å
84	K	80.7	Confident	89.7	Confident	171 Å²	171	32.7 Å²	32.7	74%	0.743	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-35.5	-179.7	-167.6	179.6	-179.8	-176.9	0	114.1	G86 S131	K84-G86 PolarHBondContact O-N 3.09Å; K84-S131 PolarHBondContact N-O 2.85Å
85	F	79.2	Confident	89.9	Confident	190 Å²	190	32.4 Å²	32.4	83%	0.833	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	12	179	-58.9	-68.4	0	0	0	113.7	G83 N87	G83-F85 PolarHBondContact O-N 2.85Å; G83-F85 VanDerWaalsContact O-N 3.16Å; F85-N87 VanDerWaalsContact C-N 3.26Å; F85-N87 PolarHBondContact O-N 2.99Å
86	G	75.9	Confident	89.8	Confident	21 Å²	21	33.7 Å²	33.7	22%	0.216	16%	0.159	C	C	.	.	S	Bend	trans	78.6	4.9	174.1	0	0	0	0	0	115.3	R82 G83 K84	R82-G86 VanDerWaalsContact CZ-CA 3.41Å; R82-G86 PolarHBondContact NE-O 3.3Å; R82-G86 PolarHBondContact NH2-O 3.15Å; R82-G86 VanDerWaalsContact NH2-O 3.12Å; G83-G86 PolarHBondContact O-N 2.77Å; K84-G86 PolarHBondContact O-N 3.09Å
87	N	83.3	Confident	89.3	Confident	60 Å²	60	34.4 Å²	34.4	32%	0.321	16%	0.162	S	C	.	.			trans	-81.8	141.4	176.7	74.4	-68.1	0	0	0	110.6	G83 F85 K89	G83-N87 PolarHBondContact N-O 2.72Å; F85-N87 VanDerWaalsContact C-N 3.26Å; F85-N87 PolarHBondContact O-N 2.99Å; N87-K89 WeakPolarHBondContact ND2-CD 3.38Å; N87-K89 WeakPolarHBondContact ND2-CE 3.39Å; N87-K89 PolarHBondContact ND2-NZ 2.83Å
88	F	87.4	Confident	88.1	Confident	52 Å²	52	40.3 Å²	40.3	23%	0.228	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	138.7	168.2	175.5	-97.2	0	0	0	109.8	A80 C90 L91 L143 F144 Y210	A80-F88 HydrophobicContact CB-CD2 4.4Å; A80-F88 HydrophobicContact CB-CE2 4.13Å; F88-C90 WeakPolarHBondContact CE2-O 3.41Å; F88-C90 VanDerWaalsContact CZ-C 3.43Å; F88-L91 HydrophobicContact CE2-CD2 3.81Å; F88-L91 HydrophobicContact CE2-CG 4.42Å; F88-L91 HydrophobicContact CZ-CD2 3.82Å; F88-L91 HydrophobicContact CZ-CG 3.95Å; F88-L143 HydrophobicContact CD2-CD1 3.64Å; F88-L143 HydrophobicContact CE2-CD1 3.89Å; F88-F144 HydrophobicContact CB-CZ 4.36Å; F88-F144 HydrophobicContact CD2-CZ 4.3Å; F88-Y210 HydrophobicContact CB-CE1 4.41Å; F88-Y210 AromaticContact CD1-CD1 3.82Å; F88-Y210 HydrophobicContact CD1-CD1 3.82Å; F88-Y210 HydrophobicContact CD1-CE1 4.1Å; F88-Y210 HydrophobicContact CD2-CD1 4.17Å; F88-Y210 HydrophobicContact CD2-CE1 4.21Å; F88-Y210 AromaticContact CE1-CD1 3.69Å; F88-Y210 HydrophobicContact CE1-CD1 3.69Å; F88-Y210 HydrophobicContact CE1-CE1 4.42Å; F88-Y210 HydrophobicContact CE1-CG 4.47Å; F88-Y210 HydrophobicContact CE2-CD1 4.04Å; F88-Y210 HydrophobicContact CE2-CG 4.42Å; F88-Y210 HydrophobicContact CG-CD1 4.05Å; F88-Y210 AromaticContact CG-CE1 3.98Å; F88-Y210 HydrophobicContact CG-CE1 3.98Å; F88-Y210 AromaticContact CZ-CD1 3.8Å; F88-Y210 HydrophobicContact CZ-CD1 3.8Å; F88-Y210 HydrophobicContact CZ-CG 4.21Å
89	K	88.8	Confident	86.2	Confident	82 Å²	82	42.4 Å²	42.4	36%	0.357	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-54.6	177.7	-70.5	-65.5	-172.3	-165.2	0	111.6	I81 N87	I81-K89 WeakPolarHBondContact O-CB 2.89Å; I81-K89 PolarHBondContact O-N 3.05Å; N87-K89 WeakPolarHBondContact ND2-CD 3.38Å; N87-K89 WeakPolarHBondContact ND2-CE 3.39Å; N87-K89 PolarHBondContact ND2-NZ 2.83Å
90	C	92.3	Very high	84.2	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	165.8	-171.4	-74	0	0	0	0	112.1	I81 F88 C117 L255	I81-C90 HydrophobicContact CB-CB 4.46Å; I81-C90 HydrophobicContact CD1-CB 4.46Å; I81-C90 PolarHBondContact N-O 3.39Å; I81-C90 PolarHBondContact O-N 2.83Å; F88-C90 WeakPolarHBondContact CE2-O 3.41Å; F88-C90 VanDerWaalsContact CZ-C 3.43Å; C90-C117 HydrophobicContact CB-CB 3.78Å; C90-C117 WeakPolarHBondContact CB-SG 3.16Å; C90-C117 WeakPolarHBondContact SG-CA 3.48Å; C90-C117 WeakPolarHBondContact SG-CB 3.41Å; C90-C117 CovalentContact SG-SG 2Å; C90-C117 PolarHBondContact SG-SG 2.97Å; C90-L255 VanDerWaalsContact CA-O 3.31Å; C90-L255 WeakPolarHBondContact CA-O 3.29Å; C90-L255 WeakPolarHBondContact CB-O 3.21Å
91	L	94.2	Very high	82.2	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	172.1	161.4	-63	178.8	0	0	0	111	V79 F88 T113 S208 M215 L255 G256	V79-L91 CarbonylContact O-C 3.54Å; V79-L91 VanDerWaalsContact O-CA 3.31Å; V79-L91 WeakPolarHBondContact O-CA 3.49Å; F88-L91 HydrophobicContact CE2-CD2 3.81Å; F88-L91 HydrophobicContact CE2-CG 4.42Å; F88-L91 HydrophobicContact CZ-CD2 3.82Å; F88-L91 HydrophobicContact CZ-CG 3.95Å; L91-T113 PolarHBondContact O-OG1 2.86Å; L91-S208 VanDerWaalsContact CD1-O 3.32Å; L91-S208 WeakPolarHBondContact CD1-O 3.41Å; L91-M215 HydrophobicContact CD2-CE 3.55Å; L91-L255 PolarHBondContact N-O 3.14Å; L91-G256 CarbonylContact C-O 3.56Å; L91-G256 CarbonylContact O-C 3.56Å; L91-G256 WeakPolarHBondContact O-CA 3.49Å
92	G	94.8	Very high	80.2	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165	-175	169.7	0	0	0	0	0	111.1	V79 L112	V79-G92 VanDerWaalsContact CG2-C 3.42Å; V79-G92 WeakPolarHBondContact CG2-O 3.46Å; V79-G92 PolarHBondContact N-O 2.88Å; V79-G92 PolarHBondContact O-N 2.98Å; G92-L112 CarbonylContact C-O 3.55Å; G92-L112 WeakPolarHBondContact CA-O 3.27Å
93	S	96.1	Very high	78.6	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.8	-179.1	52.8	0	0	0	0	112.9	W77 I111 L112 Q269	W77-S93 CarbonylContact O-C 3.53Å; W77-S93 VanDerWaalsContact O-CA 3.3Å; W77-S93 WeakPolarHBondContact O-CA 3.04Å; S93-I111 CarbonylContact O-C 3.37Å; S93-I111 VanDerWaalsContact O-CA 3.27Å; S93-I111 WeakPolarHBondContact O-CA 3.47Å; S93-L112 PolarHBondContact N-O 2.93Å; S93-L112 PolarHBondContact O-N 2.88Å; S93-Q269 VanDerWaalsContact OG-CD 3.27Å; S93-Q269 PolarHBondContact OG-NE2 3.11Å; S93-Q269 PolarHBondContact OG-OE1 2.75Å
94	I	95	Very high	77.3	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	126	173.5	-54.6	164.7	0	0	0	109.4	W77 V79 I111 A136 F181 F183 L187 P189 V190	W77-I94 HydrophobicContact CB-CB 4.5Å; W77-I94 WeakPolarHBondContact O-CG1 3.19Å; W77-I94 PolarHBondContact O-N 3.04Å; V79-I94 HydrophobicContact CG1-CD1 3.81Å; V79-I94 HydrophobicContact CG1-CG1 3.58Å; I94-I111 HydrophobicContact CB-CD1 4.34Å; I94-I111 HydrophobicContact CG1-CD1 3.69Å; I94-A136 HydrophobicContact CD1-CB 4.24Å; I94-F181 HydrophobicContact CD1-CD2 3.96Å; I94-F181 HydrophobicContact CG1-CD2 4.21Å; I94-F183 HydrophobicContact CG2-CE1 3.82Å; I94-F183 HydrophobicContact CG2-CZ 4.41Å; I94-L187 HydrophobicContact CD1-CD2 4.04Å; I94-P189 WeakPolarHBondContact O-CA 3.27Å; I94-V190 PolarHBondContact O-N 2.83Å
95	I	92.6	Very high	76.9	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.021	32%	0.322	C	S	.	.			trans	-116.5	154.7	-179.5	64.1	162.3	0	0	0	110.9	S108 L110 L112 L174 V190 V192 L300	I95-S108 WeakPolarHBondContact O-CB 3.47Å; I95-S108 PolarHBondContact O-OG 2.65Å; I95-L110 HydrophobicContact CD1-CB 3.94Å; I95-L110 HydrophobicContact CD1-CD1 4.25Å; I95-L110 HydrophobicContact CG1-CB 3.51Å; I95-L110 HydrophobicContact CG1-CD1 4.44Å; I95-L110 PolarHBondContact N-O 2.77Å; I95-L112 HydrophobicContact CD1-CD1 4.24Å; I95-L112 HydrophobicContact CD1-CD2 4.29Å; I95-L112 HydrophobicContact CD1-CG 3.93Å; I95-L112 HydrophobicContact CG1-CG 4.43Å; I95-L112 HydrophobicContact CG2-CB 4.43Å; I95-L112 HydrophobicContact CG2-CD1 3.62Å; I95-L112 HydrophobicContact CG2-CG 3.8Å; I95-L174 HydrophobicContact CD1-CD1 3.95Å; I95-V190 HydrophobicContact CG2-CG1 4.34Å; I95-V192 HydrophobicContact CB-CG2 3.74Å; I95-V192 HydrophobicContact CG2-CG2 3.36Å; I95-L300 HydrophobicContact CD1-CD2 4.06Å
96	P	88.7	Confident	77.3	Confident	27 Å²	27	58.3 Å²	58.3	18%	0.175	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-67.5	144.5	178.5	27.4	-33.8	0	0	0	112.2	C53 V190	C53-P96 HydrophobicContact CB-CG 4.36Å; P96-V190 VanDerWaalsContact CD-O 3.24Å; P96-V190 WeakPolarHBondContact CD-O 3.46Å
97	E	82.6	Confident	77.9	Confident	22 Å²	22	60 Å²	60	10%	0.103	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-87.5	119	163.8	-77.2	-177.9	-158.9	0	0	108.8	R105 R109 L110	E97-R105 IonicContact OE2-NH1 3.23Å; E97-R105 PolarHBondContact OE2-NH1 3.02Å; E97-R109 WeakPolarHBondContact OE1-CA 3.36Å; E97-R109 WeakPolarHBondContact OE1-CB 3.2Å; E97-R109 WeakPolarHBondContact OE1-CG 3.31Å; E97-R109 PolarHBondContact OE1-N 2.78Å; E97-R109 IonicContact OE1-NH1 3.58Å; E97-R109 IonicContact OE2-NH1 3.19Å; E97-R109 PolarHBondContact OE2-NH1 2.79Å; E97-L110 HydrophobicContact CG-CD1 3.73Å; E97-L110 HydrophobicContact CG-CG 3.75Å
98	N	67.8	Low	78.2	Confident	125 Å²	125	57.1 Å²	57.1	67%	0.668	30%	0.295	S	S	*	.	B	Isolated β-bridge	trans	-83.9	126.8	173	-65.5	-15.1	0	0	0	109.8
99	D	54.9	Low	78.5	Confident	44 Å²	44	58.2 Å²	58.2	24%	0.235	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-79.6	148.8	166.2	-119	-32	0	0	0	110.2	D101 G102 R103 R105	D99-D101 PolarHBondContact O-N 3.28Å; D99-D101 VanDerWaalsContact O-N 3.15Å; D99-G102 PolarHBondContact O-N 2.86Å; D99-G102 VanDerWaalsContact O-N 3.08Å; D99-R103 WeakPolarHBondContact CB-O 3.3Å; D99-R105 VanDerWaalsContact CG-NH2 3.26Å; D99-R105 IonicContact OD1-CZ 3.74Å; D99-R105 IonicContact OD1-NE 3.94Å; D99-R105 IonicContact OD1-NH2 2.91Å; D99-R105 PolarHBondContact OD1-NH2 3.32Å; D99-R105 IonicContact OD2-CZ 3.32Å; D99-R105 IonicContact OD2-NE 2.87Å; D99-R105 PolarHBondContact OD2-NE 2.96Å; D99-R105 IonicContact OD2-NH2 2.92Å; D99-R105 PolarHBondContact OD2-NH2 3.43Å
100	P	51.5	Low	78.7	Confident	123 Å²	123	56 Å²	56	80%	0.799	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.3	173.2	-22.5	33.6	0	0	0	113.2	G102	P100-G102 VanDerWaalsContact C-N 3.32Å; P100-G102 PolarHBondContact O-N 3.27Å
101	D	50.4	Low	78.9	Confident	142 Å²	142	55.9 Å²	55.9	76%	0.759	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	9.4	-178.4	-56.6	-41.9	0	0	0	113.7	D99 R103	D99-D101 PolarHBondContact O-N 3.28Å; D99-D101 VanDerWaalsContact O-N 3.15Å; D101-R103 PolarHBondContact O-N 3.05Å; D101-R103 VanDerWaalsContact O-N 3.12Å
102	G	51	Low	78.9	Confident	59 Å²	59	55.9 Å²	55.9	61%	0.608	29%	0.288	S	S	*	.			trans	70.7	4.2	178.1	0	0	0	0	0	115.4	D99 P100	D99-G102 PolarHBondContact O-N 2.86Å; D99-G102 VanDerWaalsContact O-N 3.08Å; P100-G102 VanDerWaalsContact C-N 3.32Å; P100-G102 PolarHBondContact O-N 3.27Å
103	R	55.4	Low	79	Confident	198 Å²	198	55.9 Å²	55.9	75%	0.747	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-74.4	126.8	173.6	-79.3	-172	179.7	-147.2	0.5	111.1	D99 D101	D99-R103 WeakPolarHBondContact CB-O 3.3Å; D101-R103 PolarHBondContact O-N 3.05Å; D101-R103 VanDerWaalsContact O-N 3.12Å
104	H	61	Low	78.9	Confident	85 Å²	85	55.9 Å²	55.9	39%	0.394	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-74.1	136.5	171	-69.1	-66.6	0	0	0	110.8	S51	S51-H104 WeakPolarHBondContact CA-NE2 3.38Å; S51-H104 WeakPolarHBondContact CB-NE2 3.48Å
105	R	73.1	Confident	78.7	Confident	78 Å²	78	55.9 Å²	55.9	29%	0.294	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-94.2	138.3	174.7	-67.7	174	173.8	-169.1	1.1	109.8	E97 D99 F107 F183	E97-R105 IonicContact OE2-NH1 3.23Å; E97-R105 PolarHBondContact OE2-NH1 3.02Å; D99-R105 VanDerWaalsContact CG-NH2 3.26Å; D99-R105 IonicContact OD1-CZ 3.74Å; D99-R105 IonicContact OD1-NE 3.94Å; D99-R105 IonicContact OD1-NH2 2.91Å; D99-R105 PolarHBondContact OD1-NH2 3.32Å; D99-R105 IonicContact OD2-CZ 3.32Å; D99-R105 IonicContact OD2-NE 2.87Å; D99-R105 PolarHBondContact OD2-NE 2.96Å; D99-R105 IonicContact OD2-NH2 2.92Å; D99-R105 PolarHBondContact OD2-NH2 3.43Å; R105-F107 HydrophobicContact CB-CD1 4.19Å; R105-F107 HydrophobicContact CB-CD2 4.44Å; R105-F107 HydrophobicContact CB-CE1 4.02Å; R105-F107 HydrophobicContact CB-CE2 4.26Å; R105-F107 HydrophobicContact CB-CG 4.4Å; R105-F107 HydrophobicContact CB-CZ 4.06Å; R105-F107 HydrophobicContact CG-CE1 4.25Å; R105-F107 HydrophobicContact CG-CE2 4.45Å; R105-F107 HydrophobicContact CG-CZ 4.01Å; R105-F107 PolarHBondContact O-N 2.88Å; R105-F183 WeakPolarHBondContact O-CE2 3.15Å
106	N	85.7	Confident	78.6	Confident	101 Å²	101	56.5 Å²	56.5	54%	0.54	29%	0.293	S	S	.	.	S	Bend	trans	-75.8	24.2	173.6	-67.9	-17.4	0	0	0	112.9	F183	N106-F183 PolarHBondContact O-N 2.89Å
107	F	89	Confident	78.7	Confident	57 Å²	57	55.6 Å²	55.6	25%	0.25	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	160.4	-177.8	64.6	-100.8	0	0	0	110.7	R105 P180 F181 V182	R105-F107 HydrophobicContact CB-CD1 4.19Å; R105-F107 HydrophobicContact CB-CD2 4.44Å; R105-F107 HydrophobicContact CB-CE1 4.02Å; R105-F107 HydrophobicContact CB-CE2 4.26Å; R105-F107 HydrophobicContact CB-CG 4.4Å; R105-F107 HydrophobicContact CB-CZ 4.06Å; R105-F107 HydrophobicContact CG-CE1 4.25Å; R105-F107 HydrophobicContact CG-CE2 4.45Å; R105-F107 HydrophobicContact CG-CZ 4.01Å; R105-F107 PolarHBondContact O-N 2.88Å; F107-P180 HydrophobicContact CB-CB 4.02Å; F107-P180 HydrophobicContact CB-CG 4.47Å; F107-P180 HydrophobicContact CD2-CB 3.55Å; F107-P180 HydrophobicContact CD2-CG 3.96Å; F107-P180 HydrophobicContact CE2-CB 4.42Å; F107-P180 HydrophobicContact CG-CB 4.09Å; F107-P180 HydrophobicContact CG-CG 4.33Å; F107-F181 CarbonylContact C-O 3.49Å; F107-F181 WeakPolarHBondContact CA-O 3.49Å; F107-F181 VanDerWaalsContact CB-O 3.3Å; F107-F181 WeakPolarHBondContact CB-O 3.47Å; F107-V182 HydrophobicContact CB-CG2 4.41Å
108	S	90.7	Very high	79.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	143.7	172.8	175.3	0	0	0	0	113.1	I95 L110 P180 F181 F183	I95-S108 WeakPolarHBondContact O-CB 3.47Å; I95-S108 PolarHBondContact O-OG 2.65Å; S108-L110 PolarHBondContact OG-N 3.32Å; S108-P180 CarbonylContact O-C 3.58Å; S108-P180 WeakPolarHBondContact O-CA 3.21Å; S108-F181 PolarHBondContact N-O 3.25Å; S108-F181 PolarHBondContact O-N 3.36Å; S108-F183 VanDerWaalsContact CB-CZ 3.49Å
109	R	93.4	Very high	79.9	Confident	75 Å²	75	52.1 Å²	52.1	28%	0.283	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-1.9	170.1	-55.4	175.9	-178	87.2	-0.7	112.3	E97 T176 L177 P180	E97-R109 WeakPolarHBondContact OE1-CA 3.36Å; E97-R109 WeakPolarHBondContact OE1-CB 3.2Å; E97-R109 WeakPolarHBondContact OE1-CG 3.31Å; E97-R109 PolarHBondContact OE1-N 2.78Å; E97-R109 IonicContact OE1-NH1 3.58Å; E97-R109 IonicContact OE2-NH1 3.19Å; E97-R109 PolarHBondContact OE2-NH1 2.79Å; R109-T176 HydrophobicContact CB-CG2 4.33Å; R109-T176 CarbonylContact O-C 3.57Å; R109-T176 WeakPolarHBondContact O-CA 3.47Å; R109-L177 HydrophobicContact CB-CB 4.22Å; R109-L177 WeakPolarHBondContact O-CG 3.27Å; R109-L177 PolarHBondContact O-N 3.35Å; R109-P180 HydrophobicContact CG-CB 3.62Å; R109-P180 HydrophobicContact CG-CG 4.47Å
110	L	93.2	Very high	80.8	Confident	34 Å²	34	53.4 Å²	53.4	18%	0.178	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.7	-167.2	-62.4	-175.8	0	0	0	111.2	I95 E97 S108 L174 T176	I95-L110 HydrophobicContact CD1-CB 3.94Å; I95-L110 HydrophobicContact CD1-CD1 4.25Å; I95-L110 HydrophobicContact CG1-CB 3.51Å; I95-L110 HydrophobicContact CG1-CD1 4.44Å; I95-L110 PolarHBondContact N-O 2.77Å; E97-L110 HydrophobicContact CG-CD1 3.73Å; E97-L110 HydrophobicContact CG-CG 3.75Å; S108-L110 PolarHBondContact OG-N 3.32Å; L110-L174 HydrophobicContact CB-CD1 4.21Å; L110-L174 HydrophobicContact CD2-CD1 4.38Å; L110-L174 HydrophobicContact CD2-CD2 4.43Å; L110-T176 HydrophobicContact CD2-CG2 4.47Å
111	I	95.6	Very high	81.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.4	178.7	-50.6	-64.7	0	0	0	109.6	V79 S93 I94 V134 L174 V175 L177 F181	V79-I111 HydrophobicContact CG1-CD1 4.31Å; V79-I111 HydrophobicContact CG2-CD1 4.26Å; V79-I111 HydrophobicContact CG2-CG2 3.48Å; V79-I111 VanDerWaalsContact CG2-CG2 3.48Å; S93-I111 CarbonylContact O-C 3.37Å; S93-I111 VanDerWaalsContact O-CA 3.27Å; S93-I111 WeakPolarHBondContact O-CA 3.47Å; I94-I111 HydrophobicContact CB-CD1 4.34Å; I94-I111 HydrophobicContact CG1-CD1 3.69Å; I111-V134 HydrophobicContact CD1-CG1 4.42Å; I111-V134 HydrophobicContact CG1-CG1 4.24Å; I111-L174 WeakPolarHBondContact O-CA 3.48Å; I111-V175 HydrophobicContact CB-CB 4.15Å; I111-V175 PolarHBondContact N-O 2.88Å; I111-V175 PolarHBondContact O-N 2.98Å; I111-L177 HydrophobicContact CD1-CD1 4.22Å; I111-L177 HydrophobicContact CG1-CD1 4.05Å; I111-L177 HydrophobicContact CG1-CD2 4.42Å; I111-L177 HydrophobicContact CG1-CG 4.16Å; I111-F181 HydrophobicContact CD1-CD2 4.18Å; I111-F181 HydrophobicContact CD1-CE2 4.05Å
112	L	95	Very high	81.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	138.5	171.2	-72	-179	0	0	0	111.1	G92 S93 I95 L174 V192 I272 V296 V299	G92-L112 CarbonylContact C-O 3.55Å; G92-L112 WeakPolarHBondContact CA-O 3.27Å; S93-L112 PolarHBondContact N-O 2.93Å; S93-L112 PolarHBondContact O-N 2.88Å; I95-L112 HydrophobicContact CD1-CD1 4.24Å; I95-L112 HydrophobicContact CD1-CD2 4.29Å; I95-L112 HydrophobicContact CD1-CG 3.93Å; I95-L112 HydrophobicContact CG1-CG 4.43Å; I95-L112 HydrophobicContact CG2-CB 4.43Å; I95-L112 HydrophobicContact CG2-CD1 3.62Å; I95-L112 HydrophobicContact CG2-CG 3.8Å; L112-L174 HydrophobicContact CD2-CB 4.47Å; L112-L174 HydrophobicContact CD2-CD1 3.72Å; L112-L174 HydrophobicContact CG-CD1 4.42Å; L112-V192 HydrophobicContact CD1-CG1 4.38Å; L112-V192 HydrophobicContact CD1-CG2 4.3Å; L112-I272 HydrophobicContact CB-CD1 3.95Å; L112-V296 HydrophobicContact CD1-CB 4.22Å; L112-V296 HydrophobicContact CD1-CG1 3.99Å; L112-V299 HydrophobicContact CD2-CG1 3.44Å; L112-V299 VanDerWaalsContact CD2-CG1 3.44Å
113	T	95.7	Very high	82.2	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	-175.9	178.4	-170.2	0	0	0	0	111.2	I81 L91 C117 F118 A173 V175	I81-T113 HydrophobicContact CD1-CG2 3.68Å; L91-T113 PolarHBondContact O-OG1 2.86Å; T113-C117 PolarHBondContact OG1-SG 2.99Å; T113-F118 HydrophobicContact CG2-CE2 3.52Å; T113-F118 HydrophobicContact CG2-CZ 3.71Å; T113-A173 HydrophobicContact CG2-CB 4.1Å; T113-A173 PolarHBondContact N-O 3.31Å; T113-A173 PolarHBondContact O-N 2.98Å; T113-A173 VanDerWaalsContact O-O 3.13Å; T113-V175 HydrophobicContact CG2-CG2 4.04Å
114	A	94.1	Very high	82.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	144.2	177.3	0	0	0	0	0	111.9	S116 C117 I272 L274	A114-S116 VanDerWaalsContact C-N 3.26Å; A114-S116 PolarHBondContact O-N 2.83Å; A114-C117 VanDerWaalsContact O-CB 3.24Å; A114-C117 WeakPolarHBondContact O-CB 3.19Å; A114-C117 PolarHBondContact O-N 3.21Å; A114-C117 PolarHBondContact O-SG 2.7Å; A114-I272 HydrophobicContact CB-CG2 4.34Å; A114-L274 HydrophobicContact CB-CD2 3.5Å; A114-L274 VanDerWaalsContact CB-CD2 3.5Å
115	G	91.3	Very high	83.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-65	-30.7	175.8	0	0	0	0	0	113.3	C117 F118 N170 G171	G115-C117 PolarHBondContact O-N 2.77Å; G115-C117 VanDerWaalsContact O-N 3.08Å; G115-F118 PolarHBondContact O-N 2.85Å; G115-F118 VanDerWaalsContact O-N 3.1Å; G115-N170 WeakPolarHBondContact CA-O 3.06Å; G115-G171 PolarHBondContact N-O 3.33Å
116	S	90	Very high	84	Confident	17 Å²	17	59.3 Å²	59.3	12%	0.119	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-60	-18.8	176.5	-70.3	0	0	0	0	113.8	A114 F118 R119 K167 N170	A114-S116 VanDerWaalsContact C-N 3.26Å; A114-S116 PolarHBondContact O-N 2.83Å; S116-F118 PolarHBondContact O-N 2.81Å; S116-R119 PolarHBondContact O-N 2.77Å; S116-K167 WeakPolarHBondContact OG-CA 3.46Å; S116-K167 PolarHBondContact OG-O 2.99Å; S116-N170 WeakPolarHBondContact OG-CB 3.28Å; S116-N170 PolarHBondContact OG-ND2 2.88Å
117	C	91	Very high	83.9	Confident	8 Å²	8	54.7 Å²	54.7	5%	0.054	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.6	-25.5	175.6	-55.9	0	0	0	0	113.4	C90 T113 A114 G115	C90-C117 HydrophobicContact CB-CB 3.78Å; C90-C117 WeakPolarHBondContact CB-SG 3.16Å; C90-C117 WeakPolarHBondContact SG-CA 3.48Å; C90-C117 WeakPolarHBondContact SG-CB 3.41Å; C90-C117 CovalentContact SG-SG 2Å; C90-C117 PolarHBondContact SG-SG 2.97Å; T113-C117 PolarHBondContact OG1-SG 2.99Å; A114-C117 VanDerWaalsContact O-CB 3.24Å; A114-C117 WeakPolarHBondContact O-CB 3.19Å; A114-C117 PolarHBondContact O-N 3.21Å; A114-C117 PolarHBondContact O-SG 2.7Å; G115-C117 PolarHBondContact O-N 2.77Å; G115-C117 VanDerWaalsContact O-N 3.08Å
118	F	91.5	Very high	83.8	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-109.3	5.3	-172.2	-51.6	-66.2	0	0	0	113.7	I81 T113 G115 S116 W126 G127 Y132 I156 I158 A173 V175	I81-F118 HydrophobicContact CD1-CZ 4.04Å; I81-F118 HydrophobicContact CG2-CE1 4.33Å; T113-F118 HydrophobicContact CG2-CE2 3.52Å; T113-F118 HydrophobicContact CG2-CZ 3.71Å; G115-F118 PolarHBondContact O-N 2.85Å; G115-F118 VanDerWaalsContact O-N 3.1Å; S116-F118 PolarHBondContact O-N 2.81Å; F118-W126 HydrophobicContact CB-CE3 4.32Å; F118-G127 PolarHBondContact O-N 3.44Å; F118-Y132 WeakPolarHBondContact CA-OH 3.27Å; F118-Y132 HydrophobicContact CB-CE2 4.48Å; F118-Y132 HydrophobicContact CD1-CD1 4.14Å; F118-Y132 AromaticContact CD1-CD2 3.82Å; F118-Y132 HydrophobicContact CD1-CD2 3.82Å; F118-Y132 AromaticContact CD1-CE1 3.98Å; F118-Y132 HydrophobicContact CD1-CE1 3.98Å; F118-Y132 AromaticContact CD1-CE2 3.65Å; F118-Y132 HydrophobicContact CD1-CE2 3.65Å; F118-Y132 HydrophobicContact CD1-CG 4.07Å; F118-Y132 AromaticContact CD1-CZ 3.76Å; F118-Y132 HydrophobicContact CE1-CD1 4.3Å; F118-Y132 HydrophobicContact CE1-CD2 4.2Å; F118-Y132 HydrophobicContact CE1-CE2 4.47Å; F118-Y132 HydrophobicContact CE1-CG 4.13Å; F118-Y132 PolarHBondContact O-OH 2.88Å; F118-I156 HydrophobicContact CD1-CD1 3.58Å; F118-I156 HydrophobicContact CD2-CG2 3.62Å; F118-I156 HydrophobicContact CE1-CD1 3.75Å; F118-I156 HydrophobicContact CE1-CG1 4.45Å; F118-I156 HydrophobicContact CE2-CG2 3.68Å; F118-I156 HydrophobicContact CG-CD1 4.02Å; F118-I156 HydrophobicContact CG-CG2 4.07Å; F118-I156 HydrophobicContact CZ-CD1 4.32Å; F118-I156 HydrophobicContact CZ-CG2 4.19Å; F118-I158 HydrophobicContact CB-CD1 4.05Å; F118-I158 HydrophobicContact CD2-CD1 4.05Å; F118-I158 HydrophobicContact CG-CD1 4.46Å; F118-A173 HydrophobicContact CD2-CB 4.04Å; F118-A173 HydrophobicContact CE2-CB 3.72Å; F118-V175 HydrophobicContact CE1-CG2 4.3Å; F118-V175 HydrophobicContact CE2-CG2 3.92Å; F118-V175 HydrophobicContact CZ-CG2 3.39Å
119	R	84.9	Confident	83.8	Confident	73 Å²	73	56.5 Å²	56.5	28%	0.275	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.2	179.7	-166.8	166.7	-178.5	169.9	-1	111	S116 V121 W126 N170	S116-R119 PolarHBondContact O-N 2.77Å; R119-V121 PolarHBondContact O-N 3.36Å; R119-W126 HydrophobicContact CB-CE3 4.18Å; R119-W126 HydrophobicContact CB-CZ3 3.99Å; R119-N170 WeakPolarHBondContact CD-OD1 3.3Å; R119-N170 PolarHBondContact NH1-OD1 2.76Å
120	H	73.5	Confident	83.5	Confident	71 Å²	71	56.9 Å²	56.9	33%	0.329	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	113.4	172	-69.6	-91.1	0	0	0	109.6	L122 Q123 K124 R125	H120-L122 PolarHBondContact O-N 3.17Å; H120-Q123 HydrophobicContact CB-CB 4.26Å; H120-Q123 PolarHBondContact O-N 2.52Å; H120-K124 WeakPolarHBondContact O-CA 3.11Å; H120-K124 PolarHBondContact O-N 3.18Å; H120-R125 PolarHBondContact N-O 2.72Å
121	V	63.2	Low	83.3	Confident	115 Å²	115	56.2 Å²	56.2	70%	0.697	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-49.8	-177.8	-178.3	0	0	0	0	111.6	R119	R119-V121 PolarHBondContact O-N 3.36Å
122	L	60.3	Low	83.1	Confident	174 Å²	174	56.4 Å²	56.4	91%	0.911	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-37.9	-176.1	-69.2	169.3	0	0	0	113.7	H120	H120-L122 PolarHBondContact O-N 3.17Å
123	Q	59.1	Low	82.9	Confident	131 Å²	131	57.9 Å²	57.9	61%	0.612	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-7.5	-174.6	-67.8	-175.7	-11.7	0	0	113.4	H120 R125	H120-Q123 HydrophobicContact CB-CB 4.26Å; H120-Q123 PolarHBondContact O-N 2.52Å; Q123-R125 HydrophobicContact CB-CB 4.39Å; Q123-R125 WeakPolarHBondContact O-CG 3.24Å; Q123-R125 PolarHBondContact O-N 3.21Å
124	K	64.7	Low	82.8	Confident	142 Å²	142	57.9 Å²	57.9	62%	0.617	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	27.5	-172.9	-61.1	-173.7	176.8	-174.3	0	113.9	H120	H120-K124 WeakPolarHBondContact O-CA 3.11Å; H120-K124 PolarHBondContact O-N 3.18Å
125	R	78.6	Confident	82.7	Confident	178 Å²	178	59.3 Å²	59.3	67%	0.672	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	152.3	-179.2	-74.7	177.5	-175.1	-170.3	0.8	111.3	H120 Q123	H120-R125 PolarHBondContact N-O 2.72Å; Q123-R125 HydrophobicContact CB-CB 4.39Å; Q123-R125 WeakPolarHBondContact O-CG 3.24Å; Q123-R125 PolarHBondContact O-N 3.21Å
126	W	83.3	Confident	82.6	Confident	69 Å²	69	59.3 Å²	59.3	26%	0.261	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	137.7	170.5	-62.4	103.7	0	0	0	110.3	F118 R119 I158 N170 I311 L313	F118-W126 HydrophobicContact CB-CE3 4.32Å; R119-W126 HydrophobicContact CB-CE3 4.18Å; R119-W126 HydrophobicContact CB-CZ3 3.99Å; W126-I158 HydrophobicContact CD2-CD1 4.4Å; W126-I158 HydrophobicContact CE3-CD1 3.48Å; W126-I158 VanDerWaalsContact CE3-CD1 3.48Å; W126-I158 HydrophobicContact CH2-CD1 3.93Å; W126-I158 HydrophobicContact CH2-CG2 4.08Å; W126-I158 HydrophobicContact CZ3-CD1 3.2Å; W126-I158 HydrophobicContact CZ3-CG1 4.49Å; W126-I158 HydrophobicContact CZ3-CG2 4.31Å; W126-N170 HydrophobicContact CH2-CB 4.11Å; W126-I311 HydrophobicContact CD2-CG2 4.42Å; W126-I311 HydrophobicContact CH2-CD1 4.1Å; W126-I311 HydrophobicContact CZ2-CD1 3.27Å; W126-L313 HydrophobicContact CB-CD1 3.97Å; W126-L313 HydrophobicContact CB-CD2 3.73Å; W126-L313 HydrophobicContact CE3-CD1 4.34Å; W126-L313 HydrophobicContact CG-CD1 4.46Å; W126-L313 HydrophobicContact CG-CD2 4.2Å
127	G	83.5	Confident	82.4	Confident	4 Å²	4	62.3 Å²	62.3	4%	0.041	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-74.4	153.8	172.5	0	0	0	0	0	111.6	F118	F118-G127 PolarHBondContact O-N 3.44Å
128	T	88	Confident	82	Confident	81 Å²	81	62.7 Å²	62.7	50%	0.497	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-78.6	150.5	174.2	58.8	0	0	0	0	110.3	S130 S131 Y132	T128-S130 PolarHBondContact O-N 2.83Å; T128-S130 VanDerWaalsContact O-N 3.09Å; T128-S130 PolarHBondContact OG1-OG 3.41Å; T128-S131 WeakPolarHBondContact O-CB 3.2Å; T128-S131 PolarHBondContact O-N 2.93Å; T128-S131 PolarHBondContact O-OG 3.06Å; T128-Y132 VanDerWaalsContact O-CD2 3.3Å; T128-Y132 WeakPolarHBondContact O-CD2 3.35Å; T128-Y132 WeakPolarHBondContact O-CE2 3.45Å
129	P	89.2	Confident	81.4	Confident	13 Å²	13	65.8 Å²	65.8	8%	0.084	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-54.7	-31.9	177.2	-29.3	37.2	0	0	0	113.9	S131 Y132 P153 I156 L313	P129-S131 PolarHBondContact O-N 2.94Å; P129-Y132 PolarHBondContact O-N 3.26Å; P129-P153 HydrophobicContact CB-CB 3.94Å; P129-I156 HydrophobicContact CB-CD1 4.25Å; P129-I156 HydrophobicContact CB-CG1 4.42Å; P129-I156 HydrophobicContact CG-CD1 4.16Å; P129-I156 HydrophobicContact CG-CG1 4.27Å; P129-L313 HydrophobicContact CG-CB 4.13Å; P129-L313 VanDerWaalsContact CG-O 3.23Å; P129-L313 WeakPolarHBondContact CG-O 3.17Å
130	S	88.5	Confident	81	Confident	84 Å²	84	62.9 Å²	62.9	59%	0.587	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-66	-11.9	175.1	54.4	0	0	0	0	115.1	T128 Y132	T128-S130 PolarHBondContact O-N 2.83Å; T128-S130 VanDerWaalsContact O-N 3.09Å; T128-S130 PolarHBondContact OG1-OG 3.41Å; S130-Y132 VanDerWaalsContact C-N 3.33Å
131	S	88.1	Confident	81	Confident	19 Å²	19	64.9 Å²	64.9	13%	0.133	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-90.7	4.8	179.7	70	0	0	0	0	113.7	G83 K84 T128 P129	G83-S131 CarbonylContact C-O 3.56Å; K84-S131 PolarHBondContact N-O 2.85Å; T128-S131 WeakPolarHBondContact O-CB 3.2Å; T128-S131 PolarHBondContact O-N 2.93Å; T128-S131 PolarHBondContact O-OG 3.06Å; P129-S131 PolarHBondContact O-N 2.94Å
132	Y	91.6	Very high	81.4	Confident	5 Å²	5	68 Å²	68	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.8	-176.4	-55.5	-81.3	0	0	0	111.9	I81 R82 F118 T128 P129 S130 Q152 P153 I156	I81-Y132 HydrophobicContact CG2-CD1 4.3Å; R82-Y132 CarbonylContact O-C 3.54Å; R82-Y132 VanDerWaalsContact O-CA 3.27Å; R82-Y132 WeakPolarHBondContact O-CA 3.5Å; F118-Y132 WeakPolarHBondContact CA-OH 3.27Å; F118-Y132 HydrophobicContact CB-CE2 4.48Å; F118-Y132 HydrophobicContact CD1-CD1 4.14Å; F118-Y132 AromaticContact CD1-CD2 3.82Å; F118-Y132 HydrophobicContact CD1-CD2 3.82Å; F118-Y132 AromaticContact CD1-CE1 3.98Å; F118-Y132 HydrophobicContact CD1-CE1 3.98Å; F118-Y132 AromaticContact CD1-CE2 3.65Å; F118-Y132 HydrophobicContact CD1-CE2 3.65Å; F118-Y132 HydrophobicContact CD1-CG 4.07Å; F118-Y132 AromaticContact CD1-CZ 3.76Å; F118-Y132 HydrophobicContact CE1-CD1 4.3Å; F118-Y132 HydrophobicContact CE1-CD2 4.2Å; F118-Y132 HydrophobicContact CE1-CE2 4.47Å; F118-Y132 HydrophobicContact CE1-CG 4.13Å; F118-Y132 PolarHBondContact O-OH 2.88Å; T128-Y132 VanDerWaalsContact O-CD2 3.3Å; T128-Y132 WeakPolarHBondContact O-CD2 3.35Å; T128-Y132 WeakPolarHBondContact O-CE2 3.45Å; P129-Y132 PolarHBondContact O-N 3.26Å; S130-Y132 VanDerWaalsContact C-N 3.33Å; Y132-Q152 PolarHBondContact O-OE1 3.49Å; Y132-P153 WeakPolarHBondContact O-CD 3.4Å; Y132-I156 HydrophobicContact CD2-CD1 4.15Å; Y132-I156 HydrophobicContact CE2-CD1 4.43Å
133	T	92	Very high	81.6	Confident	30 Å²	30	60 Å²	60	18%	0.184	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.8	171.8	-57	0	0	0	0	108.8	R82 F135 Q152	R82-T133 PolarHBondContact N-O 3.48Å; R82-T133 PolarHBondContact O-N 3.22Å; T133-F135 HydrophobicContact CG2-CD2 4.06Å; T133-F135 HydrophobicContact CG2-CE1 4.46Å; T133-F135 HydrophobicContact CG2-CE2 3.45Å; T133-F135 VanDerWaalsContact CG2-CE2 3.45Å; T133-F135 HydrophobicContact CG2-CZ 3.69Å; T133-Q152 PolarHBondContact OG1-NE2 2.9Å
134	V	93.1	Very high	82.1	Confident	1 Å²	1	57 Å²	57	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130	176	-176.3	0	0	0	0	109	V79 A80 I81 I111 S150 G151 P153 L177 F181	V79-V134 HydrophobicContact CB-CG1 3.8Å; V79-V134 HydrophobicContact CG1-CG1 4.29Å; V79-V134 HydrophobicContact CG2-CG1 3.83Å; A80-V134 CarbonylContact O-C 3.36Å; I81-V134 HydrophobicContact CG1-CG2 4.37Å; I111-V134 HydrophobicContact CD1-CG1 4.42Å; I111-V134 HydrophobicContact CG1-CG1 4.24Å; V134-S150 CarbonylContact O-C 3.57Å; V134-S150 VanDerWaalsContact O-CA 3.3Å; V134-S150 WeakPolarHBondContact O-CA 3.1Å; V134-G151 PolarHBondContact N-O 3.29Å; V134-G151 PolarHBondContact O-N 3.12Å; V134-P153 HydrophobicContact CG2-CG 4.3Å; V134-L177 HydrophobicContact CB-CD2 4Å; V134-L177 HydrophobicContact CG2-CD2 3.78Å; V134-F181 HydrophobicContact CG1-CE2 4.16Å; V134-F181 HydrophobicContact CG1-CZ 4.37Å
135	F	91.8	Very high	82	Confident	30 Å²	30	51.7 Å²	51.7	13%	0.132	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.7	177.2	-68.3	-95.5	0	0	0	109.7	V79 A80 R82 T133 L138 F144 Q149	V79-F135 CarbonylContact C-O 3.59Å; V79-F135 VanDerWaalsContact CA-O 3.22Å; V79-F135 WeakPolarHBondContact CA-O 3.41Å; V79-F135 VanDerWaalsContact CB-O 3.23Å; V79-F135 WeakPolarHBondContact CB-O 3.4Å; A80-F135 PolarHBondContact N-O 3.39Å; A80-F135 PolarHBondContact O-N 2.78Å; R82-F135 HydrophobicContact CB-CD2 4.12Å; R82-F135 HydrophobicContact CB-CE2 3.72Å; R82-F135 HydrophobicContact CG-CE2 4.35Å; T133-F135 HydrophobicContact CG2-CD2 4.06Å; T133-F135 HydrophobicContact CG2-CE1 4.46Å; T133-F135 HydrophobicContact CG2-CE2 3.45Å; T133-F135 VanDerWaalsContact CG2-CE2 3.45Å; T133-F135 HydrophobicContact CG2-CZ 3.69Å; F135-L138 HydrophobicContact CB-CD2 3.91Å; F135-F144 HydrophobicContact CB-CD1 4.34Å; F135-F144 HydrophobicContact CD1-CD1 4.09Å; F135-F144 AromaticContact CD2-CD1 3.58Å; F135-F144 HydrophobicContact CD2-CD1 3.58Å; F135-F144 AromaticContact CD2-CE1 3.64Å; F135-F144 HydrophobicContact CD2-CE1 3.64Å; F135-F144 HydrophobicContact CE1-CD1 4.28Å; F135-F144 AromaticContact CE2-CD1 3.8Å; F135-F144 HydrophobicContact CE2-CD1 3.8Å; F135-F144 HydrophobicContact CE2-CE1 4.02Å; F135-F144 AromaticContact CG-CD1 3.73Å; F135-F144 HydrophobicContact CG-CD1 3.73Å; F135-F144 HydrophobicContact CG-CE1 4.13Å; F135-F144 HydrophobicContact CZ-CD1 4.15Å; F135-Q149 WeakPolarHBondContact CA-O 3.35Å
136	A	89.3	Confident	80.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	170.8	173.3	0	0	0	0	0	109.8	V79 I94 G148 Q149 F181 L187	V79-A136 HydrophobicContact CG1-CB 3.78Å; I94-A136 HydrophobicContact CD1-CB 4.24Å; A136-G148 VanDerWaalsContact O-CA 3.29Å; A136-G148 WeakPolarHBondContact O-CA 3.39Å; A136-Q149 PolarHBondContact N-O 3.08Å; A136-Q149 PolarHBondContact O-N 3.21Å; A136-Q149 VanDerWaalsContact O-N 3.09Å; A136-F181 HydrophobicContact CB-CD1 4.37Å; A136-F181 HydrophobicContact CB-CD2 4.04Å; A136-F181 HydrophobicContact CB-CE1 4.07Å; A136-F181 HydrophobicContact CB-CE2 3.69Å; A136-F181 HydrophobicContact CB-CG 4.38Å; A136-F181 HydrophobicContact CB-CZ 3.71Å; A136-L187 HydrophobicContact CB-CD1 4.41Å; A136-L187 HydrophobicContact CB-CD2 3.73Å
137	R	85.1	Confident	79.9	Confident	79 Å²	79	58.2 Å²	58.2	30%	0.298	29%	0.285	S	S	.	.	S	Bend	trans	58.1	60	-173.6	-173.9	-176.5	171.7	-170.3	24.5	110.2	R147 E186 L187	R137-R147 WeakPolarHBondContact CD-O 3.44Å; R137-R147 PolarHBondContact NH1-O 3.47Å; R137-E186 VanDerWaalsContact CD-OE2 3.32Å; R137-E186 WeakPolarHBondContact CD-OE2 3.22Å; R137-E186 HydrophobicContact CG-CB 4.26Å; R137-E186 VanDerWaalsContact CZ-CD 3.44Å; R137-E186 IonicContact CZ-OE1 3.51Å; R137-E186 VanDerWaalsContact CZ-OE1 3.26Å; R137-E186 IonicContact CZ-OE2 3.78Å; R137-E186 IonicContact NE-OE1 2.99Å; R137-E186 PolarHBondContact NE-OE1 2.56Å; R137-E186 VanDerWaalsContact NE-OE1 3.09Å; R137-E186 IonicContact NE-OE2 3.88Å; R137-E186 PolarHBondContact NE-OE2 2.85Å; R137-E186 IonicContact NH1-OE2 3.07Å; R137-E186 IonicContact NH2-OE1 3.56Å; R137-E186 PolarHBondContact NH2-OE1 2.9Å; R137-E186 IonicContact NH2-OE2 3.75Å; R137-E186 PolarHBondContact NH2-OE2 2.86Å; R137-L187 HydrophobicContact CB-CD2 4.24Å; R137-L187 HydrophobicContact CB-CG 4.4Å
138	L	82.5	Confident	79	Confident	16 Å²	16	59.2 Å²	59.2	8%	0.084	30%	0.295	C	S	.	.			trans	-83.1	152.4	-177.7	-49.3	171.7	0	0	0	109.4	V74 T78 A80 F135 L143 M215	V74-L138 HydrophobicContact CG2-CB 3.94Å; V74-L138 WeakPolarHBondContact CG2-O 3.4Å; T78-L138 HydrophobicContact CG2-CD1 4.5Å; A80-L138 HydrophobicContact CB-CD1 3.84Å; A80-L138 HydrophobicContact CB-CD2 3.96Å; F135-L138 HydrophobicContact CB-CD2 3.91Å; L138-L143 HydrophobicContact CB-CD2 4.34Å; L138-L143 HydrophobicContact CD1-CD2 4.18Å; L138-L143 WeakPolarHBondContact CD2-O 3.5Å; L138-M215 HydrophobicContact CB-CE 4.47Å; L138-M215 HydrophobicContact CD1-CE 3.41Å; L138-M215 VanDerWaalsContact CD1-CE 3.41Å; L138-M215 HydrophobicContact CD1-SD 4.38Å
139	D	79.6	Confident	78.6	Confident	66 Å²	66	58.2 Å²	58.2	35%	0.353	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-105.2	144.9	165.2	176.9	-44.5	0	0	0	107.1	F141 R142	D139-F141 PolarHBondContact O-N 3.2Å; D139-F141 PolarHBondContact OD1-N 3.3Å; D139-R142 HydrophobicContact CB-CB 4.15Å; D139-R142 CarbonylContact O-C 3.6Å; D139-R142 PolarHBondContact O-N 3.28Å; D139-R142 VanDerWaalsContact O-N 3.12Å
140	R	76.4	Confident	78.4	Confident	12 Å²	12	61.2 Å²	61.2	5%	0.045	31%	0.306	C	S	.	.	S	Bend	trans	-49	-32.7	178.2	-77.3	-173.8	-172.8	-124.7	3.5	113.4	Y67 S70 K71 S72 E73 V74 R214 M215 D216	Y67-R140 PolarHBondContact O-NH2 2.93Å; S70-R140 PolarHBondContact O-NE 3.33Å; S70-R140 PolarHBondContact O-NH2 3.01Å; K71-R140 VanDerWaalsContact O-CD 3.3Å; K71-R140 WeakPolarHBondContact O-CD 3.44Å; S72-R140 WeakPolarHBondContact O-CG 3.39Å; S72-R140 PolarHBondContact O-N 2.88Å; E73-R140 PolarHBondContact O-NE 2.96Å; E73-R140 PolarHBondContact O-NH2 3.14Å; E73-R140 VanDerWaalsContact O-NH2 3.14Å; V74-R140 HydrophobicContact CG1-CB 4.4Å; V74-R140 HydrophobicContact CG1-CG 3.53Å; R140-R214 CarbonylContact O-C 3.26Å; R140-R214 VanDerWaalsContact O-CA 3.28Å; R140-R214 WeakPolarHBondContact O-CA 3.32Å; R140-M215 WeakPolarHBondContact CG-O 3.32Å; R140-M215 PolarHBondContact O-N 3.01Å; R140-D216 IonicContact NH1-OD1 3.1Å; R140-D216 PolarHBondContact NH1-OD1 2.65Å
141	F	73.6	Confident	78.4	Confident	113 Å²	113	57.3 Å²	57.3	50%	0.496	28%	0.279	S	S	.	.	S	Bend	trans	-104.1	-19.9	-178.7	-56.3	-80.6	0	0	0	113.9	D139 R214	D139-F141 PolarHBondContact O-N 3.2Å; D139-F141 PolarHBondContact OD1-N 3.3Å; F141-R214 HydrophobicContact CE1-CG 4.48Å
142	R	70.7	Confident	78.6	Confident	182 Å²	182	60 Å²	60	69%	0.687	29%	0.29	S	S	*	.			trans	-130.1	73.6	-171.5	-63.4	-178.1	-178.4	-178.8	1.4	111.8	D139 F144 G145	D139-R142 HydrophobicContact CB-CB 4.15Å; D139-R142 CarbonylContact O-C 3.6Å; D139-R142 PolarHBondContact O-N 3.28Å; D139-R142 VanDerWaalsContact O-N 3.12Å; R142-F144 PolarHBondContact O-N 2.86Å; R142-F144 VanDerWaalsContact O-N 3.08Å; R142-G145 PolarHBondContact O-N 2.83Å
143	L	64.9	Low	78.6	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.031	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-32.2	176.9	-63.9	-170.3	0	0	0	114.3	A80 F88 L138 Y210 M215	A80-L143 HydrophobicContact CB-CD1 4.27Å; F88-L143 HydrophobicContact CD2-CD1 3.64Å; F88-L143 HydrophobicContact CE2-CD1 3.89Å; L138-L143 HydrophobicContact CB-CD2 4.34Å; L138-L143 HydrophobicContact CD1-CD2 4.18Å; L138-L143 WeakPolarHBondContact CD2-O 3.5Å; L143-Y210 HydrophobicContact CD1-CD1 4.05Å; L143-Y210 HydrophobicContact CD1-CD2 3.69Å; L143-Y210 HydrophobicContact CD1-CE1 3.64Å; L143-Y210 HydrophobicContact CD1-CE2 3.25Å; L143-Y210 HydrophobicContact CD1-CG 4.04Å; L143-Y210 WeakPolarHBondContact CD1-OH 3.46Å; L143-Y210 HydrophobicContact CD2-CD2 4.04Å; L143-Y210 HydrophobicContact CD2-CE2 3.91Å; L143-Y210 HydrophobicContact CG-CD2 4.07Å; L143-Y210 HydrophobicContact CG-CE2 3.48Å; L143-Y210 VanDerWaalsContact CG-CE2 3.48Å; L143-M215 HydrophobicContact CD2-CE 3.35Å
144	F	69.4	Low	78.7	Confident	68 Å²	68	64.5 Å²	64.5	30%	0.298	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	28.8	-173.8	-49	-58.4	0	0	0	111.9	A80 R82 F88 F135 R142	A80-F144 HydrophobicContact CB-CE1 4.28Å; R82-F144 HydrophobicContact CB-CE1 3.98Å; R82-F144 HydrophobicContact CB-CZ 4.23Å; R82-F144 HydrophobicContact CG-CE1 4.13Å; R82-F144 HydrophobicContact CG-CZ 4.06Å; F88-F144 HydrophobicContact CB-CZ 4.36Å; F88-F144 HydrophobicContact CD2-CZ 4.3Å; F135-F144 HydrophobicContact CB-CD1 4.34Å; F135-F144 HydrophobicContact CD1-CD1 4.09Å; F135-F144 AromaticContact CD2-CD1 3.58Å; F135-F144 HydrophobicContact CD2-CD1 3.58Å; F135-F144 AromaticContact CD2-CE1 3.64Å; F135-F144 HydrophobicContact CD2-CE1 3.64Å; F135-F144 HydrophobicContact CE1-CD1 4.28Å; F135-F144 AromaticContact CE2-CD1 3.8Å; F135-F144 HydrophobicContact CE2-CD1 3.8Å; F135-F144 HydrophobicContact CE2-CE1 4.02Å; F135-F144 AromaticContact CG-CD1 3.73Å; F135-F144 HydrophobicContact CG-CD1 3.73Å; F135-F144 HydrophobicContact CG-CE1 4.13Å; F135-F144 HydrophobicContact CZ-CD1 4.15Å; R142-F144 PolarHBondContact O-N 2.86Å; R142-F144 VanDerWaalsContact O-N 3.08Å
145	G	62.1	Low	78.6	Confident	29 Å²	29	64.4 Å²	64.4	30%	0.299	31%	0.307	S	S	.	.			trans	-64.8	157.4	178	0	0	0	0	0	113	R142 R147 G148	R142-G145 PolarHBondContact O-N 2.83Å; G145-R147 PolarHBondContact O-N 3.12Å; G145-G148 PolarHBondContact O-N 2.88Å
146	I	56.2	Low	78.7	Confident	187 Å²	187	63 Å²	63	96%	0.959	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.6	-177.1	-57.2	170.8	0	0	0	112.7
147	R	62.4	Low	78.7	Confident	197 Å²	197	65.8 Å²	65.8	74%	0.743	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.2	-178.9	-74	-175.5	169	-178.6	-3.2	114.8	R137 G145	R137-R147 WeakPolarHBondContact CD-O 3.44Å; R137-R147 PolarHBondContact NH1-O 3.47Å; G145-R147 PolarHBondContact O-N 3.12Å
148	G	65.3	Low	79	Confident	25 Å²	25	62 Å²	62	26%	0.258	30%	0.297	S	S	.	.			trans	-75.1	141.8	-173.5	0	0	0	0	0	113.8	A136 G145	A136-G148 VanDerWaalsContact O-CA 3.29Å; A136-G148 WeakPolarHBondContact O-CA 3.39Å; G145-G148 PolarHBondContact O-N 2.88Å
149	Q	78.4	Confident	79.1	Confident	60 Å²	60	61.8 Å²	61.8	28%	0.28	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	134.9	168.3	-68.7	-171	28.4	0	0	109.1	F135 A136 F181 L187	F135-Q149 WeakPolarHBondContact CA-O 3.35Å; A136-Q149 PolarHBondContact N-O 3.08Å; A136-Q149 PolarHBondContact O-N 3.21Å; A136-Q149 VanDerWaalsContact O-N 3.09Å; Q149-F181 HydrophobicContact CB-CD1 3.91Å; Q149-F181 HydrophobicContact CB-CE1 3.74Å; Q149-L187 HydrophobicContact CG-CD1 4.25Å
150	S	86	Confident	79.3	Confident	77 Å²	77	59.6 Å²	59.6	54%	0.538	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136	176.6	68.7	0	0	0	0	111.9	V134	V134-S150 CarbonylContact O-C 3.57Å; V134-S150 VanDerWaalsContact O-CA 3.3Å; V134-S150 WeakPolarHBondContact O-CA 3.1Å
151	G	88.4	Confident	79.3	Confident	2 Å²	2	60.3 Å²	60.3	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.8	178.9	0	0	0	0	0	110.4	V134	V134-G151 PolarHBondContact N-O 3.29Å; V134-G151 PolarHBondContact O-N 3.12Å
152	Q	91.9	Very high	78.9	Confident	75 Å²	75	59.2 Å²	59.2	35%	0.35	29%	0.287	S	S	.	.			trans	-91.6	126.2	173.2	-69.6	-63	-39	0	0	109.4	Y132 T133 K154 L177 K178	Y132-Q152 PolarHBondContact O-OE1 3.49Å; T133-Q152 PolarHBondContact OG1-NE2 2.9Å; Q152-K154 PolarHBondContact O-N 3.46Å; Q152-L177 CarbonylContact O-C 3.58Å; Q152-L177 WeakPolarHBondContact O-CA 3.15Å; Q152-K178 HydrophobicContact CB-CD 3.98Å; Q152-K178 HydrophobicContact CB-CG 4.43Å; Q152-K178 WeakPolarHBondContact O-CG 2.85Å; Q152-K178 PolarHBondContact O-N 2.78Å
153	P	92.5	Very high	78.4	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.013	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	129.8	173.3	-26.7	38.5	0	0	0	112	P129 Y132 V134 I156 V175	P129-P153 HydrophobicContact CB-CB 3.94Å; Y132-P153 WeakPolarHBondContact O-CD 3.4Å; V134-P153 HydrophobicContact CG2-CG 4.3Å; P153-I156 HydrophobicContact CB-CG1 4.48Å; P153-V175 HydrophobicContact CB-CG1 3.72Å; P153-V175 HydrophobicContact CG-CG1 3.86Å
154	K	92.6	Very high	78.1	Confident	127 Å²	127	54.8 Å²	54.8	55%	0.552	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	-45	167	-176.1	-178.9	176.9	-177.1	0	110.1	Q152 T176 K178	Q152-K154 PolarHBondContact O-N 3.46Å; K154-T176 WeakPolarHBondContact CA-O 3.38Å; K154-T176 WeakPolarHBondContact CB-O 3.3Å; K154-T176 PolarHBondContact N-O 3.44Å; K154-K178 HydrophobicContact CB-CG 3.75Å; K154-K178 HydrophobicContact CG-CG 4.42Å
155	G	92	Very high	77.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	155.1	-178.6	0	0	0	0	0	111.6	T176 L313	G155-T176 PolarHBondContact N-O 2.94Å; G155-T176 PolarHBondContact O-N 2.87Å; G155-L313 CarbonylContact C-O 3.57Å; G155-L313 VanDerWaalsContact CA-O 3.24Å; G155-L313 WeakPolarHBondContact CA-O 3.08Å
156	I	92.6	Very high	77.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.5	176.7	-54.9	162.9	0	0	0	107.3	F118 P129 Y132 P153 I158 A173 V175 L313	F118-I156 HydrophobicContact CD1-CD1 3.58Å; F118-I156 HydrophobicContact CD2-CG2 3.62Å; F118-I156 HydrophobicContact CE1-CD1 3.75Å; F118-I156 HydrophobicContact CE1-CG1 4.45Å; F118-I156 HydrophobicContact CE2-CG2 3.68Å; F118-I156 HydrophobicContact CG-CD1 4.02Å; F118-I156 HydrophobicContact CG-CG2 4.07Å; F118-I156 HydrophobicContact CZ-CD1 4.32Å; F118-I156 HydrophobicContact CZ-CG2 4.19Å; P129-I156 HydrophobicContact CB-CD1 4.25Å; P129-I156 HydrophobicContact CB-CG1 4.42Å; P129-I156 HydrophobicContact CG-CD1 4.16Å; P129-I156 HydrophobicContact CG-CG1 4.27Å; Y132-I156 HydrophobicContact CD2-CD1 4.15Å; Y132-I156 HydrophobicContact CE2-CD1 4.43Å; P153-I156 HydrophobicContact CB-CG1 4.48Å; I156-I158 HydrophobicContact CG2-CD1 4.04Å; I156-I158 HydrophobicContact CG2-CG1 3.75Å; I156-A173 HydrophobicContact CG2-CB 4.44Å; I156-V175 HydrophobicContact CG1-CG1 4.28Å; I156-V175 HydrophobicContact CG1-CG2 4.4Å; I156-V175 HydrophobicContact CG2-CG2 4.44Å; I156-L313 HydrophobicContact CB-CB 4.2Å; I156-L313 HydrophobicContact CB-CD1 4.29Å; I156-L313 HydrophobicContact CG2-CD1 4.47Å; I156-L313 PolarHBondContact N-O 2.95Å; I156-L313 PolarHBondContact O-N 3.29Å
157	R	90.8	Very high	78.5	Confident	58 Å²	58	55.1 Å²	55.1	22%	0.219	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.9	176.5	180	174.4	176.7	-175.2	-1.1	108.7	A173 L174 F310 E312	R157-A173 CarbonylContact O-C 3.43Å; R157-A173 VanDerWaalsContact O-CA 3.31Å; R157-A173 WeakPolarHBondContact O-CA 3.38Å; R157-L174 PolarHBondContact N-O 3.41Å; R157-L174 PolarHBondContact O-N 3.42Å; R157-F310 HydrophobicContact CG-CB 4.12Å; R157-F310 HydrophobicContact CG-CD1 3.56Å; R157-F310 HydrophobicContact CG-CE1 4.22Å; R157-F310 HydrophobicContact CG-CG 4.08Å; R157-F310 VanDerWaalsContact NE-CE1 3.3Å; R157-F310 VanDerWaalsContact NE-CG 3.3Å; R157-E312 HydrophobicContact CG-CG 4.38Å
158	I	89.7	Confident	79	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.8	-173.2	-51	-179.8	0	0	0	108.9	F118 W126 I156 P160 N170 A173 F310 I311 L313	F118-I158 HydrophobicContact CB-CD1 4.05Å; F118-I158 HydrophobicContact CD2-CD1 4.05Å; F118-I158 HydrophobicContact CG-CD1 4.46Å; W126-I158 HydrophobicContact CD2-CD1 4.4Å; W126-I158 HydrophobicContact CE3-CD1 3.48Å; W126-I158 VanDerWaalsContact CE3-CD1 3.48Å; W126-I158 HydrophobicContact CH2-CD1 3.93Å; W126-I158 HydrophobicContact CH2-CG2 4.08Å; W126-I158 HydrophobicContact CZ3-CD1 3.2Å; W126-I158 HydrophobicContact CZ3-CG1 4.49Å; W126-I158 HydrophobicContact CZ3-CG2 4.31Å; I156-I158 HydrophobicContact CG2-CD1 4.04Å; I156-I158 HydrophobicContact CG2-CG1 3.75Å; I158-P160 WeakPolarHBondContact O-CD 3.43Å; I158-N170 WeakPolarHBondContact CG2-O 3.45Å; I158-A173 HydrophobicContact CB-CB 4.46Å; I158-A173 HydrophobicContact CG1-CB 3.93Å; I158-A173 HydrophobicContact CG2-CB 4.49Å; I158-F310 CarbonylContact O-C 3.53Å; I158-F310 WeakPolarHBondContact O-CA 3.42Å; I158-I311 HydrophobicContact CB-CB 4.25Å; I158-I311 PolarHBondContact N-O 3.34Å; I158-I311 PolarHBondContact O-N 2.85Å; I158-L313 HydrophobicContact CD1-CD1 3.9Å
159	M	86.6	Confident	79.5	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	100.1	171.4	-179.8	59.4	88.7	0	0	109.1	G171 V172 N306 R309 F310	M159-G171 VanDerWaalsContact O-CA 3.32Å; M159-G171 WeakPolarHBondContact O-CA 3.44Å; M159-V172 HydrophobicContact CB-CG2 4.28Å; M159-V172 PolarHBondContact N-O 3.13Å; M159-V172 PolarHBondContact O-N 3.04Å; M159-N306 HydrophobicContact CE-CB 3.95Å; M159-R309 HydrophobicContact CE-CB 4.3Å; M159-R309 HydrophobicContact SD-CB 3.8Å; M159-F310 HydrophobicContact CB-CD1 4.09Å; M159-F310 HydrophobicContact CB-CE1 3.94Å; M159-F310 HydrophobicContact CE-CD1 3.83Å; M159-F310 HydrophobicContact CE-CD2 3.91Å; M159-F310 HydrophobicContact CE-CE1 3.34Å; M159-F310 HydrophobicContact CE-CE2 3.36Å; M159-F310 HydrophobicContact CE-CG 4.13Å; M159-F310 HydrophobicContact CE-CZ 3.08Å; M159-F310 HydrophobicContact CG-CE1 4.48Å; M159-F310 HydrophobicContact SD-CD1 4.38Å; M159-F310 HydrophobicContact SD-CE1 4.32Å
160	P	83.9	Confident	79.6	Confident	19 Å²	19	45.9 Å²	45.9	12%	0.123	23%	0.226	C	C	.	.			trans	-71.7	142.5	176.4	30.6	-33.9	0	0	0	111.4	I158 W169 R309 I311	I158-P160 WeakPolarHBondContact O-CD 3.43Å; P160-W169 WeakPolarHBondContact CA-O 3.42Å; P160-W169 WeakPolarHBondContact CB-O 3.45Å; P160-R309 VanDerWaalsContact CD-O 3.23Å; P160-R309 WeakPolarHBondContact CD-O 3.45Å; P160-I311 HydrophobicContact CG-CD1 4.15Å; P160-I311 HydrophobicContact CG-CG1 4.45Å
161	Y	76.2	Confident	79.7	Confident	28 Å²	28	42.2 Å²	42.2	11%	0.11	20%	0.201	C	C	.	.			trans	-90.7	-19	176.1	-71.5	-16.3	0	0	0	113.5	A163 I168 W169 V172 T239 L274 F292 G294 H295 T298	Y161-A163 VanDerWaalsContact C-N 3.31Å; Y161-A163 PolarHBondContact O-N 2.78Å; Y161-I168 HydrophobicContact CD2-CG2 3.99Å; Y161-W169 PolarHBondContact N-O 3.28Å; Y161-V172 HydrophobicContact CE1-CG2 4.41Å; Y161-V172 WeakPolarHBondContact OH-CG1 3.24Å; Y161-T239 HydrophobicContact CD1-CG2 4.33Å; Y161-T239 HydrophobicContact CD2-CG2 3.64Å; Y161-T239 HydrophobicContact CE2-CG2 4.37Å; Y161-T239 HydrophobicContact CG-CG2 3.61Å; Y161-L274 HydrophobicContact CD2-CD1 3.93Å; Y161-L274 HydrophobicContact CE2-CD1 3.47Å; Y161-L274 VanDerWaalsContact CE2-CD1 3.47Å; Y161-F292 HydrophobicContact CE2-CE1 4.44Å; Y161-G294 WeakPolarHBondContact OH-CA 2.97Å; Y161-H295 PolarHBondContact OH-N 3.25Å; Y161-T298 HydrophobicContact CE1-CG2 4.11Å; Y161-T298 PolarHBondContact OH-OG1 2.91Å
162	N	64.6	Low	79.9	Confident	89 Å²	89	42.1 Å²	42.1	48%	0.476	20%	0.2	S	C	.	.			trans	59.3	32.5	-178.1	-57.9	-36.7	0	0	0	114.8	W169	N162-W169 HydrophobicContact CB-CH2 4.04Å; N162-W169 HydrophobicContact CB-CZ2 4.1Å; N162-W169 HydrophobicContact CB-CZ3 4.41Å; N162-W169 PolarHBondContact N-O 3.33Å; N162-W169 WeakPolarHBondContact O-CZ3 3.41Å; N162-W169 WeakPolarHBondContact OD1-CZ2 3.48Å
163	A	60.2	Low	79.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.008	18%	0.183	C	C	.	.			trans	-92.4	153.8	177.4	0	0	0	0	0	113.4	Y161 N165 I168 E235 L236	Y161-A163 VanDerWaalsContact C-N 3.31Å; Y161-A163 PolarHBondContact O-N 2.78Å; A163-N165 VanDerWaalsContact C-N 3.27Å; A163-N165 PolarHBondContact O-N 2.87Å; A163-I168 HydrophobicContact CB-CG2 4.2Å; A163-E235 WeakPolarHBondContact CA-OE2 3.34Å; A163-E235 HydrophobicContact CB-CB 4.16Å; A163-L236 HydrophobicContact CB-CD2 3.74Å
164	V	57.6	Low	80	Confident	95 Å²	95	39.3 Å²	39.3	58%	0.576	19%	0.187	S	C	*	.	S	Bend	trans	-46.5	-43.5	-171.9	-159.2	0	0	0	0	114.2	E166 E235	V164-E166 PolarHBondContact O-N 3.4Å; V164-E235 WeakPolarHBondContact CA-OE2 3.44Å; V164-E235 HydrophobicContact CG2-CB 4.23Å; V164-E235 HydrophobicContact CG2-CG 3.68Å; V164-E235 VanDerWaalsContact CG2-OE1 3.24Å; V164-E235 WeakPolarHBondContact CG2-OE1 3.45Å; V164-E235 WeakPolarHBondContact CG2-OE2 3.27Å; V164-E235 PolarHBondContact N-OE2 2.71Å
165	N	65.3	Low	80.1	Confident	60 Å²	60	33.3 Å²	33.3	32%	0.321	16%	0.161	S	C	.	.	S	Bend	trans	-76.3	119.8	-174.4	179.9	-21.1	0	0	0	109.8	A163 K167 I168 W169 S275	A163-N165 VanDerWaalsContact C-N 3.27Å; A163-N165 PolarHBondContact O-N 2.87Å; N165-K167 PolarHBondContact O-N 2.75Å; N165-K167 WeakPolarHBondContact OD1-CB 3.36Å; N165-K167 PolarHBondContact OD1-N 3.09Å; N165-I168 HydrophobicContact CB-CB 4.28Å; N165-I168 HydrophobicContact CB-CD1 3.98Å; N165-I168 HydrophobicContact CB-CG1 4.09Å; N165-I168 CarbonylContact O-C 3.59Å; N165-I168 PolarHBondContact O-N 3.16Å; N165-W169 WeakPolarHBondContact O-CB 3.5Å; N165-W169 PolarHBondContact O-N 2.91Å; N165-S275 PolarHBondContact ND2-OG 3.47Å; N165-S275 VanDerWaalsContact ND2-OG 3.15Å
166	E	63.1	Low	80.3	Confident	119 Å²	119	35 Å²	35	56%	0.556	17%	0.172	S	C	*	.	H	α-helix	trans	-53.8	-30.6	-178.5	-65.2	-165.9	158.7	0	0	113.7	V164 N170	V164-E166 PolarHBondContact O-N 3.4Å; E166-N170 PolarHBondContact O-ND2 3Å
167	K	67.7	Low	80.3	Confident	112 Å²	112	35.1 Å²	35.1	49%	0.487	17%	0.172	S	C	.	.	H	α-helix	trans	-70.5	-35.4	176.4	-68.5	-175.4	178.1	178.9	0	112.5	S116 N165	S116-K167 WeakPolarHBondContact OG-CA 3.46Å; S116-K167 PolarHBondContact OG-O 2.99Å; N165-K167 PolarHBondContact O-N 2.75Å; N165-K167 WeakPolarHBondContact OD1-CB 3.36Å; N165-K167 PolarHBondContact OD1-N 3.09Å
168	I	73.6	Confident	80.4	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-87.5	-30.3	179.6	-52.9	173.7	0	0	0	110.9	Y161 A163 N165 N170 G171 L236 L274 L277 F292	Y161-I168 HydrophobicContact CD2-CG2 3.99Å; A163-I168 HydrophobicContact CB-CG2 4.2Å; N165-I168 HydrophobicContact CB-CB 4.28Å; N165-I168 HydrophobicContact CB-CD1 3.98Å; N165-I168 HydrophobicContact CB-CG1 4.09Å; N165-I168 CarbonylContact O-C 3.59Å; N165-I168 PolarHBondContact O-N 3.16Å; I168-N170 PolarHBondContact O-N 2.75Å; I168-N170 VanDerWaalsContact O-N 3.13Å; I168-G171 WeakPolarHBondContact O-CA 3.32Å; I168-G171 PolarHBondContact O-N 3.27Å; I168-L236 HydrophobicContact CB-CD2 4.19Å; I168-L236 HydrophobicContact CD1-CD1 3.88Å; I168-L236 HydrophobicContact CD1-CD2 3.65Å; I168-L236 HydrophobicContact CD1-CG 4.41Å; I168-L236 HydrophobicContact CG1-CD2 4.48Å; I168-L236 HydrophobicContact CG2-CD2 3.47Å; I168-L236 VanDerWaalsContact CG2-CD2 3.47Å; I168-L274 HydrophobicContact CG1-CB 4.47Å; I168-L274 HydrophobicContact CG2-CD1 4.32Å; I168-L277 HydrophobicContact CD1-CD2 3.86Å; I168-F292 HydrophobicContact CD1-CD1 3.92Å; I168-F292 HydrophobicContact CD1-CE1 4.5Å; I168-F292 HydrophobicContact CD1-CG 4.5Å; I168-F292 HydrophobicContact CG1-CD1 4.14Å; I168-F292 HydrophobicContact CG2-CD1 4.04Å; I168-F292 HydrophobicContact CG2-CE1 3.63Å
169	W	75.1	Confident	80.5	Confident	80 Å²	80	46.4 Å²	46.4	30%	0.303	22%	0.222	S	C	.	.	H	α-helix	trans	-48.1	-43.8	178.5	-178.4	-73.2	0	0	0	112.1	P160 Y161 N162 N165 G171	P160-W169 WeakPolarHBondContact CA-O 3.42Å; P160-W169 WeakPolarHBondContact CB-O 3.45Å; Y161-W169 PolarHBondContact N-O 3.28Å; N162-W169 HydrophobicContact CB-CH2 4.04Å; N162-W169 HydrophobicContact CB-CZ2 4.1Å; N162-W169 HydrophobicContact CB-CZ3 4.41Å; N162-W169 PolarHBondContact N-O 3.33Å; N162-W169 WeakPolarHBondContact O-CZ3 3.41Å; N162-W169 WeakPolarHBondContact OD1-CZ2 3.48Å; N165-W169 WeakPolarHBondContact O-CB 3.5Å; N165-W169 PolarHBondContact O-N 2.91Å; W169-G171 PolarHBondContact O-N 3.12Å
170	N	81.9	Confident	80.8	Confident	7 Å²	7	47.7 Å²	47.7	4%	0.037	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-6.7	-176	-53.8	-45	0	0	0	113.4	G115 S116 R119 W126 I158 E166 I168	G115-N170 WeakPolarHBondContact CA-O 3.06Å; S116-N170 WeakPolarHBondContact OG-CB 3.28Å; S116-N170 PolarHBondContact OG-ND2 2.88Å; R119-N170 WeakPolarHBondContact CD-OD1 3.3Å; R119-N170 PolarHBondContact NH1-OD1 2.76Å; W126-N170 HydrophobicContact CH2-CB 4.11Å; I158-N170 WeakPolarHBondContact CG2-O 3.45Å; E166-N170 PolarHBondContact O-ND2 3Å; I168-N170 PolarHBondContact O-N 2.75Å; I168-N170 VanDerWaalsContact O-N 3.13Å
171	G	87.5	Confident	81.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.			trans	54.3	-137.4	176	0	0	0	0	0	113.7	G115 M159 I168 W169 L274	G115-G171 PolarHBondContact N-O 3.33Å; M159-G171 VanDerWaalsContact O-CA 3.32Å; M159-G171 WeakPolarHBondContact O-CA 3.44Å; I168-G171 WeakPolarHBondContact O-CA 3.32Å; I168-G171 PolarHBondContact O-N 3.27Å; W169-G171 PolarHBondContact O-N 3.12Å; G171-L274 VanDerWaalsContact O-CD2 3.26Å; G171-L274 WeakPolarHBondContact O-CD2 3.26Å
172	V	91.8	Very high	81.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	156.3	-174.3	-67.2	0	0	0	0	111.6	M159 Y161 I272 L274 T298 V299	M159-V172 HydrophobicContact CB-CG2 4.28Å; M159-V172 PolarHBondContact N-O 3.13Å; M159-V172 PolarHBondContact O-N 3.04Å; Y161-V172 HydrophobicContact CE1-CG2 4.41Å; Y161-V172 WeakPolarHBondContact OH-CG1 3.24Å; V172-I272 HydrophobicContact CB-CD1 4.03Å; V172-I272 HydrophobicContact CG1-CB 4.14Å; V172-I272 HydrophobicContact CG1-CD1 3.85Å; V172-I272 HydrophobicContact CG1-CG1 4.47Å; V172-L274 HydrophobicContact CG1-CD1 4.47Å; V172-L274 HydrophobicContact CG1-CD2 4.37Å; V172-T298 WeakPolarHBondContact CG2-OG1 3.44Å; V172-V299 HydrophobicContact CG2-CB 3.76Å; V172-V299 HydrophobicContact CG2-CG1 4.34Å
173	A	93.6	Very high	83	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.8	-176.5	0	0	0	0	0	112.8	T113 F118 I156 R157 I158	T113-A173 HydrophobicContact CG2-CB 4.1Å; T113-A173 PolarHBondContact N-O 3.31Å; T113-A173 PolarHBondContact O-N 2.98Å; T113-A173 VanDerWaalsContact O-O 3.13Å; F118-A173 HydrophobicContact CD2-CB 4.04Å; F118-A173 HydrophobicContact CE2-CB 3.72Å; I156-A173 HydrophobicContact CG2-CB 4.44Å; R157-A173 CarbonylContact O-C 3.43Å; R157-A173 VanDerWaalsContact O-CA 3.31Å; R157-A173 WeakPolarHBondContact O-CA 3.38Å; I158-A173 HydrophobicContact CB-CB 4.46Å; I158-A173 HydrophobicContact CG1-CB 3.93Å; I158-A173 HydrophobicContact CG2-CB 4.49Å
174	L	94.3	Very high	84.3	Confident	18 Å²	18	48.4 Å²	48.4	9%	0.094	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.7	171.5	-178.7	69.7	0	0	0	108.6	I95 L110 I111 L112 R157 V299	I95-L174 HydrophobicContact CD1-CD1 3.95Å; L110-L174 HydrophobicContact CB-CD1 4.21Å; L110-L174 HydrophobicContact CD2-CD1 4.38Å; L110-L174 HydrophobicContact CD2-CD2 4.43Å; I111-L174 WeakPolarHBondContact O-CA 3.48Å; L112-L174 HydrophobicContact CD2-CB 4.47Å; L112-L174 HydrophobicContact CD2-CD1 3.72Å; L112-L174 HydrophobicContact CG-CD1 4.42Å; R157-L174 PolarHBondContact N-O 3.41Å; R157-L174 PolarHBondContact O-N 3.42Å; L174-V299 HydrophobicContact CB-CG1 4.46Å; L174-V299 HydrophobicContact CB-CG2 3.79Å
175	V	94.8	Very high	85.7	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.8	175.2	-173.7	0	0	0	0	108.8	I111 T113 F118 P153 I156 L177	I111-V175 HydrophobicContact CB-CB 4.15Å; I111-V175 PolarHBondContact N-O 2.88Å; I111-V175 PolarHBondContact O-N 2.98Å; T113-V175 HydrophobicContact CG2-CG2 4.04Å; F118-V175 HydrophobicContact CE1-CG2 4.3Å; F118-V175 HydrophobicContact CE2-CG2 3.92Å; F118-V175 HydrophobicContact CZ-CG2 3.39Å; P153-V175 HydrophobicContact CB-CG1 3.72Å; P153-V175 HydrophobicContact CG-CG1 3.86Å; I156-V175 HydrophobicContact CG1-CG1 4.28Å; I156-V175 HydrophobicContact CG1-CG2 4.4Å; I156-V175 HydrophobicContact CG2-CG2 4.44Å; V175-L177 HydrophobicContact CG1-CD2 4.37Å
176	T	94.6	Very high	86.7	Confident	36 Å²	36	50.5 Å²	50.5	22%	0.221	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.1	171.4	-52.6	0	0	0	0	109.1	R109 L110 K154 G155	R109-T176 HydrophobicContact CB-CG2 4.33Å; R109-T176 CarbonylContact O-C 3.57Å; R109-T176 WeakPolarHBondContact O-CA 3.47Å; L110-T176 HydrophobicContact CD2-CG2 4.47Å; K154-T176 WeakPolarHBondContact CA-O 3.38Å; K154-T176 WeakPolarHBondContact CB-O 3.3Å; K154-T176 PolarHBondContact N-O 3.44Å; G155-T176 PolarHBondContact N-O 2.94Å; G155-T176 PolarHBondContact O-N 2.87Å
177	L	94.2	Very high	88	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	152.2	178.4	-58	177.2	0	0	0	112.2	R109 I111 V134 Q152 V175 K179 F181	R109-L177 HydrophobicContact CB-CB 4.22Å; R109-L177 WeakPolarHBondContact O-CG 3.27Å; R109-L177 PolarHBondContact O-N 3.35Å; I111-L177 HydrophobicContact CD1-CD1 4.22Å; I111-L177 HydrophobicContact CG1-CD1 4.05Å; I111-L177 HydrophobicContact CG1-CD2 4.42Å; I111-L177 HydrophobicContact CG1-CG 4.16Å; V134-L177 HydrophobicContact CB-CD2 4Å; V134-L177 HydrophobicContact CG2-CD2 3.78Å; Q152-L177 CarbonylContact O-C 3.58Å; Q152-L177 WeakPolarHBondContact O-CA 3.15Å; V175-L177 HydrophobicContact CG1-CD2 4.37Å; L177-K179 VanDerWaalsContact CB-O 3.27Å; L177-K179 WeakPolarHBondContact CB-O 3.43Å; L177-F181 HydrophobicContact CD1-CD2 3.71Å; L177-F181 HydrophobicContact CD1-CE1 4.44Å; L177-F181 HydrophobicContact CD1-CE2 3.42Å; L177-F181 VanDerWaalsContact CD1-CE2 3.42Å; L177-F181 HydrophobicContact CD1-CG 4.34Å; L177-F181 HydrophobicContact CD1-CZ 3.83Å
178	K	92.4	Very high	89.1	Confident	127 Å²	127	39.6 Å²	39.6	55%	0.552	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67	-43.3	172.6	-69.8	-179.6	-175.6	178.4	0	111.7	Q152 K154	Q152-K178 HydrophobicContact CB-CD 3.98Å; Q152-K178 HydrophobicContact CB-CG 4.43Å; Q152-K178 WeakPolarHBondContact O-CG 2.85Å; Q152-K178 PolarHBondContact O-N 2.78Å; K154-K178 HydrophobicContact CB-CG 3.75Å; K154-K178 HydrophobicContact CG-CG 4.42Å
179	K	92.4	Very high	90.1	Very high	168 Å²	168	39.5 Å²	39.5	73%	0.73	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.5	175.4	-66.2	-174.8	178.9	-176.5	0	108.9	L177	L177-K179 VanDerWaalsContact CB-O 3.27Å; L177-K179 WeakPolarHBondContact CB-O 3.43Å
180	P	91.2	Very high	91	Very high	39 Å²	39	35.7 Å²	35.7	25%	0.253	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	151.4	177.7	30.8	-34.2	0	0	0	111.6	F107 S108 R109	F107-P180 HydrophobicContact CB-CB 4.02Å; F107-P180 HydrophobicContact CB-CG 4.47Å; F107-P180 HydrophobicContact CD2-CB 3.55Å; F107-P180 HydrophobicContact CD2-CG 3.96Å; F107-P180 HydrophobicContact CE2-CB 4.42Å; F107-P180 HydrophobicContact CG-CB 4.09Å; F107-P180 HydrophobicContact CG-CG 4.33Å; S108-P180 CarbonylContact O-C 3.58Å; S108-P180 WeakPolarHBondContact O-CA 3.21Å; R109-P180 HydrophobicContact CG-CB 3.62Å; R109-P180 HydrophobicContact CG-CG 4.47Å
181	F	91.2	Very high	91.5	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.018	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	129.7	160.9	-67.5	-43.8	0	0	0	109.1	V79 I94 F107 S108 I111 V134 A136 Q149 L177	V79-F181 HydrophobicContact CG1-CE2 4.36Å; I94-F181 HydrophobicContact CD1-CD2 3.96Å; I94-F181 HydrophobicContact CG1-CD2 4.21Å; F107-F181 CarbonylContact C-O 3.49Å; F107-F181 WeakPolarHBondContact CA-O 3.49Å; F107-F181 VanDerWaalsContact CB-O 3.3Å; F107-F181 WeakPolarHBondContact CB-O 3.47Å; S108-F181 PolarHBondContact N-O 3.25Å; S108-F181 PolarHBondContact O-N 3.36Å; I111-F181 HydrophobicContact CD1-CD2 4.18Å; I111-F181 HydrophobicContact CD1-CE2 4.05Å; V134-F181 HydrophobicContact CG1-CE2 4.16Å; V134-F181 HydrophobicContact CG1-CZ 4.37Å; A136-F181 HydrophobicContact CB-CD1 4.37Å; A136-F181 HydrophobicContact CB-CD2 4.04Å; A136-F181 HydrophobicContact CB-CE1 4.07Å; A136-F181 HydrophobicContact CB-CE2 3.69Å; A136-F181 HydrophobicContact CB-CG 4.38Å; A136-F181 HydrophobicContact CB-CZ 3.71Å; Q149-F181 HydrophobicContact CB-CD1 3.91Å; Q149-F181 HydrophobicContact CB-CE1 3.74Å; L177-F181 HydrophobicContact CD1-CD2 3.71Å; L177-F181 HydrophobicContact CD1-CE1 4.44Å; L177-F181 HydrophobicContact CD1-CE2 3.42Å; L177-F181 VanDerWaalsContact CD1-CE2 3.42Å; L177-F181 HydrophobicContact CD1-CG 4.34Å; L177-F181 HydrophobicContact CD1-CZ 3.83Å
182	V	89.9	Confident	91.5	Very high	80 Å²	80	36.7 Å²	36.7	49%	0.485	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.4	178.3	-177.9	0	0	0	0	108.6	F107	F107-V182 HydrophobicContact CB-CG2 4.41Å
183	F	89.7	Confident	90.8	Very high	16 Å²	16	40.3 Å²	40.3	7%	0.07	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-74	138.9	-179.3	-54.4	-36.3	0	0	0	111	Y59 I94 R105 N106 S108 L187 P189	Y59-F183 HydrophobicContact CD1-CB 3.61Å; Y59-F183 HydrophobicContact CD1-CG 4.47Å; Y59-F183 HydrophobicContact CE1-CB 3.72Å; Y59-F183 AromaticContact CE1-CD2 3.81Å; Y59-F183 HydrophobicContact CE1-CD2 3.81Å; Y59-F183 HydrophobicContact CE1-CG 4.14Å; Y59-F183 HydrophobicContact CG-CB 4.33Å; I94-F183 HydrophobicContact CG2-CE1 3.82Å; I94-F183 HydrophobicContact CG2-CZ 4.41Å; R105-F183 WeakPolarHBondContact O-CE2 3.15Å; N106-F183 PolarHBondContact O-N 2.89Å; S108-F183 VanDerWaalsContact CB-CZ 3.49Å; F183-L187 CarbonylContact C-O 3.59Å; F183-L187 WeakPolarHBondContact CA-O 3.1Å; F183-L187 WeakPolarHBondContact CB-O 3.46Å; F183-P189 HydrophobicContact CD2-CG 4.14Å; F183-P189 HydrophobicContact CE1-CB 4.02Å; F183-P189 HydrophobicContact CE1-CG 4.07Å; F183-P189 HydrophobicContact CE2-CB 4.23Å; F183-P189 HydrophobicContact CE2-CG 3.62Å; F183-P189 HydrophobicContact CZ-CB 3.66Å; F183-P189 HydrophobicContact CZ-CG 3.56Å
184	N	88.3	Confident	89.5	Confident	53 Å²	53	45.3 Å²	45.3	28%	0.283	23%	0.227	S	C	.	.	B	Isolated β-bridge	trans	-158.6	-169.7	-179.2	64.6	29.3	0	0	0	109.5	Y59 E186 L187	Y59-N184 CarbonylContact O-C 3.5Å; Y59-N184 VanDerWaalsContact O-C 3.26Å; N184-E186 PolarHBondContact O-N 3.08Å; N184-E186 WeakPolarHBondContact OD1-CA 3.46Å; N184-E186 PolarHBondContact OD1-N 3.24Å; N184-L187 PolarHBondContact N-O 3.1Å; N184-L187 CarbonylContact O-C 3.52Å; N184-L187 PolarHBondContact O-N 3.46Å; N184-L187 VanDerWaalsContact O-N 3.16Å; N184-L187 PolarHBondContact OD1-N 3.28Å
185	K	87.3	Confident	88.4	Confident	135 Å²	135	49.3 Å²	49.3	59%	0.587	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19	179.8	62.5	172.6	-171.5	180	0	115.8	Y59 G60 G61 Y67	Y59-K185 WeakPolarHBondContact O-CA 3.5Å; Y59-K185 PolarHBondContact O-N 3.36Å; Y59-K185 VanDerWaalsContact O-N 3.08Å; G60-K185 WeakPolarHBondContact O-CB 3.47Å; G61-K185 WeakPolarHBondContact CA-O 3.02Å; Y67-K185 PolarHBondContact OH-O 2.9Å
186	E	85.9	Confident	87.2	Confident	64 Å²	64	52.9 Å²	52.9	30%	0.299	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-15.3	-179.3	-69	164.1	145.6	0	0	113.1	P76 R137 N184	P76-E186 WeakPolarHBondContact CB-O 3.23Å; R137-E186 VanDerWaalsContact CD-OE2 3.32Å; R137-E186 WeakPolarHBondContact CD-OE2 3.22Å; R137-E186 HydrophobicContact CG-CB 4.26Å; R137-E186 VanDerWaalsContact CZ-CD 3.44Å; R137-E186 IonicContact CZ-OE1 3.51Å; R137-E186 VanDerWaalsContact CZ-OE1 3.26Å; R137-E186 IonicContact CZ-OE2 3.78Å; R137-E186 IonicContact NE-OE1 2.99Å; R137-E186 PolarHBondContact NE-OE1 2.56Å; R137-E186 VanDerWaalsContact NE-OE1 3.09Å; R137-E186 IonicContact NE-OE2 3.88Å; R137-E186 PolarHBondContact NE-OE2 2.85Å; R137-E186 IonicContact NH1-OE2 3.07Å; R137-E186 IonicContact NH2-OE1 3.56Å; R137-E186 PolarHBondContact NH2-OE1 2.9Å; R137-E186 IonicContact NH2-OE2 3.75Å; R137-E186 PolarHBondContact NH2-OE2 2.86Å; N184-E186 PolarHBondContact O-N 3.08Å; N184-E186 WeakPolarHBondContact OD1-CA 3.46Å; N184-E186 PolarHBondContact OD1-N 3.24Å
187	L	90.2	Very high	86.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-133.2	118.7	-175.9	-73.1	175.8	0	0	0	110.2	P76 I94 A136 R137 Q149 F183 N184	P76-L187 WeakPolarHBondContact O-CD2 3.45Å; I94-L187 HydrophobicContact CD1-CD2 4.04Å; A136-L187 HydrophobicContact CB-CD1 4.41Å; A136-L187 HydrophobicContact CB-CD2 3.73Å; R137-L187 HydrophobicContact CB-CD2 4.24Å; R137-L187 HydrophobicContact CB-CG 4.4Å; Q149-L187 HydrophobicContact CG-CD1 4.25Å; F183-L187 CarbonylContact C-O 3.59Å; F183-L187 WeakPolarHBondContact CA-O 3.1Å; F183-L187 WeakPolarHBondContact CB-O 3.46Å; N184-L187 PolarHBondContact N-O 3.1Å; N184-L187 CarbonylContact O-C 3.52Å; N184-L187 PolarHBondContact O-N 3.46Å; N184-L187 VanDerWaalsContact O-N 3.16Å; N184-L187 PolarHBondContact OD1-N 3.28Å
188	S	92.1	Very high	85.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	30%	0.296	C	S	.	.			trans	-144.1	152.3	175.3	59.7	0	0	0	0	110.2	Y59 P76 W77	Y59-S188 VanDerWaalsContact CD2-CB 3.43Å; P76-S188 CarbonylContact C-O 3.52Å; P76-S188 WeakPolarHBondContact CG-OG 3.29Å; W77-S188 VanDerWaalsContact CA-O 3.3Å; W77-S188 WeakPolarHBondContact CA-O 3.22Å; W77-S188 VanDerWaalsContact CB-O 3.31Å; W77-S188 WeakPolarHBondContact CB-O 3.18Å; W77-S188 PolarHBondContact N-O 2.88Å
189	P	93.8	Very high	85	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-82.5	146.9	-178.1	33.2	-34.4	0	0	0	111.8	C53 G54 Y59 I94 F183	C53-P189 HydrophobicContact CB-CG 4.31Å; G54-P189 PolarHBondContact N-O 3.32Å; Y59-P189 HydrophobicContact CE2-CG 4.49Å; I94-P189 WeakPolarHBondContact O-CA 3.27Å; F183-P189 HydrophobicContact CD2-CG 4.14Å; F183-P189 HydrophobicContact CE1-CB 4.02Å; F183-P189 HydrophobicContact CE1-CG 4.07Å; F183-P189 HydrophobicContact CE2-CB 4.23Å; F183-P189 HydrophobicContact CE2-CG 3.62Å; F183-P189 HydrophobicContact CZ-CB 3.66Å; F183-P189 HydrophobicContact CZ-CG 3.56Å
190	V	94.1	Very high	84.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-82.2	144.6	167.3	69.1	0	0	0	0	110.1	W77 I94 I95 P96 V260 A267 Q269	W77-V190 HydrophobicContact CB-CB 4.04Å; W77-V190 HydrophobicContact CB-CG1 4.37Å; W77-V190 HydrophobicContact CD2-CB 3.69Å; W77-V190 HydrophobicContact CD2-CG2 4.16Å; W77-V190 HydrophobicContact CE3-CB 4.06Å; W77-V190 HydrophobicContact CG-CB 3.69Å; W77-V190 HydrophobicContact CG-CG1 4.28Å; W77-V190 HydrophobicContact CG-CG2 4.49Å; W77-V190 HydrophobicContact CZ2-CG2 4.43Å; I94-V190 PolarHBondContact O-N 2.83Å; I95-V190 HydrophobicContact CG2-CG1 4.34Å; P96-V190 VanDerWaalsContact CD-O 3.24Å; P96-V190 WeakPolarHBondContact CD-O 3.46Å; V190-V260 HydrophobicContact CG2-CG1 4.06Å; V190-V260 HydrophobicContact CG2-CG2 4.19Å; V190-A267 HydrophobicContact CG2-CB 4.29Å; V190-Q269 HydrophobicContact CG1-CB 3.94Å; V190-Q269 HydrophobicContact CG2-CB 4.07Å
191	C	92.2	Very high	83.6	Confident	2 Å²	2	53 Å²	53	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	149.1	171.5	-65	0	0	0	0	110.7	C53 R266 A267 Y268 Q269	C53-C191 VanDerWaalsContact CA-SG 3.56Å; C53-C191 HydrophobicContact CB-CB 4.01Å; C53-C191 WeakPolarHBondContact CB-SG 3.48Å; C53-C191 PolarHBondContact O-SG 3.17Å; C53-C191 WeakPolarHBondContact SG-CA 3.32Å; C53-C191 WeakPolarHBondContact SG-CB 3.29Å; C53-C191 CovalentContact SG-SG 2.03Å; C53-C191 PolarHBondContact SG-SG 2.69Å; C191-R266 VanDerWaalsContact SG-CD 3.58Å; C191-A267 WeakPolarHBondContact CB-O 3.43Å; C191-A267 PolarHBondContact N-O 3.26Å; C191-Y268 HydrophobicContact CB-CD1 3.41Å; C191-Y268 VanDerWaalsContact CB-CD1 3.41Å; C191-Y268 HydrophobicContact CB-CE1 3.57Å; C191-Y268 HydrophobicContact CB-CG 4.04Å; C191-Y268 CarbonylContact O-C 3.52Å; C191-Y268 WeakPolarHBondContact O-CA 3.3Å; C191-Q269 PolarHBondContact O-N 2.57Å
192	V	88.4	Confident	82.9	Confident	26 Å²	26	59.2 Å²	59.2	16%	0.158	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.7	175.9	-167.7	0	0	0	0	108.9	I95 L112 T194 V296 L300	I95-V192 HydrophobicContact CB-CG2 3.74Å; I95-V192 HydrophobicContact CG2-CG2 3.36Å; L112-V192 HydrophobicContact CD1-CG1 4.38Å; L112-V192 HydrophobicContact CD1-CG2 4.3Å; V192-T194 PolarHBondContact O-N 3.23Å; V192-V296 HydrophobicContact CG1-CB 3.74Å; V192-V296 HydrophobicContact CG1-CG1 4.4Å; V192-V296 HydrophobicContact CG1-CG2 3.46Å; V192-V296 VanDerWaalsContact CG1-CG2 3.46Å; V192-L300 HydrophobicContact CB-CD1 4.25Å; V192-L300 HydrophobicContact CG1-CD1 3.55Å
193	K	76.6	Confident	82.6	Confident	76 Å²	76	56.4 Å²	56.4	33%	0.33	31%	0.305	S	S	.	.			trans	-79.4	117.2	169.4	-77.9	-69.8	-173.6	175.6	0	109	V195 A197 Y268 F270	K193-V195 VanDerWaalsContact C-N 3.31Å; K193-A197 HydrophobicContact CB-CB 4.41Å; K193-A197 HydrophobicContact CG-CB 4.44Å; K193-Y268 HydrophobicContact CD-CD1 4.18Å; K193-Y268 HydrophobicContact CD-CE1 4.38Å; K193-Y268 HydrophobicContact CG-CD1 3.96Å; K193-F270 HydrophobicContact CG-CE1 4.08Å; K193-F270 HydrophobicContact CG-CZ 4.23Å
194	T	66.2	Low	82.6	Confident	105 Å²	105	62.3 Å²	62.3	64%	0.644	33%	0.33	S	S	*	.	S	Bend	trans	-79.7	-15.3	179.9	49.2	0	0	0	0	113.1	V192	V192-T194 PolarHBondContact O-N 3.23Å
195	V	70.8	Confident	82.8	Confident	102 Å²	102	59.8 Å²	59.8	62%	0.618	32%	0.317	S	S	*	.	S	Bend	trans	-95.3	152.6	172.9	-175.5	0	0	0	0	108.8	K193 A197 H295	K193-V195 VanDerWaalsContact C-N 3.31Å; V195-A197 PolarHBondContact O-N 2.8Å; V195-H295 PolarHBondContact O-CE1 2.84Å
196	Y	70.2	Confident	83	Confident	75 Å²	75	53.6 Å²	53.6	29%	0.294	29%	0.29	S	S	.	.			trans	-64.8	56.9	170	-68.9	-80	0	0	0	112.2	K240 H295 A297 T298	Y196-K240 HydrophobicContact CD1-CB 3.9Å; Y196-K240 HydrophobicContact CD1-CD 3.51Å; Y196-K240 HydrophobicContact CD1-CG 4.4Å; Y196-K240 HydrophobicContact CD2-CD 4.16Å; Y196-K240 HydrophobicContact CE1-CB 3.97Å; Y196-K240 HydrophobicContact CE1-CD 3.51Å; Y196-K240 HydrophobicContact CE1-CG 4.34Å; Y196-K240 HydrophobicContact CE2-CD 4.16Å; Y196-K240 HydrophobicContact CG-CD 3.85Å; Y196-H295 HydrophobicContact CD1-CB 4.34Å; Y196-H295 AromaticContact CD1-CG 3.82Å; Y196-H295 AromaticContact CD1-ND1 3.68Å; Y196-H295 HydrophobicContact CE1-CB 4.43Å; Y196-A297 HydrophobicContact CD1-CB 4.23Å; Y196-A297 HydrophobicContact CE1-CB 4.13Å; Y196-A297 HydrophobicContact CE2-CB 4.46Å; Y196-A297 HydrophobicContact CG-CB 4.43Å; Y196-T298 HydrophobicContact CE1-CG2 3.67Å
197	A	73.7	Confident	83.3	Confident	29 Å²	29	50.6 Å²	50.6	24%	0.24	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-83.3	138.4	-178.5	0	0	0	0	0	109.8	K193 V195 F270 H295	K193-A197 HydrophobicContact CB-CB 4.41Å; K193-A197 HydrophobicContact CG-CB 4.44Å; V195-A197 PolarHBondContact O-N 2.8Å; A197-F270 HydrophobicContact CB-CE1 4.18Å; A197-F270 VanDerWaalsContact O-CD1 3.23Å; A197-F270 WeakPolarHBondContact O-CD1 3.31Å; A197-H295 PolarHBondContact O-NE2 2.89Å
198	I	78.2	Confident	83.3	Confident	125 Å²	125	50.6 Å²	50.6	64%	0.641	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-90.2	141.7	170.5	-57.6	173.9	0	0	0	107.7
199	P	82.8	Confident	83.2	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.019	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-56.3	137.2	171.4	-20.6	29.8	0	0	0	110.9	M222 C261 F270	P199-M222 HydrophobicContact CG-CE 4.24Å; P199-C261 HydrophobicContact CB-CB 4.19Å; P199-C261 VanDerWaalsContact CG-SG 3.57Å; P199-F270 HydrophobicContact CB-CD2 4.39Å; P199-F270 HydrophobicContact CB-CE1 4.34Å; P199-F270 HydrophobicContact CB-CE2 4.25Å; P199-F270 HydrophobicContact CB-CZ 4.21Å; P199-F270 HydrophobicContact CG-CB 4.05Å; P199-F270 HydrophobicContact CG-CD1 3.72Å; P199-F270 HydrophobicContact CG-CD2 3.85Å; P199-F270 HydrophobicContact CG-CE1 4.04Å; P199-F270 HydrophobicContact CG-CE2 4.18Å; P199-F270 HydrophobicContact CG-CG 3.61Å; P199-F270 HydrophobicContact CG-CZ 4.25Å
200	P	81.8	Confident	82.8	Confident	57 Å²	57	53 Å²	53	37%	0.37	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-57.6	142.4	172.3	-21.4	31.6	0	0	0	111.2	T202 S203 V263	P200-T202 PolarHBondContact O-N 2.88Å; P200-S203 VanDerWaalsContact O-CB 3.29Å; P200-S203 WeakPolarHBondContact O-CB 3.3Å; P200-S203 PolarHBondContact O-N 3.06Å; P200-S203 PolarHBondContact O-OG 3.43Å; P200-V263 HydrophobicContact CG-CG1 4.39Å; P200-V263 HydrophobicContact CG-CG2 4.31Å
201	D	72.4	Confident	82.1	Confident	159 Å²	159	55.7 Å²	55.7	85%	0.85	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.7	-178.5	-63.7	-24.3	0	0	0	113.3	S203	D201-S203 VanDerWaalsContact C-N 3.33Å
202	T	76.7	Confident	81.3	Confident	136 Å²	136	64.1 Å²	64.1	83%	0.834	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-6.7	177	57.6	0	0	0	0	114	P200	P200-T202 PolarHBondContact O-N 2.88Å
203	S	83	Confident	80.8	Confident	20 Å²	20	70.5 Å²	70.5	14%	0.14	36%	0.361	C	S	.	.	S	Bend	trans	-82.6	136.4	-176.1	68.9	0	0	0	0	112.1	P200 D201 C205 L262	P200-S203 VanDerWaalsContact O-CB 3.29Å; P200-S203 WeakPolarHBondContact O-CB 3.3Å; P200-S203 PolarHBondContact O-N 3.06Å; P200-S203 PolarHBondContact O-OG 3.43Å; D201-S203 VanDerWaalsContact C-N 3.33Å; S203-C205 PolarHBondContact O-N 2.82Å; S203-L262 WeakPolarHBondContact CB-O 3.47Å
204	K	89.5	Confident	81	Confident	140 Å²	140	71.5 Å²	71.5	61%	0.609	36%	0.362	S	S	*	.			trans	-79.3	116.6	171.3	-67.1	-176.8	-178.9	180	0	108.9	L219 C261 L262	K204-L219 HydrophobicContact CB-CD1 4.28Å; K204-C261 WeakPolarHBondContact O-CA 3.42Å; K204-L262 PolarHBondContact O-N 2.67Å
205	C	92.1	Very high	81.9	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.007	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.2	179.8	-65	0	0	0	0	111.3	S203 L219 V220 M222 L259 V260 C261	S203-C205 PolarHBondContact O-N 2.82Å; C205-L219 WeakPolarHBondContact O-CD1 3.47Å; C205-V220 HydrophobicContact CB-CG2 3.83Å; C205-V220 PolarHBondContact O-N 2.93Å; C205-M222 HydrophobicContact CB-CG 4.29Å; C205-M222 HydrophobicContact CB-SD 3.75Å; C205-M222 VanDerWaalsContact SG-SD 3.66Å; C205-L259 HydrophobicContact CB-CD1 4.32Å; C205-V260 CarbonylContact C-O 3.51Å; C205-V260 WeakPolarHBondContact CA-O 3.37Å; C205-C261 HydrophobicContact CB-CB 4.06Å; C205-C261 WeakPolarHBondContact CB-SG 3.34Å; C205-C261 WeakPolarHBondContact SG-CB 3.12Å; C205-C261 CovalentContact SG-SG 2.04Å; C205-C261 PolarHBondContact SG-SG 2.8Å
206	F	91.9	Very high	82.6	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	155.3	177	48.8	-93.4	0	0	0	111.7	L68 L75 W77 E218 V260 L262	L68-F206 HydrophobicContact CD1-CD1 4.37Å; L68-F206 HydrophobicContact CD1-CE1 4.19Å; L68-F206 HydrophobicContact CD2-CD1 4.19Å; L68-F206 HydrophobicContact CD2-CD2 4.38Å; L68-F206 HydrophobicContact CD2-CE1 4.32Å; L68-F206 HydrophobicContact CD2-CG 4.22Å; L68-F206 HydrophobicContact CD2-CZ 4.49Å; L75-F206 HydrophobicContact CD1-CD2 3.7Å; L75-F206 HydrophobicContact CD1-CE2 3.16Å; L75-F206 HydrophobicContact CD1-CZ 4.03Å; L75-F206 HydrophobicContact CG-CE2 4.49Å; W77-F206 HydrophobicContact CZ2-CE2 4.43Å; W77-F206 HydrophobicContact CZ2-CZ 4.46Å; F206-E218 CarbonylContact C-O 3.58Å; F206-E218 WeakPolarHBondContact CA-O 3.18Å; F206-E218 WeakPolarHBondContact CB-O 3.47Å; F206-V260 HydrophobicContact CD2-CB 3.94Å; F206-V260 HydrophobicContact CD2-CG1 4.49Å; F206-V260 HydrophobicContact CE1-CG1 4.33Å; F206-V260 HydrophobicContact CE2-CB 3.34Å; F206-V260 HydrophobicContact CE2-CG1 3.49Å; F206-V260 VanDerWaalsContact CE2-CG1 3.49Å; F206-V260 HydrophobicContact CE2-CG2 4.19Å; F206-V260 HydrophobicContact CZ-CB 3.76Å; F206-V260 HydrophobicContact CZ-CG1 3.4Å; F206-V260 PolarHBondContact N-O 3.29Å; F206-V260 PolarHBondContact O-N 3.19Å; F206-L262 HydrophobicContact CE1-CD1 4.43Å; F206-L262 HydrophobicContact CE1-CD2 3.89Å; F206-L262 HydrophobicContact CE1-CG 3.93Å; F206-L262 HydrophobicContact CZ-CD2 4.2Å
207	V	91.9	Very high	83.4	Confident	2 Å²	2	61 Å²	61	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136	172.7	65.1	0	0	0	0	111	T209 E218 V220 H246 P258 Y293	V207-T209 HydrophobicContact CG1-CG2 4.11Å; V207-E218 HydrophobicContact CG1-CB 4.42Å; V207-E218 PolarHBondContact N-O 3.09Å; V207-E218 PolarHBondContact O-N 2.79Å; V207-V220 HydrophobicContact CB-CG1 4.47Å; V207-V220 HydrophobicContact CG1-CG1 3.73Å; V207-H246 VanDerWaalsContact CG1-CE1 3.47Å; V207-H246 WeakPolarHBondContact CG1-CE1 3.43Å; V207-P258 WeakPolarHBondContact CA-O 3.29Å; V207-Y293 HydrophobicContact CB-CE1 4.23Å; V207-Y293 HydrophobicContact CG2-CE1 3.8Å
208	S	91.4	Very high	84	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130	172.7	-39.8	0	0	0	0	110.6	T78 L91 E217	T78-S208 PolarHBondContact OG1-OG 2.72Å; L91-S208 VanDerWaalsContact CD1-O 3.32Å; L91-S208 WeakPolarHBondContact CD1-O 3.41Å; S208-E217 WeakPolarHBondContact CA-OE2 3.32Å; S208-E217 VanDerWaalsContact CB-OE2 3.22Å; S208-E217 WeakPolarHBondContact CB-OE2 3.46Å; S208-E217 PolarHBondContact N-OE2 3.06Å; S208-E217 VanDerWaalsContact OG-CD 3.23Å; S208-E217 PolarHBondContact OG-OE1 3.01Å; S208-E217 VanDerWaalsContact OG-OE1 3.07Å; S208-E217 PolarHBondContact OG-OE2 2.87Å
209	T	88.7	Confident	84.5	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.043	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	154.5	-178.6	64.3	0	0	0	0	110.3	V207 M215 D216 K253	V207-T209 HydrophobicContact CG1-CG2 4.11Å; T209-M215 VanDerWaalsContact O-CA 3.26Å; T209-M215 WeakPolarHBondContact O-CA 3.43Å; T209-M215 VanDerWaalsContact O-CG 3.29Å; T209-M215 WeakPolarHBondContact O-CG 3.18Å; T209-D216 PolarHBondContact N-O 2.93Å; T209-D216 PolarHBondContact O-N 3.1Å; T209-D216 PolarHBondContact OG1-O 3.46Å; T209-K253 HydrophobicContact CG2-CD 3.6Å
210	Y	87	Confident	84.8	Confident	43 Å²	43	59.6 Å²	59.6	17%	0.169	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	108.4	174.9	177.8	-106.1	0	0	0	110.1	F88 L143 K213 R214 M215 S254	F88-Y210 HydrophobicContact CB-CE1 4.41Å; F88-Y210 AromaticContact CD1-CD1 3.82Å; F88-Y210 HydrophobicContact CD1-CD1 3.82Å; F88-Y210 HydrophobicContact CD1-CE1 4.1Å; F88-Y210 HydrophobicContact CD2-CD1 4.17Å; F88-Y210 HydrophobicContact CD2-CE1 4.21Å; F88-Y210 AromaticContact CE1-CD1 3.69Å; F88-Y210 HydrophobicContact CE1-CD1 3.69Å; F88-Y210 HydrophobicContact CE1-CE1 4.42Å; F88-Y210 HydrophobicContact CE1-CG 4.47Å; F88-Y210 HydrophobicContact CE2-CD1 4.04Å; F88-Y210 HydrophobicContact CE2-CG 4.42Å; F88-Y210 HydrophobicContact CG-CD1 4.05Å; F88-Y210 AromaticContact CG-CE1 3.98Å; F88-Y210 HydrophobicContact CG-CE1 3.98Å; F88-Y210 AromaticContact CZ-CD1 3.8Å; F88-Y210 HydrophobicContact CZ-CD1 3.8Å; F88-Y210 HydrophobicContact CZ-CG 4.21Å; L143-Y210 HydrophobicContact CD1-CD1 4.05Å; L143-Y210 HydrophobicContact CD1-CD2 3.69Å; L143-Y210 HydrophobicContact CD1-CE1 3.64Å; L143-Y210 HydrophobicContact CD1-CE2 3.25Å; L143-Y210 HydrophobicContact CD1-CG 4.04Å; L143-Y210 WeakPolarHBondContact CD1-OH 3.46Å; L143-Y210 HydrophobicContact CD2-CD2 4.04Å; L143-Y210 HydrophobicContact CD2-CE2 3.91Å; L143-Y210 HydrophobicContact CG-CD2 4.07Å; L143-Y210 HydrophobicContact CG-CE2 3.48Å; L143-Y210 VanDerWaalsContact CG-CE2 3.48Å; Y210-K213 VanDerWaalsContact CE2-C 3.4Å; Y210-K213 WeakPolarHBondContact OH-CA 3.38Å; Y210-R214 CarbonylContact C-O 3.55Å; Y210-R214 WeakPolarHBondContact CA-O 3.16Å; Y210-R214 WeakPolarHBondContact CD2-O 3.37Å; Y210-M215 HydrophobicContact CD2-CB 4.33Å; Y210-S254 WeakPolarHBondContact CA-OG 3.34Å; Y210-S254 VanDerWaalsContact CB-OG 3.29Å; Y210-S254 WeakPolarHBondContact CB-OG 3.1Å; Y210-S254 PolarHBondContact N-OG 2.72Å; Y210-S254 PolarHBondContact O-OG 3.42Å
211	H	78.5	Confident	85	Confident	57 Å²	57	64.2 Å²	64.2	26%	0.264	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.2	-175.6	175.3	-123	0	0	0	109.9	K213 R214 E252	H211-K213 PolarHBondContact O-N 2.95Å; H211-K213 VanDerWaalsContact O-N 3.11Å; H211-R214 PolarHBondContact N-O 3.03Å; H211-R214 WeakPolarHBondContact O-CA 3.08Å; H211-R214 WeakPolarHBondContact O-CB 3.04Å; H211-R214 PolarHBondContact O-N 2.94Å; H211-R214 VanDerWaalsContact O-O 3.06Å; H211-E252 IonicContact CD2-OE2 2.71Å
212	K	75.9	Confident	85.7	Confident	179 Å²	179	58.8 Å²	58.8	78%	0.778	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	42.8	-179.7	-69.5	174.9	-179.1	178	0	114.1	R214	K212-R214 PolarHBondContact O-N 3.18Å
213	K	77	Confident	85.7	Confident	160 Å²	160	53.2 Å²	53.2	70%	0.696	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.7	15.8	-177.5	-54.7	177.6	-179.6	174.1	0	115.5	Y210 H211	Y210-K213 VanDerWaalsContact CE2-C 3.4Å; Y210-K213 WeakPolarHBondContact OH-CA 3.38Å; H211-K213 PolarHBondContact O-N 2.95Å; H211-K213 VanDerWaalsContact O-N 3.11Å
214	R	82.2	Confident	85.1	Confident	97 Å²	97	56 Å²	56	37%	0.366	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.9	179.1	-179.2	177.6	164.2	124.2	8.9	110.6	R140 F141 Y210 H211 K212 D216	R140-R214 CarbonylContact O-C 3.26Å; R140-R214 VanDerWaalsContact O-CA 3.28Å; R140-R214 WeakPolarHBondContact O-CA 3.32Å; F141-R214 HydrophobicContact CE1-CG 4.48Å; Y210-R214 CarbonylContact C-O 3.55Å; Y210-R214 WeakPolarHBondContact CA-O 3.16Å; Y210-R214 WeakPolarHBondContact CD2-O 3.37Å; H211-R214 PolarHBondContact N-O 3.03Å; H211-R214 WeakPolarHBondContact O-CA 3.08Å; H211-R214 WeakPolarHBondContact O-CB 3.04Å; H211-R214 PolarHBondContact O-N 2.94Å; H211-R214 VanDerWaalsContact O-O 3.06Å; K212-R214 PolarHBondContact O-N 3.18Å; R214-D216 WeakPolarHBondContact CD-OD2 3.07Å; R214-D216 IonicContact CZ-OD1 3.55Å; R214-D216 IonicContact CZ-OD2 3.55Å; R214-D216 VanDerWaalsContact NE-CG 3.31Å; R214-D216 IonicContact NE-OD1 2.88Å; R214-D216 PolarHBondContact NE-OD1 3.33Å; R214-D216 IonicContact NE-OD2 2.7Å; R214-D216 PolarHBondContact NE-OD2 2.93Å; R214-D216 IonicContact NH2-OD1 3.55Å; R214-D216 PolarHBondContact NH2-OD1 2.96Å; R214-D216 IonicContact NH2-OD2 3.64Å
215	M	84.7	Confident	84	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	135.5	169.1	-168.3	176.1	-62	0	0	110.2	V74 T78 L91 L138 R140 L143 T209 Y210	V74-M215 HydrophobicContact CB-SD 3.81Å; V74-M215 HydrophobicContact CG1-CB 3.93Å; V74-M215 HydrophobicContact CG1-CG 3.93Å; V74-M215 HydrophobicContact CG1-SD 3.49Å; V74-M215 WeakPolarHBondContact CG1-SD 3.09Å; V74-M215 HydrophobicContact CG2-SD 4.25Å; T78-M215 HydrophobicContact CG2-CE 4.08Å; T78-M215 HydrophobicContact CG2-SD 3.59Å; T78-M215 VanDerWaalsContact CG2-SD 3.59Å; L91-M215 HydrophobicContact CD2-CE 3.55Å; L138-M215 HydrophobicContact CB-CE 4.47Å; L138-M215 HydrophobicContact CD1-CE 3.41Å; L138-M215 VanDerWaalsContact CD1-CE 3.41Å; L138-M215 HydrophobicContact CD1-SD 4.38Å; R140-M215 WeakPolarHBondContact CG-O 3.32Å; R140-M215 PolarHBondContact O-N 3.01Å; L143-M215 HydrophobicContact CD2-CE 3.35Å; T209-M215 VanDerWaalsContact O-CA 3.26Å; T209-M215 WeakPolarHBondContact O-CA 3.43Å; T209-M215 VanDerWaalsContact O-CG 3.29Å; T209-M215 WeakPolarHBondContact O-CG 3.18Å; Y210-M215 HydrophobicContact CD2-CB 4.33Å
216	D	84.8	Confident	82.3	Confident	35 Å²	35	54.3 Å²	54.3	19%	0.187	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.7	175.1	-74.9	-49.9	0	0	0	110.7	R140 T209 R214	R140-D216 IonicContact NH1-OD1 3.1Å; R140-D216 PolarHBondContact NH1-OD1 2.65Å; T209-D216 PolarHBondContact N-O 2.93Å; T209-D216 PolarHBondContact O-N 3.1Å; T209-D216 PolarHBondContact OG1-O 3.46Å; R214-D216 WeakPolarHBondContact CD-OD2 3.07Å; R214-D216 IonicContact CZ-OD1 3.55Å; R214-D216 IonicContact CZ-OD2 3.55Å; R214-D216 VanDerWaalsContact NE-CG 3.31Å; R214-D216 IonicContact NE-OD1 2.88Å; R214-D216 PolarHBondContact NE-OD1 3.33Å; R214-D216 IonicContact NE-OD2 2.7Å; R214-D216 PolarHBondContact NE-OD2 2.93Å; R214-D216 IonicContact NH2-OD1 3.55Å; R214-D216 PolarHBondContact NH2-OD1 2.96Å; R214-D216 IonicContact NH2-OD2 3.64Å
217	E	87.4	Confident	80.9	Confident	27 Å²	27	58.5 Å²	58.5	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.5	169.9	-54.9	-59.2	162.3	0	0	108.1	L68 L75 S208	L68-E217 HydrophobicContact CD2-CB 3.93Å; L68-E217 HydrophobicContact CD2-CG 4.23Å; L75-E217 HydrophobicContact CD1-CG 3.81Å; L75-E217 WeakPolarHBondContact CD1-OE2 3.33Å; L75-E217 HydrophobicContact CG-CG 3.95Å; S208-E217 WeakPolarHBondContact CA-OE2 3.32Å; S208-E217 VanDerWaalsContact CB-OE2 3.22Å; S208-E217 WeakPolarHBondContact CB-OE2 3.46Å; S208-E217 PolarHBondContact N-OE2 3.06Å; S208-E217 VanDerWaalsContact OG-CD 3.23Å; S208-E217 PolarHBondContact OG-OE1 3.01Å; S208-E217 VanDerWaalsContact OG-OE1 3.07Å; S208-E217 PolarHBondContact OG-OE2 2.87Å
218	E	86.8	Confident	79.6	Confident	17 Å²	17	58.6 Å²	58.6	8%	0.079	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	126.4	-175.8	-169.1	172.7	136.7	0	0	110.8	F206 V207 H246 T251 K253	F206-E218 CarbonylContact C-O 3.58Å; F206-E218 WeakPolarHBondContact CA-O 3.18Å; F206-E218 WeakPolarHBondContact CB-O 3.47Å; V207-E218 HydrophobicContact CG1-CB 4.42Å; V207-E218 PolarHBondContact N-O 3.09Å; V207-E218 PolarHBondContact O-N 2.79Å; E218-H246 IonicContact OE1-CE1 3.65Å; E218-H246 IonicContact OE1-CG 3.63Å; E218-H246 IonicContact OE1-ND1 2.85Å; E218-H246 PolarHBondContact OE1-ND1 3.04Å; E218-T251 PolarHBondContact OE2-OG1 3Å; E218-K253 IonicContact OE1-NZ 2.88Å; E218-K253 PolarHBondContact OE1-NZ 3.43Å; E218-K253 IonicContact OE2-NZ 2.71Å; E218-K253 PolarHBondContact OE2-NZ 3.26Å
219	L	88.4	Confident	77.8	Confident	103 Å²	103	61.2 Å²	61.2	54%	0.539	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	132.2	171.9	-170.5	75.8	0	0	0	109.5	K204 C205	K204-L219 HydrophobicContact CB-CD1 4.28Å; C205-L219 WeakPolarHBondContact O-CD1 3.47Å
220	V	88.6	Confident	76.3	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.048	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	150	-178.7	-56	0	0	0	0	110.9	C205 V207 M222 H246 L259	C205-V220 HydrophobicContact CB-CG2 3.83Å; C205-V220 PolarHBondContact O-N 2.93Å; V207-V220 HydrophobicContact CB-CG1 4.47Å; V207-V220 HydrophobicContact CG1-CG1 3.73Å; V220-M222 HydrophobicContact CG2-SD 4.07Å; V220-H246 WeakPolarHBondContact CG1-CE1 3.43Å; V220-L259 HydrophobicContact CG2-CD1 3.63Å
221	R	87.3	Confident	74.3	Confident	153 Å²	153	61 Å²	61	58%	0.577	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	121.5	173.7	-60.3	-178.8	-162.1	-162.1	-1.5	108.6	S244 T245 D247	R221-S244 CarbonylContact O-C 3.43Å; R221-S244 WeakPolarHBondContact O-CA 3.1Å; R221-S244 WeakPolarHBondContact O-CB 3.11Å; R221-T245 PolarHBondContact N-O 3.16Å; R221-T245 PolarHBondContact O-N 3.26Å; R221-D247 IonicContact CZ-OD1 2.64Å; R221-D247 VanDerWaalsContact CZ-OD1 3.31Å; R221-D247 IonicContact CZ-OD2 2.76Å; R221-D247 IonicContact NE-OD1 3.64Å; R221-D247 PolarHBondContact NE-OD1 2.84Å; R221-D247 IonicContact NE-OD2 3.59Å; R221-D247 IonicContact NH2-OD1 3.06Å; R221-D247 PolarHBondContact NH2-OD1 3.5Å; R221-D247 IonicContact NH2-OD2 2.69Å; R221-D247 PolarHBondContact NH2-OD2 3.18Å
222	M	86.1	Confident	72.9	Confident	45 Å²	45	60 Å²	60	22%	0.222	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	137.2	178.8	-58.1	-47.8	-57.2	0	0	109.7	P199 C205 V220 I242 L259	P199-M222 HydrophobicContact CG-CE 4.24Å; C205-M222 HydrophobicContact CB-CG 4.29Å; C205-M222 HydrophobicContact CB-SD 3.75Å; C205-M222 VanDerWaalsContact SG-SD 3.66Å; V220-M222 HydrophobicContact CG2-SD 4.07Å; M222-I242 HydrophobicContact CE-CG2 3.15Å; M222-L259 HydrophobicContact CE-CD2 3.89Å; M222-L259 HydrophobicContact SD-CD1 4.32Å; M222-L259 HydrophobicContact SD-CD2 4.39Å
223	V	77.3	Confident	72.1	Confident	19 Å²	19	54.8 Å²	54.8	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.6	177.8	173.3	0	0	0	0	107.8	V227 C228 C243 T245 L290	V223-V227 HydrophobicContact CG1-CB 3.63Å; V223-V227 HydrophobicContact CG1-CG1 3.67Å; V223-C228 HydrophobicContact CG1-CB 4.23Å; V223-C243 HydrophobicContact CB-CB 3.93Å; V223-C243 HydrophobicContact CG1-CB 4.38Å; V223-C243 HydrophobicContact CG2-CB 4.48Å; V223-C243 PolarHBondContact N-O 2.84Å; V223-T245 HydrophobicContact CG2-CG2 3.75Å; V223-L290 HydrophobicContact CG1-CD2 4.31Å; V223-L290 HydrophobicContact CG2-CD2 3.83Å
224	P	70.8	Confident	71.1	Confident	79 Å²	79	48.6 Å²	48.6	51%	0.513	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-52.6	144	179.4	-27.4	34.5	0	0	0	111.9	S226 V227 C228	P224-S226 PolarHBondContact O-N 2.74Å; P224-S226 VanDerWaalsContact O-N 3.07Å; P224-V227 HydrophobicContact CB-CG2 4.47Å; P224-V227 PolarHBondContact O-N 3.14Å; P224-C228 PolarHBondContact O-N 3.12Å
225	G	64.7	Low	69.9	Low	43 Å²	43	45.3 Å²	45.3	44%	0.443	26%	0.255	S	S	.	.	H	α-helix	trans	-54.5	-29.6	-179.8	0	0	0	0	0	113.7	C228 N229	G225-C228 CarbonylContact O-C 3.46Å; G225-N229 WeakPolarHBondContact O-CA 3.47Å; G225-N229 WeakPolarHBondContact O-CB 3.5Å; G225-N229 PolarHBondContact O-N 3.25Å; G225-N229 PolarHBondContact O-ND2 2.56Å; G225-N229 PolarHBondContact O-OD1 3.05Å
226	S	58.1	Low	69	Low	62 Å²	62	45.6 Å²	45.6	43%	0.434	26%	0.257	S	S	.	.	H	α-helix	trans	-68.3	-30.5	174.3	51.7	0	0	0	0	114.1	P224 N229	P224-S226 PolarHBondContact O-N 2.74Å; P224-S226 VanDerWaalsContact O-N 3.07Å; S226-N229 WeakPolarHBondContact O-CB 3.37Å
227	V	61.8	Low	68	Low	92 Å²	92	44.3 Å²	44.3	56%	0.558	25%	0.251	S	S	*	.	H	α-helix	trans	-91	-34.3	177.1	-178	0	0	0	0	110.6	V223 P224 N229	V223-V227 HydrophobicContact CG1-CB 3.63Å; V223-V227 HydrophobicContact CG1-CG1 3.67Å; P224-V227 HydrophobicContact CB-CG2 4.47Å; P224-V227 PolarHBondContact O-N 3.14Å; V227-N229 PolarHBondContact O-N 3.19Å
228	C	65.3	Low	66.9	Low	5 Å²	5	46.2 Å²	46.2	3%	0.034	26%	0.259	C	S	.	.	H	α-helix	trans	-70.9	-12.3	168.3	-172.8	0	0	0	0	111.5	V223 P224 G225 F230 C243	V223-C228 HydrophobicContact CG1-CB 4.23Å; P224-C228 PolarHBondContact O-N 3.12Å; G225-C228 CarbonylContact O-C 3.46Å; C228-F230 WeakPolarHBondContact O-CD1 3.08Å; C228-F230 WeakPolarHBondContact O-CD2 3.22Å; C228-F230 WeakPolarHBondContact O-CE1 3.21Å; C228-F230 WeakPolarHBondContact O-CE2 3.46Å; C228-F230 WeakPolarHBondContact O-CG 3.45Å; C228-F230 WeakPolarHBondContact O-CZ 3.01Å; C228-F230 PolarHBondContact O-N 2.86Å; C228-F230 WeakPolarHBondContact SG-CZ 3.44Å; C228-C243 HydrophobicContact CB-CB 3.57Å; C228-C243 WeakPolarHBondContact CB-SG 3.5Å; C228-C243 WeakPolarHBondContact SG-CB 3.1Å; C228-C243 PolarHBondContact SG-N 3.07Å; C228-C243 CovalentContact SG-SG 2.04Å; C228-C243 PolarHBondContact SG-SG 2.03Å
229	N	53.1	Low	66	Low	54 Å²	54	45.7 Å²	45.7	29%	0.289	26%	0.257	S	S	.	.	S	Bend	trans	-68.3	102.3	175.4	-96	-16.4	0	0	0	108.4	G225 S226 V227 G231 S694	G225-N229 WeakPolarHBondContact O-CA 3.47Å; G225-N229 WeakPolarHBondContact O-CB 3.5Å; G225-N229 PolarHBondContact O-N 3.25Å; G225-N229 PolarHBondContact O-ND2 2.56Å; G225-N229 PolarHBondContact O-OD1 3.05Å; S226-N229 WeakPolarHBondContact O-CB 3.37Å; V227-N229 PolarHBondContact O-N 3.19Å; N229-G231 VanDerWaalsContact C-N 3.26Å; N229-G231 PolarHBondContact O-N 3.26Å; N229-S694 PolarHBondContact OD1-OG 3.4Å
230	F	55.9	Low	65.3	Low	14 Å²	14	42.9 Å²	42.9	6%	0.061	24%	0.24	C	C	.	.			trans	-71.5	69.6	-163.5	-51.6	-80.9	0	0	0	113.4	C228 H232 F233 P234 L236 A237 C243 L277 F292	C228-F230 WeakPolarHBondContact O-CD1 3.08Å; C228-F230 WeakPolarHBondContact O-CD2 3.22Å; C228-F230 WeakPolarHBondContact O-CE1 3.21Å; C228-F230 WeakPolarHBondContact O-CE2 3.46Å; C228-F230 WeakPolarHBondContact O-CG 3.45Å; C228-F230 WeakPolarHBondContact O-CZ 3.01Å; C228-F230 PolarHBondContact O-N 2.86Å; C228-F230 WeakPolarHBondContact SG-CZ 3.44Å; F230-H232 PolarHBondContact O-N 2.81Å; F230-F233 VanDerWaalsContact CB-C 3.47Å; F230-F233 HydrophobicContact CB-CB 3.79Å; F230-F233 WeakPolarHBondContact CB-O 2.99Å; F230-F233 HydrophobicContact CD1-CB 4.36Å; F230-F233 HydrophobicContact CD1-CD2 4.27Å; F230-F233 HydrophobicContact CG-CB 4.3Å; F230-F233 CarbonylContact O-C 3.57Å; F230-F233 PolarHBondContact O-N 3.09Å; F230-P234 WeakPolarHBondContact O-CA 3.31Å; F230-P234 VanDerWaalsContact O-N 3.11Å; F230-L236 HydrophobicContact CB-CB 4.31Å; F230-L236 HydrophobicContact CD1-CB 4.12Å; F230-L236 HydrophobicContact CD1-CD1 3.81Å; F230-L236 HydrophobicContact CD2-CB 3.34Å; F230-L236 HydrophobicContact CE1-CB 4.3Å; F230-L236 HydrophobicContact CE1-CD1 3.87Å; F230-L236 HydrophobicContact CE2-CB 3.54Å; F230-L236 HydrophobicContact CG-CB 3.65Å; F230-L236 HydrophobicContact CG-CD1 4.16Å; F230-L236 HydrophobicContact CG-CG 4.45Å; F230-L236 HydrophobicContact CZ-CB 4.03Å; F230-L236 HydrophobicContact CZ-CD1 4.25Å; F230-A237 HydrophobicContact CD2-CB 4.38Å; F230-C243 WeakPolarHBondContact CE1-SG 3.24Å; F230-C243 WeakPolarHBondContact CZ-SG 3.49Å; F230-L277 HydrophobicContact CD1-CD1 3.73Å; F230-L277 HydrophobicContact CE1-CD1 3.27Å; F230-L277 HydrophobicContact CZ-CD1 4.33Å; F230-F292 AromaticContact CE1-CD2 3.89Å; F230-F292 HydrophobicContact CE1-CD2 3.89Å; F230-F292 HydrophobicContact CE1-CE2 4.29Å; F230-F292 HydrophobicContact CE2-CD2 4.37Å; F230-F292 AromaticContact CE2-CE2 3.95Å; F230-F292 HydrophobicContact CE2-CE2 3.95Å; F230-F292 AromaticContact CZ-CD2 3.4Å; F230-F292 HydrophobicContact CZ-CD2 3.4Å; F230-F292 VanDerWaalsContact CZ-CD2 3.4Å; F230-F292 AromaticContact CZ-CE2 3.41Å; F230-F292 HydrophobicContact CZ-CE2 3.41Å; F230-F292 VanDerWaalsContact CZ-CE2 3.41Å
231	G	46.5	Very low	64.9	Low	33 Å²	33	43.3 Å²	43.3	34%	0.34	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-35	170.5	0	0	0	0	0	111.8	N229 H502	N229-G231 VanDerWaalsContact C-N 3.26Å; N229-G231 PolarHBondContact O-N 3.26Å; G231-H502 CarbonylContact O-C 3.49Å
232	H	49.3	Very low	64.9	Low	35 Å²	35	36.6 Å²	36.6	16%	0.162	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-23	175	-69.1	-109.4	0	0	0	116.2	F230 P234 R500 E501 H502	F230-H232 PolarHBondContact O-N 2.81Å; H232-P234 VanDerWaalsContact C-CD 3.42Å; H232-R500 PolarHBondContact CE1-O 3.08Å; H232-E501 PolarHBondContact CD2-O 2.85Å; H232-E501 WeakPolarHBondContact CE1-CA 3.45Å; H232-E501 PolarHBondContact CE1-O 2.04Å; H232-E501 IonicContact CE1-OE2 3.49Å; H232-E501 PolarHBondContact ND1-O 2.91Å; H232-E501 WeakPolarHBondContact NE2-CA 3.24Å; H232-E501 PolarHBondContact NE2-O 2.73Å; H232-E501 IonicContact NE2-OE2 2.78Å; H232-E501 PolarHBondContact NE2-OE2 2.94Å; H232-E501 VanDerWaalsContact NE2-OE2 3.07Å; H232-H502 HydrophobicContact CB-CB 3.97Å; H232-H502 AromaticContact ND1-CD2 3.61Å; H232-H502 AromaticContact ND1-CG 3.99Å
233	F	58.2	Low	64.9	Low	70 Å²	70	34.5 Å²	34.5	31%	0.307	21%	0.212	S	C	.	.			trans	-129.5	62.8	-179.5	-48.4	-84.4	0	0	0	111	F230 E235 L236 L277	F230-F233 VanDerWaalsContact CB-C 3.47Å; F230-F233 HydrophobicContact CB-CB 3.79Å; F230-F233 WeakPolarHBondContact CB-O 2.99Å; F230-F233 HydrophobicContact CD1-CB 4.36Å; F230-F233 HydrophobicContact CD1-CD2 4.27Å; F230-F233 HydrophobicContact CG-CB 4.3Å; F230-F233 CarbonylContact O-C 3.57Å; F230-F233 PolarHBondContact O-N 3.09Å; F233-E235 PolarHBondContact O-N 2.7Å; F233-L236 HydrophobicContact CB-CB 4.37Å; F233-L236 HydrophobicContact CB-CD1 3.62Å; F233-L236 HydrophobicContact CB-CG 3.82Å; F233-L236 HydrophobicContact CG-CD1 4.14Å; F233-L236 WeakPolarHBondContact O-CB 3.48Å; F233-L236 PolarHBondContact O-N 3.32Å; F233-L277 HydrophobicContact CD2-CD1 4.43Å; F233-L277 HydrophobicContact CD2-CD2 4.32Å; F233-L277 HydrophobicContact CE2-CB 4.08Å; F233-L277 HydrophobicContact CE2-CD2 4.28Å; F233-L277 HydrophobicContact CZ-CD2 4.44Å
234	P	55.4	Low	65.4	Low	30 Å²	30	33.6 Å²	33.6	20%	0.195	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.3	-169.2	28.2	-36.8	0	0	0	113.2	F230 H232 L236 V697	F230-P234 WeakPolarHBondContact O-CA 3.31Å; F230-P234 VanDerWaalsContact O-N 3.11Å; H232-P234 VanDerWaalsContact C-CD 3.42Å; P234-L236 VanDerWaalsContact C-N 3.31Å; P234-V697 HydrophobicContact CB-CG2 3.32Å; P234-V697 HydrophobicContact CG-CG2 3.56Å; P234-V697 VanDerWaalsContact O-CG2 3.27Å; P234-V697 WeakPolarHBondContact O-CG2 3.12Å
235	E	57.7	Low	66	Low	28 Å²	28	31.5 Å²	31.5	13%	0.131	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-19.8	169.7	-53.3	-159	178.6	0	0	113.9	A163 V164 F233 V697 R699	A163-E235 WeakPolarHBondContact CA-OE2 3.34Å; A163-E235 HydrophobicContact CB-CB 4.16Å; V164-E235 WeakPolarHBondContact CA-OE2 3.44Å; V164-E235 HydrophobicContact CG2-CB 4.23Å; V164-E235 HydrophobicContact CG2-CG 3.68Å; V164-E235 VanDerWaalsContact CG2-OE1 3.24Å; V164-E235 WeakPolarHBondContact CG2-OE1 3.45Å; V164-E235 WeakPolarHBondContact CG2-OE2 3.27Å; V164-E235 PolarHBondContact N-OE2 2.71Å; F233-E235 PolarHBondContact O-N 2.7Å; E235-V697 HydrophobicContact CG-CB 4.04Å; E235-V697 HydrophobicContact CG-CG1 4.07Å; E235-V697 HydrophobicContact CG-CG2 4.25Å; E235-R699 IonicContact OE1-CZ 2.81Å; E235-R699 IonicContact OE1-NE 3.09Å; E235-R699 PolarHBondContact OE1-NE 3.29Å; E235-R699 IonicContact OE1-NH2 2.94Å; E235-R699 PolarHBondContact OE1-NH2 3.16Å; E235-R699 IonicContact OE2-CZ 2.91Å; E235-R699 IonicContact OE2-NE 3.26Å; E235-R699 IonicContact OE2-NH2 3.76Å; E235-R699 PolarHBondContact OE2-NH2 2.94Å
236	L	66	Low	66.6	Low	5 Å²	5	30.4 Å²	30.4	3%	0.026	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-23.9	-179.8	-64.3	-175	0	0	0	113.4	A163 I168 F230 F233 P234 K238 T239 L277 F292	A163-L236 HydrophobicContact CB-CD2 3.74Å; I168-L236 HydrophobicContact CB-CD2 4.19Å; I168-L236 HydrophobicContact CD1-CD1 3.88Å; I168-L236 HydrophobicContact CD1-CD2 3.65Å; I168-L236 HydrophobicContact CD1-CG 4.41Å; I168-L236 HydrophobicContact CG1-CD2 4.48Å; I168-L236 HydrophobicContact CG2-CD2 3.47Å; I168-L236 VanDerWaalsContact CG2-CD2 3.47Å; F230-L236 HydrophobicContact CB-CB 4.31Å; F230-L236 HydrophobicContact CD1-CB 4.12Å; F230-L236 HydrophobicContact CD1-CD1 3.81Å; F230-L236 HydrophobicContact CD2-CB 3.34Å; F230-L236 HydrophobicContact CE1-CB 4.3Å; F230-L236 HydrophobicContact CE1-CD1 3.87Å; F230-L236 HydrophobicContact CE2-CB 3.54Å; F230-L236 HydrophobicContact CG-CB 3.65Å; F230-L236 HydrophobicContact CG-CD1 4.16Å; F230-L236 HydrophobicContact CG-CG 4.45Å; F230-L236 HydrophobicContact CZ-CB 4.03Å; F230-L236 HydrophobicContact CZ-CD1 4.25Å; F233-L236 HydrophobicContact CB-CB 4.37Å; F233-L236 HydrophobicContact CB-CD1 3.62Å; F233-L236 HydrophobicContact CB-CG 3.82Å; F233-L236 HydrophobicContact CG-CD1 4.14Å; F233-L236 WeakPolarHBondContact O-CB 3.48Å; F233-L236 PolarHBondContact O-N 3.32Å; P234-L236 VanDerWaalsContact C-N 3.31Å; L236-K238 PolarHBondContact O-N 2.71Å; L236-T239 WeakPolarHBondContact O-CB 3.43Å; L236-T239 WeakPolarHBondContact O-CG2 3.2Å; L236-T239 PolarHBondContact O-N 2.8Å; L236-T239 PolarHBondContact O-OG1 2.85Å; L236-L277 HydrophobicContact CD1-CD1 3.76Å; L236-L277 HydrophobicContact CD1-CD2 3.68Å; L236-L277 HydrophobicContact CD1-CG 4.39Å; L236-F292 HydrophobicContact CD1-CD2 4.44Å; L236-F292 HydrophobicContact CD2-CE1 4.35Å; L236-F292 HydrophobicContact CD2-CZ 4.44Å
237	A	62.8	Low	67.2	Low	8 Å²	8	32.1 Å²	32.1	7%	0.066	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-64.9	-27.1	-179	0	0	0	0	0	113	F230 T239 S694 T695	F230-A237 HydrophobicContact CD2-CB 4.38Å; A237-T239 PolarHBondContact O-N 3.26Å; A237-T239 VanDerWaalsContact O-N 3.14Å; A237-S694 WeakPolarHBondContact CB-O 3.44Å; A237-T695 WeakPolarHBondContact CB-O 2.89Å; A237-T695 WeakPolarHBondContact CB-OG1 3.31Å
238	K	64	Low	67.3	Low	67 Å²	67	35.3 Å²	35.3	29%	0.291	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-60.4	-23.4	169.5	-65.3	-164	174.8	-169.6	0	115.4	L236 K240 R696 V697	L236-K238 PolarHBondContact O-N 2.71Å; K238-K240 VanDerWaalsContact C-N 3.31Å; K238-R696 HydrophobicContact CD-CB 4.24Å; K238-R696 HydrophobicContact CD-CG 4.14Å; K238-R696 HydrophobicContact CG-CB 4.04Å; K238-R696 HydrophobicContact CG-CG 3.7Å; K238-V697 VanDerWaalsContact CE-N 3.29Å; K238-V697 WeakPolarHBondContact CE-O 3.46Å; K238-V697 VanDerWaalsContact NZ-C 3.34Å; K238-V697 PolarHBondContact NZ-O 3.47Å
239	T	68.7	Low	66.7	Low	6 Å²	6	39.2 Å²	39.2	4%	0.037	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-85.9	-9.5	-166.8	69	0	0	0	0	112.5	Y161 L236 A237 G241 F292	Y161-T239 HydrophobicContact CD1-CG2 4.33Å; Y161-T239 HydrophobicContact CD2-CG2 3.64Å; Y161-T239 HydrophobicContact CE2-CG2 4.37Å; Y161-T239 HydrophobicContact CG-CG2 3.61Å; L236-T239 WeakPolarHBondContact O-CB 3.43Å; L236-T239 WeakPolarHBondContact O-CG2 3.2Å; L236-T239 PolarHBondContact O-N 2.8Å; L236-T239 PolarHBondContact O-OG1 2.85Å; A237-T239 PolarHBondContact O-N 3.26Å; A237-T239 VanDerWaalsContact O-N 3.14Å; T239-G241 PolarHBondContact O-N 3.01Å; T239-G241 VanDerWaalsContact O-N 3.13Å; T239-G241 PolarHBondContact OG1-N 3.16Å; T239-F292 WeakPolarHBondContact OG1-CZ 3.31Å
240	K	74.1	Confident	66.8	Low	44 Å²	44	45.1 Å²	45.1	19%	0.191	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	32.3	-173.3	-54.7	-174.8	-170.8	-173.8	0	112.4	Y196 K238 H295 A691 D692	Y196-K240 HydrophobicContact CD1-CB 3.9Å; Y196-K240 HydrophobicContact CD1-CD 3.51Å; Y196-K240 HydrophobicContact CD1-CG 4.4Å; Y196-K240 HydrophobicContact CD2-CD 4.16Å; Y196-K240 HydrophobicContact CE1-CB 3.97Å; Y196-K240 HydrophobicContact CE1-CD 3.51Å; Y196-K240 HydrophobicContact CE1-CG 4.34Å; Y196-K240 HydrophobicContact CE2-CD 4.16Å; Y196-K240 HydrophobicContact CG-CD 3.85Å; K238-K240 VanDerWaalsContact C-N 3.31Å; K240-H295 VanDerWaalsContact O-CB 3.29Å; K240-H295 WeakPolarHBondContact O-CB 3.43Å; K240-A691 PolarHBondContact NZ-O 2.94Å; K240-D692 HydrophobicContact CD-CB 4.09Å
241	G	80.7	Confident	66.7	Low	18 Å²	18	46 Å²	46	19%	0.186	25%	0.246	C	C	.	.			trans	-72.7	173.1	179.5	0	0	0	0	0	112.1	T239 Y293	T239-G241 PolarHBondContact O-N 3.01Å; T239-G241 VanDerWaalsContact O-N 3.13Å; T239-G241 PolarHBondContact OG1-N 3.16Å; G241-Y293 CarbonylContact C-O 3.51Å; G241-Y293 WeakPolarHBondContact CA-O 3.32Å
242	I	86.5	Confident	67.5	Low	12 Å²	12	51.2 Å²	51.2	6%	0.062	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	147.3	-177.8	-51.1	172.3	0	0	0	107.8	M222 L259 F270 Y293	M222-I242 HydrophobicContact CE-CG2 3.15Å; I242-L259 HydrophobicContact CB-CD2 4.49Å; I242-L259 HydrophobicContact CD1-CD2 4.44Å; I242-L259 HydrophobicContact CG2-CD2 4.27Å; I242-F270 HydrophobicContact CD1-CB 3.84Å; I242-Y293 PolarHBondContact N-O 3.21Å; I242-Y293 WeakPolarHBondContact O-CD2 3.31Å; I242-Y293 PolarHBondContact O-N 3.02Å
243	C	85.9	Confident	68.5	Low	1 Å²	1	50.8 Å²	50.8	1%	0.007	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	150.5	172.6	-56.8	0	0	0	0	111.7	V223 C228 F230 H291	V223-C243 HydrophobicContact CB-CB 3.93Å; V223-C243 HydrophobicContact CG1-CB 4.38Å; V223-C243 HydrophobicContact CG2-CB 4.48Å; V223-C243 PolarHBondContact N-O 2.84Å; C228-C243 HydrophobicContact CB-CB 3.57Å; C228-C243 WeakPolarHBondContact CB-SG 3.5Å; C228-C243 WeakPolarHBondContact SG-CB 3.1Å; C228-C243 PolarHBondContact SG-N 3.07Å; C228-C243 CovalentContact SG-SG 2.04Å; C228-C243 PolarHBondContact SG-SG 2.03Å; F230-C243 WeakPolarHBondContact CE1-SG 3.24Å; F230-C243 WeakPolarHBondContact CZ-SG 3.49Å; C243-H291 VanDerWaalsContact CA-O 3.25Å; C243-H291 WeakPolarHBondContact CA-O 3.32Å
244	S	87.8	Confident	69.7	Low	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.4	164.2	68.4	0	0	0	0	111.3	R221 H246 H291 Y293	R221-S244 CarbonylContact O-C 3.43Å; R221-S244 WeakPolarHBondContact O-CA 3.1Å; R221-S244 WeakPolarHBondContact O-CB 3.11Å; S244-H246 PolarHBondContact OG-NE2 3.11Å; S244-H291 PolarHBondContact N-O 3.08Å; S244-H291 PolarHBondContact O-N 3.21Å; S244-Y293 WeakPolarHBondContact OG-CE2 2.82Å; S244-Y293 PolarHBondContact OG-OH 3.1Å
245	T	83.9	Confident	71.3	Confident	35 Å²	35	48.4 Å²	48.4	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	153.1	161.4	50.3	0	0	0	0	109.4	R221 V223 L290	R221-T245 PolarHBondContact N-O 3.16Å; R221-T245 PolarHBondContact O-N 3.26Å; V223-T245 HydrophobicContact CG2-CG2 3.75Å; T245-L290 HydrophobicContact CG2-CD2 3.75Å
246	H	77.8	Confident	73	Confident	20 Å²	20	47 Å²	47	9%	0.093	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.7	180	-78.3	-98.7	0	0	0	109.2	V207 E218 V220 S244 R248 K253 H291 Y293	V207-H246 VanDerWaalsContact CG1-CE1 3.47Å; V207-H246 WeakPolarHBondContact CG1-CE1 3.43Å; E218-H246 IonicContact OE1-CE1 3.65Å; E218-H246 IonicContact OE1-CG 3.63Å; E218-H246 IonicContact OE1-ND1 2.85Å; E218-H246 PolarHBondContact OE1-ND1 3.04Å; V220-H246 WeakPolarHBondContact CG1-CE1 3.43Å; S244-H246 PolarHBondContact OG-NE2 3.11Å; H246-R248 PolarHBondContact O-N 3.08Å; H246-K253 WeakPolarHBondContact CE1-CE 3.08Å; H246-K253 PolarHBondContact CE1-NZ 2.88Å; H246-K253 VanDerWaalsContact ND1-CE 3.27Å; H246-K253 WeakPolarHBondContact ND1-CE 3.4Å; H246-K253 PolarHBondContact ND1-NZ 3.13Å; H246-H291 AromaticContact CD2-CD2 3.06Å; H246-H291 PolarHBondContact CD2-CD2 2.05Å; H246-H291 AromaticContact CD2-CE1 3.92Å; H246-H291 AromaticContact CD2-CG 3.21Å; H246-H291 AromaticContact CD2-ND1 3.76Å; H246-H291 AromaticContact CD2-NE2 3.52Å; H246-H291 AromaticContact CG-CD2 3.84Å; H246-H291 AromaticContact CG-NE2 3.86Å; H246-H291 AromaticContact NE2-CD2 3.86Å; H246-H291 AromaticContact NE2-CG 3.49Å; H246-H291 AromaticContact NE2-ND1 3.84Å; H246-Y293 PolarHBondContact NE2-OH 2.56Å
247	D	69.3	Low	74.3	Confident	98 Å²	98	46.8 Å²	46.8	52%	0.524	24%	0.241	S	C	.	.	S	Bend	trans	-68.5	-21.2	177.4	-70.5	-3.2	0	0	0	111.2	R221	R221-D247 IonicContact CZ-OD1 2.64Å; R221-D247 VanDerWaalsContact CZ-OD1 3.31Å; R221-D247 IonicContact CZ-OD2 2.76Å; R221-D247 IonicContact NE-OD1 3.64Å; R221-D247 PolarHBondContact NE-OD1 2.84Å; R221-D247 IonicContact NE-OD2 3.59Å; R221-D247 IonicContact NH2-OD1 3.06Å; R221-D247 PolarHBondContact NH2-OD1 3.5Å; R221-D247 IonicContact NH2-OD2 2.69Å; R221-D247 PolarHBondContact NH2-OD2 3.18Å
248	R	64.9	Low	75.8	Confident	159 Å²	159	46.4 Å²	46.4	60%	0.6	24%	0.238	S	C	*	.			trans	-106.6	99.2	179.6	-66	-177.1	177	170.8	0.5	111.9	H246 E250 T251	H246-R248 PolarHBondContact O-N 3.08Å; R248-E250 PolarHBondContact O-N 2.94Å; R248-E250 VanDerWaalsContact O-N 3.08Å; R248-T251 HydrophobicContact CB-CG2 3.69Å; R248-T251 PolarHBondContact O-N 3.3Å; R248-T251 PolarHBondContact O-OG1 2.9Å
249	A	52.3	Low	77.2	Confident	87 Å²	87	43.2 Å²	43.2	72%	0.719	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.8	179.5	0	0	0	0	0	115
250	E	54.3	Low	78.5	Confident	178 Å²	178	43 Å²	43	83%	0.832	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.2	17.1	-171.3	-62.4	-169.7	163.8	0	0	115.3	R248 E252	R248-E250 PolarHBondContact O-N 2.94Å; R248-E250 VanDerWaalsContact O-N 3.08Å; E250-E252 PolarHBondContact O-N 3.11Å
251	T	55.6	Low	79.4	Confident	31 Å²	31	40.9 Å²	40.9	19%	0.19	21%	0.214	C	C	.	.			trans	-95.9	100.8	-173.8	45.9	0	0	0	0	111.5	E218 R248 K253	E218-T251 PolarHBondContact OE2-OG1 3Å; R248-T251 HydrophobicContact CB-CG2 3.69Å; R248-T251 PolarHBondContact O-N 3.3Å; R248-T251 PolarHBondContact O-OG1 2.9Å; T251-K253 WeakPolarHBondContact O-CD 3.48Å; T251-K253 WeakPolarHBondContact O-CE 3.48Å; T251-K253 WeakPolarHBondContact O-CG 3.21Å; T251-K253 PolarHBondContact O-N 3.14Å; T251-K253 VanDerWaalsContact O-N 3.08Å; T251-K253 WeakPolarHBondContact OG1-CE 3.18Å; T251-K253 PolarHBondContact OG1-NZ 2.71Å
252	E	62.3	Low	79.9	Confident	143 Å²	143	41.8 Å²	41.8	67%	0.668	21%	0.214	S	C	*	.			trans	-55.8	115.5	167.7	-75.6	-171.3	159.5	0	0	109.6	H211 E250	H211-E252 IonicContact CD2-OE2 2.71Å; E250-E252 PolarHBondContact O-N 3.11Å
253	K	70.5	Confident	80	Confident	27 Å²	27	43.4 Å²	43.4	12%	0.117	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-90.4	143.8	-176.1	-56.8	-54.9	-178.4	-176.3	0	111.5	T209 E218 H246 T251 Y273	T209-K253 HydrophobicContact CG2-CD 3.6Å; E218-K253 IonicContact OE1-NZ 2.88Å; E218-K253 PolarHBondContact OE1-NZ 3.43Å; E218-K253 IonicContact OE2-NZ 2.71Å; E218-K253 PolarHBondContact OE2-NZ 3.26Å; H246-K253 WeakPolarHBondContact CE1-CE 3.08Å; H246-K253 PolarHBondContact CE1-NZ 2.88Å; H246-K253 VanDerWaalsContact ND1-CE 3.27Å; H246-K253 WeakPolarHBondContact ND1-CE 3.4Å; H246-K253 PolarHBondContact ND1-NZ 3.13Å; T251-K253 WeakPolarHBondContact O-CD 3.48Å; T251-K253 WeakPolarHBondContact O-CE 3.48Å; T251-K253 WeakPolarHBondContact O-CG 3.21Å; T251-K253 PolarHBondContact O-N 3.14Å; T251-K253 VanDerWaalsContact O-N 3.08Å; T251-K253 WeakPolarHBondContact OG1-CE 3.18Å; T251-K253 PolarHBondContact OG1-NZ 2.71Å; K253-Y273 HydrophobicContact CB-CD1 3.84Å; K253-Y273 HydrophobicContact CB-CD2 4.44Å; K253-Y273 HydrophobicContact CB-CE1 3.26Å; K253-Y273 HydrophobicContact CB-CE2 3.94Å; K253-Y273 HydrophobicContact CB-CG 4.4Å; K253-Y273 HydrophobicContact CG-CE1 4.27Å; K253-Y273 HydrophobicContact CG-CE2 4.09Å
254	S	82.9	Confident	79.8	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.063	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-88.5	119.5	-180	-65.3	0	0	0	0	111.2	Y210 G256 G257 Y273	Y210-S254 WeakPolarHBondContact CA-OG 3.34Å; Y210-S254 VanDerWaalsContact CB-OG 3.29Å; Y210-S254 WeakPolarHBondContact CB-OG 3.1Å; Y210-S254 PolarHBondContact N-OG 2.72Å; Y210-S254 PolarHBondContact O-OG 3.42Å; S254-G256 PolarHBondContact O-N 3.34Å; S254-G257 PolarHBondContact O-N 3.38Å; S254-Y273 WeakPolarHBondContact O-CD1 3.26Å
255	L	90	Very high	79.6	Confident	40 Å²	40	50.5 Å²	50.5	21%	0.209	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	136.3	170.1	-69.7	176.6	0	0	0	110.8	C90 L91 G257 L274	C90-L255 VanDerWaalsContact CA-O 3.31Å; C90-L255 WeakPolarHBondContact CA-O 3.29Å; C90-L255 WeakPolarHBondContact CB-O 3.21Å; L91-L255 PolarHBondContact N-O 3.14Å; L255-G257 VanDerWaalsContact C-N 3.29Å; L255-G257 PolarHBondContact O-N 3.4Å; L255-L274 WeakPolarHBondContact CD2-O 3.41Å
256	G	92.3	Very high	79.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-0.6	-179	0	0	0	0	0	115	L91 S254 Y273	L91-G256 CarbonylContact C-O 3.56Å; L91-G256 CarbonylContact O-C 3.56Å; L91-G256 WeakPolarHBondContact O-CA 3.49Å; S254-G256 PolarHBondContact O-N 3.34Å; G256-Y273 PolarHBondContact N-O 2Å
257	G	93.2	Very high	80.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.289	C	S	.	.			trans	-57.1	127.5	175.2	0	0	0	0	0	112	S254 L255 Y273	S254-G257 PolarHBondContact O-N 3.38Å; L255-G257 VanDerWaalsContact C-N 3.29Å; L255-G257 PolarHBondContact O-N 3.4Å; G257-Y273 PolarHBondContact O-N 2.96Å
258	P	95.1	Very high	81.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.6	-179	31	-35.1	0	0	0	111.1	V207 V260 Q269	V207-P258 WeakPolarHBondContact CA-O 3.29Å; P258-V260 HydrophobicContact CB-CG2 4.01Å; P258-V260 HydrophobicContact CG-CG2 4.45Å; P258-Q269 HydrophobicContact CB-CG 4.12Å
259	L	94.1	Very high	83	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.5	167.3	175.6	69.6	0	0	0	108.7	C205 V220 M222 I242 Q269 F270 G271 Y293	C205-L259 HydrophobicContact CB-CD1 4.32Å; V220-L259 HydrophobicContact CG2-CD1 3.63Å; M222-L259 HydrophobicContact CE-CD2 3.89Å; M222-L259 HydrophobicContact SD-CD1 4.32Å; M222-L259 HydrophobicContact SD-CD2 4.39Å; I242-L259 HydrophobicContact CB-CD2 4.49Å; I242-L259 HydrophobicContact CD1-CD2 4.44Å; I242-L259 HydrophobicContact CG2-CD2 4.27Å; L259-Q269 WeakPolarHBondContact O-CA 3.47Å; L259-Q269 WeakPolarHBondContact O-CG 3.18Å; L259-F270 PolarHBondContact O-N 2.91Å; L259-G271 PolarHBondContact N-O 3.06Å; L259-G271 PolarHBondContact O-N 2.9Å; L259-Y293 HydrophobicContact CB-CD1 3.63Å; L259-Y293 HydrophobicContact CB-CE1 3.84Å; L259-Y293 HydrophobicContact CB-CG 4.26Å; L259-Y293 HydrophobicContact CD1-CE1 4.29Å; L259-Y293 HydrophobicContact CD2-CD1 4.21Å; L259-Y293 HydrophobicContact CD2-CD2 4.22Å; L259-Y293 HydrophobicContact CD2-CG 4.02Å; L259-Y293 HydrophobicContact CG-CD1 4.39Å; L259-Y293 HydrophobicContact CG-CE1 4.45Å
260	V	94.5	Very high	84.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.6	-173.3	179.3	0	0	0	0	109.8	W77 V190 C205 F206 P258 A267 Y268 Q269	W77-V260 HydrophobicContact CZ2-CG1 4.15Å; V190-V260 HydrophobicContact CG2-CG1 4.06Å; V190-V260 HydrophobicContact CG2-CG2 4.19Å; C205-V260 CarbonylContact C-O 3.51Å; C205-V260 WeakPolarHBondContact CA-O 3.37Å; F206-V260 HydrophobicContact CD2-CB 3.94Å; F206-V260 HydrophobicContact CD2-CG1 4.49Å; F206-V260 HydrophobicContact CE1-CG1 4.33Å; F206-V260 HydrophobicContact CE2-CB 3.34Å; F206-V260 HydrophobicContact CE2-CG1 3.49Å; F206-V260 VanDerWaalsContact CE2-CG1 3.49Å; F206-V260 HydrophobicContact CE2-CG2 4.19Å; F206-V260 HydrophobicContact CZ-CB 3.76Å; F206-V260 HydrophobicContact CZ-CG1 3.4Å; F206-V260 PolarHBondContact N-O 3.29Å; F206-V260 PolarHBondContact O-N 3.19Å; P258-V260 HydrophobicContact CB-CG2 4.01Å; P258-V260 HydrophobicContact CG-CG2 4.45Å; V260-A267 HydrophobicContact CG1-CB 3.72Å; V260-Y268 CarbonylContact C-O 3.47Å; V260-Y268 VanDerWaalsContact CA-O 3.29Å; V260-Y268 WeakPolarHBondContact CA-O 3.32Å; V260-Q269 HydrophobicContact CG2-CB 4.25Å; V260-Q269 HydrophobicContact CG2-CG 4.31Å
261	C	93.5	Very high	86.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.1	178.6	-50.4	0	0	0	0	111.1	P199 K204 C205 Y268 F270	P199-C261 HydrophobicContact CB-CB 4.19Å; P199-C261 VanDerWaalsContact CG-SG 3.57Å; K204-C261 WeakPolarHBondContact O-CA 3.42Å; C205-C261 HydrophobicContact CB-CB 4.06Å; C205-C261 WeakPolarHBondContact CB-SG 3.34Å; C205-C261 WeakPolarHBondContact SG-CB 3.12Å; C205-C261 CovalentContact SG-SG 2.04Å; C205-C261 PolarHBondContact SG-SG 2.8Å; C261-Y268 PolarHBondContact N-O 3.4Å; C261-Y268 PolarHBondContact O-N 3.05Å; C261-F270 HydrophobicContact CB-CD2 3.93Å; C261-F270 HydrophobicContact CB-CE2 3.78Å
262	L	91.5	Very high	88.5	Confident	38 Å²	38	25.2 Å²	25.2	20%	0.199	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	114.7	176.9	-55.8	-179	0	0	0	110	I64 S203 K204 F206 A267	I64-L262 HydrophobicContact CD1-CD2 3.92Å; I64-L262 HydrophobicContact CG2-CD2 3.9Å; S203-L262 WeakPolarHBondContact CB-O 3.47Å; K204-L262 PolarHBondContact O-N 2.67Å; F206-L262 HydrophobicContact CE1-CD1 4.43Å; F206-L262 HydrophobicContact CE1-CD2 3.89Å; F206-L262 HydrophobicContact CE1-CG 3.93Å; F206-L262 HydrophobicContact CZ-CD2 4.2Å; L262-A267 HydrophobicContact CD2-CB 4.09Å
263	V	87.4	Confident	90	Very high	45 Å²	45	19 Å²	19	27%	0.273	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	114.2	177.9	-176.2	0	0	0	0	108.2	P200 G265 R266 Y268 F270	P200-V263 HydrophobicContact CG-CG1 4.39Å; P200-V263 HydrophobicContact CG-CG2 4.31Å; V263-G265 VanDerWaalsContact C-N 3.28Å; V263-G265 PolarHBondContact O-N 2.97Å; V263-R266 PolarHBondContact N-O 2.85Å; V263-R266 PolarHBondContact O-N 2.73Å; V263-Y268 HydrophobicContact CB-CD2 3.96Å; V263-Y268 HydrophobicContact CB-CE2 4.2Å; V263-Y268 HydrophobicContact CG2-CD2 4.36Å; V263-F270 HydrophobicContact CG2-CE2 4.28Å; V263-F270 HydrophobicContact CG2-CZ 4.24Å
264	G	82	Confident	90.9	Very high	88 Å²	88	17.8 Å²	17.8	91%	0.907	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	35.7	-177.3	0	0	0	0	0	113.7	R266	G264-R266 VanDerWaalsContact C-N 3.29Å; G264-R266 PolarHBondContact O-N 2.78Å
265	G	83.4	Confident	91.1	Very high	62 Å²	62	17.6 Å²	17.6	64%	0.639	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.9	-1.8	-179.5	0	0	0	0	0	115.7	V263	V263-G265 VanDerWaalsContact C-N 3.28Å; V263-G265 PolarHBondContact O-N 2.97Å
266	R	89.1	Confident	90.7	Very high	35 Å²	35	19.7 Å²	19.7	13%	0.132	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	140.5	-179.7	-179.7	179.7	-71.7	-171.5	-5.7	111.3	S51 E55 C191 V263 G264 Y268	S51-R266 PolarHBondContact O-NH1 2.76Å; S51-R266 VanDerWaalsContact O-NH1 3.14Å; S51-R266 PolarHBondContact O-NH2 2.87Å; S51-R266 PolarHBondContact OG-NH1 3.3Å; E55-R266 HydrophobicContact CG-CB 4.36Å; E55-R266 HydrophobicContact CG-CG 4.22Å; E55-R266 IonicContact OE1-CZ 2.7Å; E55-R266 IonicContact OE1-NE 2.7Å; E55-R266 PolarHBondContact OE1-NE 3.42Å; E55-R266 IonicContact OE1-NH2 2.94Å; E55-R266 PolarHBondContact OE1-NH2 3.29Å; C191-R266 VanDerWaalsContact SG-CD 3.58Å; V263-R266 PolarHBondContact N-O 2.85Å; V263-R266 PolarHBondContact O-N 2.73Å; G264-R266 VanDerWaalsContact C-N 3.29Å; G264-R266 PolarHBondContact O-N 2.78Å; R266-Y268 HydrophobicContact CB-CD2 4.5Å; R266-Y268 HydrophobicContact CB-CE2 3.89Å; R266-Y268 WeakPolarHBondContact CD-OH 3.43Å; R266-Y268 HydrophobicContact CG-CD2 4.34Å; R266-Y268 HydrophobicContact CG-CE2 3.78Å; R266-Y268 WeakPolarHBondContact O-CD2 3.29Å
267	A	92.6	Very high	89.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.8	177.9	0	0	0	0	0	112.5	G54 I64 W77 V190 C191 V260 L262	G54-A267 WeakPolarHBondContact CA-O 3.23Å; G54-A267 PolarHBondContact O-N 2.68Å; I64-A267 HydrophobicContact CD1-CB 3.95Å; W77-A267 HydrophobicContact CH2-CB 3.4Å; W77-A267 HydrophobicContact CZ2-CB 3.81Å; W77-A267 HydrophobicContact CZ3-CB 4.16Å; V190-A267 HydrophobicContact CG2-CB 4.29Å; C191-A267 WeakPolarHBondContact CB-O 3.43Å; C191-A267 PolarHBondContact N-O 3.26Å; V260-A267 HydrophobicContact CG1-CB 3.72Å; L262-A267 HydrophobicContact CD2-CB 4.09Å
268	Y	92.7	Very high	88.5	Confident	40 Å²	40	25.3 Å²	25.3	16%	0.157	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.5	173.9	-70.9	-91.9	0	0	0	110.7	C191 K193 V260 C261 V263 R266 F270	C191-Y268 HydrophobicContact CB-CD1 3.41Å; C191-Y268 VanDerWaalsContact CB-CD1 3.41Å; C191-Y268 HydrophobicContact CB-CE1 3.57Å; C191-Y268 HydrophobicContact CB-CG 4.04Å; C191-Y268 CarbonylContact O-C 3.52Å; C191-Y268 WeakPolarHBondContact O-CA 3.3Å; K193-Y268 HydrophobicContact CD-CD1 4.18Å; K193-Y268 HydrophobicContact CD-CE1 4.38Å; K193-Y268 HydrophobicContact CG-CD1 3.96Å; V260-Y268 CarbonylContact C-O 3.47Å; V260-Y268 VanDerWaalsContact CA-O 3.29Å; V260-Y268 WeakPolarHBondContact CA-O 3.32Å; C261-Y268 PolarHBondContact N-O 3.4Å; C261-Y268 PolarHBondContact O-N 3.05Å; V263-Y268 HydrophobicContact CB-CD2 3.96Å; V263-Y268 HydrophobicContact CB-CE2 4.2Å; V263-Y268 HydrophobicContact CG2-CD2 4.36Å; R266-Y268 HydrophobicContact CB-CD2 4.5Å; R266-Y268 HydrophobicContact CB-CE2 3.89Å; R266-Y268 WeakPolarHBondContact CD-OH 3.43Å; R266-Y268 HydrophobicContact CG-CD2 4.34Å; R266-Y268 HydrophobicContact CG-CE2 3.78Å; R266-Y268 WeakPolarHBondContact O-CD2 3.29Å; Y268-F270 WeakPolarHBondContact O-CD2 3.44Å
269	Q	94	Very high	86.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.7	169.8	-169.3	-177.4	-10.1	0	0	110.2	S93 V190 C191 P258 L259 V260 G271 V296	S93-Q269 VanDerWaalsContact OG-CD 3.27Å; S93-Q269 PolarHBondContact OG-NE2 3.11Å; S93-Q269 PolarHBondContact OG-OE1 2.75Å; V190-Q269 HydrophobicContact CG1-CB 3.94Å; V190-Q269 HydrophobicContact CG2-CB 4.07Å; C191-Q269 PolarHBondContact O-N 2.57Å; P258-Q269 HydrophobicContact CB-CG 4.12Å; L259-Q269 WeakPolarHBondContact O-CA 3.47Å; L259-Q269 WeakPolarHBondContact O-CG 3.18Å; V260-Q269 HydrophobicContact CG2-CB 4.25Å; V260-Q269 HydrophobicContact CG2-CG 4.31Å; Q269-G271 PolarHBondContact NE2-O 2.69Å; Q269-V296 HydrophobicContact CG-CG1 3.85Å
270	F	91.9	Very high	84.5	Confident	3 Å²	3	36.2 Å²	36.2	1%	0.013	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-33.7	179.9	-74.4	-94.2	0	0	0	112.4	K193 A197 P199 I242 L259 C261 V263 Y268 V296	K193-F270 HydrophobicContact CG-CE1 4.08Å; K193-F270 HydrophobicContact CG-CZ 4.23Å; A197-F270 HydrophobicContact CB-CE1 4.18Å; A197-F270 VanDerWaalsContact O-CD1 3.23Å; A197-F270 WeakPolarHBondContact O-CD1 3.31Å; P199-F270 HydrophobicContact CB-CD2 4.39Å; P199-F270 HydrophobicContact CB-CE1 4.34Å; P199-F270 HydrophobicContact CB-CE2 4.25Å; P199-F270 HydrophobicContact CB-CZ 4.21Å; P199-F270 HydrophobicContact CG-CB 4.05Å; P199-F270 HydrophobicContact CG-CD1 3.72Å; P199-F270 HydrophobicContact CG-CD2 3.85Å; P199-F270 HydrophobicContact CG-CE1 4.04Å; P199-F270 HydrophobicContact CG-CE2 4.18Å; P199-F270 HydrophobicContact CG-CG 3.61Å; P199-F270 HydrophobicContact CG-CZ 4.25Å; I242-F270 HydrophobicContact CD1-CB 3.84Å; L259-F270 PolarHBondContact O-N 2.91Å; C261-F270 HydrophobicContact CB-CD2 3.93Å; C261-F270 HydrophobicContact CB-CE2 3.78Å; V263-F270 HydrophobicContact CG2-CE2 4.28Å; V263-F270 HydrophobicContact CG2-CZ 4.24Å; Y268-F270 WeakPolarHBondContact O-CD2 3.44Å; F270-V296 PolarHBondContact O-N 3.13Å
271	G	91.7	Very high	82.3	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	171.7	-175	0	0	0	0	0	114.5	L259 Q269 G294	L259-G271 PolarHBondContact N-O 3.06Å; L259-G271 PolarHBondContact O-N 2.9Å; Q269-G271 PolarHBondContact NE2-O 2.69Å; G271-G294 CarbonylContact C-O 3.55Å; G271-G294 VanDerWaalsContact CA-O 3.29Å; G271-G294 WeakPolarHBondContact CA-O 3.33Å
272	I	94.2	Very high	79.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.3	175.9	-59.9	170.1	0	0	0	107.5	L112 A114 V172 L274 Y293 G294 V296	L112-I272 HydrophobicContact CB-CD1 3.95Å; A114-I272 HydrophobicContact CB-CG2 4.34Å; V172-I272 HydrophobicContact CB-CD1 4.03Å; V172-I272 HydrophobicContact CG1-CB 4.14Å; V172-I272 HydrophobicContact CG1-CD1 3.85Å; V172-I272 HydrophobicContact CG1-CG1 4.47Å; I272-L274 HydrophobicContact CG2-CD2 4.49Å; I272-L274 WeakPolarHBondContact O-CG 3.48Å; I272-L274 PolarHBondContact O-N 2.73Å; I272-Y293 CarbonylContact O-C 3.47Å; I272-Y293 WeakPolarHBondContact O-CA 3.41Å; I272-G294 PolarHBondContact N-O 3.14Å; I272-G294 PolarHBondContact O-N 3.47Å; I272-V296 HydrophobicContact CD1-CG1 4.43Å; I272-V296 HydrophobicContact CG1-CG1 4.15Å
273	Y	93.5	Very high	76.8	Confident	13 Å²	13	48.7 Å²	48.7	5%	0.051	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	127.4	-177.1	180	-99.8	0	0	0	112.1	K253 S254 G256 G257 S275 E276 H291 Y293	K253-Y273 HydrophobicContact CB-CD1 3.84Å; K253-Y273 HydrophobicContact CB-CD2 4.44Å; K253-Y273 HydrophobicContact CB-CE1 3.26Å; K253-Y273 HydrophobicContact CB-CE2 3.94Å; K253-Y273 HydrophobicContact CB-CG 4.4Å; K253-Y273 HydrophobicContact CG-CE1 4.27Å; K253-Y273 HydrophobicContact CG-CE2 4.09Å; S254-Y273 WeakPolarHBondContact O-CD1 3.26Å; G256-Y273 PolarHBondContact N-O 2Å; G257-Y273 PolarHBondContact O-N 2.96Å; Y273-S275 VanDerWaalsContact OH-C 3.29Å; Y273-E276 PolarHBondContact OH-N 3.4Å; Y273-H291 HydrophobicContact CD2-CB 4.41Å; Y273-H291 HydrophobicContact CE2-CB 3.89Å; Y273-H291 AromaticContact CE2-ND1 3.57Å; Y273-Y293 HydrophobicContact CD2-CD1 4.32Å; Y273-Y293 AromaticContact CD2-CE1 3.86Å; Y273-Y293 HydrophobicContact CD2-CE1 3.86Å; Y273-Y293 HydrophobicContact CD2-CE2 4.49Å; Y273-Y293 AromaticContact CD2-CZ 3.96Å; Y273-Y293 HydrophobicContact CG-CE1 4.27Å
274	L	89.7	Confident	74.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-39	-176.8	-61.3	-174.8	0	0	0	114.3	A114 Y161 I168 G171 V172 L255 I272 F292	A114-L274 HydrophobicContact CB-CD2 3.5Å; A114-L274 VanDerWaalsContact CB-CD2 3.5Å; Y161-L274 HydrophobicContact CD2-CD1 3.93Å; Y161-L274 HydrophobicContact CE2-CD1 3.47Å; Y161-L274 VanDerWaalsContact CE2-CD1 3.47Å; I168-L274 HydrophobicContact CG1-CB 4.47Å; I168-L274 HydrophobicContact CG2-CD1 4.32Å; G171-L274 VanDerWaalsContact O-CD2 3.26Å; G171-L274 WeakPolarHBondContact O-CD2 3.26Å; V172-L274 HydrophobicContact CG1-CD1 4.47Å; V172-L274 HydrophobicContact CG1-CD2 4.37Å; L255-L274 WeakPolarHBondContact CD2-O 3.41Å; I272-L274 HydrophobicContact CG2-CD2 4.49Å; I272-L274 WeakPolarHBondContact O-CG 3.48Å; I272-L274 PolarHBondContact O-N 2.73Å; L274-F292 HydrophobicContact CB-CD1 4.17Å; L274-F292 HydrophobicContact CD1-CD1 4.36Å; L274-F292 HydrophobicContact CD1-CE1 3.98Å; L274-F292 PolarHBondContact N-O 3.43Å
275	S	85.9	Confident	72.3	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.042	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	155.9	179.7	-168.3	0	0	0	0	111.6	N165 Y273 F292	N165-S275 PolarHBondContact ND2-OG 3.47Å; N165-S275 VanDerWaalsContact ND2-OG 3.15Å; Y273-S275 VanDerWaalsContact OH-C 3.29Å; S275-F292 PolarHBondContact N-O 2.85Å; S275-F292 WeakPolarHBondContact O-CB 3.41Å; S275-F292 PolarHBondContact O-N 3.02Å
276	E	82.7	Confident	70.4	Confident	83 Å²	83	60.6 Å²	60.6	39%	0.388	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	144.5	158.6	-171.9	-178.8	179.7	0	0	109.2	Y273 S289 L290	Y273-E276 PolarHBondContact OH-N 3.4Å; E276-S289 WeakPolarHBondContact OE1-CB 3.43Å; E276-L290 CarbonylContact C-O 3.41Å
277	L	73.3	Confident	68.6	Low	5 Å²	5	68.6 Å²	68.6	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.3	175.8	-59.5	178	0	0	0	107.3	I168 F230 F233 L236 T279 L290 F292	I168-L277 HydrophobicContact CD1-CD2 3.86Å; F230-L277 HydrophobicContact CD1-CD1 3.73Å; F230-L277 HydrophobicContact CE1-CD1 3.27Å; F230-L277 HydrophobicContact CZ-CD1 4.33Å; F233-L277 HydrophobicContact CD2-CD1 4.43Å; F233-L277 HydrophobicContact CD2-CD2 4.32Å; F233-L277 HydrophobicContact CE2-CB 4.08Å; F233-L277 HydrophobicContact CE2-CD2 4.28Å; F233-L277 HydrophobicContact CZ-CD2 4.44Å; L236-L277 HydrophobicContact CD1-CD1 3.76Å; L236-L277 HydrophobicContact CD1-CD2 3.68Å; L236-L277 HydrophobicContact CD1-CG 4.39Å; L277-T279 PolarHBondContact O-N 2.82Å; L277-L290 WeakPolarHBondContact CA-O 3.48Å; L277-L290 HydrophobicContact CB-CB 4.17Å; L277-L290 PolarHBondContact N-O 2.91Å; L277-L290 PolarHBondContact O-N 3.48Å; L277-F292 HydrophobicContact CD1-CB 3.73Å; L277-F292 HydrophobicContact CD1-CD2 4.24Å; L277-F292 HydrophobicContact CD1-CG 4.23Å; L277-F292 HydrophobicContact CD2-CB 4.47Å; L277-F292 HydrophobicContact CG-CB 3.88Å
278	I	66	Low	67.1	Low	113 Å²	113	73.5 Å²	73.5	58%	0.579	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	108.9	178.8	-57.4	172	0	0	0	106.9
279	T	55.6	Low	66	Low	27 Å²	27	72.9 Å²	72.9	17%	0.166	34%	0.343	C	S	.	.			trans	-78.7	133.4	168.4	56	0	0	0	0	108	L277 Q288 L290	L277-T279 PolarHBondContact O-N 2.82Å; T279-Q288 PolarHBondContact OG1-O 2.96Å; T279-L290 HydrophobicContact CG2-CD1 3.68Å; T279-L290 HydrophobicContact CG2-CG 4.18Å
280	R	50.2	Low	65.4	Low	203 Å²	203	73.6 Å²	73.6	77%	0.766	35%	0.347	S	S	*	.			trans	-96.5	98.9	167.3	-79.7	-170.9	168.8	-169.1	-3.4	106.6
281	E	47.5	Very low	65.1	Low	70 Å²	70	73.7 Å²	73.7	33%	0.327	35%	0.347	S	S	.	.			trans	-65.5	132.7	-179.4	-69.9	-174	-174.6	0	0	112.3	S284 Q288	E281-S284 PolarHBondContact OE2-OG 2.97Å; E281-Q288 VanDerWaalsContact OE1-CG 3.31Å; E281-Q288 WeakPolarHBondContact OE1-CG 3.41Å
282	A	36.4	Very low	64.9	Low	27 Å²	27	73.7 Å²	73.7	22%	0.223	35%	0.347	C	S	.	.	S	Bend	trans	-76.1	-14.9	170.3	0	0	0	0	0	115.7	E501	A282-E501 WeakPolarHBondContact CA-OE1 3.44Å; A282-E501 HydrophobicContact CB-CG 3.82Å; A282-E501 WeakPolarHBondContact CB-OE1 3.07Å; A282-E501 PolarHBondContact N-OE1 2.95Å
283	F	33.6	Very low	64.7	Low	203 Å²	203	73.7 Å²	73.7	89%	0.89	35%	0.347	S	S	*	.	S	Bend	trans	-153.7	37.6	-169.2	-75	-77.1	0	0	0	117.6
284	S	35.1	Very low	64.5	Low	69 Å²	69	73.1 Å²	73.1	48%	0.483	35%	0.345	S	S	.	.			trans	-157.6	156.4	164.5	101	0	0	0	0	113	E281 Q286	E281-S284 PolarHBondContact OE2-OG 2.97Å; S284-Q286 PolarHBondContact O-N 3Å; S284-Q286 VanDerWaalsContact O-N 3.13Å
285	F	39.4	Very low	64.5	Low	227 Å²	227	73.3 Å²	73.3	100%	0.996	35%	0.346	S	S	*	.	S	Bend	trans	-75.6	14.6	-173.7	-77.1	-90.7	0	0	0	115.3
286	Q	43.2	Very low	64.6	Low	149 Å²	149	73 Å²	73	70%	0.696	34%	0.344	S	S	*	.	S	Bend	trans	-129.4	129.6	-179.7	-83.7	179.6	-20.7	0	0	113.1	S284 Q288	S284-Q286 PolarHBondContact O-N 3Å; S284-Q286 VanDerWaalsContact O-N 3.13Å; Q286-Q288 PolarHBondContact O-N 3.4Å
287	K	51.8	Low	64.6	Low	202 Å²	202	69.2 Å²	69.2	88%	0.878	33%	0.326	S	S	*	.			trans	-73.5	116	171.3	-71.5	175.4	-178.9	170.9	0	109.4
288	Q	60.1	Low	64.9	Low	104 Å²	104	69.5 Å²	69.5	49%	0.486	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-93.6	132.1	166.8	-67	-174.8	7.7	0	0	110.9	T279 E281 Q286	T279-Q288 PolarHBondContact OG1-O 2.96Å; E281-Q288 VanDerWaalsContact OE1-CG 3.31Å; E281-Q288 WeakPolarHBondContact OE1-CG 3.41Å; Q286-Q288 PolarHBondContact O-N 3.4Å
289	S	70.9	Confident	65.7	Low	27 Å²	27	64.1 Å²	64.1	19%	0.189	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.8	170	48.7	0	0	0	0	110.1	E276	E276-S289 WeakPolarHBondContact OE1-CB 3.43Å
290	L	80.1	Confident	66.9	Low	15 Å²	15	65.1 Å²	65.1	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.9	174.2	-66.9	176.9	0	0	0	109.4	V223 T245 E276 L277 T279	V223-L290 HydrophobicContact CG1-CD2 4.31Å; V223-L290 HydrophobicContact CG2-CD2 3.83Å; T245-L290 HydrophobicContact CG2-CD2 3.75Å; E276-L290 CarbonylContact C-O 3.41Å; L277-L290 WeakPolarHBondContact CA-O 3.48Å; L277-L290 HydrophobicContact CB-CB 4.17Å; L277-L290 PolarHBondContact N-O 2.91Å; L277-L290 PolarHBondContact O-N 3.48Å; T279-L290 HydrophobicContact CG2-CD1 3.68Å; T279-L290 HydrophobicContact CG2-CG 4.18Å
291	H	86.1	Confident	68	Low	5 Å²	5	57.8 Å²	57.8	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.8	179.4	-69.2	-104.8	0	0	0	110	C243 S244 H246 Y273 Y293	C243-H291 VanDerWaalsContact CA-O 3.25Å; C243-H291 WeakPolarHBondContact CA-O 3.32Å; S244-H291 PolarHBondContact N-O 3.08Å; S244-H291 PolarHBondContact O-N 3.21Å; H246-H291 AromaticContact CD2-CD2 3.06Å; H246-H291 PolarHBondContact CD2-CD2 2.05Å; H246-H291 AromaticContact CD2-CE1 3.92Å; H246-H291 AromaticContact CD2-CG 3.21Å; H246-H291 AromaticContact CD2-ND1 3.76Å; H246-H291 AromaticContact CD2-NE2 3.52Å; H246-H291 AromaticContact CG-CD2 3.84Å; H246-H291 AromaticContact CG-NE2 3.86Å; H246-H291 AromaticContact NE2-CD2 3.86Å; H246-H291 AromaticContact NE2-CG 3.49Å; H246-H291 AromaticContact NE2-ND1 3.84Å; Y273-H291 HydrophobicContact CD2-CB 4.41Å; Y273-H291 HydrophobicContact CE2-CB 3.89Å; Y273-H291 AromaticContact CE2-ND1 3.57Å; H291-Y293 HydrophobicContact CB-CE2 3.92Å; H291-Y293 WeakPolarHBondContact O-CD2 3.19Å; H291-Y293 VanDerWaalsContact O-CE2 3.24Å; H291-Y293 WeakPolarHBondContact O-CE2 2.9Å
292	F	87.7	Confident	68.9	Low	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.8	-171.9	-178.5	-103.1	0	0	0	112.9	Y161 I168 F230 L236 T239 L274 S275 L277	Y161-F292 HydrophobicContact CE2-CE1 4.44Å; I168-F292 HydrophobicContact CD1-CD1 3.92Å; I168-F292 HydrophobicContact CD1-CE1 4.5Å; I168-F292 HydrophobicContact CD1-CG 4.5Å; I168-F292 HydrophobicContact CG1-CD1 4.14Å; I168-F292 HydrophobicContact CG2-CD1 4.04Å; I168-F292 HydrophobicContact CG2-CE1 3.63Å; F230-F292 AromaticContact CE1-CD2 3.89Å; F230-F292 HydrophobicContact CE1-CD2 3.89Å; F230-F292 HydrophobicContact CE1-CE2 4.29Å; F230-F292 HydrophobicContact CE2-CD2 4.37Å; F230-F292 AromaticContact CE2-CE2 3.95Å; F230-F292 HydrophobicContact CE2-CE2 3.95Å; F230-F292 AromaticContact CZ-CD2 3.4Å; F230-F292 HydrophobicContact CZ-CD2 3.4Å; F230-F292 VanDerWaalsContact CZ-CD2 3.4Å; F230-F292 AromaticContact CZ-CE2 3.41Å; F230-F292 HydrophobicContact CZ-CE2 3.41Å; F230-F292 VanDerWaalsContact CZ-CE2 3.41Å; L236-F292 HydrophobicContact CD1-CD2 4.44Å; L236-F292 HydrophobicContact CD2-CE1 4.35Å; L236-F292 HydrophobicContact CD2-CZ 4.44Å; T239-F292 WeakPolarHBondContact OG1-CZ 3.31Å; L274-F292 HydrophobicContact CB-CD1 4.17Å; L274-F292 HydrophobicContact CD1-CD1 4.36Å; L274-F292 HydrophobicContact CD1-CE1 3.98Å; L274-F292 PolarHBondContact N-O 3.43Å; S275-F292 PolarHBondContact N-O 2.85Å; S275-F292 WeakPolarHBondContact O-CB 3.41Å; S275-F292 PolarHBondContact O-N 3.02Å; L277-F292 HydrophobicContact CD1-CB 3.73Å; L277-F292 HydrophobicContact CD1-CD2 4.24Å; L277-F292 HydrophobicContact CD1-CG 4.23Å; L277-F292 HydrophobicContact CD2-CB 4.47Å; L277-F292 HydrophobicContact CG-CB 3.88Å
293	Y	90.6	Very high	70.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.7	-177.7	-57	-97.7	0	0	0	110.8	V207 G241 I242 S244 H246 L259 I272 Y273 H291	V207-Y293 HydrophobicContact CB-CE1 4.23Å; V207-Y293 HydrophobicContact CG2-CE1 3.8Å; G241-Y293 CarbonylContact C-O 3.51Å; G241-Y293 WeakPolarHBondContact CA-O 3.32Å; I242-Y293 PolarHBondContact N-O 3.21Å; I242-Y293 WeakPolarHBondContact O-CD2 3.31Å; I242-Y293 PolarHBondContact O-N 3.02Å; S244-Y293 WeakPolarHBondContact OG-CE2 2.82Å; S244-Y293 PolarHBondContact OG-OH 3.1Å; H246-Y293 PolarHBondContact NE2-OH 2.56Å; L259-Y293 HydrophobicContact CB-CD1 3.63Å; L259-Y293 HydrophobicContact CB-CE1 3.84Å; L259-Y293 HydrophobicContact CB-CG 4.26Å; L259-Y293 HydrophobicContact CD1-CE1 4.29Å; L259-Y293 HydrophobicContact CD2-CD1 4.21Å; L259-Y293 HydrophobicContact CD2-CD2 4.22Å; L259-Y293 HydrophobicContact CD2-CG 4.02Å; L259-Y293 HydrophobicContact CG-CD1 4.39Å; L259-Y293 HydrophobicContact CG-CE1 4.45Å; I272-Y293 CarbonylContact O-C 3.47Å; I272-Y293 WeakPolarHBondContact O-CA 3.41Å; Y273-Y293 HydrophobicContact CD2-CD1 4.32Å; Y273-Y293 AromaticContact CD2-CE1 3.86Å; Y273-Y293 HydrophobicContact CD2-CE1 3.86Å; Y273-Y293 HydrophobicContact CD2-CE2 4.49Å; Y273-Y293 AromaticContact CD2-CZ 3.96Å; Y273-Y293 HydrophobicContact CG-CE1 4.27Å; H291-Y293 HydrophobicContact CB-CE2 3.92Å; H291-Y293 WeakPolarHBondContact O-CD2 3.19Å; H291-Y293 VanDerWaalsContact O-CE2 3.24Å; H291-Y293 WeakPolarHBondContact O-CE2 2.9Å
294	G	88.9	Confident	71.1	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	132	169.4	0	0	0	0	0	111	Y161 G271 I272	Y161-G294 WeakPolarHBondContact OH-CA 2.97Å; G271-G294 CarbonylContact C-O 3.55Å; G271-G294 VanDerWaalsContact CA-O 3.29Å; G271-G294 WeakPolarHBondContact CA-O 3.33Å; I272-G294 PolarHBondContact N-O 3.14Å; I272-G294 PolarHBondContact O-N 3.47Å
295	H	88.6	Confident	72.1	Confident	5 Å²	5	56 Å²	56	2%	0.023	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	132.8	-176.1	-169.5	-70.7	0	0	0	111.8	Y161 V195 Y196 A197 K240 A297 T298	Y161-H295 PolarHBondContact OH-N 3.25Å; V195-H295 PolarHBondContact O-CE1 2.84Å; Y196-H295 HydrophobicContact CD1-CB 4.34Å; Y196-H295 AromaticContact CD1-CG 3.82Å; Y196-H295 AromaticContact CD1-ND1 3.68Å; Y196-H295 HydrophobicContact CE1-CB 4.43Å; A197-H295 PolarHBondContact O-NE2 2.89Å; K240-H295 VanDerWaalsContact O-CB 3.29Å; K240-H295 WeakPolarHBondContact O-CB 3.43Å; H295-A297 VanDerWaalsContact C-N 3.31Å; H295-A297 VanDerWaalsContact ND1-CB 3.29Å; H295-A297 WeakPolarHBondContact ND1-CB 3.47Å; H295-A297 PolarHBondContact ND1-N 2.94Å; H295-A297 PolarHBondContact O-N 2.88Å; H295-T298 HydrophobicContact CB-CG2 4.37Å; H295-T298 WeakPolarHBondContact O-CB 3.38Å; H295-T298 PolarHBondContact O-N 2.84Å; H295-T298 VanDerWaalsContact O-N 3.12Å; H295-T298 PolarHBondContact O-OG1 2.98Å
296	V	88.5	Confident	73.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.9	-174.5	-67.9	0	0	0	0	114.2	L112 V192 Q269 F270 I272 T298 V299	L112-V296 HydrophobicContact CD1-CB 4.22Å; L112-V296 HydrophobicContact CD1-CG1 3.99Å; V192-V296 HydrophobicContact CG1-CB 3.74Å; V192-V296 HydrophobicContact CG1-CG1 4.4Å; V192-V296 HydrophobicContact CG1-CG2 3.46Å; V192-V296 VanDerWaalsContact CG1-CG2 3.46Å; Q269-V296 HydrophobicContact CG-CG1 3.85Å; F270-V296 PolarHBondContact O-N 3.13Å; I272-V296 HydrophobicContact CD1-CG1 4.43Å; I272-V296 HydrophobicContact CG1-CG1 4.15Å; V296-T298 PolarHBondContact O-N 2.91Å; V296-T298 VanDerWaalsContact O-N 3.14Å; V296-V299 PolarHBondContact O-N 3.49Å
297	A	84	Confident	73.7	Confident	3 Å²	3	42.1 Å²	42.1	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-57.5	-27.5	177.9	0	0	0	0	0	113.4	Y196 H295 V299 L300 D301	Y196-A297 HydrophobicContact CD1-CB 4.23Å; Y196-A297 HydrophobicContact CE1-CB 4.13Å; Y196-A297 HydrophobicContact CE2-CB 4.46Å; Y196-A297 HydrophobicContact CG-CB 4.43Å; H295-A297 VanDerWaalsContact C-N 3.31Å; H295-A297 VanDerWaalsContact ND1-CB 3.29Å; H295-A297 WeakPolarHBondContact ND1-CB 3.47Å; H295-A297 PolarHBondContact ND1-N 2.94Å; H295-A297 PolarHBondContact O-N 2.88Å; A297-V299 VanDerWaalsContact C-N 3.3Å; A297-V299 PolarHBondContact O-N 3.22Å; A297-L300 PolarHBondContact O-N 2.84Å; A297-D301 PolarHBondContact O-N 2.91Å
298	T	78.9	Confident	73.8	Confident	10 Å²	10	41.9 Å²	41.9	6%	0.061	22%	0.224	C	C	.	.	H	α-helix	trans	-63.1	-30.7	-175.5	57	0	0	0	0	114.1	Y161 V172 Y196 H295 V296	Y161-T298 HydrophobicContact CE1-CG2 4.11Å; Y161-T298 PolarHBondContact OH-OG1 2.91Å; V172-T298 WeakPolarHBondContact CG2-OG1 3.44Å; Y196-T298 HydrophobicContact CE1-CG2 3.67Å; H295-T298 HydrophobicContact CB-CG2 4.37Å; H295-T298 WeakPolarHBondContact O-CB 3.38Å; H295-T298 PolarHBondContact O-N 2.84Å; H295-T298 VanDerWaalsContact O-N 3.12Å; H295-T298 PolarHBondContact O-OG1 2.98Å; V296-T298 PolarHBondContact O-N 2.91Å; V296-T298 VanDerWaalsContact O-N 3.14Å
299	V	82.7	Confident	74.2	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-95	-18.4	178.4	74.6	0	0	0	0	113.2	L112 V172 L174 V296 A297 F310	L112-V299 HydrophobicContact CD2-CG1 3.44Å; L112-V299 VanDerWaalsContact CD2-CG1 3.44Å; V172-V299 HydrophobicContact CG2-CB 3.76Å; V172-V299 HydrophobicContact CG2-CG1 4.34Å; L174-V299 HydrophobicContact CB-CG1 4.46Å; L174-V299 HydrophobicContact CB-CG2 3.79Å; V296-V299 PolarHBondContact O-N 3.49Å; A297-V299 VanDerWaalsContact C-N 3.3Å; A297-V299 PolarHBondContact O-N 3.22Å; V299-F310 HydrophobicContact CG2-CE1 4.31Å
300	L	81.5	Confident	74.7	Confident	48 Å²	48	43.7 Å²	43.7	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-88.9	-14.2	179.4	-63	-178.4	0	0	0	112.9	I95 V192 A297 K302	I95-L300 HydrophobicContact CD1-CD2 4.06Å; V192-L300 HydrophobicContact CB-CD1 4.25Å; V192-L300 HydrophobicContact CG1-CD1 3.55Å; A297-L300 PolarHBondContact O-N 2.84Å; L300-K302 PolarHBondContact O-N 2.92Å
301	D	72.1	Confident	74.8	Confident	48 Å²	48	45.3 Å²	45.3	26%	0.257	23%	0.231	S	C	.	.			trans	-61.8	122.2	176.1	-173.6	9.3	0	0	0	111.5	A297 S303 N306	A297-D301 PolarHBondContact O-N 2.91Å; D301-S303 VanDerWaalsContact OD1-CB 3.22Å; D301-S303 WeakPolarHBondContact OD1-CB 3.42Å; D301-S303 PolarHBondContact OD1-N 3.43Å; D301-S303 PolarHBondContact OD1-OG 2.98Å; D301-S303 VanDerWaalsContact OD1-OG 3.09Å; D301-S303 PolarHBondContact OD2-OG 3.09Å; D301-N306 PolarHBondContact OD2-ND2 3.28Å
302	K	66.7	Low	74.7	Confident	185 Å²	185	49 Å²	49	80%	0.804	25%	0.249	S	C	*	.			trans	-101.1	7.8	178.6	-64.3	-176.9	-176.7	176.4	0	112.4	L300	L300-K302 PolarHBondContact O-N 2.92Å
303	S	62.4	Low	74.5	Confident	25 Å²	25	50.2 Å²	50.2	18%	0.175	26%	0.255	C	S	.	.			trans	-55.6	136.4	179.6	63.3	0	0	0	0	111.4	D301 A305 N306 A307	D301-S303 VanDerWaalsContact OD1-CB 3.22Å; D301-S303 WeakPolarHBondContact OD1-CB 3.42Å; D301-S303 PolarHBondContact OD1-N 3.43Å; D301-S303 PolarHBondContact OD1-OG 2.98Å; D301-S303 VanDerWaalsContact OD1-OG 3.09Å; D301-S303 PolarHBondContact OD2-OG 3.09Å; S303-A305 PolarHBondContact O-N 3.04Å; S303-A305 VanDerWaalsContact O-N 3.15Å; S303-N306 PolarHBondContact O-N 2.93Å; S303-N306 PolarHBondContact OG-ND2 3.18Å; S303-A307 PolarHBondContact O-N 2.77Å
304	P	54.8	Low	73.8	Confident	87 Å²	87	53 Å²	53	57%	0.565	28%	0.284	S	S	*	.	H	α-helix	trans	-59.4	-25.9	178.8	20.6	-29.9	0	0	0	112.5	N306 A307	P304-N306 VanDerWaalsContact C-N 3.3Å; P304-N306 PolarHBondContact O-N 3.4Å; P304-A307 PolarHBondContact O-N 2.87Å
305	A	55.3	Low	72.5	Confident	34 Å²	34	56 Å²	56	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-30.6	175.1	0	0	0	0	0	114.3	S303 A688 E689	S303-A305 PolarHBondContact O-N 3.04Å; S303-A305 VanDerWaalsContact O-N 3.15Å; A305-A688 WeakPolarHBondContact CB-O 3.45Å; A305-E689 WeakPolarHBondContact CB-O 3.36Å
306	N	60.1	Low	70.7	Confident	30 Å²	30	61.4 Å²	61.4	16%	0.16	34%	0.338	C	S	.	.	H	α-helix	trans	-95.4	-13.7	-178.2	-78.3	-28.9	0	0	0	113.2	M159 D301 S303 P304 F308 R309 F310	M159-N306 HydrophobicContact CE-CB 3.95Å; D301-N306 PolarHBondContact OD2-ND2 3.28Å; S303-N306 PolarHBondContact O-N 2.93Å; S303-N306 PolarHBondContact OG-ND2 3.18Å; P304-N306 VanDerWaalsContact C-N 3.3Å; P304-N306 PolarHBondContact O-N 3.4Å; N306-F308 PolarHBondContact O-N 2.93Å; N306-F308 VanDerWaalsContact O-N 3.14Å; N306-R309 PolarHBondContact O-N 3.28Å; N306-F310 HydrophobicContact CB-CE2 4Å; N306-F310 WeakPolarHBondContact O-CD2 3.29Å; N306-F310 WeakPolarHBondContact O-CE2 3.32Å
307	A	55.8	Low	68.3	Low	56 Å²	56	69.8 Å²	69.8	46%	0.463	38%	0.377	S	S	.	.	H	α-helix	trans	-52.1	-39	-178.8	0	0	0	0	0	113.4	S303 P304 R309	S303-A307 PolarHBondContact O-N 2.77Å; P304-A307 PolarHBondContact O-N 2.87Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 3.45Å
308	F	53.8	Low	65.8	Low	196 Å²	196	78 Å²	78	86%	0.86	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-9.7	-179.6	-62.4	-77.8	0	0	0	115.1	N306	N306-F308 PolarHBondContact O-N 2.93Å; N306-F308 VanDerWaalsContact O-N 3.14Å
309	R	69.5	Low	63.5	Low	146 Å²	146	83 Å²	83	55%	0.551	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-16.2	-177.4	-66.4	-175	175.5	-175.7	1.4	113.4	M159 P160 N306 A307	M159-R309 HydrophobicContact CE-CB 4.3Å; M159-R309 HydrophobicContact SD-CB 3.8Å; P160-R309 VanDerWaalsContact CD-O 3.23Å; P160-R309 WeakPolarHBondContact CD-O 3.45Å; N306-R309 PolarHBondContact O-N 3.28Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 3.45Å
310	F	80.1	Confident	61.1	Low	24 Å²	24	88.6 Å²	88.6	11%	0.105	48%	0.484	C	S	.	.			trans	-74.9	139.8	-177.1	-66.6	-84.8	0	0	0	111.8	R157 I158 M159 V299 N306	R157-F310 HydrophobicContact CG-CB 4.12Å; R157-F310 HydrophobicContact CG-CD1 3.56Å; R157-F310 HydrophobicContact CG-CE1 4.22Å; R157-F310 HydrophobicContact CG-CG 4.08Å; R157-F310 VanDerWaalsContact NE-CE1 3.3Å; R157-F310 VanDerWaalsContact NE-CG 3.3Å; I158-F310 CarbonylContact O-C 3.53Å; I158-F310 WeakPolarHBondContact O-CA 3.42Å; M159-F310 HydrophobicContact CB-CD1 4.09Å; M159-F310 HydrophobicContact CB-CE1 3.94Å; M159-F310 HydrophobicContact CE-CD1 3.83Å; M159-F310 HydrophobicContact CE-CD2 3.91Å; M159-F310 HydrophobicContact CE-CE1 3.34Å; M159-F310 HydrophobicContact CE-CE2 3.36Å; M159-F310 HydrophobicContact CE-CG 4.13Å; M159-F310 HydrophobicContact CE-CZ 3.08Å; M159-F310 HydrophobicContact CG-CE1 4.48Å; M159-F310 HydrophobicContact SD-CD1 4.38Å; M159-F310 HydrophobicContact SD-CE1 4.32Å; V299-F310 HydrophobicContact CG2-CE1 4.31Å; N306-F310 HydrophobicContact CB-CE2 4Å; N306-F310 WeakPolarHBondContact O-CD2 3.29Å; N306-F310 WeakPolarHBondContact O-CE2 3.32Å
311	I	82.1	Confident	58.8	Low	48 Å²	48	90.8 Å²	90.8	25%	0.246	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113.3	167	-57.7	171	0	0	0	106.7	W126 I158 P160 L313	W126-I311 HydrophobicContact CD2-CG2 4.42Å; W126-I311 HydrophobicContact CH2-CD1 4.1Å; W126-I311 HydrophobicContact CZ2-CD1 3.27Å; I158-I311 HydrophobicContact CB-CB 4.25Å; I158-I311 PolarHBondContact N-O 3.34Å; I158-I311 PolarHBondContact O-N 2.85Å; P160-I311 HydrophobicContact CG-CD1 4.15Å; P160-I311 HydrophobicContact CG-CG1 4.45Å; I311-L313 HydrophobicContact CG2-CD2 4.18Å; I311-L313 HydrophobicContact CG2-CG 4.44Å
312	E	85.2	Confident	57.2	Low	83 Å²	83	94 Å²	94	39%	0.388	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128	177.3	-66.6	-165.4	155.6	0	0	111.3	R157	R157-E312 HydrophobicContact CG-CG 4.38Å
313	L	83.9	Confident	55.8	Low	26 Å²	26	94.6 Å²	94.6	14%	0.136	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.8	178.7	-53.2	170.2	0	0	0	108.7	W126 P129 G155 I156 I158 I311	W126-L313 HydrophobicContact CB-CD1 3.97Å; W126-L313 HydrophobicContact CB-CD2 3.73Å; W126-L313 HydrophobicContact CE3-CD1 4.34Å; W126-L313 HydrophobicContact CG-CD1 4.46Å; W126-L313 HydrophobicContact CG-CD2 4.2Å; P129-L313 HydrophobicContact CG-CB 4.13Å; P129-L313 VanDerWaalsContact CG-O 3.23Å; P129-L313 WeakPolarHBondContact CG-O 3.17Å; G155-L313 CarbonylContact C-O 3.57Å; G155-L313 VanDerWaalsContact CA-O 3.24Å; G155-L313 WeakPolarHBondContact CA-O 3.08Å; I156-L313 HydrophobicContact CB-CB 4.2Å; I156-L313 HydrophobicContact CB-CD1 4.29Å; I156-L313 HydrophobicContact CG2-CD1 4.47Å; I156-L313 PolarHBondContact N-O 2.95Å; I156-L313 PolarHBondContact O-N 3.29Å; I158-L313 HydrophobicContact CD1-CD1 3.9Å; I311-L313 HydrophobicContact CG2-CD2 4.18Å; I311-L313 HydrophobicContact CG2-CG 4.44Å
314	G	74.2	Confident	54.6	Low	58 Å²	58	102.8 Å²	102.8	60%	0.598	57%	0.565	S	S	*	*	S	Bend	trans	80.1	6.9	175.6	0	0	0	0	0	116.9
315	L	63.3	Low	53.8	Low	63 Å²	63	103.5 Å²	103.5	33%	0.33	57%	0.571	S	S	.	*			trans	-105.4	88.5	171.4	-66.3	163.2	0	0	0	108.7	Q317	L315-Q317 PolarHBondContact O-N 2.97Å
316	S	49.4	Very low	53.1	Low	119 Å²	119	107.6 Å²	107.6	83%	0.832	60%	0.598	S	S	*	*			trans	-71.3	113.5	170.2	-82.1	0	0	0	0	109.7	K318	S316-K318 VanDerWaalsContact C-N 3.27Å; S316-K318 PolarHBondContact O-N 2.98Å
317	Q	39.1	Very low	51.9	Low	176 Å²	176	109.4 Å²	109.4	82%	0.822	62%	0.624	S	S	*	*			trans	-65.9	92.5	153.3	-70.3	-173.1	-4.7	0	0	107.6	L315	L315-Q317 PolarHBondContact O-N 2.97Å
318	K	30.5	Very low	51	Low	175 Å²	175	111.9 Å²	111.9	76%	0.761	64%	0.638	S	S	*	*			trans	-73.4	122.8	160.4	-105.6	-178.4	176.2	179.1	0	106.4	S316 S320	S316-K318 VanDerWaalsContact C-N 3.27Å; S316-K318 PolarHBondContact O-N 2.98Å; K318-S320 PolarHBondContact O-N 3.16Å
319	P	30.9	Very low	50.3	Low	114 Å²	114	107.6 Å²	107.6	74%	0.74	63%	0.632	S	S	*	*			trans	-58.5	134.1	161.2	27.8	-30.4	0	0	0	106.2	S321	P319-S321 VanDerWaalsContact C-N 3.28Å; P319-S321 PolarHBondContact O-N 2.76Å
320	S	32.7	Very low	48.7	Very low	119 Å²	119	109.1 Å²	109.1	83%	0.832	65%	0.646	S	S	*	*			trans	-60	89.5	-179.3	51.6	0	0	0	0	110.3	K318 S322	K318-S320 PolarHBondContact O-N 3.16Å; S320-S322 PolarHBondContact O-N 2.74Å
321	S	33.4	Very low	46.5	Very low	95 Å²	95	117.2 Å²	117.2	66%	0.664	68%	0.684	S	S	*	*			trans	-80.4	89.7	162.5	62.8	0	0	0	0	107.5	P319 K323	P319-S321 VanDerWaalsContact C-N 3.28Å; P319-S321 PolarHBondContact O-N 2.76Å; S321-K323 PolarHBondContact O-N 2.96Å
322	S	37.2	Very low	44.2	Very low	116 Å²	116	124.4 Å²	124.4	81%	0.811	71%	0.713	S	S	*	*			trans	-74.3	104.1	161.9	50.3	0	0	0	0	108.2	S320	S320-S322 PolarHBondContact O-N 2.74Å
323	K	37.7	Very low	41.9	Very low	196 Å²	196	125.2 Å²	125.2	85%	0.852	73%	0.725	S	S	*	*			trans	-61.9	129.8	162.9	-72.1	178.3	173	-176.2	0	109.6	S321	S321-K323 PolarHBondContact O-N 2.96Å
324	K	38.3	Very low	39.9	Very low	198 Å²	198	131.7 Å²	131.7	86%	0.861	76%	0.755	S	S	*	*			trans	-176.8	90.6	141.8	-100.1	173	-176.1	-171.7	0	105.6
325	S	38.3	Very low	38.3	Very low	101 Å²	101	136 Å²	136	71%	0.706	76%	0.76	S	S	*	*				82.4	106.9	97.3	61.5	0	0	0	0	112.4
326	S	38.7	Very low	37.2	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	78%	0.778	S	S	*	*			trans	59	122.9	143.1	60	0	0	0	0	120.5
327	G	35.2	Very low	36.6	Very low	68 Å²	68	140.7 Å²	140.7	70%	0.701	79%	0.785	S	S	*	*			trans	127.2	108.7	134.4	0	0	0	0	0	115.8
328	S	38.2	Very low	36.8	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	79%	0.787	S	S	*	*			trans	52.1	109.5	146.6	59.3	0	0	0	0	118
329	S	39.2	Very low	37.3	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	79%	0.789	S	S	*	*				113.1	136.8	75.7	-71	0	0	0	0	107.5
330	E	34.4	Very low	38	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	79%	0.792	S	S	*	*			trans	16.8	129.1	151.6	-69.2	160.9	144.5	0	0	117.6
331	E	35	Very low	38.7	Very low	193 Å²	193	139.5 Å²	139.5	90%	0.902	79%	0.79	S	S	*	*				-178.5	179.9	71.4	-134.5	168.1	173.3	0	0	111.4
332	K	33.7	Very low	39.1	Very low	200 Å²	200	138.9 Å²	138.9	87%	0.87	80%	0.799	S	S	*	*			trans	-81.9	-178.2	-160.1	-105.2	-176.3	-179.3	172.9	0	116
333	P	36	Very low	39.2	Very low	99 Å²	99	136.9 Å²	136.9	64%	0.643	80%	0.796	S	S	*	*			trans	-96	170.4	-149	41.5	-36.5	0	0	0	114.8
334	H	42	Very low	39.6	Very low	162 Å²	162	137.7 Å²	137.7	75%	0.75	80%	0.8	S	S	*	*			trans	170	140.5	134.6	-98.6	-78.9	0	0	0	113.9
335	Q	41.2	Very low	39.8	Very low	150 Å²	150	133.3 Å²	133.3	70%	0.701	79%	0.792	S	S	*	*			trans	68.8	129.5	138.2	-80.8	170.9	-49.1	0	0	125.2
336	D	41	Very low	40.2	Very low	135 Å²	135	136.8 Å²	136.8	72%	0.722	80%	0.797	S	S	*	*			trans	58.6	110.8	130.3	-59.3	-27.2	0	0	0	120.9	K338	D336-K338 PolarHBondContact O-N 3.32Å
337	C	36.1	Very low	40.6	Very low	144 Å²	144	140.3 Å²	140.3	97%	0.973	80%	0.797	S	S	*	*			trans	-87.3	101.4	157.8	-71	0	0	0	0	110.3
338	K	43.1	Very low	41	Very low	197 Å²	197	143 Å²	143	86%	0.857	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-100.7	155.9	157.7	-110.8	-178.1	179.6	175.4	0	109.9	D336	D336-K338 PolarHBondContact O-N 3.32Å
339	P	41.1	Very low	41.2	Very low	124 Å²	124	141.7 Å²	141.7	81%	0.805	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.8	159.1	-159.5	33.6	-34	0	0	0	114.7
340	S	46.5	Very low	41.8	Very low	116 Å²	116	146.3 Å²	146.3	81%	0.811	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-58	142.4	-170.8	-153	0	0	0	0	115.5
341	P	47	Very low	42.4	Very low	122 Å²	122	143.2 Å²	143.2	79%	0.792	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.1	143.2	177.9	33.7	-32.2	0	0	0	112.3
342	G	41.2	Very low	42.8	Very low	83 Å²	83	138.9 Å²	138.9	86%	0.856	81%	0.805	S	S	*	*			trans	-84.8	178.9	-175.2	0	0	0	0	0	116
343	G	39.3	Very low	43.4	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	81%	0.808	S	S	*	*			trans	118.4	94.4	152.2	0	0	0	0	0	115.6
344	K	46.9	Very low	44.3	Very low	213 Å²	213	142 Å²	142	93%	0.926	81%	0.814	S	S	*	*				-167.3	142.7	123.1	-100.3	167	-171	-175.5	0	110.9
345	P	42	Very low	44.5	Very low	107 Å²	107	140.1 Å²	140.1	70%	0.695	82%	0.817	S	S	*	*			trans	-112.5	175.4	-159	37.9	-24.2	0	0	0	114.8
346	Q	46.2	Very low	44.5	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.813	83%	0.825	S	S	*	*			trans	83.1	125.4	166.3	-53.4	179.5	6.6	0	0	114.3
347	K	47.6	Very low	44.9	Very low	193 Å²	193	138.5 Å²	138.5	84%	0.839	83%	0.831	S	S	*	*			cis	-163.1	166.4	41.8	-112.5	168.5	-174.4	-178.6	0	111.8
348	P	43.7	Very low	45.3	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	81%	0.813	S	S	*	*			trans	-106.8	153.2	-159.1	38.7	-28.7	0	0	0	115.8
349	G	43.3	Very low	45.6	Very low	81 Å²	81	131.4 Å²	131.4	84%	0.835	81%	0.814	S	S	*	*			trans	178.9	99.9	169.9	0	0	0	0	0	115.1
350	K	49.9	Very low	45.9	Very low	201 Å²	201	132 Å²	132	87%	0.874	82%	0.816	S	S	*	*			trans	-54.2	-179.7	174.6	-77.4	175.9	175.7	178	0	115.8
351	P	47.7	Very low	45.9	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	82%	0.817	S	S	*	*			cis	-136.7	149.4	-14.7	22.7	1.5	0	0	0	117.5
352	A	44.4	Very low	46	Very low	101 Å²	101	135.5 Å²	135.5	84%	0.835	82%	0.816	S	S	*	*			trans	34.1	126.8	133.3	0	0	0	0	0	124.6
353	R	46.2	Very low	46.4	Very low	247 Å²	247	136.2 Å²	136.2	93%	0.932	81%	0.813	S	S	*	*			trans	-127.2	157.2	142.8	-99.9	-169.9	175	-168.1	-0.8	109.5
354	P	54.2	Low	46.9	Very low	117 Å²	117	141.4 Å²	141.4	76%	0.76	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-84.1	171.7	-145.9	-5.7	24.9	0	0	0	115.8
355	P	45.1	Very low	47.1	Very low	124 Å²	124	137 Å²	137	81%	0.805	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-86	143.6	-156.4	34.2	-33.7	0	0	0	114.5
356	C	41.4	Very low	47.2	Very low	130 Å²	130	136 Å²	136	88%	0.878	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.4	122.1	166.4	-63.6	0	0	0	0	110.5
357	S	50.1	Low	47	Very low	120 Å²	120	133 Å²	133	84%	0.839	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.9	138.3	165.3	33.2	0	0	0	0	110.8
358	G	45.2	Very low	46.9	Very low	59 Å²	59	129.5 Å²	129.5	61%	0.608	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.2	171.6	-168	0	0	0	0	0	116.1	T360	G358-T360 PolarHBondContact O-N 3.14Å
359	P	49.7	Very low	46.9	Very low	133 Å²	133	128 Å²	128	86%	0.864	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.9	117.6	-170.1	28.5	-32.2	0	0	0	111	K361	P359-K361 PolarHBondContact O-N 2.67Å
360	T	46.1	Very low	47.1	Very low	138 Å²	138	133 Å²	133	85%	0.847	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-59.5	126.2	165.8	-27.1	0	0	0	0	108.7	G358	G358-T360 PolarHBondContact O-N 3.14Å
361	K	46.5	Very low	47.8	Very low	193 Å²	193	133.2 Å²	133.2	84%	0.839	80%	0.8	S	S	*	*			trans	-38.2	134.7	175.7	-120.8	172.7	179.6	175.7	0	111.4	P359 A363	P359-K361 PolarHBondContact O-N 2.67Å; K361-A363 PolarHBondContact O-N 3.49Å; K361-A363 VanDerWaalsContact O-N 3.17Å
362	P	50.1	Low	48.9	Very low	118 Å²	118	135.8 Å²	135.8	77%	0.766	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.5	124.4	175	23.6	-30.3	0	0	0	109.1	Q364	P362-Q364 PolarHBondContact O-N 3.21Å
363	A	49.3	Very low	50.6	Low	98 Å²	98	133.9 Å²	133.9	81%	0.81	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-53	123.5	169.4	0	0	0	0	0	108.2	K361	K361-A363 PolarHBondContact O-N 3.49Å; K361-A363 VanDerWaalsContact O-N 3.17Å
364	Q	49.6	Very low	52.4	Low	181 Å²	181	122.4 Å²	122.4	85%	0.846	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-54.4	140.4	177.7	-75.2	179	-30.3	0	0	109.9	P362 A366	P362-Q364 PolarHBondContact O-N 3.21Å; Q364-A366 PolarHBondContact O-N 3.01Å
365	P	50.3	Low	54.1	Low	121 Å²	121	120 Å²	120	79%	0.786	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-57.3	130.9	171.3	-14.3	26.5	0	0	0	108.6
366	A	43.8	Very low	56.4	Low	87 Å²	87	114.2 Å²	114.2	72%	0.719	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-50.1	136.4	169.6	0	0	0	0	0	109.1	Q364	Q364-A366 PolarHBondContact O-N 3.01Å
367	P	43	Very low	58.8	Low	110 Å²	110	108 Å²	108	71%	0.714	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-55.3	139.7	179	-16.9	27.4	0	0	0	109.1	A369	P367-A369 PolarHBondContact O-N 3.31Å; P367-A369 VanDerWaalsContact O-N 3.11Å
368	P	45.6	Very low	60.7	Low	119 Å²	119	104.1 Å²	104.1	77%	0.773	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-53.7	125.9	175.1	22.8	-31.7	0	0	0	108.1	Q370	P368-Q370 PolarHBondContact O-N 2.94Å
369	A	44.4	Very low	62.8	Low	96 Å²	96	101.3 Å²	101.3	79%	0.793	57%	0.573	S	S	*	*			trans	-47.1	108.6	-179.7	0	0	0	0	0	109.1	P367 R371	P367-A369 PolarHBondContact O-N 3.31Å; P367-A369 VanDerWaalsContact O-N 3.11Å; A369-R371 PolarHBondContact O-N 3.43Å
370	Q	47.4	Very low	64.5	Low	185 Å²	185	98.1 Å²	98.1	86%	0.864	56%	0.558	S	S	*	*			trans	-61	111.1	-177	-72.6	-178.1	-6.1	0	0	107.6	P368 K372	P368-Q370 PolarHBondContact O-N 2.94Å; Q370-K372 PolarHBondContact O-N 2.81Å
371	R	63	Low	66.3	Low	205 Å²	205	92.1 Å²	92.1	77%	0.774	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-60.6	122.7	177	-69	-177.5	177.6	-167.8	-2.3	107.7	A369 E471	A369-R371 PolarHBondContact O-N 3.43Å; R371-E471 IonicContact NH1-OE1 3.48Å; R371-E471 PolarHBondContact NH1-OE1 2.79Å
372	K	72.1	Confident	68	Low	170 Å²	170	85.3 Å²	85.3	74%	0.739	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-54.8	133.6	179.7	-66.9	-176.7	178.9	-178.3	0	109.9	Q370	Q370-K372 PolarHBondContact O-N 2.81Å
373	P	79.3	Confident	69.6	Low	60 Å²	60	83.2 Å²	83.2	39%	0.39	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-60.9	139.9	177.6	25.1	-33	0	0	0	110.6	Y375 I428	P373-Y375 HydrophobicContact CB-CE2 3.96Å; P373-Y375 HydrophobicContact CG-CE2 3.8Å; P373-I428 HydrophobicContact CB-CD1 4.24Å; P373-I428 HydrophobicContact CB-CG1 4.19Å
374	V	84	Confident	71	Confident	6 Å²	6	81 Å²	81	4%	0.036	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-96.7	130.1	175.4	-177.2	0	0	0	0	108.3	T381 I428 A429 R470 V475	V374-T381 HydrophobicContact CG1-CG2 4.29Å; V374-T381 HydrophobicContact CG2-CG2 3.69Å; V374-I428 CarbonylContact O-C 3.57Å; V374-I428 WeakPolarHBondContact O-CA 3.41Å; V374-A429 PolarHBondContact O-N 2.87Å; V374-R470 HydrophobicContact CG2-CB 4.5Å; V374-V475 HydrophobicContact CG1-CG1 4.33Å; V374-V475 HydrophobicContact CG1-CG2 3.93Å
375	Y	90.9	Very high	72.7	Confident	68 Å²	68	76.4 Å²	76.4	27%	0.267	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-112	155.2	174.8	-61.6	-79.7	0	0	0	110	P373 Q426 I428 V475	P373-Y375 HydrophobicContact CB-CE2 3.96Å; P373-Y375 HydrophobicContact CG-CE2 3.8Å; Y375-Q426 WeakPolarHBondContact CE1-O 3.44Å; Y375-I428 HydrophobicContact CE1-CG1 4.32Å; Y375-V475 WeakPolarHBondContact O-CG1 3.15Å
376	C	92.8	Very high	74.4	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.007	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	149.9	175.3	63.1	0	0	0	0	111	D378 H421 A429 P476 C478	C376-D378 PolarHBondContact O-N 3.38Å; C376-H421 HydrophobicContact CB-CB 3.64Å; C376-A429 HydrophobicContact CB-CB 4.27Å; C376-P476 CarbonylContact C-O 3.47Å; C376-P476 WeakPolarHBondContact CA-O 3.11Å; C376-P476 WeakPolarHBondContact CB-O 3.18Å; C376-C478 HydrophobicContact CB-CB 4.04Å; C376-C478 WeakPolarHBondContact CB-SG 3.07Å; C376-C478 PolarHBondContact O-SG 2.94Å; C376-C478 WeakPolarHBondContact SG-CA 2.99Å; C376-C478 WeakPolarHBondContact SG-CB 3.3Å; C376-C478 CovalentContact SG-SG 2.05Å; C376-C478 PolarHBondContact SG-SG 3.08Å
377	G	91.2	Very high	76.2	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	9.8	176.3	0	0	0	0	0	115.3	V386 P476 A555	G377-V386 WeakPolarHBondContact O-CG2 3.34Å; G377-P476 PolarHBondContact N-O 3.46Å; G377-A555 PolarHBondContact O-N 2.86Å
378	D	91	Very high	78.1	Confident	39 Å²	39	64.4 Å²	64.4	21%	0.209	36%	0.357	C	S	.	.			trans	-115.3	113.1	-178.1	-177.9	-4.9	0	0	0	110.4	C376 A380	C376-D378 PolarHBondContact O-N 3.38Å; D378-A380 WeakPolarHBondContact OD1-CB 3.37Å; D378-A380 PolarHBondContact OD1-N 3.14Å
379	T	89.3	Confident	79.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.323	C	S	.	.			trans	-96.1	3.8	-178.8	56.5	0	0	0	0	113.5	T381 F382 R384 T385 V386 Y389 P400 W401	T379-T381 PolarHBondContact O-N 3.44Å; T379-F382 WeakPolarHBondContact O-CA 3.4Å; T379-F382 PolarHBondContact O-N 3.26Å; T379-R384 CarbonylContact C-O 3.44Å; T379-R384 PolarHBondContact OG1-O 2Å; T379-T385 PolarHBondContact OG1-O 3.44Å; T379-V386 HydrophobicContact CG2-CG2 4.16Å; T379-V386 WeakPolarHBondContact OG1-CA 3.47Å; T379-V386 WeakPolarHBondContact OG1-CG2 3.39Å; T379-V386 PolarHBondContact OG1-N 3.11Å; T379-V386 VanDerWaalsContact OG1-N 3.07Å; T379-Y389 HydrophobicContact CG2-CD2 4.39Å; T379-Y389 HydrophobicContact CG2-CE2 3.69Å; T379-P400 HydrophobicContact CG2-CG 3.76Å; T379-W401 HydrophobicContact CG2-CH2 4.34Å; T379-W401 HydrophobicContact CG2-CZ3 4.05Å
380	A	85.9	Confident	81.3	Confident	65 Å²	65	56.1 Å²	56.1	54%	0.537	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-58.5	-24.8	175.5	0	0	0	0	0	112	D378 F382 G383 R384	D378-A380 WeakPolarHBondContact OD1-CB 3.37Å; D378-A380 PolarHBondContact OD1-N 3.14Å; A380-F382 PolarHBondContact O-N 2.92Å; A380-G383 PolarHBondContact O-N 2.95Å; A380-R384 WeakPolarHBondContact CA-O 3.5Å; A380-R384 PolarHBondContact N-O 3.31Å
381	T	82.4	Confident	82.3	Confident	13 Å²	13	49.8 Å²	49.8	8%	0.08	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-53.5	-33.6	168.5	-66.8	0	0	0	0	112.9	V374 T379 R470	V374-T381 HydrophobicContact CG1-CG2 4.29Å; V374-T381 HydrophobicContact CG2-CG2 3.69Å; T379-T381 PolarHBondContact O-N 3.44Å; T381-R470 HydrophobicContact CG2-CB 4.45Å; T381-R470 HydrophobicContact CG2-CG 3.56Å; T381-R470 PolarHBondContact O-NH2 2.82Å
382	F	83.5	Confident	82.1	Confident	50 Å²	50	43 Å²	43	22%	0.219	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-92.4	8.5	175.2	-58.4	-54.9	0	0	0	113.5	T379 A380 R384 P400 R470 V475	T379-F382 WeakPolarHBondContact O-CA 3.4Å; T379-F382 PolarHBondContact O-N 3.26Å; A380-F382 PolarHBondContact O-N 2.92Å; F382-R384 PolarHBondContact O-N 2.62Å; F382-P400 HydrophobicContact CE2-CB 3.91Å; F382-P400 HydrophobicContact CE2-CG 4.17Å; F382-R470 HydrophobicContact CE1-CG 3.97Å; F382-V475 HydrophobicContact CD2-CG2 4.31Å; F382-V475 HydrophobicContact CE2-CB 4.1Å; F382-V475 HydrophobicContact CE2-CG2 3.42Å; F382-V475 VanDerWaalsContact CE2-CG2 3.42Å; F382-V475 HydrophobicContact CZ-CG2 3.65Å
383	G	82.2	Confident	80.9	Confident	73 Å²	73	42.4 Å²	42.4	75%	0.753	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	20.2	-175.8	0	0	0	0	0	113.4	A380	A380-G383 PolarHBondContact O-N 2.95Å
384	R	80.2	Confident	79.7	Confident	52 Å²	52	43.5 Å²	43.5	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	-130.3	152.8	-176	-63.7	-172.8	-172.3	-169.2	5.9	110.3	T379 A380 F382 Y389 D397 D693	T379-R384 CarbonylContact C-O 3.44Å; T379-R384 PolarHBondContact OG1-O 2Å; A380-R384 WeakPolarHBondContact CA-O 3.5Å; A380-R384 PolarHBondContact N-O 3.31Å; F382-R384 PolarHBondContact O-N 2.62Å; R384-Y389 HydrophobicContact CB-CE2 4.23Å; R384-D397 IonicContact CZ-OD2 3.03Å; R384-D397 IonicContact NH1-OD2 2.89Å; R384-D397 PolarHBondContact NH1-OD2 3.22Å; R384-D397 IonicContact NH2-OD2 3.26Å; R384-D693 IonicContact CZ-OD2 3.31Å; R384-D693 IonicContact NH2-OD2 3.58Å; R384-D693 PolarHBondContact NH2-OD2 2.87Å
385	T	84.9	Confident	78.4	Confident	85 Å²	85	45 Å²	45	52%	0.521	28%	0.282	S	S	.	.			trans	-84.3	159.7	168.2	63.1	0	0	0	0	109.6	T379 E387 S388 Y389	T379-T385 PolarHBondContact OG1-O 3.44Å; T385-E387 WeakPolarHBondContact CB-OE2 3.37Å; T385-E387 PolarHBondContact O-N 3.22Å; T385-S388 PolarHBondContact O-N 2.87Å; T385-S388 PolarHBondContact O-OG 3.32Å; T385-S388 PolarHBondContact OG1-N 3Å; T385-Y389 WeakPolarHBondContact O-CD2 3.34Å
386	V	85.7	Confident	77	Confident	2 Å²	2	48 Å²	48	1%	0.012	30%	0.298	C	S	.	.	S	Bend	trans	-66.1	-35.7	178.3	-174.6	0	0	0	0	110.4	G377 T379 S388 Y389 F399 W401 L550 A555	G377-V386 WeakPolarHBondContact O-CG2 3.34Å; T379-V386 HydrophobicContact CG2-CG2 4.16Å; T379-V386 WeakPolarHBondContact OG1-CA 3.47Å; T379-V386 WeakPolarHBondContact OG1-CG2 3.39Å; T379-V386 PolarHBondContact OG1-N 3.11Å; T379-V386 VanDerWaalsContact OG1-N 3.07Å; V386-S388 PolarHBondContact O-N 3.44Å; V386-Y389 WeakPolarHBondContact O-CB 3.23Å; V386-Y389 PolarHBondContact O-N 2.86Å; V386-F399 HydrophobicContact CG1-CE1 3.95Å; V386-W401 HydrophobicContact CG1-CH2 3.86Å; V386-W401 HydrophobicContact CG1-CZ2 4.38Å; V386-L550 HydrophobicContact CB-CD2 4.27Å; V386-L550 HydrophobicContact CG1-CD1 4.24Å; V386-L550 HydrophobicContact CG1-CD2 3.37Å; V386-L550 HydrophobicContact CG1-CG 4.45Å; V386-A555 HydrophobicContact CG1-CB 4.09Å
387	E	81.8	Confident	76	Confident	48 Å²	48	49.2 Å²	49.2	22%	0.224	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-61.3	-30.4	178.3	-64.5	69.8	-153.2	0	0	111.8	T385 Y389 V390 T391 L550 G553	T385-E387 WeakPolarHBondContact CB-OE2 3.37Å; T385-E387 PolarHBondContact O-N 3.22Å; E387-Y389 PolarHBondContact O-N 3.04Å; E387-V390 CarbonylContact O-C 3.47Å; E387-V390 WeakPolarHBondContact O-CG2 3.22Å; E387-V390 PolarHBondContact O-N 2.9Å; E387-T391 PolarHBondContact O-N 3.3Å; E387-T391 PolarHBondContact O-OG1 2.89Å; E387-L550 HydrophobicContact CG-CD1 4.03Å; E387-G553 WeakPolarHBondContact OE1-CA 3.29Å
388	S	82	Confident	75.7	Confident	15 Å²	15	51.8 Å²	51.8	11%	0.105	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-66.4	-17.6	179.6	73	0	0	0	0	114.4	T385 V386 V390 N394 A395	T385-S388 PolarHBondContact O-N 2.87Å; T385-S388 PolarHBondContact O-OG 3.32Å; T385-S388 PolarHBondContact OG1-N 3Å; V386-S388 PolarHBondContact O-N 3.44Å; S388-V390 VanDerWaalsContact C-N 3.27Å; S388-N394 CarbonylContact O-C 3.54Å; S388-N394 VanDerWaalsContact O-CB 3.27Å; S388-N394 WeakPolarHBondContact O-CB 3.42Å; S388-A395 PolarHBondContact O-N 3.05Å
389	Y	82.1	Confident	75.6	Confident	15 Å²	15	50.1 Å²	50.1	6%	0.059	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-77.3	-13.8	173.4	-70.5	-95.7	0	0	0	112.9	T379 R384 T385 V386 E387 A395 D397 M398 F399	T379-Y389 HydrophobicContact CG2-CD2 4.39Å; T379-Y389 HydrophobicContact CG2-CE2 3.69Å; R384-Y389 HydrophobicContact CB-CE2 4.23Å; T385-Y389 WeakPolarHBondContact O-CD2 3.34Å; V386-Y389 WeakPolarHBondContact O-CB 3.23Å; V386-Y389 PolarHBondContact O-N 2.86Å; E387-Y389 PolarHBondContact O-N 3.04Å; Y389-A395 WeakPolarHBondContact O-CA 3.47Å; Y389-D397 HydrophobicContact CD1-CB 4.05Å; Y389-D397 WeakPolarHBondContact CD1-O 3.09Å; Y389-D397 HydrophobicContact CE1-CB 4.21Å; Y389-M398 WeakPolarHBondContact CD1-O 3.44Å; Y389-M398 WeakPolarHBondContact CE1-O 3.43Å; Y389-F399 HydrophobicContact CG-CD1 4.15Å
390	V	76.7	Confident	75.7	Confident	27 Å²	27	50.8 Å²	50.8	16%	0.164	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-6.8	-175.6	-70.1	0	0	0	0	113.1	E387 S388 F399 Y493 E506 L550	E387-V390 CarbonylContact O-C 3.47Å; E387-V390 WeakPolarHBondContact O-CG2 3.22Å; E387-V390 PolarHBondContact O-N 2.9Å; S388-V390 VanDerWaalsContact C-N 3.27Å; V390-F399 HydrophobicContact CG1-CE1 3.97Å; V390-F399 HydrophobicContact CG1-CE2 4Å; V390-F399 HydrophobicContact CG1-CZ 3.37Å; V390-Y493 HydrophobicContact CB-CD1 4.08Å; V390-Y493 HydrophobicContact CB-CE1 3.5Å; V390-Y493 VanDerWaalsContact CB-CE1 3.5Å; V390-Y493 HydrophobicContact CB-CE2 4.48Å; V390-Y493 HydrophobicContact CG1-CD1 3.64Å; V390-Y493 HydrophobicContact CG1-CD2 4.48Å; V390-Y493 HydrophobicContact CG1-CE1 3.62Å; V390-Y493 HydrophobicContact CG1-CE2 4.47Å; V390-Y493 HydrophobicContact CG1-CG 4.09Å; V390-Y493 HydrophobicContact CG2-CE1 3.83Å; V390-Y493 HydrophobicContact CG2-CE2 3.96Å; V390-Y493 VanDerWaalsContact CG2-CZ 3.48Å; V390-Y493 WeakPolarHBondContact CG2-OH 3.41Å; V390-E506 HydrophobicContact CG1-CB 4.21Å; V390-L550 HydrophobicContact CG2-CD1 4.26Å
391	T	68	Low	76.1	Confident	52 Å²	52	47.7 Å²	47.7	32%	0.319	29%	0.287	S	S	.	.	S	Bend	trans	-132.8	147.6	178.7	60.6	0	0	0	0	111.7	E387	E387-T391 PolarHBondContact O-N 3.3Å; E387-T391 PolarHBondContact O-OG1 2.89Å
392	G	57.2	Low	76.6	Confident	63 Å²	63	48.1 Å²	48.1	65%	0.649	29%	0.289	S	S	*	.	S	Bend	trans	73.1	-172.8	179.3	0	0	0	0	0	114.3	N394 A395	G392-N394 PolarHBondContact O-N 2.76Å; G392-N394 VanDerWaalsContact O-N 3.1Å; G392-A395 WeakPolarHBondContact O-CB 3.12Å; G392-A395 PolarHBondContact O-N 2.68Å
393	N	48.8	Very low	77.1	Confident	157 Å²	157	47.1 Å²	47.1	84%	0.84	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.5	-177.6	-69.4	-10.3	0	0	0	113.7	A395	N393-A395 VanDerWaalsContact C-N 3.3Å
394	N	53.6	Low	77.4	Confident	82 Å²	82	46.3 Å²	46.3	44%	0.439	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-4.9	178.2	-65.7	-14.9	0	0	0	113.3	S388 G392 Q396 D397	S388-N394 CarbonylContact O-C 3.54Å; S388-N394 VanDerWaalsContact O-CB 3.27Å; S388-N394 WeakPolarHBondContact O-CB 3.42Å; G392-N394 PolarHBondContact O-N 2.76Å; G392-N394 VanDerWaalsContact O-N 3.1Å; N394-Q396 PolarHBondContact O-N 3.15Å; N394-D397 PolarHBondContact O-N 3.15Å; N394-D397 VanDerWaalsContact O-N 3.12Å
395	A	57.2	Low	77.8	Confident	39 Å²	39	44.9 Å²	44.9	32%	0.322	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	4.7	178.4	0	0	0	0	0	114.6	S388 Y389 G392 N393	S388-A395 PolarHBondContact O-N 3.05Å; Y389-A395 WeakPolarHBondContact O-CA 3.47Å; G392-A395 WeakPolarHBondContact O-CB 3.12Å; G392-A395 PolarHBondContact O-N 2.68Å; N393-A395 VanDerWaalsContact C-N 3.3Å
396	Q	59.6	Low	77.7	Confident	131 Å²	131	44.5 Å²	44.5	61%	0.612	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-15.8	172.2	-62.9	-175.4	-8.3	0	0	112.5	N394	N394-Q396 PolarHBondContact O-N 3.15Å
397	D	73.6	Confident	76.9	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.134	27%	0.266	C	S	.	.	S	Bend	trans	-86.4	131.6	177.8	-75	-42.4	0	0	0	111.1	R384 Y389 N394	R384-D397 IonicContact CZ-OD2 3.03Å; R384-D397 IonicContact NH1-OD2 2.89Å; R384-D397 PolarHBondContact NH1-OD2 3.22Å; R384-D397 IonicContact NH2-OD2 3.26Å; Y389-D397 HydrophobicContact CD1-CB 4.05Å; Y389-D397 WeakPolarHBondContact CD1-O 3.09Å; Y389-D397 HydrophobicContact CE1-CB 4.21Å; N394-D397 PolarHBondContact O-N 3.15Å; N394-D397 VanDerWaalsContact O-N 3.12Å
398	M	83.8	Confident	76.2	Confident	54 Å²	54	51 Å²	51	27%	0.266	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-71.3	153	179.2	-53.6	170	-51.2	0	0	110.5	Y389 M504 E506 T695	Y389-M398 WeakPolarHBondContact CD1-O 3.44Å; Y389-M398 WeakPolarHBondContact CE1-O 3.43Å; M398-M504 HydrophobicContact CB-CE 4.34Å; M398-M504 HydrophobicContact CE-CE 3.72Å; M398-M504 HydrophobicContact CG-CB 4.07Å; M398-M504 HydrophobicContact CG-CE 4.26Å; M398-M504 HydrophobicContact SD-CB 3.73Å; M398-M504 HydrophobicContact SD-CE 3.22Å; M398-M504 WeakPolarHBondContact SD-CE 3.07Å; M398-M504 HydrophobicContact SD-CG 4.03Å; M398-M504 HydrophobicContact SD-SD 4.43Å; M398-E506 WeakPolarHBondContact CA-OE1 3.47Å; M398-T695 HydrophobicContact CE-CG2 3.95Å
399	F	90.1	Very high	74.9	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.018	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-56.8	137.8	173.4	-73	-54.4	0	0	0	111.9	V386 Y389 V390 W401 N402 Y493 E506	V386-F399 HydrophobicContact CG1-CE1 3.95Å; Y389-F399 HydrophobicContact CG-CD1 4.15Å; V390-F399 HydrophobicContact CG1-CE1 3.97Å; V390-F399 HydrophobicContact CG1-CE2 4Å; V390-F399 HydrophobicContact CG1-CZ 3.37Å; F399-W401 HydrophobicContact CB-CD2 4.19Å; F399-W401 HydrophobicContact CB-CG 4.37Å; F399-W401 HydrophobicContact CB-CZ2 3.86Å; F399-W401 VanDerWaalsContact CB-NE1 3.31Å; F399-W401 HydrophobicContact CD1-CH2 4.1Å; F399-W401 AromaticContact CD1-CZ2 3.47Å; F399-W401 HydrophobicContact CD1-CZ2 3.47Å; F399-W401 VanDerWaalsContact CD1-CZ2 3.47Å; F399-W401 HydrophobicContact CD2-CZ2 4.34Å; F399-W401 AromaticContact CD2-NE1 3.94Å; F399-W401 HydrophobicContact CE1-CZ2 4.03Å; F399-W401 AromaticContact CG-CE2 3.79Å; F399-W401 AromaticContact CG-CZ2 3.65Å; F399-W401 HydrophobicContact CG-CZ2 3.65Å; F399-W401 AromaticContact CG-NE1 3.67Å; F399-W401 PolarHBondContact O-N 2.97Å; F399-N402 WeakPolarHBondContact O-CB 3.38Å; F399-N402 PolarHBondContact O-N 2.81Å; F399-Y493 HydrophobicContact CE2-CG 4.41Å; F399-Y493 HydrophobicContact CZ-CD2 4.43Å; F399-Y493 HydrophobicContact CZ-CG 4.37Å; F399-E506 HydrophobicContact CD2-CG 3.59Å; F399-E506 HydrophobicContact CE2-CB 4.33Å; F399-E506 HydrophobicContact CE2-CG 3.67Å; F399-E506 PolarHBondContact N-OE1 3.04Å
400	P	91.3	Very high	73.5	Confident	14 Å²	14	64.4 Å²	64.4	9%	0.091	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-2.3	-170.3	29	-35	0	0	0	114.3	T379 F382 V474	T379-P400 HydrophobicContact CG2-CG 3.76Å; F382-P400 HydrophobicContact CE2-CB 3.91Å; F382-P400 HydrophobicContact CE2-CG 4.17Å; P400-V474 WeakPolarHBondContact O-CA 3.4Å; P400-V474 WeakPolarHBondContact O-CB 3.43Å; P400-V474 WeakPolarHBondContact O-CG1 3.32Å
401	W	93.9	Very high	72.7	Confident	1 Å²	1	65.7 Å²	65.7	0%	0.004	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-4.6	173.7	43.1	74.9	0	0	0	113.4	T379 V386 F399 S418 L419 V475 V477 I548 A555	T379-W401 HydrophobicContact CG2-CH2 4.34Å; T379-W401 HydrophobicContact CG2-CZ3 4.05Å; V386-W401 HydrophobicContact CG1-CH2 3.86Å; V386-W401 HydrophobicContact CG1-CZ2 4.38Å; F399-W401 HydrophobicContact CB-CD2 4.19Å; F399-W401 HydrophobicContact CB-CG 4.37Å; F399-W401 HydrophobicContact CB-CZ2 3.86Å; F399-W401 VanDerWaalsContact CB-NE1 3.31Å; F399-W401 HydrophobicContact CD1-CH2 4.1Å; F399-W401 AromaticContact CD1-CZ2 3.47Å; F399-W401 HydrophobicContact CD1-CZ2 3.47Å; F399-W401 VanDerWaalsContact CD1-CZ2 3.47Å; F399-W401 HydrophobicContact CD2-CZ2 4.34Å; F399-W401 AromaticContact CD2-NE1 3.94Å; F399-W401 HydrophobicContact CE1-CZ2 4.03Å; F399-W401 AromaticContact CG-CE2 3.79Å; F399-W401 AromaticContact CG-CZ2 3.65Å; F399-W401 HydrophobicContact CG-CZ2 3.65Å; F399-W401 AromaticContact CG-NE1 3.67Å; F399-W401 PolarHBondContact O-N 2.97Å; W401-S418 CarbonylContact O-C 3.48Å; W401-S418 WeakPolarHBondContact O-CA 3.15Å; W401-L419 HydrophobicContact CB-CB 4.27Å; W401-L419 PolarHBondContact O-N 2.97Å; W401-V475 WeakPolarHBondContact CB-O 3.29Å; W401-V477 HydrophobicContact CB-CB 4.16Å; W401-V477 HydrophobicContact CB-CG1 4.46Å; W401-V477 HydrophobicContact CD2-CB 3.65Å; W401-V477 HydrophobicContact CD2-CG2 4.12Å; W401-V477 HydrophobicContact CE3-CB 4.01Å; W401-V477 HydrophobicContact CE3-CG2 4.45Å; W401-V477 HydrophobicContact CG-CB 3.71Å; W401-V477 HydrophobicContact CG-CG1 4.26Å; W401-V477 HydrophobicContact CZ2-CG2 4.4Å; W401-I548 HydrophobicContact CZ2-CG2 4.06Å; W401-A555 HydrophobicContact CH2-CB 3.26Å; W401-A555 HydrophobicContact CZ2-CB 3.41Å; W401-A555 VanDerWaalsContact CZ2-CB 3.41Å; W401-A555 HydrophobicContact CZ3-CB 4.11Å
402	N	93.1	Very high	72.8	Confident	22 Å²	22	65.6 Å²	65.6	12%	0.118	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	134.2	-177.3	-74.9	-12.2	0	0	0	111.6	F399 T495 M504 E506	F399-N402 WeakPolarHBondContact O-CB 3.38Å; F399-N402 PolarHBondContact O-N 2.81Å; N402-T495 WeakPolarHBondContact ND2-CG2 3.41Å; N402-T495 PolarHBondContact ND2-OG1 2.97Å; N402-M504 HydrophobicContact CB-CE 3.68Å; N402-M504 HydrophobicContact CB-SD 4Å; N402-E506 PolarHBondContact ND2-OE1 3.22Å
403	V	92.4	Very high	73.8	Confident	29 Å²	29	63.7 Å²	63.7	18%	0.176	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.7	-178	-178.8	0	0	0	0	110.6	I405 I416 G417 L419 I435	V403-I405 HydrophobicContact CG1-CG1 4.42Å; V403-I416 CarbonylContact O-C 3.55Å; V403-I416 VanDerWaalsContact O-CA 3.29Å; V403-I416 WeakPolarHBondContact O-CA 3.33Å; V403-G417 PolarHBondContact N-O 3.12Å; V403-G417 PolarHBondContact O-N 2.89Å; V403-L419 HydrophobicContact CG2-CB 4.39Å; V403-I435 HydrophobicContact CB-CG2 4.33Å; V403-I435 HydrophobicContact CG1-CD1 3.97Å; V403-I435 HydrophobicContact CG1-CG2 4.32Å; V403-I435 HydrophobicContact CG2-CD1 4.31Å; V403-I435 HydrophobicContact CG2-CG1 4.19Å; V403-I435 HydrophobicContact CG2-CG2 4.35Å
404	I	89.8	Confident	75.3	Confident	56 Å²	56	61.1 Å²	61.1	29%	0.287	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.1	171.3	-57.9	179.8	0	0	0	109.2	T406 T413 Y497 M504	I404-T406 HydrophobicContact CG2-CG2 3.72Å; I404-T413 HydrophobicContact CG2-CG2 3.47Å; I404-T413 VanDerWaalsContact CG2-CG2 3.47Å; I404-T413 WeakPolarHBondContact CG2-OG1 3.4Å; I404-Y497 HydrophobicContact CD1-CD2 3.88Å; I404-Y497 HydrophobicContact CD1-CE2 3.87Å; I404-M504 HydrophobicContact CD1-CE 3.98Å; I404-M504 HydrophobicContact CD1-CG 4.11Å; I404-M504 HydrophobicContact CD1-SD 3.96Å; I404-M504 HydrophobicContact CG1-CE 3.85Å; I404-M504 HydrophobicContact CG1-CG 4.33Å; I404-M504 HydrophobicContact CG1-SD 3.59Å; I404-M504 VanDerWaalsContact CG1-SD 3.59Å
405	I	87.4	Confident	77.1	Confident	22 Å²	22	57.2 Å²	57.2	11%	0.113	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	111.6	177.4	-57.7	169.6	0	0	0	108.6	V403 K414 C415 T437 F442 L462	V403-I405 HydrophobicContact CG1-CG1 4.42Å; I405-K414 PolarHBondContact O-N 2.92Å; I405-C415 HydrophobicContact CB-CB 4.28Å; I405-C415 HydrophobicContact CD1-CB 4.34Å; I405-C415 PolarHBondContact N-O 3.05Å; I405-C415 PolarHBondContact O-N 3Å; I405-T437 HydrophobicContact CD1-CG2 3.61Å; I405-T437 WeakPolarHBondContact CD1-OG1 3.26Å; I405-F442 HydrophobicContact CD1-CZ 4.23Å; I405-F442 HydrophobicContact CG2-CE1 4.24Å; I405-F442 HydrophobicContact CG2-CZ 3.97Å; I405-L462 HydrophobicContact CD1-CD1 4Å
406	T	83	Confident	78.8	Confident	77 Å²	77	55.4 Å²	55.4	47%	0.472	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	154.3	-177.1	65.7	0	0	0	0	112.2	I404 S412	I404-T406 HydrophobicContact CG2-CG2 3.72Å; T406-S412 WeakPolarHBondContact CA-O 3.28Å
407	S	70.5	Confident	80.4	Confident	26 Å²	26	49.1 Å²	49.1	18%	0.182	27%	0.267	C	S	.	.			trans	-81.8	129.5	171.8	-177.5	0	0	0	0	111.3	I409 M410 G411 S412	S407-I409 PolarHBondContact O-N 2.82Å; S407-I409 VanDerWaalsContact O-N 3.13Å; S407-M410 PolarHBondContact O-N 3.47Å; S407-G411 WeakPolarHBondContact O-CA 3.35Å; S407-G411 PolarHBondContact O-N 2.89Å; S407-S412 PolarHBondContact N-O 3.38Å; S407-S412 VanDerWaalsContact N-O 3.11Å
408	K	65.7	Low	81.5	Confident	161 Å²	161	48 Å²	48	70%	0.7	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.4	176.5	-73.4	-174.1	173.8	-174.8	0	114.4	N701	K408-N701 VanDerWaalsContact CE-OD1 3.27Å; K408-N701 WeakPolarHBondContact CE-OD1 3.17Å; K408-N701 PolarHBondContact NZ-OD1 2.98Å
409	I	54.7	Low	82	Confident	157 Å²	157	45.5 Å²	45.5	81%	0.805	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-32.6	-171.1	-59	174.2	0	0	0	112.1	S407	S407-I409 PolarHBondContact O-N 2.82Å; S407-I409 VanDerWaalsContact O-N 3.13Å
410	M	52.5	Low	82.2	Confident	154 Å²	154	45.3 Å²	45.3	76%	0.759	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.9	-8.9	-174.1	-70.1	-172.1	71.7	0	0	114.2	S407 S412	S407-M410 PolarHBondContact O-N 3.47Å; M410-S412 PolarHBondContact O-N 2.84Å
411	G	61.4	Low	82.1	Confident	53 Å²	53	45.6 Å²	45.6	55%	0.546	25%	0.248	S	C	.	.			trans	64.5	-1.6	-173	0	0	0	0	0	114.4	S407 T413	S407-G411 WeakPolarHBondContact O-CA 3.35Å; S407-G411 PolarHBondContact O-N 2.89Å; G411-T413 PolarHBondContact O-N 2.95Å
412	S	69.5	Low	81.7	Confident	51 Å²	51	52.5 Å²	52.5	36%	0.357	27%	0.274	S	S	.	.			trans	-69.8	128.9	179.9	53.9	0	0	0	0	110.8	T406 S407 M410 K414	T406-S412 WeakPolarHBondContact CA-O 3.28Å; S407-S412 PolarHBondContact N-O 3.38Å; S407-S412 VanDerWaalsContact N-O 3.11Å; M410-S412 PolarHBondContact O-N 2.84Å; S412-K414 PolarHBondContact O-N 3.02Å
413	T	77.2	Confident	81	Confident	22 Å²	22	52.4 Å²	52.4	14%	0.135	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	123.7	167.1	-58.4	0	0	0	0	108.7	I404 G411 Y497 I541	I404-T413 HydrophobicContact CG2-CG2 3.47Å; I404-T413 VanDerWaalsContact CG2-CG2 3.47Å; I404-T413 WeakPolarHBondContact CG2-OG1 3.4Å; G411-T413 PolarHBondContact O-N 2.95Å; T413-Y497 HydrophobicContact CG2-CD1 3.88Å; T413-Y497 HydrophobicContact CG2-CE1 4.19Å; T413-Y497 HydrophobicContact CG2-CG 4.1Å; T413-I541 HydrophobicContact CG2-CD1 3.7Å; T413-I541 WeakPolarHBondContact O-CD1 3.46Å
414	K	81.9	Confident	80.2	Confident	103 Å²	103	52.7 Å²	52.7	45%	0.448	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-44.2	175.7	-75.7	-170.6	163.4	-172.7	0	111.1	I405 S412 I541	I405-K414 PolarHBondContact O-N 2.92Å; S412-K414 PolarHBondContact O-N 3.02Å; K414-I541 WeakPolarHBondContact O-CG2 3.43Å
415	C	90.2	Very high	79.6	Confident	1 Å²	1	55 Å²	55	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	168.6	-172.1	-76.6	0	0	0	0	112.1	I405 C441 L543	I405-C415 HydrophobicContact CB-CB 4.28Å; I405-C415 HydrophobicContact CD1-CB 4.34Å; I405-C415 PolarHBondContact N-O 3.05Å; I405-C415 PolarHBondContact O-N 3Å; C415-C441 HydrophobicContact CB-CB 3.67Å; C415-C441 WeakPolarHBondContact CB-SG 3.36Å; C415-C441 WeakPolarHBondContact SG-CA 3.42Å; C415-C441 WeakPolarHBondContact SG-CB 3.46Å; C415-C441 CovalentContact SG-SG 2Å; C415-C441 PolarHBondContact SG-SG 2.76Å; C415-L543 WeakPolarHBondContact CA-O 3.26Å; C415-L543 VanDerWaalsContact CB-O 3.32Å; C415-L543 WeakPolarHBondContact CB-O 3.48Å
416	I	92.8	Very high	79.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	159.3	168	-59.4	171.6	0	0	0	108	V403 T437 T495 I541 L543 G544 A545	V403-I416 CarbonylContact O-C 3.55Å; V403-I416 VanDerWaalsContact O-CA 3.29Å; V403-I416 WeakPolarHBondContact O-CA 3.33Å; I416-T437 WeakPolarHBondContact O-CB 3.29Å; I416-T437 PolarHBondContact O-OG1 2.76Å; I416-T495 HydrophobicContact CD1-CG2 4.33Å; I416-T495 HydrophobicContact CG2-CG2 4.44Å; I416-I541 WeakPolarHBondContact CD1-O 3.44Å; I416-L543 PolarHBondContact N-O 3.05Å; I416-G544 CarbonylContact C-O 3.53Å; I416-G544 CarbonylContact O-C 3.52Å; I416-G544 WeakPolarHBondContact O-CA 2.82Å; I416-G544 VanDerWaalsContact O-O 3.05Å; I416-A545 HydrophobicContact CB-CB 4.17Å; I416-A545 HydrophobicContact CD1-CB 4.3Å; I416-A545 HydrophobicContact CG2-CB 4.19Å
417	G	93.6	Very high	79.1	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-175.3	168.9	0	0	0	0	0	110.9	V403 I436	V403-G417 PolarHBondContact N-O 3.12Å; V403-G417 PolarHBondContact O-N 2.89Å; G417-I436 CarbonylContact C-O 3.59Å; G417-I436 WeakPolarHBondContact CA-O 3.49Å
418	S	95.9	Very high	79.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.1	-176.8	37.7	0	0	0	0	110.4	W401 I435 I436 Q557	W401-S418 CarbonylContact O-C 3.48Å; W401-S418 WeakPolarHBondContact O-CA 3.15Å; S418-I435 CarbonylContact O-C 3.21Å; S418-I435 WeakPolarHBondContact O-CA 3.14Å; S418-I436 PolarHBondContact N-O 3.17Å; S418-I436 PolarHBondContact O-N 3.33Å; S418-I436 PolarHBondContact OG-O 2.64Å; S418-Q557 PolarHBondContact OG-NE2 2.76Å; S418-Q557 PolarHBondContact OG-OE1 2.83Å
419	L	94.9	Very high	80.5	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	121.6	169	-173.6	74.4	0	0	0	108.9	W401 V403 I435 L464 L468 V474 P476 V477	W401-L419 HydrophobicContact CB-CB 4.27Å; W401-L419 PolarHBondContact O-N 2.97Å; V403-L419 HydrophobicContact CG2-CB 4.39Å; L419-I435 HydrophobicContact CD1-CG1 4.29Å; L419-L464 HydrophobicContact CD1-CD1 4.28Å; L419-L468 HydrophobicContact CD1-CD1 4.23Å; L419-L468 HydrophobicContact CD2-CB 4.31Å; L419-L468 HydrophobicContact CD2-CD1 4.27Å; L419-V474 HydrophobicContact CD2-CB 4Å; L419-V474 HydrophobicContact CD2-CG2 3.7Å; L419-P476 HydrophobicContact CD2-CB 4.42Å; L419-P476 HydrophobicContact CG-CB 4.25Å; L419-P476 CarbonylContact O-C 3.56Å; L419-P476 VanDerWaalsContact O-CA 3.31Å; L419-P476 WeakPolarHBondContact O-CA 3.5Å; L419-V477 PolarHBondContact O-N 3.04Å
420	V	94	Very high	81.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	155.4	-171.5	-62.8	0	0	0	0	112.5	S432 F434 I436 V477 L479 Q557 F590	V420-S432 WeakPolarHBondContact O-CB 3.22Å; V420-S432 PolarHBondContact O-OG 3.35Å; V420-F434 HydrophobicContact CG2-CB 3.91Å; V420-F434 PolarHBondContact N-O 3.07Å; V420-I436 HydrophobicContact CB-CD1 4.1Å; V420-I436 HydrophobicContact CB-CG1 4.27Å; V420-I436 HydrophobicContact CG1-CB 4.33Å; V420-I436 HydrophobicContact CG1-CD1 3.56Å; V420-I436 HydrophobicContact CG1-CG1 3.72Å; V420-I436 HydrophobicContact CG2-CD1 3.75Å; V420-I436 HydrophobicContact CG2-CG1 3.62Å; V420-V477 HydrophobicContact CG1-CG1 3.97Å; V420-L479 HydrophobicContact CB-CD2 4.2Å; V420-L479 HydrophobicContact CB-CG 4.5Å; V420-L479 HydrophobicContact CG1-CD2 3.98Å; V420-Q557 VanDerWaalsContact CG1-OE1 3.26Å; V420-F590 HydrophobicContact CG2-CE2 3.87Å; V420-F590 HydrophobicContact CG2-CZ 3.77Å
421	H	89.2	Confident	83.4	Confident	20 Å²	20	51.4 Å²	51.4	9%	0.093	28%	0.276	C	S	.	.			trans	-95.7	136.9	172	-172.9	58.4	0	0	0	110.5	C376 G423 A429 P476 V477	C376-H421 HydrophobicContact CB-CB 3.64Å; H421-G423 VanDerWaalsContact CD2-CA 3.5Å; H421-G423 WeakPolarHBondContact CD2-CA 3.08Å; H421-G423 PolarHBondContact CD2-N 2.81Å; H421-G423 VanDerWaalsContact CD2-N 3.26Å; H421-G423 PolarHBondContact CD2-O 3.05Å; H421-G423 VanDerWaalsContact CD2-O 3.28Å; H421-G423 WeakPolarHBondContact NE2-CA 3.2Å; H421-G423 PolarHBondContact NE2-N 3.26Å; H421-A429 HydrophobicContact CB-CB 4.33Å; H421-A429 WeakPolarHBondContact ND1-CB 3.37Å; H421-P476 HydrophobicContact CB-CB 4.04Å; H421-P476 HydrophobicContact CB-CG 3.99Å; H421-V477 PolarHBondContact N-O 2.85Å; H421-V477 VanDerWaalsContact N-O 3.17Å
422	R	85.3	Confident	84.7	Confident	146 Å²	146	49.1 Å²	49.1	55%	0.551	25%	0.252	S	S	*	.	S	Bend	trans	-75.9	-31.4	178.1	-177.6	180	176.6	-160.6	-1.3	112.7	F590	R422-F590 HydrophobicContact CB-CD2 4.15Å; R422-F590 HydrophobicContact CB-CE2 4.34Å; R422-F590 HydrophobicContact CB-CG 4.39Å; R422-F590 HydrophobicContact CG-CB 3.84Å; R422-F590 HydrophobicContact CG-CD1 4.26Å; R422-F590 HydrophobicContact CG-CD2 3.97Å; R422-F590 HydrophobicContact CG-CG 3.78Å; R422-F590 VanDerWaalsContact CZ-O 3.24Å; R422-F590 PolarHBondContact NE-O 3.33Å; R422-F590 PolarHBondContact NH2-O 3.06Å
423	G	78.5	Confident	85.8	Confident	21 Å²	21	48.5 Å²	48.5	22%	0.216	24%	0.244	C	C	.	.	S	Bend	trans	-81.2	172.1	-177.5	0	0	0	0	0	113.4	H421	H421-G423 VanDerWaalsContact CD2-CA 3.5Å; H421-G423 WeakPolarHBondContact CD2-CA 3.08Å; H421-G423 PolarHBondContact CD2-N 2.81Å; H421-G423 VanDerWaalsContact CD2-N 3.26Å; H421-G423 PolarHBondContact CD2-O 3.05Å; H421-G423 VanDerWaalsContact CD2-O 3.28Å; H421-G423 WeakPolarHBondContact NE2-CA 3.2Å; H421-G423 PolarHBondContact NE2-N 3.26Å
424	G	76.5	Confident	86.5	Confident	35 Å²	35	49.2 Å²	49.2	36%	0.361	25%	0.246	S	C	.	.			trans	-67.4	166.3	171.8	0	0	0	0	0	112.6	Q426 Q427	G424-Q426 PolarHBondContact O-N 3.21Å; G424-Q426 VanDerWaalsContact O-N 3.1Å; G424-Q427 WeakPolarHBondContact O-CB 3.04Å; G424-Q427 PolarHBondContact O-N 3.02Å
425	Y	77.5	Confident	87	Confident	105 Å²	105	44.6 Å²	44.6	41%	0.412	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.9	-175.8	70.6	-87.2	0	0	0	115	R554	Y425-R554 PolarHBondContact O-NH1 2.85Å
426	Q	77.1	Confident	87.2	Confident	143 Å²	143	44.6 Å²	44.6	67%	0.668	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-8.1	175.4	-61.5	-177.9	-34.1	0	0	113	Y375 G424	Y375-Q426 WeakPolarHBondContact CE1-O 3.44Å; G424-Q426 PolarHBondContact O-N 3.21Å; G424-Q426 VanDerWaalsContact O-N 3.1Å
427	Q	83	Confident	87.2	Confident	112 Å²	112	44.6 Å²	44.6	52%	0.523	23%	0.225	S	C	.	.	S	Bend	trans	-83.9	144.6	-179.3	-61.6	-179.1	26.1	0	0	110.5	G424 A429	G424-Q427 WeakPolarHBondContact O-CB 3.04Å; G424-Q427 PolarHBondContact O-N 3.02Å; Q427-A429 PolarHBondContact O-N 3.18Å
428	I	82.7	Confident	87	Confident	95 Å²	95	44.6 Å²	44.6	49%	0.487	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-70.3	123.1	179.3	-59.4	173.8	0	0	0	108.9	P373 V374 Y375 N430	P373-I428 HydrophobicContact CB-CD1 4.24Å; P373-I428 HydrophobicContact CB-CG1 4.19Å; V374-I428 CarbonylContact O-C 3.57Å; V374-I428 WeakPolarHBondContact O-CA 3.41Å; Y375-I428 HydrophobicContact CE1-CG1 4.32Å; I428-N430 HydrophobicContact CG2-CB 4.41Å; I428-N430 VanDerWaalsContact CG2-CG 3.42Å; I428-N430 WeakPolarHBondContact CG2-ND2 3.34Å; I428-N430 WeakPolarHBondContact CG2-OD1 3.32Å
429	A	82.4	Confident	86.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	23%	0.228	C	C	.	.			trans	-107.4	48.1	-175.4	0	0	0	0	0	112.1	V374 C376 H421 Q427 T431 P476	V374-A429 PolarHBondContact O-N 2.87Å; C376-A429 HydrophobicContact CB-CB 4.27Å; H421-A429 HydrophobicContact CB-CB 4.33Å; H421-A429 WeakPolarHBondContact ND1-CB 3.37Å; Q427-A429 PolarHBondContact O-N 3.18Å; A429-T431 PolarHBondContact O-N 3.46Å; A429-T431 VanDerWaalsContact O-N 3.17Å; A429-P476 HydrophobicContact CB-CG 3.81Å
430	N	81.8	Confident	86	Confident	90 Å²	90	48.2 Å²	48.2	48%	0.481	25%	0.246	S	C	.	.	S	Bend	trans	-57.8	-31.7	-177.1	-73	-21.6	0	0	0	113.5	I428 S469	I428-N430 HydrophobicContact CG2-CB 4.41Å; I428-N430 VanDerWaalsContact CG2-CG 3.42Å; I428-N430 WeakPolarHBondContact CG2-ND2 3.34Å; I428-N430 WeakPolarHBondContact CG2-OD1 3.32Å; N430-S469 WeakPolarHBondContact O-CA 3.24Å; N430-S469 WeakPolarHBondContact O-CB 3.18Å
431	T	85.7	Confident	85.4	Confident	80 Å²	80	48.6 Å²	48.6	49%	0.491	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.4	179.4	61.5	0	0	0	0	111.4	A429 L468	A429-T431 PolarHBondContact O-N 3.46Å; A429-T431 VanDerWaalsContact O-N 3.17Å; T431-L468 CarbonylContact C-O 3.58Å; T431-L468 WeakPolarHBondContact CA-O 3.28Å
432	S	90	Very high	84.9	Confident	5 Å²	5	50.8 Å²	50.8	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141	166.5	176.6	0	0	0	0	111.8	V420 F434 L468	V420-S432 WeakPolarHBondContact O-CB 3.22Å; V420-S432 PolarHBondContact O-OG 3.35Å; S432-F434 PolarHBondContact OG-N 3.02Å; S432-L468 PolarHBondContact N-O 2.86Å; S432-L468 PolarHBondContact O-N 2.72Å
433	D	90.9	Very high	83.6	Confident	37 Å²	37	47.8 Å²	47.8	20%	0.198	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	8.2	173.5	61.9	-22.8	0	0	0	112.9	K463 L464 P467	D433-K463 CarbonylContact O-C 3.59Å; D433-K463 WeakPolarHBondContact O-CA 3.35Å; D433-K463 WeakPolarHBondContact OD2-CE 3.39Å; D433-K463 IonicContact OD2-NZ 3.9Å; D433-L464 HydrophobicContact CB-CB 4.21Å; D433-L464 PolarHBondContact O-N 2.93Å; D433-P467 HydrophobicContact CB-CB 4.1Å
434	F	92.1	Very high	82.2	Confident	38 Å²	38	54.3 Å²	54.3	17%	0.167	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.9	-176.4	-68.6	-76.2	0	0	0	112.4	V420 S432 I461 L462 K463 F590	V420-F434 HydrophobicContact CG2-CB 3.91Å; V420-F434 PolarHBondContact N-O 3.07Å; S432-F434 PolarHBondContact OG-N 3.02Å; F434-I461 HydrophobicContact CD1-CG2 3.93Å; F434-L462 WeakPolarHBondContact CA-O 3.36Å; F434-K463 HydrophobicContact CE1-CB 4.38Å; F434-K463 HydrophobicContact CE1-CD 4.29Å; F434-K463 HydrophobicContact CE1-CG 4.2Å; F434-K463 HydrophobicContact CZ-CD 4.48Å; F434-F590 HydrophobicContact CB-CE1 4.27Å; F434-F590 HydrophobicContact CB-CZ 3.83Å; F434-F590 AromaticContact CD1-CE1 3.78Å; F434-F590 HydrophobicContact CD1-CE1 3.78Å; F434-F590 HydrophobicContact CD1-CZ 4.22Å; F434-F590 HydrophobicContact CD2-CE1 4.34Å; F434-F590 HydrophobicContact CD2-CZ 4.38Å; F434-F590 HydrophobicContact CE1-CE1 4.17Å; F434-F590 AromaticContact CG-CE1 3.87Å; F434-F590 HydrophobicContact CG-CE1 3.87Å; F434-F590 AromaticContact CG-CZ 3.9Å; F434-F590 HydrophobicContact CG-CZ 3.9Å
435	I	93.2	Very high	80.6	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.031	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135	173.5	-61.6	161.4	0	0	0	109.7	V403 S418 L419 I461 L462 L464	V403-I435 HydrophobicContact CB-CG2 4.33Å; V403-I435 HydrophobicContact CG1-CD1 3.97Å; V403-I435 HydrophobicContact CG1-CG2 4.32Å; V403-I435 HydrophobicContact CG2-CD1 4.31Å; V403-I435 HydrophobicContact CG2-CG1 4.19Å; V403-I435 HydrophobicContact CG2-CG2 4.35Å; S418-I435 CarbonylContact O-C 3.21Å; S418-I435 WeakPolarHBondContact O-CA 3.14Å; L419-I435 HydrophobicContact CD1-CG1 4.29Å; I435-I461 CarbonylContact O-C 3.59Å; I435-I461 WeakPolarHBondContact O-CA 3.04Å; I435-L462 HydrophobicContact CB-CB 4.2Å; I435-L462 HydrophobicContact CB-CD1 4.49Å; I435-L462 HydrophobicContact CG2-CD1 4.34Å; I435-L462 PolarHBondContact N-O 3.38Å; I435-L462 PolarHBondContact O-N 3.35Å; I435-L464 HydrophobicContact CD1-CD1 3.84Å; I435-L464 HydrophobicContact CD1-CD2 3.46Å; I435-L464 VanDerWaalsContact CD1-CD2 3.46Å; I435-L464 HydrophobicContact CD1-CG 3.77Å; I435-L464 HydrophobicContact CG1-CD1 4.21Å; I435-L464 HydrophobicContact CG1-CD2 4.5Å; I435-L464 HydrophobicContact CG1-CG 4.32Å
436	I	93.2	Very high	78.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137	171.9	-54.3	-174.6	0	0	0	109.9	G417 S418 V420 I459 L479 V560 V586	G417-I436 CarbonylContact C-O 3.59Å; G417-I436 WeakPolarHBondContact CA-O 3.49Å; S418-I436 PolarHBondContact N-O 3.17Å; S418-I436 PolarHBondContact O-N 3.33Å; S418-I436 PolarHBondContact OG-O 2.64Å; V420-I436 HydrophobicContact CB-CD1 4.1Å; V420-I436 HydrophobicContact CB-CG1 4.27Å; V420-I436 HydrophobicContact CG1-CB 4.33Å; V420-I436 HydrophobicContact CG1-CD1 3.56Å; V420-I436 HydrophobicContact CG1-CG1 3.72Å; V420-I436 HydrophobicContact CG2-CD1 3.75Å; V420-I436 HydrophobicContact CG2-CG1 3.62Å; I436-I459 HydrophobicContact CG2-CG2 3.33Å; I436-L479 HydrophobicContact CD1-CD2 3.72Å; I436-V560 HydrophobicContact CG2-CG2 3.5Å; I436-V560 VanDerWaalsContact CG2-CG2 3.5Å; I436-V586 HydrophobicContact CD1-CB 4.17Å; I436-V586 HydrophobicContact CD1-CG1 3.37Å; I436-V586 HydrophobicContact CD1-CG2 3.84Å; I436-V586 HydrophobicContact CG1-CG1 4.31Å; I436-V586 HydrophobicContact CG2-CG2 4.4Å
437	T	93.4	Very high	77	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	-176	177.7	-174.2	0	0	0	0	110.5	I405 I416 C441 F442 I459 A460 L462	I405-T437 HydrophobicContact CD1-CG2 3.61Å; I405-T437 WeakPolarHBondContact CD1-OG1 3.26Å; I416-T437 WeakPolarHBondContact O-CB 3.29Å; I416-T437 PolarHBondContact O-OG1 2.76Å; T437-C441 PolarHBondContact OG1-SG 3.03Å; T437-F442 HydrophobicContact CG2-CE2 3.71Å; T437-F442 HydrophobicContact CG2-CZ 4.44Å; T437-I459 CarbonylContact O-C 3.3Å; T437-I459 WeakPolarHBondContact O-CA 3.43Å; T437-I459 WeakPolarHBondContact O-CG2 3.05Å; T437-A460 HydrophobicContact CG2-CB 4.08Å; T437-A460 PolarHBondContact N-O 3.22Å; T437-A460 PolarHBondContact O-N 3.27Å; T437-L462 HydrophobicContact CG2-CD1 4.17Å; T437-L462 HydrophobicContact CG2-CG 4.39Å
438	A	90.1	Very high	74.9	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	143.7	175.1	0	0	0	0	0	111.3	D440 C441 L543 G544 L562	A438-D440 VanDerWaalsContact C-N 3.26Å; A438-D440 PolarHBondContact O-N 3.14Å; A438-C441 WeakPolarHBondContact O-CB 3.34Å; A438-C441 PolarHBondContact O-N 3.35Å; A438-C441 PolarHBondContact O-SG 2.88Å; A438-L543 HydrophobicContact CB-CD1 3.81Å; A438-L543 HydrophobicContact CB-CG 3.95Å; A438-G544 VanDerWaalsContact N-CA 3.3Å; A438-L562 HydrophobicContact CB-CD2 3.66Å
439	A	84.9	Confident	72.5	Confident	5 Å²	5	45.9 Å²	45.9	4%	0.041	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-62.5	-34.6	174.8	0	0	0	0	0	112.3	C441 F442 Y446 G458 A460	A439-C441 PolarHBondContact O-N 2.62Å; A439-F442 PolarHBondContact O-N 3.07Å; A439-Y446 WeakPolarHBondContact CB-O 3.49Å; A439-G458 WeakPolarHBondContact CB-O 3.42Å; A439-G458 PolarHBondContact N-O 3.07Å; A439-A460 HydrophobicContact CB-CB 4.43Å
440	D	84.2	Confident	70.2	Confident	72 Å²	72	54.3 Å²	54.3	39%	0.385	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-61	-15.2	179	-74.1	13.8	0	0	0	113.4	A438 F442 R457 L543	A438-D440 VanDerWaalsContact C-N 3.26Å; A438-D440 PolarHBondContact O-N 3.14Å; D440-F442 PolarHBondContact O-N 3.28Å; D440-R457 WeakPolarHBondContact OD2-CG 3.32Å; D440-R457 IonicContact OD2-NE 3.97Å; D440-L543 HydrophobicContact CB-CD1 4.38Å; D440-L543 HydrophobicContact CB-CD2 3.9Å
441	C	82.6	Confident	68.1	Low	8 Å²	8	52.2 Å²	52.2	5%	0.054	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-63.1	-26.7	171.6	-60.1	0	0	0	0	113.2	C415 T437 A438 A439	C415-C441 HydrophobicContact CB-CB 3.67Å; C415-C441 WeakPolarHBondContact CB-SG 3.36Å; C415-C441 WeakPolarHBondContact SG-CA 3.42Å; C415-C441 WeakPolarHBondContact SG-CB 3.46Å; C415-C441 CovalentContact SG-SG 2Å; C415-C441 PolarHBondContact SG-SG 2.76Å; T437-C441 PolarHBondContact OG1-SG 3.03Å; A438-C441 WeakPolarHBondContact O-CB 3.34Å; A438-C441 PolarHBondContact O-N 3.35Å; A438-C441 PolarHBondContact O-SG 2.88Å; A439-C441 PolarHBondContact O-N 2.62Å
442	F	78.5	Confident	65.8	Low	67 Å²	67	56.2 Å²	56.2	29%	0.294	30%	0.297	S	S	.	.	S	Bend	trans	-116.7	80.2	-176.4	-54.8	-80.7	0	0	0	108.6	I405 T437 A439 D440 N444 L445 A460 L462	I405-F442 HydrophobicContact CD1-CZ 4.23Å; I405-F442 HydrophobicContact CG2-CE1 4.24Å; I405-F442 HydrophobicContact CG2-CZ 3.97Å; T437-F442 HydrophobicContact CG2-CE2 3.71Å; T437-F442 HydrophobicContact CG2-CZ 4.44Å; A439-F442 PolarHBondContact O-N 3.07Å; D440-F442 PolarHBondContact O-N 3.28Å; F442-N444 PolarHBondContact O-N 2.67Å; F442-L445 WeakPolarHBondContact CB-O 3.4Å; F442-L445 PolarHBondContact O-N 2.04Å; F442-A460 HydrophobicContact CD2-CB 4.28Å; F442-A460 HydrophobicContact CE2-CB 4.37Å; F442-L462 HydrophobicContact CE1-CD2 4.4Å; F442-L462 HydrophobicContact CE2-CD1 4.11Å; F442-L462 HydrophobicContact CE2-CD2 3.77Å; F442-L462 HydrophobicContact CE2-CG 4.38Å; F442-L462 HydrophobicContact CZ-CD1 3.62Å; F442-L462 HydrophobicContact CZ-CD2 3.68Å; F442-L462 HydrophobicContact CZ-CG 4.23Å
443	A	57.7	Low	63.4	Low	83 Å²	83	62 Å²	62	69%	0.686	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	-4.2	-176.4	0	0	0	0	0	117.1
444	N	48.6	Very low	61	Low	157 Å²	157	65.5 Å²	65.5	84%	0.84	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.3	13.8	-178.3	-81.4	-48.3	0	0	0	116.1	F442	F442-N444 PolarHBondContact O-N 2.67Å
445	L	43.7	Very low	58.7	Low	74 Å²	74	68 Å²	68	39%	0.387	36%	0.361	S	S	.	.	S	Bend	trans	-152.6	118.6	175.3	-88.6	120.2	0	0	0	111.9	F442 V704	F442-L445 WeakPolarHBondContact CB-O 3.4Å; F442-L445 PolarHBondContact O-N 2.04Å; L445-V704 HydrophobicContact CD1-CG1 4.21Å; L445-V704 HydrophobicContact CD2-CG1 3.9Å
446	Y	38.9	Very low	56.6	Low	115 Å²	115	71.3 Å²	71.3	45%	0.451	37%	0.373	S	S	.	.			trans	73.4	68.7	172.3	-45.1	-74.2	0	0	0	117.5	A439	A439-Y446 WeakPolarHBondContact CB-O 3.49Å
447	G	39.2	Very low	55.1	Low	16 Å²	16	77.7 Å²	77.7	17%	0.165	40%	0.397	C	S	.	.			trans	-89.4	139.5	148.2	0	0	0	0	0	109.9	R449 L598	G447-R449 PolarHBondContact O-N 2.8Å; G447-L598 WeakPolarHBondContact O-CD1 3.49Å
448	L	39	Very low	54.1	Low	41 Å²	41	78.2 Å²	78.2	22%	0.215	40%	0.403	C	S	.	.			trans	-70.6	121.3	167.9	-81.3	148.6	0	0	0	108.5	W450 V585 V595	L448-W450 PolarHBondContact O-N 3.42Å; L448-V585 HydrophobicContact CD1-CG1 4.4Å; L448-V585 HydrophobicContact CD1-CG2 3.65Å; L448-V585 HydrophobicContact CD2-CG2 4.44Å; L448-V595 HydrophobicContact CD2-CB 4.12Å; L448-V595 HydrophobicContact CD2-CG1 3.28Å
449	R	32.4	Very low	53.9	Low	67 Å²	67	78.6 Å²	78.6	25%	0.253	40%	0.404	S	S	.	.			trans	-87.2	108.6	174.4	-155.9	-179.6	-174	123.4	-7.2	106.6	G447 N453 L598	G447-R449 PolarHBondContact O-N 2.8Å; R449-N453 VanDerWaalsContact NH2-CA 3.33Å; R449-N453 VanDerWaalsContact NH2-CG 3.26Å; R449-N453 PolarHBondContact NH2-O 3.07Å; R449-N453 PolarHBondContact NH2-OD1 3.25Å; R449-L598 HydrophobicContact CB-CD2 4.47Å
450	W	35.2	Very low	54	Low	179 Å²	179	78.7 Å²	78.7	68%	0.678	41%	0.405	S	S	*	.			trans	-115.7	107.1	173.9	-164.9	-80.2	0	0	0	108.3	L448	L448-W450 PolarHBondContact O-N 3.42Å
451	G	36.8	Very low	54.2	Low	45 Å²	45	77.8 Å²	77.8	46%	0.464	40%	0.4	S	S	.	.	S	Bend	trans	81	-171.8	-177	0	0	0	0	0	115.3	N453	G451-N453 PolarHBondContact O-N 3.4Å
452	N	37.7	Very low	54.5	Low	164 Å²	164	78.6 Å²	78.6	88%	0.877	40%	0.403	S	S	*	.	S	Bend	trans	-59.2	99.9	-162.1	-58.8	-3.5	0	0	0	113.3	E454	N452-E454 VanDerWaalsContact C-N 3.32Å; N452-E454 PolarHBondContact O-N 3.19Å
453	N	38.8	Very low	54.9	Low	128 Å²	128	81.8 Å²	81.8	68%	0.684	42%	0.417	S	S	*	.	S	Bend	trans	58	-0.1	156.1	-76.2	-10.5	0	0	0	122.5	R449 G451	R449-N453 VanDerWaalsContact NH2-CA 3.33Å; R449-N453 VanDerWaalsContact NH2-CG 3.26Å; R449-N453 PolarHBondContact NH2-O 3.07Å; R449-N453 PolarHBondContact NH2-OD1 3.25Å; G451-N453 PolarHBondContact O-N 3.4Å
454	E	40.5	Very low	56.3	Low	110 Å²	110	78.2 Å²	78.2	51%	0.514	39%	0.386	S	S	.	.			trans	-102.5	120.3	170.2	-68.7	-175.6	175.4	0	0	111.6	N452 R456	N452-E454 VanDerWaalsContact C-N 3.32Å; N452-E454 PolarHBondContact O-N 3.19Å; E454-R456 HydrophobicContact CB-CG 3.93Å; E454-R456 PolarHBondContact O-N 2.85Å; E454-R456 VanDerWaalsContact O-N 3.14Å; E454-R456 IonicContact OE2-CZ 3.64Å; E454-R456 IonicContact OE2-NE 3.15Å; E454-R456 PolarHBondContact OE2-NE 2.95Å; E454-R456 IonicContact OE2-NH2 3.38Å; E454-R456 PolarHBondContact OE2-NH2 3.18Å
455	T	43.7	Very low	58	Low	90 Å²	90	76.1 Å²	76.1	55%	0.552	37%	0.372	S	S	*	.			trans	-64.1	108.8	163.9	23.7	0	0	0	0	108.7	L598	T455-L598 HydrophobicContact CG2-CD1 3.58Å; T455-L598 HydrophobicContact CG2-CD2 4.1Å; T455-L598 HydrophobicContact CG2-CG 4.3Å
456	R	50.1	Low	60.2	Low	75 Å²	75	77.8 Å²	77.8	28%	0.283	37%	0.373	S	S	.	.			trans	-119.2	156.4	-174.2	-76.5	-173.7	170.2	-141.2	7.3	112.2	E454 G458 Y527	E454-R456 HydrophobicContact CB-CG 3.93Å; E454-R456 PolarHBondContact O-N 2.85Å; E454-R456 VanDerWaalsContact O-N 3.14Å; E454-R456 IonicContact OE2-CZ 3.64Å; E454-R456 IonicContact OE2-NE 3.15Å; E454-R456 PolarHBondContact OE2-NE 2.95Å; E454-R456 IonicContact OE2-NH2 3.38Å; E454-R456 PolarHBondContact OE2-NH2 3.18Å; R456-G458 PolarHBondContact O-N 3.02Å; R456-Y527 WeakPolarHBondContact CB-OH 3.38Å; R456-Y527 WeakPolarHBondContact CD-OH 3.19Å
457	R	60.3	Low	62.5	Low	135 Å²	135	75.1 Å²	75.1	51%	0.509	37%	0.37	S	S	.	.	S	Bend	trans	-47.3	114.3	-173.3	-52.7	-175.1	178.2	148.4	1.4	110.5	D440 L562	D440-R457 WeakPolarHBondContact OD2-CG 3.32Å; D440-R457 IonicContact OD2-NE 3.97Å; R457-L562 HydrophobicContact CB-CD1 4.25Å
458	G	74.2	Confident	64.9	Low	11 Å²	11	74.9 Å²	74.9	11%	0.113	37%	0.365	C	S	.	.			trans	-141.5	-167.3	-179.8	0	0	0	0	0	111.7	A439 R456 L562	A439-G458 WeakPolarHBondContact CB-O 3.42Å; A439-G458 PolarHBondContact N-O 3.07Å; R456-G458 PolarHBondContact O-N 3.02Å; G458-L562 WeakPolarHBondContact O-CD2 3.39Å
459	I	85.6	Confident	67.2	Low	8 Å²	8	73.5 Å²	73.5	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.8	178.3	-60.9	176.6	0	0	0	109.3	I436 T437 V560 E582 I583 V585 V586	I436-I459 HydrophobicContact CG2-CG2 3.33Å; T437-I459 CarbonylContact O-C 3.3Å; T437-I459 WeakPolarHBondContact O-CA 3.43Å; T437-I459 WeakPolarHBondContact O-CG2 3.05Å; I459-V560 HydrophobicContact CD1-CB 4.13Å; I459-V560 HydrophobicContact CD1-CG2 3.86Å; I459-V560 HydrophobicContact CG1-CB 4.06Å; I459-V560 HydrophobicContact CG1-CG2 4.1Å; I459-V560 HydrophobicContact CG2-CG2 4.26Å; I459-E582 WeakPolarHBondContact CD1-O 3.17Å; I459-I583 HydrophobicContact CD1-CG2 4.38Å; I459-V585 HydrophobicContact CB-CG1 4.34Å; I459-V585 HydrophobicContact CD1-CG1 4.22Å; I459-V586 HydrophobicContact CD1-CG2 4.32Å; I459-V586 HydrophobicContact CG2-CG2 4.08Å
460	A	85.7	Confident	69.6	Low	7 Å²	7	75.4 Å²	75.4	6%	0.058	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	139.3	169.1	0	0	0	0	0	110.5	T437 A439 F442	T437-A460 HydrophobicContact CG2-CB 4.08Å; T437-A460 PolarHBondContact N-O 3.22Å; T437-A460 PolarHBondContact O-N 3.27Å; A439-A460 HydrophobicContact CB-CB 4.43Å; F442-A460 HydrophobicContact CD2-CB 4.28Å; F442-A460 HydrophobicContact CE2-CB 4.37Å
461	I	89	Confident	71.8	Confident	54 Å²	54	73 Å²	73	28%	0.277	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.1	175.1	-57.4	169.9	0	0	0	107.5	F434 I435 V586 V589 F590	F434-I461 HydrophobicContact CD1-CG2 3.93Å; I435-I461 CarbonylContact O-C 3.59Å; I435-I461 WeakPolarHBondContact O-CA 3.04Å; I461-V586 HydrophobicContact CD1-CB 4.39Å; I461-V586 HydrophobicContact CD1-CG1 4.08Å; I461-V586 HydrophobicContact CD1-CG2 4.39Å; I461-V589 HydrophobicContact CD1-CB 3.85Å; I461-V589 HydrophobicContact CD1-CG1 3.81Å; I461-V589 HydrophobicContact CD1-CG2 4.09Å; I461-F590 HydrophobicContact CD1-CE1 4.44Å; I461-F590 HydrophobicContact CG2-CE1 4.09Å; I461-F590 HydrophobicContact CG2-CZ 4.5Å
462	L	88.5	Confident	74.1	Confident	24 Å²	24	72 Å²	72	13%	0.126	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	135.6	177.8	-47	172.1	0	0	0	108.8	I405 F434 I435 T437 F442	I405-L462 HydrophobicContact CD1-CD1 4Å; F434-L462 WeakPolarHBondContact CA-O 3.36Å; I435-L462 HydrophobicContact CB-CB 4.2Å; I435-L462 HydrophobicContact CB-CD1 4.49Å; I435-L462 HydrophobicContact CG2-CD1 4.34Å; I435-L462 PolarHBondContact N-O 3.38Å; I435-L462 PolarHBondContact O-N 3.35Å; T437-L462 HydrophobicContact CG2-CD1 4.17Å; T437-L462 HydrophobicContact CG2-CG 4.39Å; F442-L462 HydrophobicContact CE1-CD2 4.4Å; F442-L462 HydrophobicContact CE2-CD1 4.11Å; F442-L462 HydrophobicContact CE2-CD2 3.77Å; F442-L462 HydrophobicContact CE2-CG 4.38Å; F442-L462 HydrophobicContact CZ-CD1 3.62Å; F442-L462 HydrophobicContact CZ-CD2 3.68Å; F442-L462 HydrophobicContact CZ-CG 4.23Å
463	K	87.4	Confident	76.2	Confident	134 Å²	134	67.1 Å²	67.1	58%	0.583	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.9	170.1	-168.6	176.9	-173.9	179.8	0	109.6	D433 F434	D433-K463 CarbonylContact O-C 3.59Å; D433-K463 WeakPolarHBondContact O-CA 3.35Å; D433-K463 WeakPolarHBondContact OD2-CE 3.39Å; D433-K463 IonicContact OD2-NZ 3.9Å; F434-K463 HydrophobicContact CE1-CB 4.38Å; F434-K463 HydrophobicContact CE1-CD 4.29Å; F434-K463 HydrophobicContact CE1-CG 4.2Å; F434-K463 HydrophobicContact CZ-CD 4.48Å
464	L	86.7	Confident	78.6	Confident	8 Å²	8	62.2 Å²	62.2	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	146.5	179.1	-65.3	175.4	0	0	0	111.1	L419 D433 I435 R466 L468 L700	L419-L464 HydrophobicContact CD1-CD1 4.28Å; D433-L464 HydrophobicContact CB-CB 4.21Å; D433-L464 PolarHBondContact O-N 2.93Å; I435-L464 HydrophobicContact CD1-CD1 3.84Å; I435-L464 HydrophobicContact CD1-CD2 3.46Å; I435-L464 VanDerWaalsContact CD1-CD2 3.46Å; I435-L464 HydrophobicContact CD1-CG 3.77Å; I435-L464 HydrophobicContact CG1-CD1 4.21Å; I435-L464 HydrophobicContact CG1-CD2 4.5Å; I435-L464 HydrophobicContact CG1-CG 4.32Å; L464-R466 VanDerWaalsContact C-N 3.28Å; L464-R466 WeakPolarHBondContact CB-O 3.27Å; L464-L468 HydrophobicContact CD1-CD1 3.91Å; L464-L468 HydrophobicContact CD1-CG 3.91Å; L464-L700 HydrophobicContact CD1-CD1 3.59Å; L464-L700 HydrophobicContact CD2-CB 4.01Å; L464-L700 HydrophobicContact CD2-CD1 3.46Å; L464-L700 VanDerWaalsContact CD2-CD1 3.46Å; L464-L700 HydrophobicContact CD2-CG 4.26Å; L464-L700 HydrophobicContact CG-CD1 4.06Å
465	E	85.2	Confident	81	Confident	114 Å²	114	57 Å²	57	53%	0.533	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-30.5	174.7	-177.4	168	-153.2	0	0	111.8	K703	E465-K703 VanDerWaalsContact OE1-CE 3.28Å; E465-K703 WeakPolarHBondContact OE1-CE 3.34Å; E465-K703 IonicContact OE1-NZ 2.7Å; E465-K703 PolarHBondContact OE1-NZ 3.03Å
466	R	88.9	Confident	83.4	Confident	108 Å²	108	52.9 Å²	52.9	41%	0.408	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.2	173.9	-170.8	-175	73.4	94.6	-10.3	109.4	L464 D472	L464-R466 VanDerWaalsContact C-N 3.28Å; L464-R466 WeakPolarHBondContact CB-O 3.27Å; R466-D472 IonicContact CZ-OD1 3.76Å; R466-D472 IonicContact CZ-OD2 3.66Å; R466-D472 VanDerWaalsContact CZ-OD2 3.29Å; R466-D472 IonicContact NH1-OD1 2.77Å; R466-D472 IonicContact NH1-OD2 3.47Å; R466-D472 PolarHBondContact NH1-OD2 2.84Å; R466-D472 IonicContact NH2-OD1 2.85Å; R466-D472 PolarHBondContact NH2-OD1 2.96Å; R466-D472 IonicContact NH2-OD2 3.47Å; R466-D472 PolarHBondContact NH2-OD2 3.49Å
467	P	88.1	Confident	85.6	Confident	60 Å²	60	49.3 Å²	49.3	39%	0.39	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	142.2	170.5	27.1	-33	0	0	0	110.5	D433	D433-P467 HydrophobicContact CB-CB 4.1Å
468	L	88.9	Confident	87.2	Confident	11 Å²	11	43 Å²	43	6%	0.058	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	144.6	174	-54.1	180	0	0	0	109.8	L419 T431 S432 L464 D472 V474 I698 L700	L419-L468 HydrophobicContact CD1-CD1 4.23Å; L419-L468 HydrophobicContact CD2-CB 4.31Å; L419-L468 HydrophobicContact CD2-CD1 4.27Å; T431-L468 CarbonylContact C-O 3.58Å; T431-L468 WeakPolarHBondContact CA-O 3.28Å; S432-L468 PolarHBondContact N-O 2.86Å; S432-L468 PolarHBondContact O-N 2.72Å; L464-L468 HydrophobicContact CD1-CD1 3.91Å; L464-L468 HydrophobicContact CD1-CG 3.91Å; L468-D472 WeakPolarHBondContact CA-OD2 3.48Å; L468-D472 HydrophobicContact CB-CB 4.44Å; L468-V474 HydrophobicContact CB-CG2 3.52Å; L468-V474 HydrophobicContact CD1-CG2 4.25Å; L468-I698 HydrophobicContact CD2-CD1 3.87Å; L468-I698 HydrophobicContact CD2-CG2 4.22Å; L468-L700 HydrophobicContact CD1-CD1 4.11Å; L468-L700 HydrophobicContact CD2-CD1 4.13Å; L468-L700 HydrophobicContact CD2-CD2 4.31Å; L468-L700 HydrophobicContact CG-CD1 4.42Å
469	S	87.3	Confident	88.2	Confident	12 Å²	12	43.6 Å²	43.6	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	-179.5	-178.1	69.5	0	0	0	0	112	N430 E471 D472 V474	N430-S469 WeakPolarHBondContact O-CA 3.24Å; N430-S469 WeakPolarHBondContact O-CB 3.18Å; S469-E471 VanDerWaalsContact CB-OE2 3.27Å; S469-E471 WeakPolarHBondContact CB-OE2 3.48Å; S469-E471 PolarHBondContact O-N 3.25Å; S469-E471 PolarHBondContact OG-N 2.97Å; S469-E471 PolarHBondContact OG-OE2 2.77Å; S469-D472 PolarHBondContact N-OD2 2.92Å; S469-D472 WeakPolarHBondContact O-CA 3.34Å; S469-D472 VanDerWaalsContact O-CB 3.28Å; S469-D472 WeakPolarHBondContact O-CB 3.44Å; S469-D472 PolarHBondContact O-N 3.28Å; S469-V474 WeakPolarHBondContact O-CG2 3.46Å
470	R	82.7	Confident	88.5	Confident	107 Å²	107	43.3 Å²	43.3	40%	0.404	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-53.8	-34.3	168.6	-177.4	-167.3	173.8	159.2	-4.9	112.4	V374 T381 F382 D472 N473	V374-R470 HydrophobicContact CG2-CB 4.5Å; T381-R470 HydrophobicContact CG2-CB 4.45Å; T381-R470 HydrophobicContact CG2-CG 3.56Å; T381-R470 PolarHBondContact O-NH2 2.82Å; F382-R470 HydrophobicContact CE1-CG 3.97Å; R470-D472 PolarHBondContact O-N 3.05Å; R470-N473 WeakPolarHBondContact O-CA 3.33Å; R470-N473 PolarHBondContact O-N 3.19Å
471	E	82.7	Confident	88.7	Confident	127 Å²	127	49.8 Å²	49.8	59%	0.593	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-65.8	-16.2	178.2	-62.7	103	-176.1	0	0	113	R371 S469 N473	R371-E471 IonicContact NH1-OE1 3.48Å; R371-E471 PolarHBondContact NH1-OE1 2.79Å; S469-E471 VanDerWaalsContact CB-OE2 3.27Å; S469-E471 WeakPolarHBondContact CB-OE2 3.48Å; S469-E471 PolarHBondContact O-N 3.25Å; S469-E471 PolarHBondContact OG-N 2.97Å; S469-E471 PolarHBondContact OG-OE2 2.77Å; E471-N473 VanDerWaalsContact C-N 3.33Å
472	D	83.8	Confident	88.6	Confident	24 Å²	24	53.7 Å²	53.7	13%	0.128	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-90.5	6.1	173	-70.8	-56.7	0	0	0	113.2	R466 L468 S469 R470 V474 I698	R466-D472 IonicContact CZ-OD1 3.76Å; R466-D472 IonicContact CZ-OD2 3.66Å; R466-D472 VanDerWaalsContact CZ-OD2 3.29Å; R466-D472 IonicContact NH1-OD1 2.77Å; R466-D472 IonicContact NH1-OD2 3.47Å; R466-D472 PolarHBondContact NH1-OD2 2.84Å; R466-D472 IonicContact NH2-OD1 2.85Å; R466-D472 PolarHBondContact NH2-OD1 2.96Å; R466-D472 IonicContact NH2-OD2 3.47Å; R466-D472 PolarHBondContact NH2-OD2 3.49Å; L468-D472 WeakPolarHBondContact CA-OD2 3.48Å; L468-D472 HydrophobicContact CB-CB 4.44Å; S469-D472 PolarHBondContact N-OD2 2.92Å; S469-D472 WeakPolarHBondContact O-CA 3.34Å; S469-D472 VanDerWaalsContact O-CB 3.28Å; S469-D472 WeakPolarHBondContact O-CB 3.44Å; S469-D472 PolarHBondContact O-N 3.28Å; R470-D472 PolarHBondContact O-N 3.05Å; D472-V474 VanDerWaalsContact C-N 3.27Å; D472-V474 HydrophobicContact CB-CG2 4.13Å; D472-V474 PolarHBondContact O-N 2.96Å; D472-I698 HydrophobicContact CB-CD1 3.62Å
473	N	82.8	Confident	88.2	Confident	63 Å²	63	54.1 Å²	54.1	34%	0.337	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	34.9	-174	-63.9	-11.8	0	0	0	113.5	R470 E471	R470-N473 WeakPolarHBondContact O-CA 3.33Å; R470-N473 PolarHBondContact O-N 3.19Å; E471-N473 VanDerWaalsContact C-N 3.33Å
474	V	88.5	Confident	88.2	Confident	24 Å²	24	49.5 Å²	49.5	15%	0.145	24%	0.242	C	C	.	.			trans	-125.1	148.8	174.7	-58.9	0	0	0	0	110.7	P400 L419 L468 S469 D472	P400-V474 WeakPolarHBondContact O-CA 3.4Å; P400-V474 WeakPolarHBondContact O-CB 3.43Å; P400-V474 WeakPolarHBondContact O-CG1 3.32Å; L419-V474 HydrophobicContact CD2-CB 4Å; L419-V474 HydrophobicContact CD2-CG2 3.7Å; L468-V474 HydrophobicContact CB-CG2 3.52Å; L468-V474 HydrophobicContact CD1-CG2 4.25Å; S469-V474 WeakPolarHBondContact O-CG2 3.46Å; D472-V474 VanDerWaalsContact C-N 3.27Å; D472-V474 HydrophobicContact CB-CG2 4.13Å; D472-V474 PolarHBondContact O-N 2.96Å
475	V	91.4	Very high	88	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.			trans	-129.8	132.2	167.1	166.6	0	0	0	0	105.7	V374 Y375 F382 W401	V374-V475 HydrophobicContact CG1-CG1 4.33Å; V374-V475 HydrophobicContact CG1-CG2 3.93Å; Y375-V475 WeakPolarHBondContact O-CG1 3.15Å; F382-V475 HydrophobicContact CD2-CG2 4.31Å; F382-V475 HydrophobicContact CE2-CB 4.1Å; F382-V475 HydrophobicContact CE2-CG2 3.42Å; F382-V475 VanDerWaalsContact CE2-CG2 3.42Å; F382-V475 HydrophobicContact CZ-CG2 3.65Å; W401-V475 WeakPolarHBondContact CB-O 3.29Å
476	P	94.3	Very high	88.1	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.032	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-69.3	146.2	176.7	28.4	-34.5	0	0	0	111.2	C376 G377 L419 H421 A429	C376-P476 CarbonylContact C-O 3.47Å; C376-P476 WeakPolarHBondContact CA-O 3.11Å; C376-P476 WeakPolarHBondContact CB-O 3.18Å; G377-P476 PolarHBondContact N-O 3.46Å; L419-P476 HydrophobicContact CD2-CB 4.42Å; L419-P476 HydrophobicContact CG-CB 4.25Å; L419-P476 CarbonylContact O-C 3.56Å; L419-P476 VanDerWaalsContact O-CA 3.31Å; L419-P476 WeakPolarHBondContact O-CA 3.5Å; H421-P476 HydrophobicContact CB-CB 4.04Å; H421-P476 HydrophobicContact CB-CG 3.99Å; A429-P476 HydrophobicContact CB-CG 3.81Å
477	V	95.1	Very high	87.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-77.6	150.7	172.2	70.2	0	0	0	0	111.4	W401 L419 V420 H421 I548 A555 Q557	W401-V477 HydrophobicContact CB-CB 4.16Å; W401-V477 HydrophobicContact CB-CG1 4.46Å; W401-V477 HydrophobicContact CD2-CB 3.65Å; W401-V477 HydrophobicContact CD2-CG2 4.12Å; W401-V477 HydrophobicContact CE3-CB 4.01Å; W401-V477 HydrophobicContact CE3-CG2 4.45Å; W401-V477 HydrophobicContact CG-CB 3.71Å; W401-V477 HydrophobicContact CG-CG1 4.26Å; W401-V477 HydrophobicContact CZ2-CG2 4.4Å; L419-V477 PolarHBondContact O-N 3.04Å; V420-V477 HydrophobicContact CG1-CG1 3.97Å; H421-V477 PolarHBondContact N-O 2.85Å; H421-V477 VanDerWaalsContact N-O 3.17Å; V477-I548 HydrophobicContact CB-CD1 4.48Å; V477-I548 HydrophobicContact CG1-CD1 4.22Å; V477-I548 HydrophobicContact CG2-CD1 3.86Å; V477-A555 HydrophobicContact CG2-CB 3.87Å; V477-A555 WeakPolarHBondContact CG2-O 3.27Å; V477-Q557 HydrophobicContact CG1-CB 4.01Å; V477-Q557 HydrophobicContact CG2-CB 4.5Å
478	C	95.1	Very high	86.7	Confident	2 Å²	2	41 Å²	41	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	145.3	172.2	-62.4	0	0	0	0	110.5	C376 A555 Y556 Q557	C376-C478 HydrophobicContact CB-CB 4.04Å; C376-C478 WeakPolarHBondContact CB-SG 3.07Å; C376-C478 PolarHBondContact O-SG 2.94Å; C376-C478 WeakPolarHBondContact SG-CA 2.99Å; C376-C478 WeakPolarHBondContact SG-CB 3.3Å; C376-C478 CovalentContact SG-SG 2.05Å; C376-C478 PolarHBondContact SG-SG 3.08Å; C478-A555 PolarHBondContact N-O 3.03Å; C478-Y556 HydrophobicContact CB-CD1 3.59Å; C478-Y556 HydrophobicContact CB-CE1 3.79Å; C478-Y556 HydrophobicContact CB-CG 4.32Å; C478-Y556 CarbonylContact O-C 3.48Å; C478-Y556 WeakPolarHBondContact O-CA 3.41Å; C478-Q557 PolarHBondContact O-N 3.33Å
479	L	94.3	Very high	85.9	Confident	23 Å²	23	42.2 Å²	42.2	12%	0.12	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.2	166.6	-66.7	179.6	0	0	0	109.4	V420 I436 I583 V586 F590	V420-L479 HydrophobicContact CB-CD2 4.2Å; V420-L479 HydrophobicContact CB-CG 4.5Å; V420-L479 HydrophobicContact CG1-CD2 3.98Å; I436-L479 HydrophobicContact CD1-CD2 3.72Å; L479-I583 HydrophobicContact CB-CD1 3.89Å; L479-I583 HydrophobicContact CD2-CD1 3.89Å; L479-I583 HydrophobicContact CG-CD1 4.42Å; L479-V586 HydrophobicContact CD1-CG1 3.76Å; L479-F590 HydrophobicContact CD1-CD2 3.73Å; L479-F590 HydrophobicContact CD1-CE2 3.68Å
480	A	93.1	Very high	85.6	Confident	2 Å²	2	41.6 Å²	41.6	2%	0.017	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-61.5	156	170.5	0	0	0	0	0	110.9	Q557 Y558 I583 H587	A480-Q557 VanDerWaalsContact CB-O 3.23Å; A480-Q557 WeakPolarHBondContact CB-O 3.25Å; A480-Q557 PolarHBondContact N-O 3.38Å; A480-Y558 HydrophobicContact CB-CD1 3.51Å; A480-Y558 HydrophobicContact CB-CD2 3.98Å; A480-Y558 HydrophobicContact CB-CE1 3.52Å; A480-Y558 HydrophobicContact CB-CE2 3.98Å; A480-Y558 HydrophobicContact CB-CG 3.75Å; A480-I583 HydrophobicContact CB-CD1 4.27Å; A480-H587 PolarHBondContact O-CE1 3.06Å; A480-H587 PolarHBondContact O-NE2 2.92Å
481	E	89.1	Confident	85.8	Confident	143 Å²	143	37.1 Å²	37.1	67%	0.668	20%	0.196	S	C	*	.	P	Polyproline II helix	trans	-61.3	152.9	179.2	-66.8	-177.7	180	0	0	111.6	G483 S484	E481-G483 PolarHBondContact O-N 2.85Å; E481-S484 PolarHBondContact N-OG 3.15Å; E481-S484 WeakPolarHBondContact O-CB 3.34Å; E481-S484 PolarHBondContact O-N 3.16Å; E481-S484 PolarHBondContact O-OG 2.98Å
482	R	87.3	Confident	86.2	Confident	136 Å²	136	31 Å²	31	51%	0.513	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	125.6	-178.4	-169.5	-170.3	-174.9	117.5	10.4	110.3	S484 N584 D588	R482-S484 PolarHBondContact O-N 3.3Å; R482-S484 VanDerWaalsContact O-N 3.15Å; R482-N584 WeakPolarHBondContact CA-OD1 3.34Å; R482-N584 HydrophobicContact CG-CB 4.45Å; R482-N584 WeakPolarHBondContact CG-OD1 3.41Å; R482-D588 IonicContact CZ-OD1 2.94Å; R482-D588 IonicContact CZ-OD2 3.48Å; R482-D588 IonicContact NH1-OD1 3.74Å; R482-D588 PolarHBondContact NH1-OD1 3.15Å; R482-D588 IonicContact NH1-OD2 2.77Å; R482-D588 IonicContact NH2-OD1 2.64Å; R482-D588 PolarHBondContact NH2-OD1 3.2Å; R482-D588 IonicContact NH2-OD2 2.69Å; R482-D588 PolarHBondContact NH2-OD2 2.77Å
483	G	80.5	Confident	86.6	Confident	34 Å²	34	30.4 Å²	30.4	35%	0.351	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	6.5	178.9	0	0	0	0	0	115.3	E481 N584	E481-G483 PolarHBondContact O-N 2.85Å; G483-N584 PolarHBondContact N-OD1 2.9Å
484	S	85.8	Confident	87	Confident	36 Å²	36	27.4 Å²	27.4	25%	0.252	15%	0.148	S	C	.	.			trans	-73.6	148.5	175.7	66.5	0	0	0	0	111.1	E481 R482 Y558	E481-S484 PolarHBondContact N-OG 3.15Å; E481-S484 WeakPolarHBondContact O-CB 3.34Å; E481-S484 PolarHBondContact O-N 3.16Å; E481-S484 PolarHBondContact O-OG 2.98Å; R482-S484 PolarHBondContact O-N 3.3Å; R482-S484 VanDerWaalsContact O-N 3.15Å; S484-Y558 WeakPolarHBondContact OG-CE1 3.5Å
485	V	84.3	Confident	87.1	Confident	54 Å²	54	26.3 Å²	26.3	33%	0.327	14%	0.141	S	C	.	.			trans	-107.7	153.4	169.7	-69.8	0	0	0	0	109.3	A515 H516 Y558	V485-A515 HydrophobicContact CB-CB 3.73Å; V485-A515 HydrophobicContact CG1-CB 3.69Å; V485-A515 HydrophobicContact CG2-CB 4.33Å; V485-H516 WeakPolarHBondContact CG1-CE1 3.25Å; V485-H516 WeakPolarHBondContact CG1-NE2 3.47Å; V485-Y558 WeakPolarHBondContact O-CE1 3.05Å
486	P	86	Confident	87	Confident	10 Å²	10	26.6 Å²	26.6	7%	0.065	14%	0.142	C	C	.	.			trans	-52.5	128.5	175.5	-25.9	33.9	0	0	0	110	C492 I511 V530 M547 C549 Y558	P486-C492 VanDerWaalsContact CB-SG 3.52Å; P486-I511 HydrophobicContact CB-CG1 4.31Å; P486-I511 HydrophobicContact CG-CD1 4.43Å; P486-I511 HydrophobicContact CG-CG1 4.26Å; P486-V530 HydrophobicContact CG-CG1 4.42Å; P486-M547 HydrophobicContact CG-SD 4.46Å; P486-C549 HydrophobicContact CB-CB 4.3Å; P486-C549 VanDerWaalsContact CG-SG 3.55Å; P486-Y558 HydrophobicContact CB-CD2 4.4Å; P486-Y558 HydrophobicContact CB-CE1 4.47Å; P486-Y558 HydrophobicContact CB-CE2 4.37Å; P486-Y558 HydrophobicContact CB-CG 4.47Å; P486-Y558 VanDerWaalsContact CD-CD1 3.48Å; P486-Y558 HydrophobicContact CG-CD1 3.79Å; P486-Y558 HydrophobicContact CG-CD2 3.94Å; P486-Y558 HydrophobicContact CG-CE1 4.22Å; P486-Y558 HydrophobicContact CG-CE2 4.37Å; P486-Y558 HydrophobicContact CG-CG 3.63Å; P486-Y558 VanDerWaalsContact N-CE1 3.25Å
487	P	80	Confident	86.7	Confident	28 Å²	28	27.4 Å²	27.4	18%	0.182	15%	0.145	C	C	.	.			trans	-68.6	157.2	176	29.5	-32.3	0	0	0	108.7	F489 A490 V551 Y558	P487-F489 HydrophobicContact CB-CD1 4.08Å; P487-F489 HydrophobicContact CB-CE1 3.37Å; P487-F489 HydrophobicContact CB-CZ 3.63Å; P487-F489 HydrophobicContact CG-CE1 3.85Å; P487-F489 HydrophobicContact CG-CE2 4.11Å; P487-F489 HydrophobicContact CG-CZ 3.55Å; P487-F489 PolarHBondContact O-N 3.32Å; P487-A490 HydrophobicContact CG-CB 4Å; P487-A490 WeakPolarHBondContact O-CA 2.98Å; P487-A490 WeakPolarHBondContact O-CB 3.43Å; P487-A490 PolarHBondContact O-N 3.43Å; P487-V551 HydrophobicContact CG-CG1 3.98Å; P487-V551 HydrophobicContact CG-CG2 3.76Å; P487-Y558 VanDerWaalsContact CD-OH 3.24Å; P487-Y558 WeakPolarHBondContact CD-OH 3.27Å
488	P	67.4	Low	86.2	Confident	21 Å²	21	27.9 Å²	27.9	14%	0.136	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-23.6	-163.1	5.7	1	0	0	0	114.8	Y984 V1064	P488-Y984 HydrophobicContact CB-CD2 3.94Å; P488-Y984 HydrophobicContact CB-CE1 3.9Å; P488-Y984 HydrophobicContact CB-CE2 3.16Å; P488-Y984 WeakPolarHBondContact CB-OH 3.43Å; P488-Y984 HydrophobicContact CG-CD1 3.43Å; P488-Y984 VanDerWaalsContact CG-CD1 3.43Å; P488-Y984 HydrophobicContact CG-CD2 3.67Å; P488-Y984 HydrophobicContact CG-CE1 2.93Å; P488-Y984 HydrophobicContact CG-CE2 3.15Å; P488-Y984 HydrophobicContact CG-CG 3.81Å; P488-Y984 WeakPolarHBondContact CG-OH 3.09Å; P488-V1064 HydrophobicContact CB-CG1 3.94Å
489	F	72.9	Confident	85.5	Confident	35 Å²	35	33.2 Å²	33.2	15%	0.154	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-7.4	168.1	60.7	-88.6	0	0	0	112	P487 V551 K552 Y987 L990	P487-F489 HydrophobicContact CB-CD1 4.08Å; P487-F489 HydrophobicContact CB-CE1 3.37Å; P487-F489 HydrophobicContact CB-CZ 3.63Å; P487-F489 HydrophobicContact CG-CE1 3.85Å; P487-F489 HydrophobicContact CG-CE2 4.11Å; P487-F489 HydrophobicContact CG-CZ 3.55Å; P487-F489 PolarHBondContact O-N 3.32Å; F489-V551 HydrophobicContact CE2-CG1 3.84Å; F489-V551 HydrophobicContact CZ-CG1 4Å; F489-K552 HydrophobicContact CE2-CG 4.41Å; F489-Y987 AromaticContact CD1-CD1 3.76Å; F489-Y987 HydrophobicContact CD1-CD1 3.76Å; F489-Y987 AromaticContact CD1-CD2 3.95Å; F489-Y987 HydrophobicContact CD1-CD2 3.95Å; F489-Y987 AromaticContact CD1-CE1 3.48Å; F489-Y987 HydrophobicContact CD1-CE1 3.48Å; F489-Y987 VanDerWaalsContact CD1-CE1 3.48Å; F489-Y987 AromaticContact CD1-CE2 3.7Å; F489-Y987 HydrophobicContact CD1-CE2 3.7Å; F489-Y987 HydrophobicContact CD1-CG 4.01Å; F489-Y987 AromaticContact CD1-CZ 3.5Å; F489-Y987 HydrophobicContact CD2-CE1 4.2Å; F489-Y987 HydrophobicContact CE1-CD1 4.01Å; F489-Y987 HydrophobicContact CE1-CD2 4.05Å; F489-Y987 AromaticContact CE1-CE1 3.25Å; F489-Y987 HydrophobicContact CE1-CE1 3.25Å; F489-Y987 AromaticContact CE1-CE2 3.31Å; F489-Y987 HydrophobicContact CE1-CE2 3.31Å; F489-Y987 HydrophobicContact CE1-CG 4.37Å; F489-Y987 AromaticContact CE1-CZ 2.88Å; F489-Y987 WeakPolarHBondContact CE1-OH 3.31Å; F489-Y987 AromaticContact CE2-CE1 3.98Å; F489-Y987 HydrophobicContact CE2-CE1 3.98Å; F489-Y987 HydrophobicContact CG-CD1 4.14Å; F489-Y987 AromaticContact CG-CE1 3.98Å; F489-Y987 HydrophobicContact CG-CE1 3.98Å; F489-Y987 AromaticContact CZ-CE1 3.52Å; F489-Y987 HydrophobicContact CZ-CE1 3.52Å; F489-Y987 HydrophobicContact CZ-CE2 4.21Å; F489-Y987 AromaticContact CZ-CZ 3.35Å; F489-Y987 WeakPolarHBondContact CZ-OH 3.02Å; F489-L990 HydrophobicContact CB-CD1 3.93Å
490	A	81.7	Confident	84.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-72.7	134.9	177.4	0	0	0	0	0	110.5	P487 C549 L550 V551	P487-A490 HydrophobicContact CG-CB 4Å; P487-A490 WeakPolarHBondContact O-CA 2.98Å; P487-A490 WeakPolarHBondContact O-CB 3.43Å; P487-A490 PolarHBondContact O-N 3.43Å; A490-C549 HydrophobicContact CB-CB 4.04Å; A490-L550 WeakPolarHBondContact CA-O 3.16Å; A490-L550 WeakPolarHBondContact CB-O 3.18Å; A490-V551 HydrophobicContact CB-CG2 3.94Å
491	S	85.8	Confident	83.7	Confident	12 Å²	12	39.9 Å²	39.9	8%	0.084	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	116.3	165.6	-64.2	0	0	0	0	108.4	C549 L550	S491-C549 WeakPolarHBondContact O-CA 3.17Å; S491-L550 PolarHBondContact O-N 3.42Å
492	C	91.2	Very high	83.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.8	-179.6	-64.9	0	0	0	0	110.9	P486 I508 V509 I511 I548 C549	P486-C492 VanDerWaalsContact CB-SG 3.52Å; C492-I508 CarbonylContact O-C 3.48Å; C492-I508 WeakPolarHBondContact O-CA 3.36Å; C492-V509 HydrophobicContact CB-CG2 4.07Å; C492-V509 PolarHBondContact O-N 3.11Å; C492-I511 HydrophobicContact CB-CD1 3.9Å; C492-I511 HydrophobicContact CB-CG1 4.11Å; C492-I548 CarbonylContact C-O 3.57Å; C492-I548 WeakPolarHBondContact CA-O 3.41Å; C492-C549 HydrophobicContact CB-CB 4.1Å; C492-C549 WeakPolarHBondContact CB-SG 3.47Å; C492-C549 WeakPolarHBondContact SG-CB 3.41Å; C492-C549 CovalentContact SG-SG 2.04Å; C492-C549 PolarHBondContact SG-SG 3.32Å
493	Y	91.9	Very high	82.7	Confident	11 Å²	11	35 Å²	35	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.6	-178.7	-62.4	-92	0	0	0	110	V390 F399 E507 I508 I548 L550	V390-Y493 HydrophobicContact CB-CD1 4.08Å; V390-Y493 HydrophobicContact CB-CE1 3.5Å; V390-Y493 VanDerWaalsContact CB-CE1 3.5Å; V390-Y493 HydrophobicContact CB-CE2 4.48Å; V390-Y493 HydrophobicContact CG1-CD1 3.64Å; V390-Y493 HydrophobicContact CG1-CD2 4.48Å; V390-Y493 HydrophobicContact CG1-CE1 3.62Å; V390-Y493 HydrophobicContact CG1-CE2 4.47Å; V390-Y493 HydrophobicContact CG1-CG 4.09Å; V390-Y493 HydrophobicContact CG2-CE1 3.83Å; V390-Y493 HydrophobicContact CG2-CE2 3.96Å; V390-Y493 VanDerWaalsContact CG2-CZ 3.48Å; V390-Y493 WeakPolarHBondContact CG2-OH 3.41Å; F399-Y493 HydrophobicContact CE2-CG 4.41Å; F399-Y493 HydrophobicContact CZ-CD2 4.43Å; F399-Y493 HydrophobicContact CZ-CG 4.37Å; Y493-E507 CarbonylContact C-O 3.54Å; Y493-E507 VanDerWaalsContact CA-O 3.24Å; Y493-E507 WeakPolarHBondContact CA-O 3.21Å; Y493-I508 HydrophobicContact CD1-CB 3.95Å; Y493-I508 HydrophobicContact CE1-CB 3.69Å; Y493-I508 HydrophobicContact CE1-CD1 4.33Å; Y493-I508 HydrophobicContact CE1-CG1 4.11Å; Y493-I548 PolarHBondContact N-O 3.43Å; Y493-I548 PolarHBondContact O-N 2.65Å; Y493-L550 HydrophobicContact CD2-CD1 4.38Å; Y493-L550 HydrophobicContact CD2-CG 4.19Å; Y493-L550 HydrophobicContact CE2-CD1 3.78Å; Y493-L550 HydrophobicContact CE2-CG 3.96Å
494	V	91.6	Very high	82.9	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.6	176.2	-53.4	0	0	0	0	108.4	H496 E506 E507 V509 Y580	V494-H496 WeakPolarHBondContact CG2-NE2 3.47Å; V494-H496 PolarHBondContact O-CE1 2.85Å; V494-E506 WeakPolarHBondContact O-CA 3.47Å; V494-E507 HydrophobicContact CG2-CB 4.42Å; V494-E507 PolarHBondContact N-O 3.3Å; V494-E507 PolarHBondContact O-N 2.89Å; V494-V509 HydrophobicContact CB-CG1 4.21Å; V494-V509 HydrophobicContact CG1-CB 4.32Å; V494-V509 HydrophobicContact CG1-CG1 3.72Å; V494-V509 HydrophobicContact CG1-CG2 3.62Å; V494-V509 HydrophobicContact CG2-CG1 3.46Å; V494-V509 VanDerWaalsContact CG2-CG1 3.46Å; V494-Y580 VanDerWaalsContact CB-OH 3.27Å; V494-Y580 WeakPolarHBondContact CB-OH 3.45Å; V494-Y580 HydrophobicContact CG1-CE1 4.14Å; V494-Y580 HydrophobicContact CG1-CE2 4.42Å; V494-Y580 WeakPolarHBondContact CG1-OH 3.42Å
495	T	91.1	Very high	82.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133	-178.6	-53.2	0	0	0	0	110	N402 I416 M504 A545	N402-T495 WeakPolarHBondContact ND2-CG2 3.41Å; N402-T495 PolarHBondContact ND2-OG1 2.97Å; I416-T495 HydrophobicContact CD1-CG2 4.33Å; I416-T495 HydrophobicContact CG2-CG2 4.44Å; T495-M504 HydrophobicContact CG2-CB 4Å; T495-M504 HydrophobicContact CG2-CG 4.35Å; T495-M504 HydrophobicContact CG2-SD 4.09Å; T495-A545 WeakPolarHBondContact O-CB 3.44Å
496	H	89.1	Confident	82.8	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.028	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	150.7	171	8.2	58.5	0	0	0	109.4	V494 M504 D505 E507 Y540 I541	V494-H496 WeakPolarHBondContact CG2-NE2 3.47Å; V494-H496 PolarHBondContact O-CE1 2.85Å; H496-M504 CarbonylContact O-C 3.46Å; H496-M504 VanDerWaalsContact O-CA 3.29Å; H496-M504 WeakPolarHBondContact O-CA 3.44Å; H496-D505 PolarHBondContact CE1-O 3.21Å; H496-D505 PolarHBondContact N-O 2.88Å; H496-D505 PolarHBondContact ND1-O 3.05Å; H496-D505 PolarHBondContact O-N 3.28Å; H496-E507 WeakPolarHBondContact CE1-CB 3.19Å; H496-E507 IonicContact CE1-OE2 3.16Å; H496-E507 WeakPolarHBondContact NE2-CB 3.38Å; H496-E507 IonicContact NE2-OE2 2.72Å; H496-E507 PolarHBondContact NE2-OE2 2.84Å; H496-Y540 HydrophobicContact CB-CD2 3.63Å; H496-Y540 HydrophobicContact CB-CE2 4.35Å; H496-Y540 HydrophobicContact CB-CG 3.96Å; H496-Y540 AromaticContact CD2-CD2 3.97Å; H496-Y540 AromaticContact CG-CD2 3.52Å; H496-Y540 AromaticContact CG-CE2 3.93Å; H496-Y540 AromaticContact ND1-CD2 3.95Å; H496-Y540 AromaticContact ND1-CE2 3.87Å; H496-I541 WeakPolarHBondContact CA-O 3.37Å
497	Y	88.7	Confident	82.8	Confident	22 Å²	22	34.4 Å²	34.4	9%	0.086	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	112.5	176.6	176.7	-92.3	0	0	0	108	I404 T413 K499 H502 R503 M504 Y540 I541	I404-Y497 HydrophobicContact CD1-CD2 3.88Å; I404-Y497 HydrophobicContact CD1-CE2 3.87Å; T413-Y497 HydrophobicContact CG2-CD1 3.88Å; T413-Y497 HydrophobicContact CG2-CE1 4.19Å; T413-Y497 HydrophobicContact CG2-CG 4.1Å; Y497-K499 PolarHBondContact O-N 2.71Å; Y497-H502 WeakPolarHBondContact CE2-O 3.29Å; Y497-H502 WeakPolarHBondContact OH-CA 3.16Å; Y497-H502 PolarHBondContact OH-ND1 3.38Å; Y497-H502 PolarHBondContact OH-O 3.01Å; Y497-R503 WeakPolarHBondContact CA-O 3.27Å; Y497-M504 HydrophobicContact CD2-CG 3.98Å; Y497-Y540 CarbonylContact O-C 3.55Å; Y497-Y540 WeakPolarHBondContact O-CA 3.24Å; Y497-I541 HydrophobicContact CD1-CD1 3.87Å; Y497-I541 HydrophobicContact CD1-CG1 4.33Å; Y497-I541 HydrophobicContact CE1-CD1 4.49Å; Y497-I541 PolarHBondContact N-O 2.66Å; Y497-I541 PolarHBondContact O-N 2.91Å
498	D	83.9	Confident	83.1	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.059	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	116.2	175.1	-171	-18.2	0	0	0	109.4	R500 E501 H502 R503 Y540	D498-R500 VanDerWaalsContact C-N 3.29Å; D498-R500 PolarHBondContact O-N 3.06Å; D498-R500 WeakPolarHBondContact OD1-CB 3.39Å; D498-R500 PolarHBondContact OD1-N 3Å; D498-E501 HydrophobicContact CB-CB 3.95Å; D498-E501 PolarHBondContact OD1-N 2.92Å; D498-E501 WeakPolarHBondContact OD2-CB 3.47Å; D498-E501 WeakPolarHBondContact OD2-CG 3.49Å; D498-H502 WeakPolarHBondContact O-CA 3.33Å; D498-H502 PolarHBondContact O-N 2.77Å; D498-R503 PolarHBondContact N-O 2.04Å; D498-Y540 HydrophobicContact CB-CD1 3.9Å; D498-Y540 HydrophobicContact CB-CE1 3.56Å; D498-Y540 VanDerWaalsContact CG-CE1 3.45Å; D498-Y540 WeakPolarHBondContact OD2-CE1 3.29Å
499	K	80	Confident	84.1	Confident	113 Å²	113	32.5 Å²	32.5	49%	0.491	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.4	176.6	-69.4	175.9	-173.5	179.7	0	113.5	Y497 H502 Q539 I541	Y497-K499 PolarHBondContact O-N 2.71Å; K499-H502 PolarHBondContact O-CE1 2.78Å; K499-Q539 VanDerWaalsContact CB-O 3.29Å; K499-Q539 WeakPolarHBondContact CB-O 3.41Å; K499-Q539 WeakPolarHBondContact CD-O 3.42Å; K499-Q539 WeakPolarHBondContact CG-O 3.1Å; K499-Q539 PolarHBondContact N-O 3.14Å; K499-Q539 VanDerWaalsContact N-O 3.12Å; K499-I541 HydrophobicContact CD-CD1 4.34Å; K499-I541 HydrophobicContact CD-CG1 4.1Å; K499-I541 VanDerWaalsContact CE-CD1 3.46Å; K499-I541 HydrophobicContact CG-CD1 3.96Å; K499-I541 HydrophobicContact CG-CG1 3.87Å
500	R	75.8	Confident	84.5	Confident	143 Å²	143	31.6 Å²	31.6	54%	0.54	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-47.4	177.9	-74.1	-160.5	179.9	169.7	-2.4	110.8	H232 D498 H502 Q539	H232-R500 PolarHBondContact CE1-O 3.08Å; D498-R500 VanDerWaalsContact C-N 3.29Å; D498-R500 PolarHBondContact O-N 3.06Å; D498-R500 WeakPolarHBondContact OD1-CB 3.39Å; D498-R500 PolarHBondContact OD1-N 3Å; R500-H502 VanDerWaalsContact C-N 3.31Å; R500-Q539 HydrophobicContact CG-CB 4.42Å; R500-Q539 HydrophobicContact CG-CG 3.99Å; R500-Q539 VanDerWaalsContact CZ-CD 3.47Å; R500-Q539 VanDerWaalsContact NE-OE1 3.15Å
501	E	74.2	Confident	84.5	Confident	22 Å²	22	32 Å²	32	10%	0.103	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.9	-176.4	-70.8	-71.1	137	0	0	113.6	H232 A282 D498 R503	H232-E501 PolarHBondContact CD2-O 2.85Å; H232-E501 WeakPolarHBondContact CE1-CA 3.45Å; H232-E501 PolarHBondContact CE1-O 2.04Å; H232-E501 IonicContact CE1-OE2 3.49Å; H232-E501 PolarHBondContact ND1-O 2.91Å; H232-E501 WeakPolarHBondContact NE2-CA 3.24Å; H232-E501 PolarHBondContact NE2-O 2.73Å; H232-E501 IonicContact NE2-OE2 2.78Å; H232-E501 PolarHBondContact NE2-OE2 2.94Å; H232-E501 VanDerWaalsContact NE2-OE2 3.07Å; A282-E501 WeakPolarHBondContact CA-OE1 3.44Å; A282-E501 HydrophobicContact CB-CG 3.82Å; A282-E501 WeakPolarHBondContact CB-OE1 3.07Å; A282-E501 PolarHBondContact N-OE1 2.95Å; D498-E501 HydrophobicContact CB-CB 3.95Å; D498-E501 PolarHBondContact OD1-N 2.92Å; D498-E501 WeakPolarHBondContact OD2-CB 3.47Å; D498-E501 WeakPolarHBondContact OD2-CG 3.49Å; E501-R503 HydrophobicContact CB-CG 4.22Å; E501-R503 VanDerWaalsContact CG-NH2 3.28Å; E501-R503 PolarHBondContact O-N 2.85Å; E501-R503 IonicContact OE2-CZ 3.35Å; E501-R503 IonicContact OE2-NE 2.73Å; E501-R503 IonicContact OE2-NH2 2.93Å; E501-R503 PolarHBondContact OE2-NH2 3.28Å
502	H	76.8	Confident	83.7	Confident	86 Å²	86	31.9 Å²	31.9	40%	0.398	14%	0.138	S	C	.	.			trans	47.6	16.6	-179.4	-72.3	-63.4	0	0	0	116.1	G231 H232 Y497 D498 K499 R500	G231-H502 CarbonylContact O-C 3.49Å; H232-H502 HydrophobicContact CB-CB 3.97Å; H232-H502 AromaticContact ND1-CD2 3.61Å; H232-H502 AromaticContact ND1-CG 3.99Å; Y497-H502 WeakPolarHBondContact CE2-O 3.29Å; Y497-H502 WeakPolarHBondContact OH-CA 3.16Å; Y497-H502 PolarHBondContact OH-ND1 3.38Å; Y497-H502 PolarHBondContact OH-O 3.01Å; D498-H502 WeakPolarHBondContact O-CA 3.33Å; D498-H502 PolarHBondContact O-N 2.77Å; K499-H502 PolarHBondContact O-CE1 2.78Å; R500-H502 VanDerWaalsContact C-N 3.31Å
503	R	79.3	Confident	82.2	Confident	90 Å²	90	35.5 Å²	35.5	34%	0.34	15%	0.152	S	C	.	.	S	Bend	trans	-110.2	160.7	-177.5	80.1	-179.5	112.8	105.7	-5.2	111.6	Y497 D498 E501 D505	Y497-R503 WeakPolarHBondContact CA-O 3.27Å; D498-R503 PolarHBondContact N-O 2.04Å; E501-R503 HydrophobicContact CB-CG 4.22Å; E501-R503 VanDerWaalsContact CG-NH2 3.28Å; E501-R503 PolarHBondContact O-N 2.85Å; E501-R503 IonicContact OE2-CZ 3.35Å; E501-R503 IonicContact OE2-NE 2.73Å; E501-R503 IonicContact OE2-NH2 2.93Å; E501-R503 PolarHBondContact OE2-NH2 3.28Å; R503-D505 WeakPolarHBondContact CD-OD1 3.38Å; R503-D505 WeakPolarHBondContact CG-OD1 3.42Å; R503-D505 IonicContact CZ-OD1 3.75Å; R503-D505 IonicContact NE-OD1 2.98Å; R503-D505 IonicContact NH1-OD1 3.95Å; R503-D505 PolarHBondContact NH1-OD1 2.89Å; R503-D505 IonicContact NH1-OD2 3.87Å; R503-D505 PolarHBondContact NH1-OD2 3.2Å
504	M	83	Confident	80.8	Confident	13 Å²	13	38.6 Å²	38.6	6%	0.064	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	135	163.8	-63.5	-169.7	-77.2	0	0	108.5	M398 N402 I404 T495 H496 Y497	M398-M504 HydrophobicContact CB-CE 4.34Å; M398-M504 HydrophobicContact CE-CE 3.72Å; M398-M504 HydrophobicContact CG-CB 4.07Å; M398-M504 HydrophobicContact CG-CE 4.26Å; M398-M504 HydrophobicContact SD-CB 3.73Å; M398-M504 HydrophobicContact SD-CE 3.22Å; M398-M504 WeakPolarHBondContact SD-CE 3.07Å; M398-M504 HydrophobicContact SD-CG 4.03Å; M398-M504 HydrophobicContact SD-SD 4.43Å; N402-M504 HydrophobicContact CB-CE 3.68Å; N402-M504 HydrophobicContact CB-SD 4Å; I404-M504 HydrophobicContact CD1-CE 3.98Å; I404-M504 HydrophobicContact CD1-CG 4.11Å; I404-M504 HydrophobicContact CD1-SD 3.96Å; I404-M504 HydrophobicContact CG1-CE 3.85Å; I404-M504 HydrophobicContact CG1-CG 4.33Å; I404-M504 HydrophobicContact CG1-SD 3.59Å; I404-M504 VanDerWaalsContact CG1-SD 3.59Å; T495-M504 HydrophobicContact CG2-CB 4Å; T495-M504 HydrophobicContact CG2-CG 4.35Å; T495-M504 HydrophobicContact CG2-SD 4.09Å; H496-M504 CarbonylContact O-C 3.46Å; H496-M504 VanDerWaalsContact O-CA 3.29Å; H496-M504 WeakPolarHBondContact O-CA 3.44Å; Y497-M504 HydrophobicContact CD2-CG 3.98Å
505	D	81.8	Confident	79.5	Confident	29 Å²	29	39.1 Å²	39.1	16%	0.155	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.2	172.1	-63	-42.5	0	0	0	107.7	H496 R503 Y540	H496-D505 PolarHBondContact CE1-O 3.21Å; H496-D505 PolarHBondContact N-O 2.88Å; H496-D505 PolarHBondContact ND1-O 3.05Å; H496-D505 PolarHBondContact O-N 3.28Å; R503-D505 WeakPolarHBondContact CD-OD1 3.38Å; R503-D505 WeakPolarHBondContact CG-OD1 3.42Å; R503-D505 IonicContact CZ-OD1 3.75Å; R503-D505 IonicContact NE-OD1 2.98Å; R503-D505 IonicContact NH1-OD1 3.95Å; R503-D505 PolarHBondContact NH1-OD1 2.89Å; R503-D505 IonicContact NH1-OD2 3.87Å; R503-D505 PolarHBondContact NH1-OD2 3.2Å; D505-Y540 PolarHBondContact OD2-OH 3.46Å
506	E	87.3	Confident	78.7	Confident	37 Å²	37	41.9 Å²	41.9	17%	0.173	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121	170.8	-68.9	77.7	-174.1	0	0	109.8	V390 M398 F399 N402 V494	V390-E506 HydrophobicContact CG1-CB 4.21Å; M398-E506 WeakPolarHBondContact CA-OE1 3.47Å; F399-E506 HydrophobicContact CD2-CG 3.59Å; F399-E506 HydrophobicContact CE2-CB 4.33Å; F399-E506 HydrophobicContact CE2-CG 3.67Å; F399-E506 PolarHBondContact N-OE1 3.04Å; N402-E506 PolarHBondContact ND2-OE1 3.22Å; V494-E506 WeakPolarHBondContact O-CA 3.47Å
507	E	84.9	Confident	77.9	Confident	44 Å²	44	42.6 Å²	42.6	21%	0.206	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.4	177.7	180	173.1	161.1	0	0	109.7	Y493 V494 H496	Y493-E507 CarbonylContact C-O 3.54Å; Y493-E507 VanDerWaalsContact CA-O 3.24Å; Y493-E507 WeakPolarHBondContact CA-O 3.21Å; V494-E507 HydrophobicContact CG2-CB 4.42Å; V494-E507 PolarHBondContact N-O 3.3Å; V494-E507 PolarHBondContact O-N 2.89Å; H496-E507 WeakPolarHBondContact CE1-CB 3.19Å; H496-E507 IonicContact CE1-OE2 3.16Å; H496-E507 WeakPolarHBondContact NE2-CB 3.38Å; H496-E507 IonicContact NE2-OE2 2.72Å; H496-E507 PolarHBondContact NE2-OE2 2.84Å
508	I	87.1	Confident	76.8	Confident	8 Å²	8	45.3 Å²	45.3	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	128.7	172.7	-170.9	172.6	0	0	0	109.2	C492 Y493 P1049 K1053 P1062	C492-I508 CarbonylContact O-C 3.48Å; C492-I508 WeakPolarHBondContact O-CA 3.36Å; Y493-I508 HydrophobicContact CD1-CB 3.95Å; Y493-I508 HydrophobicContact CE1-CB 3.69Å; Y493-I508 HydrophobicContact CE1-CD1 4.33Å; Y493-I508 HydrophobicContact CE1-CG1 4.11Å; I508-P1049 HydrophobicContact CG2-CB 3.92Å; I508-K1053 HydrophobicContact CD1-CB 4.46Å; I508-K1053 HydrophobicContact CD1-CD 4.23Å; I508-K1053 HydrophobicContact CD1-CG 4.37Å; I508-P1062 HydrophobicContact CD1-CG 3.83Å; I508-P1062 HydrophobicContact CG1-CG 4.05Å
509	V	87.7	Confident	75.5	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153.5	-175.3	-61.5	0	0	0	0	111.9	C492 V494 I511 A532 E534	C492-V509 HydrophobicContact CB-CG2 4.07Å; C492-V509 PolarHBondContact O-N 3.11Å; V494-V509 HydrophobicContact CB-CG1 4.21Å; V494-V509 HydrophobicContact CG1-CB 4.32Å; V494-V509 HydrophobicContact CG1-CG1 3.72Å; V494-V509 HydrophobicContact CG1-CG2 3.62Å; V494-V509 HydrophobicContact CG2-CG1 3.46Å; V494-V509 VanDerWaalsContact CG2-CG1 3.46Å; V509-I511 HydrophobicContact CG2-CD1 4.25Å; V509-A532 HydrophobicContact CB-CB 3.93Å; V509-A532 HydrophobicContact CG2-CB 3.71Å; V509-E534 HydrophobicContact CB-CG 4.43Å; V509-E534 HydrophobicContact CG1-CG 3.78Å
510	M	81.1	Confident	74	Confident	16 Å²	16	44.6 Å²	44.6	8%	0.079	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.6	174.3	-58.4	-177.6	-74.5	0	0	109.2	A532 I533 P1049 P1062 Y1066 K1126	M510-A532 CarbonylContact O-C 3.58Å; M510-A532 VanDerWaalsContact O-CA 3.29Å; M510-A532 WeakPolarHBondContact O-CA 3.15Å; M510-I533 HydrophobicContact CB-CB 4.37Å; M510-I533 HydrophobicContact CB-CD1 4.28Å; M510-I533 HydrophobicContact CE-CB 4.15Å; M510-I533 HydrophobicContact CE-CD1 4.11Å; M510-I533 HydrophobicContact CE-CG2 4.06Å; M510-I533 PolarHBondContact O-N 3.33Å; M510-P1049 HydrophobicContact CE-CG 3.93Å; M510-P1049 HydrophobicContact CG-CB 4.37Å; M510-P1049 HydrophobicContact CG-CG 3.55Å; M510-P1049 HydrophobicContact SD-CG 3.71Å; M510-P1062 HydrophobicContact CG-CB 4.02Å; M510-P1062 VanDerWaalsContact CG-O 3.29Å; M510-P1062 WeakPolarHBondContact CG-O 3.31Å; M510-Y1066 HydrophobicContact SD-CD1 4.42Å; M510-Y1066 HydrophobicContact SD-CE1 4.11Å; M510-K1126 PolarHBondContact SD-NZ 2.98Å
511	I	82.4	Confident	72.5	Confident	9 Å²	9	39.4 Å²	39.4	5%	0.046	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	138.6	170.4	-50.6	-56.2	0	0	0	108.3	P486 C492 V509 A515 V530 A532 M547	P486-I511 HydrophobicContact CB-CG1 4.31Å; P486-I511 HydrophobicContact CG-CD1 4.43Å; P486-I511 HydrophobicContact CG-CG1 4.26Å; C492-I511 HydrophobicContact CB-CD1 3.9Å; C492-I511 HydrophobicContact CB-CG1 4.11Å; V509-I511 HydrophobicContact CG2-CD1 4.25Å; I511-A515 HydrophobicContact CG2-CB 3.65Å; I511-V530 HydrophobicContact CD1-CG1 4.34Å; I511-V530 HydrophobicContact CG2-CG1 3.99Å; I511-A532 HydrophobicContact CD1-CB 3.98Å; I511-M547 HydrophobicContact CD1-CE 3.76Å; I511-M547 HydrophobicContact CD1-SD 3.64Å
512	T	69.3	Low	70.8	Confident	8 Å²	8	44.7 Å²	44.7	5%	0.049	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	145	173.2	49.5	0	0	0	0	109.8	N514 A515 C531 I533 L577	T512-N514 VanDerWaalsContact C-N 3.26Å; T512-N514 CarbonylContact O-C 3.4Å; T512-N514 VanDerWaalsContact O-C 3.3Å; T512-N514 PolarHBondContact O-N 2.92Å; T512-N514 PolarHBondContact OG1-O 2.83Å; T512-A515 WeakPolarHBondContact O-CA 3.11Å; T512-A515 PolarHBondContact O-N 2.86Å; T512-C531 HydrophobicContact CG2-CB 4.4Å; T512-C531 PolarHBondContact N-O 3.28Å; T512-C531 PolarHBondContact OG1-O 2.59Å; T512-I533 HydrophobicContact CG2-CG1 4.3Å; T512-L577 HydrophobicContact CG2-CD2 4.41Å
513	R	58.7	Low	69.1	Low	76 Å²	76	50.3 Å²	50.3	29%	0.287	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	-39.3	-177.5	-158.7	179.3	-179.4	176.1	0.3	111.2	A515 E1128 N1131	R513-A515 PolarHBondContact O-N 3.01Å; R513-E1128 HydrophobicContact CB-CG 4.38Å; R513-E1128 WeakPolarHBondContact CB-OE1 3.4Å; R513-E1128 VanDerWaalsContact CB-OE2 3.3Å; R513-E1128 WeakPolarHBondContact CB-OE2 3.45Å; R513-E1128 PolarHBondContact N-OE1 2.85Å; R513-E1128 VanDerWaalsContact N-OE1 3.07Å; R513-N1131 PolarHBondContact NH1-ND2 3.04Å; R513-N1131 PolarHBondContact NH1-OD1 3Å
514	N	63.6	Low	67.2	Low	77 Å²	77	47.3 Å²	47.3	41%	0.412	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	80.5	156.2	-69.4	-26.2	0	0	0	108.5	T512 H516 D1130	T512-N514 VanDerWaalsContact C-N 3.26Å; T512-N514 CarbonylContact O-C 3.4Å; T512-N514 VanDerWaalsContact O-C 3.3Å; T512-N514 PolarHBondContact O-N 2.92Å; T512-N514 PolarHBondContact OG1-O 2.83Å; N514-H516 PolarHBondContact O-N 3.01Å; N514-D1130 PolarHBondContact ND2-OD2 3.09Å
515	A	63.6	Low	65.3	Low	11 Å²	11	50.4 Å²	50.4	9%	0.091	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	-34	-175.1	0	0	0	0	0	111.2	V485 I511 T512 R513 V530 C531	V485-A515 HydrophobicContact CB-CB 3.73Å; V485-A515 HydrophobicContact CG1-CB 3.69Å; V485-A515 HydrophobicContact CG2-CB 4.33Å; I511-A515 HydrophobicContact CG2-CB 3.65Å; T512-A515 WeakPolarHBondContact O-CA 3.11Å; T512-A515 PolarHBondContact O-N 2.86Å; R513-A515 PolarHBondContact O-N 3.01Å; A515-V530 HydrophobicContact CB-CG1 4.49Å; A515-V530 VanDerWaalsContact O-CA 3.22Å; A515-V530 WeakPolarHBondContact O-CA 3.27Å; A515-C531 PolarHBondContact O-N 2.79Å
516	H	73.7	Confident	64.1	Low	57 Å²	57	55.8 Å²	55.8	26%	0.264	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	128.1	171.8	-67.5	-63.9	0	0	0	112.1	V485 N514 R528 G529 E582	V485-H516 WeakPolarHBondContact CG1-CE1 3.25Å; V485-H516 WeakPolarHBondContact CG1-NE2 3.47Å; N514-H516 PolarHBondContact O-N 3.01Å; H516-R528 HydrophobicContact CB-CG 4.46Å; H516-R528 PolarHBondContact CD2-NH2 3.48Å; H516-R528 PolarHBondContact CE1-NE 2.93Å; H516-R528 VanDerWaalsContact CE1-NE 3.3Å; H516-R528 PolarHBondContact CE1-NH2 2.88Å; H516-R528 PolarHBondContact ND1-NE 3.12Å; H516-R528 VanDerWaalsContact ND1-NE 3.15Å; H516-R528 PolarHBondContact NE2-NH2 3.07Å; H516-G529 VanDerWaalsContact CA-O 3.27Å; H516-G529 WeakPolarHBondContact CA-O 2.97Å; H516-E582 IonicContact CE1-OE1 3.37Å; H516-E582 PolarHBondContact CE1-OE1 2.85Å; H516-E582 IonicContact ND1-OE1 3.2Å; H516-E582 PolarHBondContact ND1-OE1 3.08Å; H516-E582 VanDerWaalsContact ND1-OE1 3.08Å
517	C	73.6	Confident	62.8	Low	21 Å²	21	56.9 Å²	56.9	14%	0.142	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.3	170.2	64.8	0	0	0	0	110.7	G529 C531 F579	C517-G529 PolarHBondContact N-O 2.9Å; C517-G529 PolarHBondContact O-N 3.02Å; C517-C531 HydrophobicContact CB-CB 3.55Å; C517-C531 WeakPolarHBondContact CB-SG 3.19Å; C517-C531 VanDerWaalsContact SG-CA 3.53Å; C517-C531 WeakPolarHBondContact SG-CB 3.14Å; C517-C531 PolarHBondContact SG-N 3.03Å; C517-C531 CovalentContact SG-SG 2Å; C517-C531 PolarHBondContact SG-SG 3.21Å; C517-F579 VanDerWaalsContact SG-CD2 3.56Å
518	L	65.3	Low	62.4	Low	79 Å²	79	61 Å²	61	41%	0.414	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.4	-179.3	-56.7	175.4	0	0	0	109.2	A520 E526 Y527 R528	L518-A520 PolarHBondContact O-N 2.88Å; L518-A520 VanDerWaalsContact O-N 3.09Å; L518-E526 HydrophobicContact CB-CB 4.31Å; L518-E526 HydrophobicContact CD1-CB 4.2Å; L518-E526 HydrophobicContact CD1-CG 4.28Å; L518-E526 HydrophobicContact CD2-CB 4.06Å; L518-E526 HydrophobicContact CG-CB 4.4Å; L518-Y527 WeakPolarHBondContact CA-O 3.3Å; L518-R528 HydrophobicContact CD2-CB 4.32Å
519	A	56.4	Low	62.2	Low	14 Å²	14	60.7 Å²	60.7	12%	0.116	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	93.5	168.7	0	0	0	0	0	109.1	G521 Y527 L565 F579	A519-G521 PolarHBondContact O-N 2.7Å; A519-Y527 PolarHBondContact N-O 3.04Å; A519-L565 HydrophobicContact CB-CD2 4.5Å; A519-F579 HydrophobicContact CB-CD1 4.31Å; A519-F579 HydrophobicContact CB-CD2 3.99Å; A519-F579 HydrophobicContact CB-CE1 4.08Å; A519-F579 HydrophobicContact CB-CE2 3.74Å; A519-F579 HydrophobicContact CB-CG 4.28Å; A519-F579 HydrophobicContact CB-CZ 3.8Å
520	A	49	Very low	62.1	Low	96 Å²	96	60.7 Å²	60.7	79%	0.793	33%	0.332	S	S	*	.			trans	-69.9	109.5	177.4	0	0	0	0	0	111	L518	L518-A520 PolarHBondContact O-N 2.88Å; L518-A520 VanDerWaalsContact O-N 3.09Å
521	G	44.2	Very low	62.3	Low	33 Å²	33	59.9 Å²	59.9	34%	0.34	33%	0.329	S	S	.	.			trans	-109.4	125.1	159.6	0	0	0	0	0	108.3	A519 K523 A524	A519-G521 PolarHBondContact O-N 2.7Å; G521-K523 PolarHBondContact O-N 3.21Å; G521-A524 PolarHBondContact O-N 3.43Å; G521-A524 VanDerWaalsContact O-N 3.14Å
522	S	37.6	Very low	62.6	Low	133 Å²	133	59.5 Å²	59.5	93%	0.93	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	0.6	-164.3	-40	0	0	0	0	118.6
523	K	40.8	Very low	63.2	Low	205 Å²	205	60.6 Å²	60.6	89%	0.891	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.8	21.6	-179	-65.4	-168.7	177	-176.3	0	114.4	G521	G521-K523 PolarHBondContact O-N 3.21Å
524	A	40.9	Very low	64.3	Low	26 Å²	26	57.3 Å²	57.3	22%	0.215	32%	0.32	C	S	.	.	S	Bend	trans	-144.7	155.5	-170.9	0	0	0	0	0	113.7	G521 E526	G521-A524 PolarHBondContact O-N 3.43Å; G521-A524 VanDerWaalsContact O-N 3.14Å; A524-E526 PolarHBondContact O-N 3.21Å
525	P	43.3	Very low	64.7	Low	79 Å²	79	57.5 Å²	57.5	51%	0.513	32%	0.318	S	S	.	.			trans	-53.4	134.8	-178.1	19.9	-32.6	0	0	0	111.8	Y527	P525-Y527 WeakPolarHBondContact O-CD2 3.42Å; P525-Y527 WeakPolarHBondContact O-CE2 3.05Å; P525-Y527 PolarHBondContact O-N 3.27Å
526	E	55.4	Low	65	Low	142 Å²	142	62.3 Å²	62.3	66%	0.664	34%	0.337	S	S	*	.			trans	-62.7	118.3	-177.7	-63.8	175.2	147.3	0	0	110.3	L518 A524 R528	L518-E526 HydrophobicContact CB-CB 4.31Å; L518-E526 HydrophobicContact CD1-CB 4.2Å; L518-E526 HydrophobicContact CD1-CG 4.28Å; L518-E526 HydrophobicContact CD2-CB 4.06Å; L518-E526 HydrophobicContact CG-CB 4.4Å; A524-E526 PolarHBondContact O-N 3.21Å; E526-R528 PolarHBondContact O-N 3.43Å
527	Y	60.9	Low	65.1	Low	59 Å²	59	64.3 Å²	64.3	23%	0.231	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	115.8	174.9	-65.7	-91.8	0	0	0	108.9	R456 L518 A519 P525 F579	R456-Y527 WeakPolarHBondContact CB-OH 3.38Å; R456-Y527 WeakPolarHBondContact CD-OH 3.19Å; L518-Y527 WeakPolarHBondContact CA-O 3.3Å; A519-Y527 PolarHBondContact N-O 3.04Å; P525-Y527 WeakPolarHBondContact O-CD2 3.42Å; P525-Y527 WeakPolarHBondContact O-CE2 3.05Å; P525-Y527 PolarHBondContact O-N 3.27Å; Y527-F579 WeakPolarHBondContact O-CE2 3.39Å; Y527-F579 WeakPolarHBondContact O-CZ 3.01Å
528	R	76.3	Confident	64.9	Low	132 Å²	132	73.2 Å²	73.2	50%	0.498	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	128.1	170.9	-163.5	180	172	164.8	-4.9	109.4	H516 L518 E526 E582	H516-R528 HydrophobicContact CB-CG 4.46Å; H516-R528 PolarHBondContact CD2-NH2 3.48Å; H516-R528 PolarHBondContact CE1-NE 2.93Å; H516-R528 VanDerWaalsContact CE1-NE 3.3Å; H516-R528 PolarHBondContact CE1-NH2 2.88Å; H516-R528 PolarHBondContact ND1-NE 3.12Å; H516-R528 VanDerWaalsContact ND1-NE 3.15Å; H516-R528 PolarHBondContact NE2-NH2 3.07Å; L518-R528 HydrophobicContact CD2-CB 4.32Å; E526-R528 PolarHBondContact O-N 3.43Å; R528-E582 WeakPolarHBondContact CD-OE1 3.39Å; R528-E582 VanDerWaalsContact CG-OE1 3.23Å; R528-E582 WeakPolarHBondContact CG-OE1 3.48Å; R528-E582 IonicContact CZ-OE1 3.68Å; R528-E582 IonicContact NE-OE1 3.3Å; R528-E582 PolarHBondContact NE-OE1 3.48Å
529	G	81.9	Confident	65.5	Low	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	-177.5	176.5	0	0	0	0	0	110.6	H516 C517 Y580	H516-G529 VanDerWaalsContact CA-O 3.27Å; H516-G529 WeakPolarHBondContact CA-O 2.97Å; C517-G529 PolarHBondContact N-O 2.9Å; C517-G529 PolarHBondContact O-N 3.02Å; G529-Y580 CarbonylContact C-O 3.55Å; G529-Y580 WeakPolarHBondContact CA-O 3.19Å
530	V	86.5	Confident	66.8	Low	1 Å²	1	73.2 Å²	73.2	1%	0.006	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	131.7	167.1	-176.7	0	0	0	0	108.5	P486 I511 A515 M547 Y580	P486-V530 HydrophobicContact CG-CG1 4.42Å; I511-V530 HydrophobicContact CD1-CG1 4.34Å; I511-V530 HydrophobicContact CG2-CG1 3.99Å; A515-V530 HydrophobicContact CB-CG1 4.49Å; A515-V530 VanDerWaalsContact O-CA 3.22Å; A515-V530 WeakPolarHBondContact O-CA 3.27Å; V530-M547 HydrophobicContact CB-SD 4.25Å; V530-M547 HydrophobicContact CG1-CE 4.21Å; V530-M547 HydrophobicContact CG1-SD 3.78Å; V530-Y580 PolarHBondContact N-O 2.87Å; V530-Y580 WeakPolarHBondContact O-CB 3.41Å; V530-Y580 PolarHBondContact O-N 3.34Å
531	C	85.8	Confident	68.6	Low	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.4	174.4	-83.9	0	0	0	0	111.7	T512 A515 C517 L577 G578	T512-C531 HydrophobicContact CG2-CB 4.4Å; T512-C531 PolarHBondContact N-O 3.28Å; T512-C531 PolarHBondContact OG1-O 2.59Å; A515-C531 PolarHBondContact O-N 2.79Å; C517-C531 HydrophobicContact CB-CB 3.55Å; C517-C531 WeakPolarHBondContact CB-SG 3.19Å; C517-C531 VanDerWaalsContact SG-CA 3.53Å; C517-C531 WeakPolarHBondContact SG-CB 3.14Å; C517-C531 PolarHBondContact SG-N 3.03Å; C517-C531 CovalentContact SG-SG 2Å; C517-C531 PolarHBondContact SG-SG 3.21Å; C531-L577 HydrophobicContact CB-CD1 4.43Å; C531-G578 WeakPolarHBondContact CA-O 3.44Å
532	A	87	Confident	70.8	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.1	171.5	0	0	0	0	0	110.3	V509 M510 I511 E534 M547 L577 G578 Y580	V509-A532 HydrophobicContact CB-CB 3.93Å; V509-A532 HydrophobicContact CG2-CB 3.71Å; M510-A532 CarbonylContact O-C 3.58Å; M510-A532 VanDerWaalsContact O-CA 3.29Å; M510-A532 WeakPolarHBondContact O-CA 3.15Å; I511-A532 HydrophobicContact CD1-CB 3.98Å; A532-E534 HydrophobicContact CB-CG 4.29Å; A532-E534 PolarHBondContact O-N 3.5Å; A532-M547 HydrophobicContact CB-CE 3.67Å; A532-L577 CarbonylContact O-C 3.53Å; A532-L577 WeakPolarHBondContact O-CA 3.21Å; A532-G578 PolarHBondContact N-O 3.47Å; A532-G578 VanDerWaalsContact N-O 3.14Å; A532-G578 PolarHBondContact O-N 3.32Å; A532-Y580 HydrophobicContact CB-CE2 4.48Å
533	I	82.2	Confident	73.4	Confident	31 Å²	31	64.2 Å²	64.2	16%	0.159	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.8	175.6	-56.3	170.5	0	0	0	107.9	M510 T512 Q575 L577	M510-I533 HydrophobicContact CB-CB 4.37Å; M510-I533 HydrophobicContact CB-CD1 4.28Å; M510-I533 HydrophobicContact CE-CB 4.15Å; M510-I533 HydrophobicContact CE-CD1 4.11Å; M510-I533 HydrophobicContact CE-CG2 4.06Å; M510-I533 PolarHBondContact O-N 3.33Å; T512-I533 HydrophobicContact CG2-CG1 4.3Å; I533-Q575 VanDerWaalsContact CG1-NE2 3.27Å; I533-Q575 HydrophobicContact CG2-CG 4.21Å; I533-Q575 VanDerWaalsContact CG2-NE2 3.29Å; I533-L577 HydrophobicContact CB-CD2 4.3Å; I533-L577 HydrophobicContact CG1-CD2 3.78Å
534	E	81.6	Confident	75.8	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.037	25%	0.253	C	S	.	.			trans	-141.2	129.5	-171.5	-70.4	178.9	-167.1	0	0	111.9	V509 A532 K536 Q542 Q564 N576 G578 Y580	V509-E534 HydrophobicContact CB-CG 4.43Å; V509-E534 HydrophobicContact CG1-CG 3.78Å; A532-E534 HydrophobicContact CB-CG 4.29Å; A532-E534 PolarHBondContact O-N 3.5Å; E534-K536 PolarHBondContact O-N 3.1Å; E534-Q542 PolarHBondContact OE2-NE2 2.87Å; E534-Q564 PolarHBondContact O-NE2 2.73Å; E534-N576 PolarHBondContact N-O 3.45Å; E534-N576 CarbonylContact O-C 3.53Å; E534-N576 WeakPolarHBondContact O-CB 3.18Å; E534-G578 WeakPolarHBondContact OE2-CA 3.02Å; E534-Y580 WeakPolarHBondContact OE1-CE2 2.92Å; E534-Y580 PolarHBondContact OE1-OH 3.47Å; E534-Y580 PolarHBondContact OE2-OH 3.23Å
535	E	73	Confident	78.4	Confident	80 Å²	80	53.2 Å²	53.2	37%	0.374	24%	0.242	S	C	.	.			trans	-88	104.7	171	-63.6	-162.6	160.2	0	0	110.2	K537 R1025	E535-K537 PolarHBondContact O-N 3.43Å; E535-K537 VanDerWaalsContact O-N 3.15Å; E535-R1025 IonicContact OE1-CZ 2.94Å; E535-R1025 IonicContact OE1-NE 2.85Å; E535-R1025 PolarHBondContact OE1-NE 3.22Å; E535-R1025 IonicContact OE1-NH2 3.59Å; E535-R1025 IonicContact OE2-CZ 3.03Å; E535-R1025 IonicContact OE2-NE 2.59Å; E535-R1025 IonicContact OE2-NH2 3.08Å; E535-R1025 PolarHBondContact OE2-NH2 2.01Å
536	K	70.1	Confident	80.9	Confident	112 Å²	112	49.4 Å²	49.4	49%	0.487	22%	0.218	S	C	.	.			trans	-70.6	117.9	178	176.2	174.1	-173.2	173.3	0	111.2	E534 Q564	E534-K536 PolarHBondContact O-N 3.1Å; K536-Q564 VanDerWaalsContact CB-CD 3.49Å
537	K	74.9	Confident	82.7	Confident	100 Å²	100	42.7 Å²	42.7	44%	0.435	19%	0.186	S	C	.	.			trans	-80.9	132.2	166.2	-55	-172.4	-155.8	161.7	0	109.4	E535 Q539 Y540	E535-K537 PolarHBondContact O-N 3.43Å; E535-K537 VanDerWaalsContact O-N 3.15Å; K537-Q539 PolarHBondContact O-N 3.01Å; K537-Y540 HydrophobicContact CB-CD1 4.12Å; K537-Y540 HydrophobicContact CB-CD2 3.9Å; K537-Y540 HydrophobicContact CB-CE1 4.31Å; K537-Y540 HydrophobicContact CB-CE2 4.12Å; K537-Y540 HydrophobicContact CB-CG 3.93Å; K537-Y540 HydrophobicContact CD-CD2 4.23Å; K537-Y540 HydrophobicContact CD-CE1 4.16Å; K537-Y540 HydrophobicContact CD-CE2 3.57Å; K537-Y540 HydrophobicContact CG-CD2 4.24Å; K537-Y540 HydrophobicContact CG-CE2 4.06Å; K537-Y540 PolarHBondContact NZ-OH 2.92Å; K537-Y540 PolarHBondContact O-N 3.46Å; K537-Y540 VanDerWaalsContact O-N 3.15Å
538	K	70.1	Confident	84.3	Confident	207 Å²	207	39.9 Å²	39.9	90%	0.9	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.9	-174.6	-73.5	-177.2	178.7	176.6	0	114.2
539	Q	77.5	Confident	85.1	Confident	61 Å²	61	33.6 Å²	33.6	29%	0.285	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-7.7	-174.7	-70.4	147.6	28.2	0	0	113.9	K499 R500 K537	K499-Q539 VanDerWaalsContact CB-O 3.29Å; K499-Q539 WeakPolarHBondContact CB-O 3.41Å; K499-Q539 WeakPolarHBondContact CD-O 3.42Å; K499-Q539 WeakPolarHBondContact CG-O 3.1Å; K499-Q539 PolarHBondContact N-O 3.14Å; K499-Q539 VanDerWaalsContact N-O 3.12Å; R500-Q539 HydrophobicContact CG-CB 4.42Å; R500-Q539 HydrophobicContact CG-CG 3.99Å; R500-Q539 VanDerWaalsContact CZ-CD 3.47Å; R500-Q539 VanDerWaalsContact NE-OE1 3.15Å; K537-Q539 PolarHBondContact O-N 3.01Å
540	Y	85	Confident	85.6	Confident	32 Å²	32	34.2 Å²	34.2	13%	0.125	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.5	-174.5	-71.7	5	0	0	0	111.3	H496 Y497 D498 D505 K537	H496-Y540 HydrophobicContact CB-CD2 3.63Å; H496-Y540 HydrophobicContact CB-CE2 4.35Å; H496-Y540 HydrophobicContact CB-CG 3.96Å; H496-Y540 AromaticContact CD2-CD2 3.97Å; H496-Y540 AromaticContact CG-CD2 3.52Å; H496-Y540 AromaticContact CG-CE2 3.93Å; H496-Y540 AromaticContact ND1-CD2 3.95Å; H496-Y540 AromaticContact ND1-CE2 3.87Å; Y497-Y540 CarbonylContact O-C 3.55Å; Y497-Y540 WeakPolarHBondContact O-CA 3.24Å; D498-Y540 HydrophobicContact CB-CD1 3.9Å; D498-Y540 HydrophobicContact CB-CE1 3.56Å; D498-Y540 VanDerWaalsContact CG-CE1 3.45Å; D498-Y540 WeakPolarHBondContact OD2-CE1 3.29Å; D505-Y540 PolarHBondContact OD2-OH 3.46Å; K537-Y540 HydrophobicContact CB-CD1 4.12Å; K537-Y540 HydrophobicContact CB-CD2 3.9Å; K537-Y540 HydrophobicContact CB-CE1 4.31Å; K537-Y540 HydrophobicContact CB-CE2 4.12Å; K537-Y540 HydrophobicContact CB-CG 3.93Å; K537-Y540 HydrophobicContact CD-CD2 4.23Å; K537-Y540 HydrophobicContact CD-CE1 4.16Å; K537-Y540 HydrophobicContact CD-CE2 3.57Å; K537-Y540 HydrophobicContact CG-CD2 4.24Å; K537-Y540 HydrophobicContact CG-CE2 4.06Å; K537-Y540 PolarHBondContact NZ-OH 2.92Å; K537-Y540 PolarHBondContact O-N 3.46Å; K537-Y540 VanDerWaalsContact O-N 3.15Å
541	I	86.4	Confident	85.6	Confident	15 Å²	15	35.1 Å²	35.1	8%	0.077	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	122.3	162.5	-55.5	175.5	0	0	0	106.8	T413 K414 I416 H496 Y497 K499	T413-I541 HydrophobicContact CG2-CD1 3.7Å; T413-I541 WeakPolarHBondContact O-CD1 3.46Å; K414-I541 WeakPolarHBondContact O-CG2 3.43Å; I416-I541 WeakPolarHBondContact CD1-O 3.44Å; H496-I541 WeakPolarHBondContact CA-O 3.37Å; Y497-I541 HydrophobicContact CD1-CD1 3.87Å; Y497-I541 HydrophobicContact CD1-CG1 4.33Å; Y497-I541 HydrophobicContact CE1-CD1 4.49Å; Y497-I541 PolarHBondContact N-O 2.66Å; Y497-I541 PolarHBondContact O-N 2.91Å; K499-I541 HydrophobicContact CD-CD1 4.34Å; K499-I541 HydrophobicContact CD-CG1 4.1Å; K499-I541 VanDerWaalsContact CE-CD1 3.46Å; K499-I541 HydrophobicContact CG-CD1 3.96Å; K499-I541 HydrophobicContact CG-CG1 3.87Å
542	Q	90.8	Very high	85.5	Confident	13 Å²	13	43.3 Å²	43.3	6%	0.061	20%	0.196	C	C	.	.			trans	-126	-7.7	178.1	-163.9	179	4.2	0	0	111.8	E534 G544 A545 Y561 Y580	E534-Q542 PolarHBondContact OE2-NE2 2.87Å; Q542-G544 PolarHBondContact O-N 3.02Å; Q542-A545 HydrophobicContact CG-CB 4.05Å; Q542-A545 WeakPolarHBondContact O-CB 3.35Å; Q542-A545 PolarHBondContact O-N 3.26Å; Q542-Y561 HydrophobicContact CB-CD1 4.05Å; Q542-Y561 HydrophobicContact CB-CE1 3.99Å; Q542-Y561 HydrophobicContact CB-CG 4.38Å; Q542-Y561 HydrophobicContact CG-CD1 3.97Å; Q542-Y561 HydrophobicContact CG-CD2 3.86Å; Q542-Y561 HydrophobicContact CG-CE1 4.2Å; Q542-Y561 HydrophobicContact CG-CE2 4.06Å; Q542-Y561 HydrophobicContact CG-CG 3.78Å; Q542-Y561 WeakPolarHBondContact O-CB 3.39Å; Q542-Y561 VanDerWaalsContact O-CD1 3.25Å; Q542-Y561 WeakPolarHBondContact O-CD1 3.43Å; Q542-Y580 PolarHBondContact NE2-OH 2.85Å
543	L	91.1	Very high	85.3	Confident	45 Å²	45	45.1 Å²	45.1	24%	0.236	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	124.1	-178.4	-170.9	63.6	0	0	0	110.8	C415 I416 A438 D440 A545 L562	C415-L543 WeakPolarHBondContact CA-O 3.26Å; C415-L543 VanDerWaalsContact CB-O 3.32Å; C415-L543 WeakPolarHBondContact CB-O 3.48Å; I416-L543 PolarHBondContact N-O 3.05Å; A438-L543 HydrophobicContact CB-CD1 3.81Å; A438-L543 HydrophobicContact CB-CG 3.95Å; D440-L543 HydrophobicContact CB-CD1 4.38Å; D440-L543 HydrophobicContact CB-CD2 3.9Å; L543-A545 VanDerWaalsContact C-N 3.28Å; L543-A545 PolarHBondContact O-N 3.14Å; L543-L562 VanDerWaalsContact CD1-O 3.32Å; L543-L562 WeakPolarHBondContact CD1-O 3.23Å
544	G	92	Very high	85.7	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	0.3	-176.9	0	0	0	0	0	115.5	I416 A438 Q542 Y561	I416-G544 CarbonylContact C-O 3.53Å; I416-G544 CarbonylContact O-C 3.52Å; I416-G544 WeakPolarHBondContact O-CA 2.82Å; I416-G544 VanDerWaalsContact O-O 3.05Å; A438-G544 VanDerWaalsContact N-CA 3.3Å; Q542-G544 PolarHBondContact O-N 3.02Å; G544-Y561 PolarHBondContact N-O 2.55Å
545	A	94.1	Very high	86.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.214	C	C	.	.			trans	-63	142.2	177.9	0	0	0	0	0	111.9	I416 T495 Q542 L543 V560 Y561	I416-A545 HydrophobicContact CB-CB 4.17Å; I416-A545 HydrophobicContact CD1-CB 4.3Å; I416-A545 HydrophobicContact CG2-CB 4.19Å; T495-A545 WeakPolarHBondContact O-CB 3.44Å; Q542-A545 HydrophobicContact CG-CB 4.05Å; Q542-A545 WeakPolarHBondContact O-CB 3.35Å; Q542-A545 PolarHBondContact O-N 3.26Å; L543-A545 VanDerWaalsContact C-N 3.28Å; L543-A545 PolarHBondContact O-N 3.14Å; A545-V560 WeakPolarHBondContact O-CA 3.02Å; A545-Y561 PolarHBondContact O-N 2.99Å
546	P	95.4	Very high	87.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	145	174.8	35.6	-37.7	0	0	0	111.4	I548 Q557	P546-I548 HydrophobicContact CB-CD1 3.62Å; P546-I548 HydrophobicContact CB-CG1 4Å; P546-I548 HydrophobicContact CG-CD1 4.06Å; P546-I548 HydrophobicContact CG-CG1 3.99Å; P546-Q557 HydrophobicContact CB-CG 4.03Å
547	M	94.3	Very high	88.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	111.6	158.9	176.2	-178.4	-74.9	0	0	108.3	P486 I511 V530 A532 Q557 Y558 G559 Y580	P486-M547 HydrophobicContact CG-SD 4.46Å; I511-M547 HydrophobicContact CD1-CE 3.76Å; I511-M547 HydrophobicContact CD1-SD 3.64Å; V530-M547 HydrophobicContact CB-SD 4.25Å; V530-M547 HydrophobicContact CG1-CE 4.21Å; V530-M547 HydrophobicContact CG1-SD 3.78Å; A532-M547 HydrophobicContact CB-CE 3.67Å; M547-Q557 WeakPolarHBondContact O-CA 3.46Å; M547-Y558 PolarHBondContact O-N 3.43Å; M547-G559 PolarHBondContact N-O 3.17Å; M547-Y580 HydrophobicContact CB-CD1 3.53Å; M547-Y580 HydrophobicContact CB-CE1 3.73Å; M547-Y580 HydrophobicContact CB-CG 4.05Å; M547-Y580 HydrophobicContact CE-CD1 4.13Å; M547-Y580 HydrophobicContact CE-CD2 3.22Å; M547-Y580 HydrophobicContact CE-CE1 4.28Å; M547-Y580 HydrophobicContact CE-CE2 3.42Å; M547-Y580 VanDerWaalsContact CE-CE2 3.42Å; M547-Y580 HydrophobicContact CE-CG 3.62Å
548	I	94.9	Very high	89.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.3	-177	-57.8	-52.9	0	0	0	109.5	W401 V477 C492 Y493 P546 L550 A555 Y556 Q557	W401-I548 HydrophobicContact CZ2-CG2 4.06Å; V477-I548 HydrophobicContact CB-CD1 4.48Å; V477-I548 HydrophobicContact CG1-CD1 4.22Å; V477-I548 HydrophobicContact CG2-CD1 3.86Å; C492-I548 CarbonylContact C-O 3.57Å; C492-I548 WeakPolarHBondContact CA-O 3.41Å; Y493-I548 PolarHBondContact N-O 3.43Å; Y493-I548 PolarHBondContact O-N 2.65Å; P546-I548 HydrophobicContact CB-CD1 3.62Å; P546-I548 HydrophobicContact CB-CG1 4Å; P546-I548 HydrophobicContact CG-CD1 4.06Å; P546-I548 HydrophobicContact CG-CG1 3.99Å; I548-L550 HydrophobicContact CG2-CD2 4.4Å; I548-A555 HydrophobicContact CG2-CB 3.74Å; I548-Y556 CarbonylContact C-O 3.55Å; I548-Y556 WeakPolarHBondContact CA-O 3.47Å; I548-Q557 HydrophobicContact CD1-CB 3.67Å; I548-Q557 HydrophobicContact CD1-CG 4.03Å
549	C	93.4	Very high	90.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.8	176.4	-53.9	0	0	0	0	110.6	P486 A490 S491 C492 Y556 Y558	P486-C549 HydrophobicContact CB-CB 4.3Å; P486-C549 VanDerWaalsContact CG-SG 3.55Å; A490-C549 HydrophobicContact CB-CB 4.04Å; S491-C549 WeakPolarHBondContact O-CA 3.17Å; C492-C549 HydrophobicContact CB-CB 4.1Å; C492-C549 WeakPolarHBondContact CB-SG 3.47Å; C492-C549 WeakPolarHBondContact SG-CB 3.41Å; C492-C549 CovalentContact SG-SG 2.04Å; C492-C549 PolarHBondContact SG-SG 3.32Å; C549-Y556 PolarHBondContact N-O 3.12Å; C549-Y556 PolarHBondContact O-N 2.84Å; C549-Y558 HydrophobicContact CB-CD2 3.74Å; C549-Y558 HydrophobicContact CB-CE2 3.69Å
550	L	90.9	Very high	91.2	Very high	13 Å²	13	21.9 Å²	21.9	7%	0.068	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117.2	177.4	-52.3	-170.4	0	0	0	108.8	V386 E387 V390 A490 S491 Y493 I548 A555	V386-L550 HydrophobicContact CB-CD2 4.27Å; V386-L550 HydrophobicContact CG1-CD1 4.24Å; V386-L550 HydrophobicContact CG1-CD2 3.37Å; V386-L550 HydrophobicContact CG1-CG 4.45Å; E387-L550 HydrophobicContact CG-CD1 4.03Å; V390-L550 HydrophobicContact CG2-CD1 4.26Å; A490-L550 WeakPolarHBondContact CA-O 3.16Å; A490-L550 WeakPolarHBondContact CB-O 3.18Å; S491-L550 PolarHBondContact O-N 3.42Å; Y493-L550 HydrophobicContact CD2-CD1 4.38Å; Y493-L550 HydrophobicContact CD2-CG 4.19Å; Y493-L550 HydrophobicContact CE2-CD1 3.78Å; Y493-L550 HydrophobicContact CE2-CG 3.96Å; I548-L550 HydrophobicContact CG2-CD2 4.4Å; L550-A555 HydrophobicContact CD2-CB 3.92Å
551	V	88.1	Confident	91.6	Very high	21 Å²	21	20.7 Å²	20.7	13%	0.127	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	110.6	-178.9	-175.9	0	0	0	0	107.7	P487 F489 A490 G553 R554 Y556	P487-V551 HydrophobicContact CG-CG1 3.98Å; P487-V551 HydrophobicContact CG-CG2 3.76Å; F489-V551 HydrophobicContact CE2-CG1 3.84Å; F489-V551 HydrophobicContact CZ-CG1 4Å; A490-V551 HydrophobicContact CB-CG2 3.94Å; V551-G553 VanDerWaalsContact C-N 3.34Å; V551-G553 PolarHBondContact O-N 3.06Å; V551-R554 PolarHBondContact N-O 2.87Å; V551-R554 PolarHBondContact O-N 2.98Å; V551-Y556 HydrophobicContact CB-CD2 3.9Å; V551-Y556 HydrophobicContact CB-CE2 3.97Å; V551-Y556 HydrophobicContact CG2-CD2 4.07Å
552	K	83.2	Confident	91.7	Very high	171 Å²	171	20.4 Å²	20.4	74%	0.743	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	47.1	179.6	-57.6	-179	178.8	-178.6	0	113	F489 R554	F489-K552 HydrophobicContact CE2-CG 4.41Å; K552-R554 VanDerWaalsContact C-N 3.34Å; K552-R554 PolarHBondContact O-N 2.94Å
553	G	83.3	Confident	91.4	Very high	39 Å²	39	21.1 Å²	21.1	40%	0.402	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	5.3	177.8	0	0	0	0	0	115.9	E387 V551	E387-G553 WeakPolarHBondContact OE1-CA 3.29Å; V551-G553 VanDerWaalsContact C-N 3.34Å; V551-G553 PolarHBondContact O-N 3.06Å
554	R	90	Very high	91	Very high	48 Å²	48	21.2 Å²	21.2	18%	0.181	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	140.3	-178.7	-173.5	171.1	-70.3	-166.1	-6.2	111.6	Y425 V551 K552 Y556	Y425-R554 PolarHBondContact O-NH1 2.85Å; V551-R554 PolarHBondContact N-O 2.87Å; V551-R554 PolarHBondContact O-N 2.98Å; K552-R554 VanDerWaalsContact C-N 3.34Å; K552-R554 PolarHBondContact O-N 2.94Å; R554-Y556 HydrophobicContact CB-CE2 3.89Å; R554-Y556 WeakPolarHBondContact CD-OH 3.11Å; R554-Y556 HydrophobicContact CG-CE2 3.88Å; R554-Y556 WeakPolarHBondContact O-CD2 3.22Å
555	A	93.9	Very high	90.3	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.5	178.6	0	0	0	0	0	113.1	G377 V386 W401 V477 C478 I548 L550	G377-A555 PolarHBondContact O-N 2.86Å; V386-A555 HydrophobicContact CG1-CB 4.09Å; W401-A555 HydrophobicContact CH2-CB 3.26Å; W401-A555 HydrophobicContact CZ2-CB 3.41Å; W401-A555 VanDerWaalsContact CZ2-CB 3.41Å; W401-A555 HydrophobicContact CZ3-CB 4.11Å; V477-A555 HydrophobicContact CG2-CB 3.87Å; V477-A555 WeakPolarHBondContact CG2-O 3.27Å; C478-A555 PolarHBondContact N-O 3.03Å; I548-A555 HydrophobicContact CG2-CB 3.74Å; L550-A555 HydrophobicContact CD2-CB 3.92Å
556	Y	94.9	Very high	89.3	Confident	41 Å²	41	26.4 Å²	26.4	16%	0.161	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.6	173.8	-64.6	-93.4	0	0	0	111	C478 I548 C549 V551 R554	C478-Y556 HydrophobicContact CB-CD1 3.59Å; C478-Y556 HydrophobicContact CB-CE1 3.79Å; C478-Y556 HydrophobicContact CB-CG 4.32Å; C478-Y556 CarbonylContact O-C 3.48Å; C478-Y556 WeakPolarHBondContact O-CA 3.41Å; I548-Y556 CarbonylContact C-O 3.55Å; I548-Y556 WeakPolarHBondContact CA-O 3.47Å; C549-Y556 PolarHBondContact N-O 3.12Å; C549-Y556 PolarHBondContact O-N 2.84Å; V551-Y556 HydrophobicContact CB-CD2 3.9Å; V551-Y556 HydrophobicContact CB-CE2 3.97Å; V551-Y556 HydrophobicContact CG2-CD2 4.07Å; R554-Y556 HydrophobicContact CB-CE2 3.89Å; R554-Y556 WeakPolarHBondContact CD-OH 3.11Å; R554-Y556 HydrophobicContact CG-CE2 3.88Å; R554-Y556 WeakPolarHBondContact O-CD2 3.22Å
557	Q	95.5	Very high	87.9	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.5	172.4	-177.7	174.6	-3.2	0	0	110.3	S418 V420 V477 C478 A480 P546 M547 I548 I583	S418-Q557 PolarHBondContact OG-NE2 2.76Å; S418-Q557 PolarHBondContact OG-OE1 2.83Å; V420-Q557 VanDerWaalsContact CG1-OE1 3.26Å; V477-Q557 HydrophobicContact CG1-CB 4.01Å; V477-Q557 HydrophobicContact CG2-CB 4.5Å; C478-Q557 PolarHBondContact O-N 3.33Å; A480-Q557 VanDerWaalsContact CB-O 3.23Å; A480-Q557 WeakPolarHBondContact CB-O 3.25Å; A480-Q557 PolarHBondContact N-O 3.38Å; P546-Q557 HydrophobicContact CB-CG 4.03Å; M547-Q557 WeakPolarHBondContact O-CA 3.46Å; I548-Q557 HydrophobicContact CD1-CB 3.67Å; I548-Q557 HydrophobicContact CD1-CG 4.03Å; Q557-I583 WeakPolarHBondContact O-CD1 2.96Å
558	Y	93.2	Very high	86.6	Confident	21 Å²	21	36.4 Å²	36.4	8%	0.082	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-25.8	179.4	-79.4	-93.1	0	0	0	113.5	A480 S484 V485 P486 P487 M547 C549	A480-Y558 HydrophobicContact CB-CD1 3.51Å; A480-Y558 HydrophobicContact CB-CD2 3.98Å; A480-Y558 HydrophobicContact CB-CE1 3.52Å; A480-Y558 HydrophobicContact CB-CE2 3.98Å; A480-Y558 HydrophobicContact CB-CG 3.75Å; S484-Y558 WeakPolarHBondContact OG-CE1 3.5Å; V485-Y558 WeakPolarHBondContact O-CE1 3.05Å; P486-Y558 HydrophobicContact CB-CD2 4.4Å; P486-Y558 HydrophobicContact CB-CE1 4.47Å; P486-Y558 HydrophobicContact CB-CE2 4.37Å; P486-Y558 HydrophobicContact CB-CG 4.47Å; P486-Y558 VanDerWaalsContact CD-CD1 3.48Å; P486-Y558 HydrophobicContact CG-CD1 3.79Å; P486-Y558 HydrophobicContact CG-CD2 3.94Å; P486-Y558 HydrophobicContact CG-CE1 4.22Å; P486-Y558 HydrophobicContact CG-CE2 4.37Å; P486-Y558 HydrophobicContact CG-CG 3.63Å; P486-Y558 VanDerWaalsContact N-CE1 3.25Å; P487-Y558 VanDerWaalsContact CD-OH 3.24Å; P487-Y558 WeakPolarHBondContact CD-OH 3.27Å; M547-Y558 PolarHBondContact O-N 3.43Å; C549-Y558 HydrophobicContact CB-CD2 3.74Å; C549-Y558 HydrophobicContact CB-CE2 3.69Å
559	G	92.4	Very high	84.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	173.9	-176.5	0	0	0	0	0	114.3	M547 S581	M547-G559 PolarHBondContact N-O 3.17Å; G559-S581 WeakPolarHBondContact CA-O 3.48Å
560	V	93.1	Very high	83	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.8	177.9	-179.8	0	0	0	0	108.6	I436 I459 A545 L562 Y580 S581 I583	I436-V560 HydrophobicContact CG2-CG2 3.5Å; I436-V560 VanDerWaalsContact CG2-CG2 3.5Å; I459-V560 HydrophobicContact CD1-CB 4.13Å; I459-V560 HydrophobicContact CD1-CG2 3.86Å; I459-V560 HydrophobicContact CG1-CB 4.06Å; I459-V560 HydrophobicContact CG1-CG2 4.1Å; I459-V560 HydrophobicContact CG2-CG2 4.26Å; A545-V560 WeakPolarHBondContact O-CA 3.02Å; V560-L562 HydrophobicContact CG1-CD2 4.33Å; V560-L562 PolarHBondContact O-N 3.07Å; V560-Y580 CarbonylContact O-C 3.54Å; V560-Y580 VanDerWaalsContact O-CA 3.3Å; V560-Y580 WeakPolarHBondContact O-CA 3.44Å; V560-S581 PolarHBondContact N-O 2.92Å; V560-S581 PolarHBondContact O-N 3.07Å; V560-I583 HydrophobicContact CG2-CG2 4.4Å
561	Y	92.8	Very high	81.4	Confident	8 Å²	8	46.2 Å²	46.2	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	122.6	-178.9	-177.1	-87.3	0	0	0	110.8	Q542 G544 A545 N563 Q564 Y580	Q542-Y561 HydrophobicContact CB-CD1 4.05Å; Q542-Y561 HydrophobicContact CB-CE1 3.99Å; Q542-Y561 HydrophobicContact CB-CG 4.38Å; Q542-Y561 HydrophobicContact CG-CD1 3.97Å; Q542-Y561 HydrophobicContact CG-CD2 3.86Å; Q542-Y561 HydrophobicContact CG-CE1 4.2Å; Q542-Y561 HydrophobicContact CG-CE2 4.06Å; Q542-Y561 HydrophobicContact CG-CG 3.78Å; Q542-Y561 WeakPolarHBondContact O-CB 3.39Å; Q542-Y561 VanDerWaalsContact O-CD1 3.25Å; Q542-Y561 WeakPolarHBondContact O-CD1 3.43Å; G544-Y561 PolarHBondContact N-O 2.55Å; A545-Y561 PolarHBondContact O-N 2.99Å; Y561-N563 WeakPolarHBondContact CE2-O 3.29Å; Y561-Q564 WeakPolarHBondContact OH-CB 3.19Å; Y561-Q564 PolarHBondContact OH-N 2.86Å; Y561-Y580 HydrophobicContact CD2-CE1 4.07Å; Y561-Y580 AromaticContact CD2-CE2 3.92Å; Y561-Y580 HydrophobicContact CD2-CE2 3.92Å; Y561-Y580 AromaticContact CD2-CZ 3.63Å; Y561-Y580 HydrophobicContact CG-CE1 4.31Å; Y561-Y580 VanDerWaalsContact N-CD1 3.29Å
562	L	87.9	Confident	79.9	Confident	9 Å²	9	53 Å²	53	5%	0.047	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-37.7	177.3	-58.8	-169.3	0	0	0	112.5	A438 R457 G458 L543 V560 F579	A438-L562 HydrophobicContact CB-CD2 3.66Å; R457-L562 HydrophobicContact CB-CD1 4.25Å; G458-L562 WeakPolarHBondContact O-CD2 3.39Å; L543-L562 VanDerWaalsContact CD1-O 3.32Å; L543-L562 WeakPolarHBondContact CD1-O 3.23Å; V560-L562 HydrophobicContact CG1-CD2 4.33Å; V560-L562 PolarHBondContact O-N 3.07Å; L562-F579 HydrophobicContact CB-CD1 4.33Å; L562-F579 HydrophobicContact CD1-CE1 4.4Å; L562-F579 PolarHBondContact N-O 3.46Å
563	N	84.2	Confident	78.6	Confident	27 Å²	27	46.7 Å²	46.7	14%	0.144	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	172.8	-179	62.5	-56.8	0	0	0	111.6	Y561 F579	Y561-N563 WeakPolarHBondContact CE2-O 3.29Å; N563-F579 WeakPolarHBondContact O-CB 3.38Å; N563-F579 PolarHBondContact O-N 3.49Å; N563-F579 VanDerWaalsContact OD1-CD1 3.26Å; N563-F579 WeakPolarHBondContact OD1-CD1 3.17Å
564	Q	82.7	Confident	77.9	Confident	47 Å²	47	51.4 Å²	51.4	22%	0.22	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.5	169	-169.8	168	42.7	0	0	109.7	E534 K536 Y561 N576 L577	E534-Q564 PolarHBondContact O-NE2 2.73Å; K536-Q564 VanDerWaalsContact CB-CD 3.49Å; Y561-Q564 WeakPolarHBondContact OH-CB 3.19Å; Y561-Q564 PolarHBondContact OH-N 2.86Å; Q564-N576 VanDerWaalsContact CD-CB 3.48Å; Q564-N576 HydrophobicContact CG-CB 3.86Å; Q564-L577 CarbonylContact C-O 3.59Å; Q564-L577 WeakPolarHBondContact CA-O 3.35Å; Q564-L577 WeakPolarHBondContact CG-O 3.46Å
565	L	77.8	Confident	77	Confident	37 Å²	37	49.9 Å²	49.9	19%	0.194	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	146	167.3	-52.2	174	0	0	0	107.9	A519 N576 L577 F579	A519-L565 HydrophobicContact CB-CD2 4.5Å; L565-N576 CarbonylContact O-C 3.5Å; L565-N576 WeakPolarHBondContact O-CA 3.49Å; L565-L577 HydrophobicContact CB-CB 4.31Å; L565-L577 PolarHBondContact N-O 2.92Å; L565-L577 PolarHBondContact O-N 2.88Å; L565-F579 HydrophobicContact CD1-CB 4.13Å; L565-F579 HydrophobicContact CD1-CD2 4.13Å; L565-F579 HydrophobicContact CG-CB 4.07Å
566	S	72.8	Confident	76.4	Confident	72 Å²	72	52.1 Å²	52.1	50%	0.503	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117	176.1	-163.9	0	0	0	0	108.3	N576	S566-N576 PolarHBondContact OG-OD1 2.85Å
567	L	67.5	Low	75.8	Confident	69 Å²	69	50.6 Å²	50.6	36%	0.361	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	119.6	174.9	-64	179.6	0	0	0	108.2	I569 Q575 L577	L567-I569 PolarHBondContact O-N 2.97Å; L567-Q575 PolarHBondContact N-O 3.38Å; L567-Q575 PolarHBondContact O-N 2.9Å; L567-L577 HydrophobicContact CD1-CD1 3.41Å; L567-L577 VanDerWaalsContact CD1-CD1 3.41Å; L567-L577 HydrophobicContact CD1-CG 4.14Å; L567-L577 HydrophobicContact CG-CD1 4.05Å
568	K	65.6	Low	75.3	Confident	142 Å²	142	50.6 Å²	50.6	62%	0.617	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	107.3	172.5	-170.3	-179.3	179.9	-171.8	0	107.3	N570	K568-N570 VanDerWaalsContact CE-O 3.22Å; K568-N570 WeakPolarHBondContact CE-O 3.17Å; K568-N570 WeakPolarHBondContact CG-O 3.05Å
569	I	58.8	Low	75.1	Confident	19 Å²	19	49.7 Å²	49.7	10%	0.097	24%	0.243	C	C	.	.			trans	-72.6	-56.2	171.3	-62.1	-176.5	0	0	0	107	L567 V573 Q575 T1020 M1026 S1087 S1088	L567-I569 PolarHBondContact O-N 2.97Å; I569-V573 HydrophobicContact CB-CG1 4.43Å; I569-V573 HydrophobicContact CD1-CG1 4.18Å; I569-V573 PolarHBondContact N-O 3.04Å; I569-V573 VanDerWaalsContact N-O 3.14Å; I569-Q575 HydrophobicContact CD1-CB 3.7Å; I569-Q575 HydrophobicContact CG1-CB 3.94Å; I569-T1020 HydrophobicContact CG1-CG2 4.44Å; I569-M1026 HydrophobicContact CD1-CE 3.51Å; I569-S1087 WeakPolarHBondContact CG2-OG 3.44Å; I569-S1088 PolarHBondContact O-OG 2.8Å
570	N	54.7	Low	75	Confident	26 Å²	26	49.7 Å²	49.7	14%	0.139	24%	0.243	C	C	.	.	S	Bend	trans	-144.8	-168	176.7	68.6	25.9	0	0	0	112.6	K568 K572 V573 S1088	K568-N570 VanDerWaalsContact CE-O 3.22Å; K568-N570 WeakPolarHBondContact CE-O 3.17Å; K568-N570 WeakPolarHBondContact CG-O 3.05Å; N570-K572 VanDerWaalsContact C-N 3.33Å; N570-K572 PolarHBondContact O-N 2.83Å; N570-K572 WeakPolarHBondContact OD1-CA 3.24Å; N570-K572 PolarHBondContact OD1-N 3.08Å; N570-V573 PolarHBondContact N-O 3.3Å; N570-V573 VanDerWaalsContact N-O 3.11Å; N570-V573 WeakPolarHBondContact OD1-CA 3.39Å; N570-V573 VanDerWaalsContact OD1-CB 3.32Å; N570-V573 WeakPolarHBondContact OD1-CB 3.43Å; N570-V573 WeakPolarHBondContact OD1-CG2 3.43Å; N570-V573 PolarHBondContact OD1-N 2.94Å; N570-S1088 WeakPolarHBondContact CB-OG 3.43Å; N570-S1088 PolarHBondContact ND2-N 3.11Å
571	E	57.7	Low	74.8	Confident	173 Å²	173	50.6 Å²	50.6	81%	0.808	25%	0.249	S	C	*	.	S	Bend	trans	-64.9	-34.2	179.5	-61.5	-162.9	152.5	0	0	113.8
572	K	56.4	Low	74.3	Confident	163 Å²	163	51.5 Å²	51.5	71%	0.709	25%	0.253	S	S	*	.	S	Bend	trans	-94.4	-26.3	-176.5	-64.5	179.3	-179.4	172.3	0	113.3	N570 E898	N570-K572 VanDerWaalsContact C-N 3.33Å; N570-K572 PolarHBondContact O-N 2.83Å; N570-K572 WeakPolarHBondContact OD1-CA 3.24Å; N570-K572 PolarHBondContact OD1-N 3.08Å; K572-E898 IonicContact NZ-OE1 2.86Å; K572-E898 PolarHBondContact NZ-OE1 3.22Å
573	V	55	Low	74.2	Confident	40 Å²	40	51.3 Å²	51.3	24%	0.242	25%	0.252	C	S	.	.			trans	-121.4	120.1	-167.9	-174.8	0	0	0	0	110.2	I569 N570 M1026	I569-V573 HydrophobicContact CB-CG1 4.43Å; I569-V573 HydrophobicContact CD1-CG1 4.18Å; I569-V573 PolarHBondContact N-O 3.04Å; I569-V573 VanDerWaalsContact N-O 3.14Å; N570-V573 PolarHBondContact N-O 3.3Å; N570-V573 VanDerWaalsContact N-O 3.11Å; N570-V573 WeakPolarHBondContact OD1-CA 3.39Å; N570-V573 VanDerWaalsContact OD1-CB 3.32Å; N570-V573 WeakPolarHBondContact OD1-CB 3.43Å; N570-V573 WeakPolarHBondContact OD1-CG2 3.43Å; N570-V573 PolarHBondContact OD1-N 2.94Å; V573-M1026 HydrophobicContact CG1-CE 4.03Å
574	K	68	Low	74.3	Confident	138 Å²	138	51.5 Å²	51.5	60%	0.6	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.1	169.9	-64.4	179.3	-177.9	177.7	0	108.2
575	Q	72	Confident	74.2	Confident	15 Å²	15	50.8 Å²	50.8	7%	0.07	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	127.3	171.6	-176.9	170.3	12.6	0	0	108.5	I533 L567 I569 L577 T1020	I533-Q575 VanDerWaalsContact CG1-NE2 3.27Å; I533-Q575 HydrophobicContact CG2-CG 4.21Å; I533-Q575 VanDerWaalsContact CG2-NE2 3.29Å; L567-Q575 PolarHBondContact N-O 3.38Å; L567-Q575 PolarHBondContact O-N 2.9Å; I569-Q575 HydrophobicContact CD1-CB 3.7Å; I569-Q575 HydrophobicContact CG1-CB 3.94Å; Q575-L577 HydrophobicContact CG-CD2 4.22Å; Q575-T1020 VanDerWaalsContact OE1-CA 3.3Å
576	N	80.9	Confident	74.7	Confident	47 Å²	47	49 Å²	49	25%	0.251	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	138.1	175.7	-50.7	-60	0	0	0	109.7	E534 Q564 L565 S566	E534-N576 PolarHBondContact N-O 3.45Å; E534-N576 CarbonylContact O-C 3.53Å; E534-N576 WeakPolarHBondContact O-CB 3.18Å; Q564-N576 VanDerWaalsContact CD-CB 3.48Å; Q564-N576 HydrophobicContact CG-CB 3.86Å; L565-N576 CarbonylContact O-C 3.5Å; L565-N576 WeakPolarHBondContact O-CA 3.49Å; S566-N576 PolarHBondContact OG-OD1 2.85Å
577	L	81.9	Confident	75.4	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.7	178.8	-56.5	179.3	0	0	0	109	T512 C531 A532 I533 Q564 L565 L567 Q575	T512-L577 HydrophobicContact CG2-CD2 4.41Å; C531-L577 HydrophobicContact CB-CD1 4.43Å; A532-L577 CarbonylContact O-C 3.53Å; A532-L577 WeakPolarHBondContact O-CA 3.21Å; I533-L577 HydrophobicContact CB-CD2 4.3Å; I533-L577 HydrophobicContact CG1-CD2 3.78Å; Q564-L577 CarbonylContact C-O 3.59Å; Q564-L577 WeakPolarHBondContact CA-O 3.35Å; Q564-L577 WeakPolarHBondContact CG-O 3.46Å; L565-L577 HydrophobicContact CB-CB 4.31Å; L565-L577 PolarHBondContact N-O 2.92Å; L565-L577 PolarHBondContact O-N 2.88Å; L567-L577 HydrophobicContact CD1-CD1 3.41Å; L567-L577 VanDerWaalsContact CD1-CD1 3.41Å; L567-L577 HydrophobicContact CD1-CG 4.14Å; L567-L577 HydrophobicContact CG-CD1 4.05Å; Q575-L577 HydrophobicContact CG-CD2 4.22Å
578	G	86.4	Confident	76.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.4	165.8	0	0	0	0	0	109.8	C531 A532 E534	C531-G578 WeakPolarHBondContact CA-O 3.44Å; A532-G578 PolarHBondContact N-O 3.47Å; A532-G578 VanDerWaalsContact N-O 3.14Å; A532-G578 PolarHBondContact O-N 3.32Å; E534-G578 WeakPolarHBondContact OE2-CA 3.02Å
579	F	88.8	Confident	77	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.013	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	119.7	174.9	176.5	-92.2	0	0	0	110.2	C517 A519 Y527 L562 N563 L565	C517-F579 VanDerWaalsContact SG-CD2 3.56Å; A519-F579 HydrophobicContact CB-CD1 4.31Å; A519-F579 HydrophobicContact CB-CD2 3.99Å; A519-F579 HydrophobicContact CB-CE1 4.08Å; A519-F579 HydrophobicContact CB-CE2 3.74Å; A519-F579 HydrophobicContact CB-CG 4.28Å; A519-F579 HydrophobicContact CB-CZ 3.8Å; Y527-F579 WeakPolarHBondContact O-CE2 3.39Å; Y527-F579 WeakPolarHBondContact O-CZ 3.01Å; L562-F579 HydrophobicContact CB-CD1 4.33Å; L562-F579 HydrophobicContact CD1-CE1 4.4Å; L562-F579 PolarHBondContact N-O 3.46Å; N563-F579 WeakPolarHBondContact O-CB 3.38Å; N563-F579 PolarHBondContact O-N 3.49Å; N563-F579 VanDerWaalsContact OD1-CD1 3.26Å; N563-F579 WeakPolarHBondContact OD1-CD1 3.17Å; L565-F579 HydrophobicContact CD1-CB 4.13Å; L565-F579 HydrophobicContact CD1-CD2 4.13Å; L565-F579 HydrophobicContact CG-CB 4.07Å
580	Y	90.6	Very high	78.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.8	179.7	-64.1	-103.2	0	0	0	109.5	V494 G529 V530 A532 E534 Q542 M547 V560 Y561	V494-Y580 VanDerWaalsContact CB-OH 3.27Å; V494-Y580 WeakPolarHBondContact CB-OH 3.45Å; V494-Y580 HydrophobicContact CG1-CE1 4.14Å; V494-Y580 HydrophobicContact CG1-CE2 4.42Å; V494-Y580 WeakPolarHBondContact CG1-OH 3.42Å; G529-Y580 CarbonylContact C-O 3.55Å; G529-Y580 WeakPolarHBondContact CA-O 3.19Å; V530-Y580 PolarHBondContact N-O 2.87Å; V530-Y580 WeakPolarHBondContact O-CB 3.41Å; V530-Y580 PolarHBondContact O-N 3.34Å; A532-Y580 HydrophobicContact CB-CE2 4.48Å; E534-Y580 WeakPolarHBondContact OE1-CE2 2.92Å; E534-Y580 PolarHBondContact OE1-OH 3.47Å; E534-Y580 PolarHBondContact OE2-OH 3.23Å; Q542-Y580 PolarHBondContact NE2-OH 2.85Å; M547-Y580 HydrophobicContact CB-CD1 3.53Å; M547-Y580 HydrophobicContact CB-CE1 3.73Å; M547-Y580 HydrophobicContact CB-CG 4.05Å; M547-Y580 HydrophobicContact CE-CD1 4.13Å; M547-Y580 HydrophobicContact CE-CD2 3.22Å; M547-Y580 HydrophobicContact CE-CE1 4.28Å; M547-Y580 HydrophobicContact CE-CE2 3.42Å; M547-Y580 VanDerWaalsContact CE-CE2 3.42Å; M547-Y580 HydrophobicContact CE-CG 3.62Å; V560-Y580 CarbonylContact O-C 3.54Å; V560-Y580 VanDerWaalsContact O-CA 3.3Å; V560-Y580 WeakPolarHBondContact O-CA 3.44Å; Y561-Y580 HydrophobicContact CD2-CE1 4.07Å; Y561-Y580 AromaticContact CD2-CE2 3.92Å; Y561-Y580 HydrophobicContact CD2-CE2 3.92Å; Y561-Y580 AromaticContact CD2-CZ 3.63Å; Y561-Y580 HydrophobicContact CG-CE1 4.31Å; Y561-Y580 VanDerWaalsContact N-CD1 3.29Å
581	S	88	Confident	79.8	Confident	18 Å²	18	44.5 Å²	44.5	13%	0.126	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	141.9	176.3	176.9	0	0	0	0	110.5	G559 V560	G559-S581 WeakPolarHBondContact CA-O 3.48Å; V560-S581 PolarHBondContact N-O 2.92Å; V560-S581 PolarHBondContact O-N 3.07Å
582	E	81.9	Confident	80.8	Confident	28 Å²	28	39 Å²	39	13%	0.131	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	146.3	169.7	-67.7	-178.1	165	0	0	111	I459 H516 R528 N584	I459-E582 WeakPolarHBondContact CD1-O 3.17Å; H516-E582 IonicContact CE1-OE1 3.37Å; H516-E582 PolarHBondContact CE1-OE1 2.85Å; H516-E582 IonicContact ND1-OE1 3.2Å; H516-E582 PolarHBondContact ND1-OE1 3.08Å; H516-E582 VanDerWaalsContact ND1-OE1 3.08Å; R528-E582 WeakPolarHBondContact CD-OE1 3.39Å; R528-E582 VanDerWaalsContact CG-OE1 3.23Å; R528-E582 WeakPolarHBondContact CG-OE1 3.48Å; R528-E582 IonicContact CZ-OE1 3.68Å; R528-E582 IonicContact NE-OE1 3.3Å; R528-E582 PolarHBondContact NE-OE1 3.48Å; E582-N584 VanDerWaalsContact C-N 3.29Å; E582-N584 PolarHBondContact O-N 2.99Å; E582-N584 PolarHBondContact OE2-ND2 3.45Å
583	I	87.4	Confident	81.7	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.021	21%	0.208	C	C	.	.	S	Bend	trans	-88.7	12.7	179.9	56.5	161.2	0	0	0	113.5	I459 L479 A480 Q557 V560 V585 V586 H587	I459-I583 HydrophobicContact CD1-CG2 4.38Å; L479-I583 HydrophobicContact CB-CD1 3.89Å; L479-I583 HydrophobicContact CD2-CD1 3.89Å; L479-I583 HydrophobicContact CG-CD1 4.42Å; A480-I583 HydrophobicContact CB-CD1 4.27Å; Q557-I583 WeakPolarHBondContact O-CD1 2.96Å; V560-I583 HydrophobicContact CG2-CG2 4.4Å; I583-V585 PolarHBondContact O-N 3.37Å; I583-V586 HydrophobicContact CB-CB 4.41Å; I583-V586 HydrophobicContact CB-CG2 4.12Å; I583-V586 HydrophobicContact CG2-CG2 4.45Å; I583-V586 WeakPolarHBondContact O-CA 3.47Å; I583-V586 VanDerWaalsContact O-CB 3.22Å; I583-V586 WeakPolarHBondContact O-CB 2.92Å; I583-V586 PolarHBondContact O-N 2.87Å; I583-H587 PolarHBondContact O-N 2.69Å
584	N	84.6	Confident	82	Confident	31 Å²	31	45 Å²	45	17%	0.166	24%	0.24	C	C	.	.	H	α-helix	trans	-55.1	-38.6	-179.4	-72.8	-24.1	0	0	0	112.8	R482 G483 E582 V586 H587 D588	R482-N584 WeakPolarHBondContact CA-OD1 3.34Å; R482-N584 HydrophobicContact CG-CB 4.45Å; R482-N584 WeakPolarHBondContact CG-OD1 3.41Å; G483-N584 PolarHBondContact N-OD1 2.9Å; E582-N584 VanDerWaalsContact C-N 3.29Å; E582-N584 PolarHBondContact O-N 2.99Å; E582-N584 PolarHBondContact OE2-ND2 3.45Å; N584-V586 PolarHBondContact O-N 2.88Å; N584-H587 WeakPolarHBondContact O-CB 3.39Å; N584-H587 PolarHBondContact O-N 2.65Å; N584-D588 PolarHBondContact O-N 3.1Å; N584-D588 VanDerWaalsContact O-N 3.14Å
585	V	81.8	Confident	81.7	Confident	33 Å²	33	39.7 Å²	39.7	20%	0.2	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-30.6	176.9	69.6	0	0	0	0	112.6	L448 I459 I583 D588 V589 V595	L448-V585 HydrophobicContact CD1-CG1 4.4Å; L448-V585 HydrophobicContact CD1-CG2 3.65Å; L448-V585 HydrophobicContact CD2-CG2 4.44Å; I459-V585 HydrophobicContact CB-CG1 4.34Å; I459-V585 HydrophobicContact CD1-CG1 4.22Å; I583-V585 PolarHBondContact O-N 3.37Å; V585-D588 PolarHBondContact O-N 3.47Å; V585-V589 WeakPolarHBondContact O-CG2 3.36Å; V585-V589 PolarHBondContact O-N 2.99Å; V585-V595 HydrophobicContact CG2-CG1 3.91Å; V585-V595 HydrophobicContact CG2-CG2 4.4Å
586	V	87.4	Confident	80.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69	-45.3	178.2	-176.9	0	0	0	0	109.9	I436 I459 I461 L479 I583 N584 D588 V589 F590	I436-V586 HydrophobicContact CD1-CB 4.17Å; I436-V586 HydrophobicContact CD1-CG1 3.37Å; I436-V586 HydrophobicContact CD1-CG2 3.84Å; I436-V586 HydrophobicContact CG1-CG1 4.31Å; I436-V586 HydrophobicContact CG2-CG2 4.4Å; I459-V586 HydrophobicContact CD1-CG2 4.32Å; I459-V586 HydrophobicContact CG2-CG2 4.08Å; I461-V586 HydrophobicContact CD1-CB 4.39Å; I461-V586 HydrophobicContact CD1-CG1 4.08Å; I461-V586 HydrophobicContact CD1-CG2 4.39Å; L479-V586 HydrophobicContact CD1-CG1 3.76Å; I583-V586 HydrophobicContact CB-CB 4.41Å; I583-V586 HydrophobicContact CB-CG2 4.12Å; I583-V586 HydrophobicContact CG2-CG2 4.45Å; I583-V586 WeakPolarHBondContact O-CA 3.47Å; I583-V586 VanDerWaalsContact O-CB 3.22Å; I583-V586 WeakPolarHBondContact O-CB 2.92Å; I583-V586 PolarHBondContact O-N 2.87Å; N584-V586 PolarHBondContact O-N 2.88Å; V586-D588 VanDerWaalsContact C-N 3.29Å; V586-D588 PolarHBondContact O-N 2.96Å; V586-V589 PolarHBondContact O-N 2.95Å; V586-F590 HydrophobicContact CG1-CD2 3.92Å; V586-F590 HydrophobicContact CG1-CE1 4.48Å; V586-F590 HydrophobicContact CG1-CE2 3.72Å; V586-F590 HydrophobicContact CG1-CG 4.41Å; V586-F590 HydrophobicContact CG1-CZ 4.01Å; V586-F590 WeakPolarHBondContact O-CB 3.2Å; V586-F590 WeakPolarHBondContact O-CG 3.29Å; V586-F590 PolarHBondContact O-N 2.94Å
587	H	87.6	Confident	79.2	Confident	43 Å²	43	48.6 Å²	48.6	20%	0.199	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-42.6	174.2	-76.2	-67.9	0	0	0	112	A480 I583 N584 F590 S591	A480-H587 PolarHBondContact O-CE1 3.06Å; A480-H587 PolarHBondContact O-NE2 2.92Å; I583-H587 PolarHBondContact O-N 2.69Å; N584-H587 WeakPolarHBondContact O-CB 3.39Å; N584-H587 PolarHBondContact O-N 2.65Å; H587-F590 PolarHBondContact O-N 2.91Å; H587-S591 VanDerWaalsContact O-CB 3.3Å; H587-S591 WeakPolarHBondContact O-CB 3.44Å; H587-S591 PolarHBondContact O-N 2.7Å; H587-S591 PolarHBondContact O-OG 3.2Å
588	D	83.9	Confident	77.3	Confident	28 Å²	28	50.8 Å²	50.8	15%	0.15	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-43.8	177.9	-75	-34.6	0	0	0	111.7	R482 N584 V585 V586 S591 G592 K593 V595	R482-D588 IonicContact CZ-OD1 2.94Å; R482-D588 IonicContact CZ-OD2 3.48Å; R482-D588 IonicContact NH1-OD1 3.74Å; R482-D588 PolarHBondContact NH1-OD1 3.15Å; R482-D588 IonicContact NH1-OD2 2.77Å; R482-D588 IonicContact NH2-OD1 2.64Å; R482-D588 PolarHBondContact NH2-OD1 3.2Å; R482-D588 IonicContact NH2-OD2 2.69Å; R482-D588 PolarHBondContact NH2-OD2 2.77Å; N584-D588 PolarHBondContact O-N 3.1Å; N584-D588 VanDerWaalsContact O-N 3.14Å; V585-D588 PolarHBondContact O-N 3.47Å; V586-D588 VanDerWaalsContact C-N 3.29Å; V586-D588 PolarHBondContact O-N 2.96Å; D588-S591 PolarHBondContact O-N 2.86Å; D588-G592 PolarHBondContact O-N 3.09Å; D588-K593 HydrophobicContact CB-CB 4.28Å; D588-K593 HydrophobicContact CB-CD 4.25Å; D588-K593 WeakPolarHBondContact O-CB 3.43Å; D588-K593 PolarHBondContact O-N 2.77Å; D588-K593 WeakPolarHBondContact OD1-CD 3.49Å; D588-K593 IonicContact OD1-NZ 3.29Å; D588-K593 PolarHBondContact OD1-NZ 3.36Å; D588-V595 HydrophobicContact CB-CG2 4.21Å
589	V	84.2	Confident	74.8	Confident	60 Å²	60	55 Å²	55	36%	0.364	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-44.7	175	173.8	0	0	0	0	111.4	I461 V585 V586 S591 G592 V595	I461-V589 HydrophobicContact CD1-CB 3.85Å; I461-V589 HydrophobicContact CD1-CG1 3.81Å; I461-V589 HydrophobicContact CD1-CG2 4.09Å; V585-V589 WeakPolarHBondContact O-CG2 3.36Å; V585-V589 PolarHBondContact O-N 2.99Å; V586-V589 PolarHBondContact O-N 2.95Å; V589-S591 VanDerWaalsContact C-N 3.29Å; V589-S591 PolarHBondContact O-N 2.64Å; V589-G592 PolarHBondContact O-N 2Å; V589-V595 HydrophobicContact CG2-CB 4.38Å; V589-V595 HydrophobicContact CG2-CG2 3.67Å
590	F	86.4	Confident	72.6	Confident	13 Å²	13	60.9 Å²	60.9	6%	0.057	34%	0.335	C	S	.	.	H	α-helix	trans	-69	-26.2	179.1	-76.6	-4	0	0	0	113.4	V420 R422 F434 I461 L479 V586 H587 G592	V420-F590 HydrophobicContact CG2-CE2 3.87Å; V420-F590 HydrophobicContact CG2-CZ 3.77Å; R422-F590 HydrophobicContact CB-CD2 4.15Å; R422-F590 HydrophobicContact CB-CE2 4.34Å; R422-F590 HydrophobicContact CB-CG 4.39Å; R422-F590 HydrophobicContact CG-CB 3.84Å; R422-F590 HydrophobicContact CG-CD1 4.26Å; R422-F590 HydrophobicContact CG-CD2 3.97Å; R422-F590 HydrophobicContact CG-CG 3.78Å; R422-F590 VanDerWaalsContact CZ-O 3.24Å; R422-F590 PolarHBondContact NE-O 3.33Å; R422-F590 PolarHBondContact NH2-O 3.06Å; F434-F590 HydrophobicContact CB-CE1 4.27Å; F434-F590 HydrophobicContact CB-CZ 3.83Å; F434-F590 AromaticContact CD1-CE1 3.78Å; F434-F590 HydrophobicContact CD1-CE1 3.78Å; F434-F590 HydrophobicContact CD1-CZ 4.22Å; F434-F590 HydrophobicContact CD2-CE1 4.34Å; F434-F590 HydrophobicContact CD2-CZ 4.38Å; F434-F590 HydrophobicContact CE1-CE1 4.17Å; F434-F590 AromaticContact CG-CE1 3.87Å; F434-F590 HydrophobicContact CG-CE1 3.87Å; F434-F590 AromaticContact CG-CZ 3.9Å; F434-F590 HydrophobicContact CG-CZ 3.9Å; I461-F590 HydrophobicContact CD1-CE1 4.44Å; I461-F590 HydrophobicContact CG2-CE1 4.09Å; I461-F590 HydrophobicContact CG2-CZ 4.5Å; L479-F590 HydrophobicContact CD1-CD2 3.73Å; L479-F590 HydrophobicContact CD1-CE2 3.68Å; V586-F590 HydrophobicContact CG1-CD2 3.92Å; V586-F590 HydrophobicContact CG1-CE1 4.48Å; V586-F590 HydrophobicContact CG1-CE2 3.72Å; V586-F590 HydrophobicContact CG1-CG 4.41Å; V586-F590 HydrophobicContact CG1-CZ 4.01Å; V586-F590 WeakPolarHBondContact O-CB 3.2Å; V586-F590 WeakPolarHBondContact O-CG 3.29Å; V586-F590 PolarHBondContact O-N 2.94Å; H587-F590 PolarHBondContact O-N 2.91Å; F590-G592 PolarHBondContact O-N 3.33Å
591	S	84.4	Confident	69.8	Low	89 Å²	89	69.7 Å²	69.7	62%	0.622	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.8	170.8	-56.1	0	0	0	0	113.2	H587 D588 V589 K593	H587-S591 VanDerWaalsContact O-CB 3.3Å; H587-S591 WeakPolarHBondContact O-CB 3.44Å; H587-S591 PolarHBondContact O-N 2.7Å; H587-S591 PolarHBondContact O-OG 3.2Å; D588-S591 PolarHBondContact O-N 2.86Å; V589-S591 VanDerWaalsContact C-N 3.29Å; V589-S591 PolarHBondContact O-N 2.64Å; S591-K593 VanDerWaalsContact C-N 3.35Å
592	G	78.5	Confident	67.3	Low	57 Å²	57	74.5 Å²	74.5	59%	0.588	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	10	-179.4	0	0	0	0	0	114.5	D588 V589 F590 K594	D588-G592 PolarHBondContact O-N 3.09Å; V589-G592 PolarHBondContact O-N 2Å; F590-G592 PolarHBondContact O-N 3.33Å; G592-K594 PolarHBondContact O-N 3.44Å
593	K	77	Confident	64.9	Low	118 Å²	118	75.9 Å²	75.9	51%	0.513	42%	0.423	S	S	.	.			trans	-67.6	134.3	173.7	-65.9	-172.8	-170.2	163.6	0	109.4	D588 S591 V595	D588-K593 HydrophobicContact CB-CB 4.28Å; D588-K593 HydrophobicContact CB-CD 4.25Å; D588-K593 WeakPolarHBondContact O-CB 3.43Å; D588-K593 PolarHBondContact O-N 2.77Å; D588-K593 WeakPolarHBondContact OD1-CD 3.49Å; D588-K593 IonicContact OD1-NZ 3.29Å; D588-K593 PolarHBondContact OD1-NZ 3.36Å; S591-K593 VanDerWaalsContact C-N 3.35Å; K593-V595 PolarHBondContact O-N 3.15Å; K593-V595 VanDerWaalsContact O-N 3.08Å
594	K	60.3	Low	62.3	Low	210 Å²	210	87.3 Å²	87.3	91%	0.913	47%	0.466	S	S	*	.			trans	-69	105.8	172.3	-75.5	-176.2	179	177.3	0	109	G592	G592-K594 PolarHBondContact O-N 3.44Å
595	V	62.1	Low	59.8	Low	27 Å²	27	95 Å²	95	16%	0.164	50%	0.501	C	S	.	.			trans	-89.7	143.1	168.6	-164.9	0	0	0	0	108.2	L448 V585 D588 V589 K593 T597	L448-V595 HydrophobicContact CD2-CB 4.12Å; L448-V595 HydrophobicContact CD2-CG1 3.28Å; V585-V595 HydrophobicContact CG2-CG1 3.91Å; V585-V595 HydrophobicContact CG2-CG2 4.4Å; D588-V595 HydrophobicContact CB-CG2 4.21Å; V589-V595 HydrophobicContact CG2-CB 4.38Å; V589-V595 HydrophobicContact CG2-CG2 3.67Å; K593-V595 PolarHBondContact O-N 3.15Å; K593-V595 VanDerWaalsContact O-N 3.08Å; V595-T597 PolarHBondContact O-N 3.01Å
596	Q	52.5	Low	57.6	Low	141 Å²	141	99.5 Å²	99.5	66%	0.659	53%	0.531	S	S	*	.			trans	-60.8	99.1	-177.9	-68.9	-177.1	23.8	0	0	111.5
597	T	47.5	Very low	55	Low	108 Å²	108	103 Å²	103	66%	0.663	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-86.2	141.1	171.2	36.7	0	0	0	0	110.1	V595 S599	V595-T597 PolarHBondContact O-N 3.01Å; T597-S599 PolarHBondContact O-N 2.71Å; T597-S599 VanDerWaalsContact O-N 3.12Å
598	L	42.5	Very low	52.6	Low	56 Å²	56	107.4 Å²	107.4	29%	0.293	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-53	120.5	171.3	-83.8	157.7	0	0	0	110	G447 R449 T455	G447-L598 WeakPolarHBondContact O-CD1 3.49Å; R449-L598 HydrophobicContact CB-CD2 4.47Å; T455-L598 HydrophobicContact CG2-CD1 3.58Å; T455-L598 HydrophobicContact CG2-CD2 4.1Å; T455-L598 HydrophobicContact CG2-CG 4.3Å
599	S	33.2	Very low	50.1	Low	89 Å²	89	115.1 Å²	115.1	62%	0.622	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-65.5	133.9	169.6	-170.6	0	0	0	0	109.7	T597 K601	T597-S599 PolarHBondContact O-N 2.71Å; T597-S599 VanDerWaalsContact O-N 3.12Å; S599-K601 PolarHBondContact O-N 2.87Å
600	E	42.5	Very low	47.6	Very low	125 Å²	125	118.1 Å²	118.1	58%	0.584	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	5.2	-177.8	-142	170.2	-160.3	0	0	114.2	T707	E600-T707 PolarHBondContact OE1-OG1 3.36Å; E600-T707 PolarHBondContact OE2-OG1 3.14Å
601	K	32.7	Very low	45.1	Very low	185 Å²	185	124.6 Å²	124.6	80%	0.804	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	11.9	-166	-79.4	-171.1	177.3	-177.6	0	117	S599 G603	S599-K601 PolarHBondContact O-N 2.87Å; K601-G603 PolarHBondContact O-N 3.34Å
602	V	35.7	Very low	42.6	Very low	120 Å²	120	129.1 Å²	129.1	73%	0.727	69%	0.693	S	S	*	*			trans	-80.2	76.2	168.2	-171.5	0	0	0	0	109.1
603	G	31.3	Very low	40.3	Very low	56 Å²	56	132.4 Å²	132.4	58%	0.577	70%	0.704	S	S	*	*			trans	-57.9	145.8	168.1	0	0	0	0	0	110.8	K601 Q605	K601-G603 PolarHBondContact O-N 3.34Å; G603-Q605 PolarHBondContact O-N 2.82Å; G603-Q605 VanDerWaalsContact O-N 3.11Å
604	R	31.4	Very low	38.1	Very low	244 Å²	244	133.6 Å²	133.6	92%	0.921	71%	0.714	S	S	*	*			trans	-22.7	111.2	159.9	-71.4	170.8	171.2	175	-4.7	111.5	P606	R604-P606 WeakPolarHBondContact O-CD 3.45Å
605	Q	32.6	Very low	36.5	Very low	192 Å²	192	132.2 Å²	132.2	90%	0.897	71%	0.711	S	S	*	*			trans	-77.4	117.3	145.1	-80.8	-146.2	-3.1	0	0	107.3	G603	G603-Q605 PolarHBondContact O-N 2.82Å; G603-Q605 VanDerWaalsContact O-N 3.11Å
606	P	35	Very low	35.1	Very low	128 Å²	128	135.7 Å²	135.7	83%	0.831	74%	0.742	S	S	*	*			trans	-83.7	113.7	168.4	31	-23.7	0	0	0	107.9	R604	R604-P606 WeakPolarHBondContact O-CD 3.45Å
607	G	33.9	Very low	34.1	Very low	74 Å²	74	133.5 Å²	133.5	76%	0.763	74%	0.743	S	S	*	*			trans	148.8	42.1	170.4	0	0	0	0	0	117.8
608	V	37.2	Very low	33.2	Very low	135 Å²	135	134.1 Å²	134.1	82%	0.818	75%	0.751	S	S	*	*			trans	-136.1	114.4	156.9	-173.8	0	0	0	0	107.1
609	K	30.3	Very low	32.8	Very low	190 Å²	190	136 Å²	136	83%	0.826	77%	0.769	S	S	*	*			trans	-56.3	135	172.5	-74.3	176.2	177.4	175.2	0	108	L611	K609-L611 PolarHBondContact O-N 3.3Å
610	P	33.1	Very low	32.7	Very low	124 Å²	124	136.7 Å²	136.7	81%	0.805	77%	0.774	S	S	*	*			trans	-62	114.8	171.5	25.8	-30.4	0	0	0	107.7	K612	P610-K612 PolarHBondContact O-N 3.15Å
611	L	33	Very low	32.3	Very low	148 Å²	148	136.9 Å²	136.9	78%	0.775	79%	0.79	S	S	*	*			trans	-56.7	126.6	162.2	-105.7	85.2	0	0	0	106.8	K609	K609-L611 PolarHBondContact O-N 3.3Å
612	K	32.3	Very low	32.4	Very low	184 Å²	184	133.2 Å²	133.2	80%	0.8	79%	0.787	S	S	*	*			trans	-48.4	149.9	167.7	-79.8	176	173.6	178	0	109.5	P610 I614	P610-K612 PolarHBondContact O-N 3.15Å; K612-I614 PolarHBondContact O-N 3.02Å
613	P	30.9	Very low	32.3	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	79%	0.79	S	S	*	*			trans	-58.3	110.6	168.3	-7	20.8	0	0	0	107.2	Q615	P613-Q615 PolarHBondContact O-N 3.32Å
614	I	29.5	Very low	32.4	Very low	142 Å²	142	134.8 Å²	134.8	73%	0.728	80%	0.8	S	S	*	*			trans	-66.5	118.1	163.5	-68.3	173.9	0	0	0	104.9	K612 A616	K612-I614 PolarHBondContact O-N 3.02Å; I614-A616 PolarHBondContact O-N 2.99Å
615	Q	27.8	Very low	32.6	Very low	181 Å²	181	129.2 Å²	129.2	85%	0.846	80%	0.799	S	S	*	*			trans	-50.9	108.1	162	-73.4	173.4	-36.5	0	0	107.7	P613 S617	P613-Q615 PolarHBondContact O-N 3.32Å; Q615-S617 VanDerWaalsContact C-N 3.27Å; Q615-S617 PolarHBondContact O-N 3.04Å; Q615-S617 VanDerWaalsContact O-N 3.13Å
616	A	32.2	Very low	32.5	Very low	100 Å²	100	131.5 Å²	131.5	83%	0.826	80%	0.799	S	S	*	*			trans	-78.5	93.3	160	0	0	0	0	0	106.4	I614 S618	I614-A616 PolarHBondContact O-N 2.99Å; A616-S618 PolarHBondContact O-N 3.07Å
617	S	30.8	Very low	32.5	Very low	95 Å²	95	134 Å²	134	66%	0.664	80%	0.8	S	S	*	*			trans	-45	123.1	167.7	25.1	0	0	0	0	111.7	Q615	Q615-S617 VanDerWaalsContact C-N 3.27Å; Q615-S617 PolarHBondContact O-N 3.04Å; Q615-S617 VanDerWaalsContact O-N 3.13Å
618	S	29.5	Very low	32.6	Very low	121 Å²	121	137.5 Å²	137.5	85%	0.846	80%	0.799	S	S	*	*			trans	-62.5	117.9	144.9	50	0	0	0	0	109.7	A616	A616-S618 PolarHBondContact O-N 3.07Å
619	S	33.3	Very low	32.5	Very low	96 Å²	96	137.8 Å²	137.8	67%	0.671	80%	0.796	S	S	*	*			trans	179.4	137.6	161.3	50.9	0	0	0	0	106
620	S	32.5	Very low	32.6	Very low	103 Å²	103	137.4 Å²	137.4	72%	0.72	80%	0.795	S	S	*	*			cis	172	140.4	6.1	39.9	0	0	0	0	104.8
621	S	34.1	Very low	32.6	Very low	130 Å²	130	142.8 Å²	142.8	91%	0.909	80%	0.799	S	S	*	*			trans	-145.8	101	142.1	57.3	0	0	0	0	107.3
622	S	33.2	Very low	32.6	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	80%	0.804	S	S	*	*			trans	-90.1	149.5	-177.9	47.4	0	0	0	0	112.1
623	S	35.1	Very low	32.6	Very low	113 Å²	113	143.3 Å²	143.3	79%	0.79	80%	0.803	S	S	*	*			trans	-170.6	98.6	140.5	45.9	0	0	0	0	107.6
624	A	32.5	Very low	32.7	Very low	95 Å²	95	141.1 Å²	141.1	79%	0.785	80%	0.803	S	S	*	*				68.1	115.2	102.2	0	0	0	0	0	112.3
625	S	34.9	Very low	32.7	Very low	127 Å²	127	141.1 Å²	141.1	89%	0.888	80%	0.803	S	S	*	*				-160.8	157.3	79.8	-75.8	0	0	0	0	114.2
626	R	31.8	Very low	32.8	Very low	241 Å²	241	142.7 Å²	142.7	91%	0.909	81%	0.808	S	S	*	*			trans	-89.9	149.7	-174.3	-66	170.1	168.4	170.1	-4.3	113
627	E	35.5	Very low	32.7	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	80%	0.798	S	S	*	*			trans	-176	110.9	136.8	-104.5	178.8	168.9	0	0	107
628	I	35.1	Very low	32.6	Very low	146 Å²	146	145.4 Å²	145.4	75%	0.749	81%	0.806	S	S	*	*				49.6	108.5	90.4	-52.5	173.2	0	0	0	109.9
629	D	34.6	Very low	32.7	Very low	141 Å²	141	146.9 Å²	146.9	75%	0.754	80%	0.804	S	S	*	*				-168.6	169.1	71.9	-137.1	-24.3	0	0	0	115.1
630	K	32.3	Very low	32.4	Very low	183 Å²	183	153 Å²	153	80%	0.796	81%	0.814	S	S	*	*			trans	-71	147.4	-168.6	-64.9	152.2	171.9	163.5	0	117.4
631	R	34.4	Very low	32.4	Very low	236 Å²	236	155 Å²	155	89%	0.891	82%	0.815	S	S	*	*				168.2	115.7	115.6	-93.1	178	-178.5	-157.7	2.2	109.8
632	R	32.7	Very low	32.3	Very low	233 Å²	233	154 Å²	154	88%	0.879	81%	0.805	S	S	*	*				73.6	127.3	89.9	-154.4	-177.4	-153.1	-146.3	7.2	111.5
633	S	31.5	Very low	32	Very low	111 Å²	111	157.1 Å²	157.1	78%	0.776	81%	0.813	S	S	*	*			cis	-172	150.7	-4.9	-89.2	0	0	0	0	106.5
634	G	33	Very low	31.9	Very low	80 Å²	80	156.7 Å²	156.7	83%	0.825	82%	0.816	S	S	*	*			trans	174.7	77.1	170.4	0	0	0	0	0	112.6
635	L	29.2	Very low	31.9	Very low	142 Å²	142	158.4 Å²	158.4	74%	0.743	82%	0.817	S	S	*	*			trans	-61	141.9	177.3	-95.7	76.9	0	0	0	113.1
636	F	30	Very low	31.7	Very low	214 Å²	214	159.6 Å²	159.6	94%	0.939	81%	0.812	S	S	*	*				-146.7	118.2	127.9	-94.4	-74.8	0	0	0	109.5
637	P	31.1	Very low	31.9	Very low	95 Å²	95	153.5 Å²	153.5	62%	0.617	80%	0.804	S	S	*	*			trans	-97.8	165.7	-177.7	37.3	-31.5	0	0	0	113.4
638	D	28.9	Very low	31.9	Very low	158 Å²	158	151 Å²	151	85%	0.845	80%	0.803	S	S	*	*			trans	-42.2	141.6	169.2	-69.2	-55.6	0	0	0	114.7
639	L	31	Very low	31.8	Very low	152 Å²	152	149.2 Å²	149.2	80%	0.796	80%	0.803	S	S	*	*			trans	-121.5	97.8	164.1	-128	105.1	0	0	0	111.1	I641	L639-I641 HydrophobicContact CD2-CD1 4.38Å; L639-I641 HydrophobicContact CD2-CG1 3.96Å
640	Y	26.9	Very low	32	Very low	223 Å²	223	150.6 Å²	150.6	88%	0.875	81%	0.809	S	S	*	*			trans	-70.1	134.4	150.3	-111.4	-102.4	0	0	0	108.4
641	I	33.4	Very low	32.1	Very low	146 Å²	146	146.7 Å²	146.7	75%	0.749	81%	0.805	S	S	*	*			trans	-110.7	116	167.3	-60.4	176.1	0	0	0	108.5	L639	L639-I641 HydrophobicContact CD2-CD1 4.38Å; L639-I641 HydrophobicContact CD2-CG1 3.96Å
642	P	30.5	Very low	32.3	Very low	108 Å²	108	146.7 Å²	146.7	70%	0.701	81%	0.805	S	S	*	*			trans	-88.5	161.8	174.1	34.8	-30.9	0	0	0	112.5
643	L	27.3	Very low	32.5	Very low	174 Å²	174	141.4 Å²	141.4	91%	0.911	80%	0.801	S	S	*	*			trans	-54.7	144.6	169.3	-89.9	73.4	0	0	0	111.8
644	A	33.3	Very low	32.7	Very low	105 Å²	105	139.7 Å²	139.7	87%	0.868	80%	0.8	S	S	*	*			trans	-123.2	148.5	167.9	0	0	0	0	0	112.2
645	T	32.6	Very low	32.7	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	80%	0.796	S	S	*	*			trans	-103.7	160.9	-155.5	-48.4	0	0	0	0	112.5
646	I	31.2	Very low	33	Very low	151 Å²	151	143.9 Å²	143.9	77%	0.774	79%	0.792	S	S	*	*			trans	-41	150.7	169.5	-58.3	156.1	0	0	0	115
647	P	36	Very low	33.2	Very low	114 Å²	114	144.3 Å²	144.3	74%	0.74	79%	0.788	S	S	*	*			trans	-104.9	157.7	156.4	34.8	-24.4	0	0	0	114.2
648	P	35.8	Very low	33.5	Very low	127 Å²	127	143.5 Å²	143.5	83%	0.825	78%	0.784	S	S	*	*			trans	-102.8	-176.9	-157.8	39.8	-32.3	0	0	0	117
649	S	33.1	Very low	33.8	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	79%	0.785	S	S	*	*			trans	-49.8	149.3	-170.9	55.9	0	0	0	0	121.8
650	I	37.7	Very low	34	Very low	171 Å²	171	142.3 Å²	142.3	88%	0.877	78%	0.776	S	S	*	*			trans	-141.2	131.8	140.8	-61.5	-175.8	0	0	0	110.5
651	S	35.6	Very low	34.4	Very low	101 Å²	101	136.7 Å²	136.7	71%	0.706	77%	0.769	S	S	*	*			trans	-57.9	168.5	177.4	48.6	0	0	0	0	116.8
652	R	36.9	Very low	34.5	Very low	236 Å²	236	134.2 Å²	134.2	89%	0.891	77%	0.765	S	S	*	*			cis	-175.8	-175	40.7	-135	-169.9	-178.2	178.3	0.5	108.4
653	P	37.4	Very low	34.8	Very low	122 Å²	122	133.6 Å²	133.6	79%	0.792	76%	0.763	S	S	*	*				-132.1	-178.8	-119.3	40.2	-18.4	0	0	0	117
654	G	35.3	Very low	35.3	Very low	74 Å²	74	130.7 Å²	130.7	76%	0.763	76%	0.757	S	S	*	*			trans	142	143.6	159.6	0	0	0	0	0	111.8
655	Q	34.4	Very low	35.6	Very low	159 Å²	159	130.3 Å²	130.3	74%	0.743	75%	0.749	S	S	*	*			cis	-179.3	154.1	-19.4	-141.3	-169.2	17.2	0	0	103.9
656	K	34.1	Very low	35.9	Very low	151 Å²	151	129 Å²	129	66%	0.657	75%	0.745	S	S	*	*			trans	81	109	155.5	-71.1	173.8	-179.9	168.5	0	116.7
657	R	35.3	Very low	36.2	Very low	224 Å²	224	126.4 Å²	126.4	85%	0.845	74%	0.74	S	S	*	*				90.9	136.8	85.7	-93.9	-173.5	179.5	-174.2	-0.8	109.1
658	S	36.5	Very low	36.3	Very low	78 Å²	78	125.2 Å²	125.2	55%	0.545	73%	0.734	S	S	.	*			cis	-174.9	158	14.5	-69.8	0	0	0	0	107.5
659	K	36.1	Very low	36.3	Very low	197 Å²	197	126.5 Å²	126.5	86%	0.857	73%	0.734	S	S	*	*			trans	62.8	152.1	136.5	-72.4	170	-173.6	-169.7	0	117.9
660	S	33.7	Very low	36.3	Very low	88 Å²	88	125.9 Å²	125.9	62%	0.615	73%	0.73	S	S	*	*			cis	175.2	163.3	-8.8	48.5	0	0	0	0	104.6
661	S	36.9	Very low	36.1	Very low	105 Å²	105	123 Å²	123	73%	0.734	73%	0.725	S	S	*	*			trans	63.2	145	147.3	56.1	0	0	0	0	118
662	S	35.2	Very low	36.1	Very low	94 Å²	94	123.4 Å²	123.4	66%	0.657	73%	0.728	S	S	*	*			cis	173.4	173.8	-1.7	46	0	0	0	0	105.7
663	S	36.9	Very low	35.8	Very low	95 Å²	95	116.8 Å²	116.8	66%	0.664	72%	0.724	S	S	*	*			trans	69.1	102.8	148.3	52	0	0	0	0	117.3
664	S	36.5	Very low	35.4	Very low	112 Å²	112	121.2 Å²	121.2	78%	0.783	73%	0.726	S	S	*	*				81.4	135.8	92.4	71.9	0	0	0	0	110.9
665	S	40.1	Very low	35.4	Very low	98 Å²	98	124 Å²	124	69%	0.685	73%	0.728	S	S	*	*			cis	-174.9	165.2	39.1	45.1	0	0	0	0	109.3
666	S	38.3	Very low	35.3	Very low	103 Å²	103	121.8 Å²	121.8	72%	0.72	73%	0.726	S	S	*	*			trans	63.2	133.4	144.3	56.9	0	0	0	0	118.4
667	S	38.7	Very low	35.1	Very low	97 Å²	97	118.5 Å²	118.5	68%	0.678	73%	0.726	S	S	*	*			cis	-178.6	157.9	8.1	36.5	0	0	0	0	108.3
668	S	38.2	Very low	34.7	Very low	88 Å²	88	112.9 Å²	112.9	62%	0.615	72%	0.721	S	S	*	*			trans	63	104.3	148.2	51.3	0	0	0	0	117.3
669	D	34.9	Very low	34.4	Very low	155 Å²	155	119.3 Å²	119.3	83%	0.829	73%	0.734	S	S	*	*				81.8	136.2	88.6	-71.5	-32.5	0	0	0	110
670	S	33.9	Very low	34	Very low	95 Å²	95	117 Å²	117	66%	0.664	73%	0.726	S	S	*	*			cis	-178.3	155.2	13.9	34.1	0	0	0	0	106.1
671	S	34.1	Very low	33.7	Very low	112 Å²	112	118.1 Å²	118.1	78%	0.783	73%	0.729	S	S	*	*			trans	63.1	146.9	153	72.4	0	0	0	0	117.9
672	S	34.6	Very low	33.3	Very low	108 Å²	108	123.1 Å²	123.1	76%	0.755	73%	0.731	S	S	*	*			cis	-167.1	119	-10.3	45.8	0	0	0	0	103.6
673	A	31.3	Very low	33	Very low	98 Å²	98	124 Å²	124	81%	0.81	73%	0.729	S	S	*	*			trans	-84.8	113.5	173.3	0	0	0	0	0	108.8
674	Y	29.1	Very low	32.6	Very low	215 Å²	215	125.8 Å²	125.8	84%	0.843	73%	0.731	S	S	*	*			trans	172.4	103.7	148.2	-97.1	-70.3	0	0	0	108.2
675	V	33.5	Very low	32.2	Very low	131 Å²	131	125.4 Å²	125.4	79%	0.794	72%	0.724	S	S	*	*			trans	-138.3	108.7	165	172.3	0	0	0	0	106.8
676	T	32.9	Very low	31.7	Very low	114 Å²	114	129.9 Å²	129.9	70%	0.699	73%	0.731	S	S	*	*				73.2	105.2	91.6	-36.7	0	0	0	0	109.8
677	A	29.3	Very low	31.4	Very low	81 Å²	81	128.8 Å²	128.8	67%	0.669	72%	0.724	S	S	*	*				64	128.7	100.3	0	0	0	0	0	111.3
678	S	28.7	Very low	31.2	Very low	106 Å²	106	127 Å²	127	74%	0.741	72%	0.715	S	S	*	*				165	166.2	60.6	-85.4	0	0	0	0	107.3
679	R	30.2	Very low	31	Very low	214 Å²	214	129.6 Å²	129.6	81%	0.808	72%	0.717	S	S	*	*			trans	73.6	109.3	149.9	-83.8	-174.2	150.6	148.7	-3.4	118
680	E	27.5	Very low	30.9	Very low	147 Å²	147	130.6 Å²	130.6	69%	0.687	72%	0.717	S	S	*	*				89.5	113.7	76.7	-87.7	-169.5	142.7	0	0	112.5
681	V	27	Very low	30.9	Very low	112 Å²	112	130 Å²	130	68%	0.679	72%	0.717	S	S	*	*				88.1	125.5	127.1	179.8	0	0	0	0	118.2
682	R	27.5	Very low	30.9	Very low	210 Å²	210	129.2 Å²	129.2	79%	0.792	71%	0.705	S	S	*	*			trans	92.4	128.9	143.9	-97	174	173.8	163.4	-1	121
683	N	29.6	Very low	30.9	Very low	114 Å²	114	128.7 Å²	128.7	61%	0.61	69%	0.693	S	S	*	*			trans	88.9	103.7	137.4	-71.1	-9.9	0	0	0	115.5
684	N	28.5	Very low	31	Very low	132 Å²	132	125.1 Å²	125.1	71%	0.706	66%	0.662	S	S	*	*				76.8	130.1	86.7	-78.3	-4.9	0	0	0	108.9
685	T	29.2	Very low	31.3	Very low	103 Å²	103	116.5 Å²	116.5	63%	0.632	63%	0.632	S	S	*	*			cis	176.6	164.9	13.4	16.1	0	0	0	0	105.2
686	K	28.9	Very low	31.6	Very low	192 Å²	192	114.6 Å²	114.6	84%	0.835	61%	0.611	S	S	*	*			trans	75.7	140.4	154.7	-72.5	161.4	179.7	-172.3	0	116
687	S	32.7	Very low	32	Very low	81 Å²	81	111.5 Å²	111.5	57%	0.566	59%	0.592	S	S	*	*			cis	-169.5	129.4	1.1	51.1	0	0	0	0	104.7
688	A	32.9	Very low	32.6	Very low	59 Å²	59	109.8 Å²	109.8	49%	0.488	57%	0.571	S	S	.	*				96.1	135.4	83.1	0	0	0	0	0	112.9	A305	A305-A688 WeakPolarHBondContact CB-O 3.45Å
689	E	35	Very low	33.3	Very low	143 Å²	143	111.3 Å²	111.3	67%	0.668	56%	0.56	S	S	*	*			trans	80.1	132.6	151.9	-69.8	157.8	175.8	0	0	116.7	A305	A305-E689 WeakPolarHBondContact CB-O 3.36Å
690	E	33	Very low	33.8	Very low	176 Å²	176	103.6 Å²	103.6	82%	0.822	54%	0.535	S	S	*	.			cis	-163.6	165	35.3	-136.1	167.9	-169.4	0	0	112.9
691	A	33.8	Very low	34.4	Very low	82 Å²	82	101.2 Å²	101.2	68%	0.678	53%	0.526	S	S	*	.			trans	-70.4	158.5	-166.9	0	0	0	0	0	116.2	K240	K240-A691 PolarHBondContact NZ-O 2.94Å
692	D	34.1	Very low	34.8	Very low	96 Å²	96	98.5 Å²	98.5	51%	0.513	51%	0.51	S	S	.	.				-173.3	155	115.3	-153.5	4.2	0	0	0	110.4	K240	K240-D692 HydrophobicContact CD-CB 4.09Å
693	D	34.1	Very low	35.1	Very low	96 Å²	96	95.6 Å²	95.6	51%	0.513	50%	0.503	S	S	.	.			trans	-72.8	164.7	-156.5	-155.3	3.1	0	0	0	115.9	R384	R384-D693 IonicContact CZ-OD2 3.31Å; R384-D693 IonicContact NH2-OD2 3.58Å; R384-D693 PolarHBondContact NH2-OD2 2.87Å
694	S	33.1	Very low	35.3	Very low	24 Å²	24	93.9 Å²	93.9	17%	0.168	50%	0.496	C	S	.	.	S	Bend	trans	89.5	120.4	179.3	121.1	0	0	0	0	119	N229 A237	N229-S694 PolarHBondContact OD1-OG 3.4Å; A237-S694 WeakPolarHBondContact CB-O 3.44Å
695	T	35.5	Very low	35.4	Very low	34 Å²	34	92.4 Å²	92.4	21%	0.209	49%	0.492	C	S	.	.			trans	22.5	98	177.7	50.5	0	0	0	0	120.3	A237 M398	A237-T695 WeakPolarHBondContact CB-O 2.89Å; A237-T695 WeakPolarHBondContact CB-OG1 3.31Å; M398-T695 HydrophobicContact CE-CG2 3.95Å
696	R	40.6	Very low	35.4	Very low	91 Å²	91	96.2 Å²	96.2	34%	0.343	50%	0.5	S	S	.	.			trans	-100.7	95.7	175.4	-79.5	-129	167.8	156	-0.4	112.7	K238 I698	K238-R696 HydrophobicContact CD-CB 4.24Å; K238-R696 HydrophobicContact CD-CG 4.14Å; K238-R696 HydrophobicContact CG-CB 4.04Å; K238-R696 HydrophobicContact CG-CG 3.7Å; R696-I698 PolarHBondContact O-N 3.07Å
697	V	40.3	Very low	35.6	Very low	49 Å²	49	90.2 Å²	90.2	30%	0.297	48%	0.48	S	S	.	.			trans	-66.9	117.8	168.1	177.7	0	0	0	0	112.5	P234 E235 K238	P234-V697 HydrophobicContact CB-CG2 3.32Å; P234-V697 HydrophobicContact CG-CG2 3.56Å; P234-V697 VanDerWaalsContact O-CG2 3.27Å; P234-V697 WeakPolarHBondContact O-CG2 3.12Å; E235-V697 HydrophobicContact CG-CB 4.04Å; E235-V697 HydrophobicContact CG-CG1 4.07Å; E235-V697 HydrophobicContact CG-CG2 4.25Å; K238-V697 VanDerWaalsContact CE-N 3.29Å; K238-V697 WeakPolarHBondContact CE-O 3.46Å; K238-V697 VanDerWaalsContact NZ-C 3.34Å; K238-V697 PolarHBondContact NZ-O 3.47Å
698	I	43.1	Very low	35.5	Very low	44 Å²	44	97.2 Å²	97.2	23%	0.226	49%	0.494	C	S	.	.			trans	-101.4	112.2	176.4	-53.7	175.6	0	0	0	108.9	L468 D472 R696 L700	L468-I698 HydrophobicContact CD2-CD1 3.87Å; L468-I698 HydrophobicContact CD2-CG2 4.22Å; D472-I698 HydrophobicContact CB-CD1 3.62Å; R696-I698 PolarHBondContact O-N 3.07Å; I698-L700 HydrophobicContact CG2-CD1 4.31Å; I698-L700 HydrophobicContact CG2-CD2 3.83Å; I698-L700 HydrophobicContact CG2-CG 3.86Å; I698-L700 PolarHBondContact O-N 3.11Å
699	R	43.1	Very low	35.3	Very low	139 Å²	139	101.8 Å²	101.8	53%	0.525	51%	0.509	S	S	.	.			trans	-77.9	114.6	171.6	-69.8	-177.1	-179.5	172.2	-2.3	109.5	E235	E235-R699 IonicContact OE1-CZ 2.81Å; E235-R699 IonicContact OE1-NE 3.09Å; E235-R699 PolarHBondContact OE1-NE 3.29Å; E235-R699 IonicContact OE1-NH2 2.94Å; E235-R699 PolarHBondContact OE1-NH2 3.16Å; E235-R699 IonicContact OE2-CZ 2.91Å; E235-R699 IonicContact OE2-NE 3.26Å; E235-R699 IonicContact OE2-NH2 3.76Å; E235-R699 PolarHBondContact OE2-NH2 2.94Å
700	L	40.9	Very low	35.2	Very low	52 Å²	52	99.4 Å²	99.4	27%	0.272	51%	0.514	S	S	.	.			trans	-110.5	128.2	178.7	-64.6	162.7	0	0	0	109.9	L464 L468 I698 V702	L464-L700 HydrophobicContact CD1-CD1 3.59Å; L464-L700 HydrophobicContact CD2-CB 4.01Å; L464-L700 HydrophobicContact CD2-CD1 3.46Å; L464-L700 VanDerWaalsContact CD2-CD1 3.46Å; L464-L700 HydrophobicContact CD2-CG 4.26Å; L464-L700 HydrophobicContact CG-CD1 4.06Å; L468-L700 HydrophobicContact CD1-CD1 4.11Å; L468-L700 HydrophobicContact CD2-CD1 4.13Å; L468-L700 HydrophobicContact CD2-CD2 4.31Å; L468-L700 HydrophobicContact CG-CD1 4.42Å; I698-L700 HydrophobicContact CG2-CD1 4.31Å; I698-L700 HydrophobicContact CG2-CD2 3.83Å; I698-L700 HydrophobicContact CG2-CG 3.86Å; I698-L700 PolarHBondContact O-N 3.11Å; L700-V702 PolarHBondContact O-N 3.49Å
701	N	39	Very low	35.2	Very low	96 Å²	96	96.3 Å²	96.3	51%	0.513	51%	0.512	S	S	.	.			trans	-78.6	105.8	168.6	-80.9	-46.6	0	0	0	108.3	K408 K703	K408-N701 VanDerWaalsContact CE-OD1 3.27Å; K408-N701 WeakPolarHBondContact CE-OD1 3.17Å; K408-N701 PolarHBondContact NZ-OD1 2.98Å; N701-K703 PolarHBondContact O-N 2.89Å
702	V	36	Very low	35	Very low	55 Å²	55	99.5 Å²	99.5	33%	0.333	52%	0.517	S	S	.	.			trans	-76.3	110.4	167.2	-175.5	0	0	0	0	107.6	L700 V704	L700-V702 PolarHBondContact O-N 3.49Å; V702-V704 PolarHBondContact O-N 3.26Å; V702-V704 VanDerWaalsContact O-N 3.12Å
703	K	33.2	Very low	34.9	Very low	150 Å²	150	103 Å²	103	65%	0.652	53%	0.534	S	S	*	.			trans	-71.8	99.2	167	-88.1	177	177.5	158.7	0	108.1	E465 N701 V705	E465-K703 VanDerWaalsContact OE1-CE 3.28Å; E465-K703 WeakPolarHBondContact OE1-CE 3.34Å; E465-K703 IonicContact OE1-NZ 2.7Å; E465-K703 PolarHBondContact OE1-NZ 3.03Å; N701-K703 PolarHBondContact O-N 2.89Å; K703-V705 PolarHBondContact O-N 3.3Å
704	V	35.2	Very low	35	Very low	77 Å²	77	110.5 Å²	110.5	47%	0.467	56%	0.555	S	S	.	*			trans	-69.5	115.1	160.8	-177.1	0	0	0	0	106.2	L445 V702 K706	L445-V704 HydrophobicContact CD1-CG1 4.21Å; L445-V704 HydrophobicContact CD2-CG1 3.9Å; V702-V704 PolarHBondContact O-N 3.26Å; V702-V704 VanDerWaalsContact O-N 3.12Å; V704-K706 VanDerWaalsContact C-N 3.31Å; V704-K706 PolarHBondContact O-N 3.32Å
705	V	30.1	Very low	35.1	Very low	102 Å²	102	113.5 Å²	113.5	62%	0.618	58%	0.577	S	S	*	*			trans	-63	97.7	171.5	-178.7	0	0	0	0	107	K703 T707	K703-V705 PolarHBondContact O-N 3.3Å; V705-T707 HydrophobicContact CG1-CG2 4.34Å
706	K	28.7	Very low	35	Very low	182 Å²	182	122.6 Å²	122.6	79%	0.791	61%	0.609	S	S	*	*			trans	-83.8	105	160.1	-80.4	-175.4	174.7	-177.7	0	105.9	V704 R708	V704-K706 VanDerWaalsContact C-N 3.31Å; V704-K706 PolarHBondContact O-N 3.32Å; K706-R708 PolarHBondContact O-N 3.24Å
707	T	32.8	Very low	34.7	Very low	67 Å²	67	128.1 Å²	128.1	41%	0.411	64%	0.635	S	S	.	*			trans	-62	131.1	165.1	48.7	0	0	0	0	108.1	E600 V705 L709	E600-T707 PolarHBondContact OE1-OG1 3.36Å; E600-T707 PolarHBondContact OE2-OG1 3.14Å; V705-T707 HydrophobicContact CG1-CG2 4.34Å; T707-L709 PolarHBondContact O-N 3.29Å
708	R	31.2	Very low	34.5	Very low	228 Å²	228	130.1 Å²	130.1	86%	0.86	66%	0.657	S	S	*	*			trans	-68.7	99.4	176.1	-74.4	179.5	172.7	-176.8	-2.5	108.3	K706	K706-R708 PolarHBondContact O-N 3.24Å
709	L	29	Very low	34	Very low	154 Å²	154	138.1 Å²	138.1	81%	0.806	69%	0.69	S	S	*	*			trans	-102.2	83.8	157.8	-106.6	100.5	0	0	0	109	T707	T707-L709 PolarHBondContact O-N 3.29Å
710	A	31.5	Very low	33.5	Very low	94 Å²	94	140.1 Å²	140.1	78%	0.777	71%	0.705	S	S	*	*			trans	-142.4	73.9	166.8	0	0	0	0	0	107.9
711	S	33.1	Very low	33.3	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	72%	0.719	S	S	*	*	S	Bend	trans	-170.4	-3.3	163.5	60.2	0	0	0	0	116.2
712	L	31.4	Very low	33.1	Very low	148 Å²	148	145 Å²	145	78%	0.775	73%	0.731	S	S	*	*	S	Bend	trans	-128	134.4	-177.8	-71.7	161.7	0	0	0	110.7
713	L	31.6	Very low	33.1	Very low	169 Å²	169	150.1 Å²	150.1	89%	0.885	75%	0.751	S	S	*	*			trans	94.1	49.3	-177.1	-48.4	173.5	0	0	0	116
714	R	34.6	Very low	33.2	Very low	254 Å²	254	148.9 Å²	148.9	96%	0.958	76%	0.761	S	S	*	*			trans	-111.3	78.6	136.7	-76.3	-172.5	-154.5	-175.9	6.3	108.4
715	S	35.9	Very low	33.1	Very low	88 Å²	88	148.3 Å²	148.3	62%	0.615	77%	0.771	S	S	*	*			trans	-173.9	147.1	161.6	-174.5	0	0	0	0	107.8
716	Y	32.7	Very low	33.3	Very low	225 Å²	225	149.2 Å²	149.2	88%	0.882	78%	0.782	S	S	*	*			trans	85	71.2	179.8	-64.9	-81.9	0	0	0	117.3
717	K	36.1	Very low	33.6	Very low	206 Å²	206	145.2 Å²	145.2	90%	0.896	78%	0.777	S	S	*	*			trans	-81.5	148.5	142.9	-101.4	179.6	173.6	-179.4	0	109.2
718	A	35	Very low	33.6	Very low	92 Å²	92	147.2 Å²	147.2	76%	0.76	79%	0.794	S	S	*	*			trans	77.7	102.1	155.8	0	0	0	0	0	118.9
719	K	33.2	Very low	33.7	Very low	211 Å²	211	142 Å²	142	92%	0.917	79%	0.792	S	S	*	*				175.5	128.5	107	-92.9	174.5	178.9	-177.2	0	111.3
720	Q	31.9	Very low	33.8	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	79%	0.79	S	S	*	*			trans	-92.6	-173.6	162	-107.2	-160.6	6.5	0	0	108.4
721	P	37.3	Very low	33.8	Very low	87 Å²	87	143.7 Å²	143.7	57%	0.565	80%	0.796	S	S	*	*			cis	-137.6	-153.5	-28.6	34.5	-12.5	0	0	0	111.9
722	H	34.8	Very low	33.6	Very low	165 Å²	165	142.1 Å²	142.1	76%	0.764	80%	0.798	S	S	*	*			trans	104.6	140.2	169.4	-61.8	-77.2	0	0	0	115.2
723	H	36.2	Very low	33.6	Very low	162 Å²	162	143.8 Å²	143.8	75%	0.75	80%	0.801	S	S	*	*			cis	-179	155.3	-31.2	-120.7	-72	0	0	0	104.9
724	S	34.7	Very low	33.4	Very low	123 Å²	123	143.7 Å²	143.7	86%	0.86	80%	0.796	S	S	*	*			trans	71	141.1	165.6	72.1	0	0	0	0	118.1
725	G	33	Very low	33.3	Very low	66 Å²	66	139.3 Å²	139.3	68%	0.68	79%	0.791	S	S	*	*			cis	175	170.2	2.9	0	0	0	0	0	110.9
726	S	34.4	Very low	33.1	Very low	121 Å²	121	142.7 Å²	142.7	85%	0.846	79%	0.794	S	S	*	*			trans	80.5	145.2	172.3	95.4	0	0	0	0	117.5
727	S	34.2	Very low	33.1	Very low	98 Å²	98	137.7 Å²	137.7	69%	0.685	79%	0.789	S	S	*	*			cis	178.5	140.3	-45.2	38.8	0	0	0	0	106.1
728	S	33.5	Very low	32.9	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	79%	0.788	S	S	*	*			trans	53.6	118.4	152.4	63.4	0	0	0	0	120.4
729	S	32.8	Very low	33	Very low	117 Å²	117	139.2 Å²	139.2	82%	0.818	79%	0.785	S	S	*	*				177	136.4	94.7	60.1	0	0	0	0	111.9
730	S	31.8	Very low	33.2	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	78%	0.776	S	S	*	*			trans	-54.5	143.2	175.2	49.9	0	0	0	0	115.9
731	L	31.9	Very low	33.4	Very low	175 Å²	175	132.1 Å²	132.1	92%	0.916	78%	0.776	S	S	*	*			trans	-159.3	116.5	135	-103.7	150.9	0	0	0	107.7
732	G	28	Very low	33.3	Very low	78 Å²	78	131.6 Å²	131.6	80%	0.804	79%	0.787	S	S	*	*			trans	-76.1	137.8	173	0	0	0	0	0	109.9
733	E	31.2	Very low	33.3	Very low	183 Å²	183	132.2 Å²	132.2	86%	0.855	79%	0.79	S	S	*	*			trans	-124.4	106.1	168.3	-150.5	173.1	174	0	0	108.8	I735	E733-I735 PolarHBondContact O-N 3.39Å
734	E	28.9	Very low	33.3	Very low	167 Å²	167	130.3 Å²	130.3	78%	0.78	79%	0.792	S	S	*	*			trans	-69.2	105	172.7	-174.2	-174.9	174.4	0	0	108.7	K736	E734-K736 PolarHBondContact O-N 3.31Å
735	I	32.7	Very low	33.4	Very low	163 Å²	163	134.2 Å²	134.2	84%	0.836	79%	0.794	S	S	*	*			trans	-78.1	95.5	176.1	-57.6	176.6	0	0	0	108.6	E733	E733-I735 PolarHBondContact O-N 3.39Å
736	K	31.3	Very low	34	Very low	158 Å²	158	141.7 Å²	141.7	69%	0.687	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-60.7	148.8	169.6	-84.4	175.3	176.7	170.2	0	112	E734	E734-K736 PolarHBondContact O-N 3.31Å
737	P	33	Very low	34.7	Very low	120 Å²	120	141.1 Å²	141.1	78%	0.779	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.5	139.3	174.9	27	-31.2	0	0	0	111.1
738	Y	30.8	Very low	35.4	Very low	225 Å²	225	140.8 Å²	140.8	88%	0.882	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53.5	133.1	174.9	-88.2	-96.5	0	0	0	111.3
739	P	37.3	Very low	36.6	Very low	106 Å²	106	142.4 Å²	142.4	69%	0.688	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.1	153	174.8	31.1	-31.6	0	0	0	110.9
740	P	37.2	Very low	37.9	Very low	112 Å²	112	137 Å²	137	73%	0.727	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-63.7	158	172.7	27.6	-33	0	0	0	111.5	G742	P740-G742 PolarHBondContact O-N 3.24Å
741	P	37	Very low	39.1	Very low	130 Å²	130	137.1 Å²	137.1	84%	0.844	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-58.1	133.8	-177.9	-16	28.5	0	0	0	111.3
742	G	34.5	Very low	40.4	Very low	77 Å²	77	135 Å²	135	79%	0.794	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-63.6	135.7	-170.6	0	0	0	0	0	115	P740	P740-G742 PolarHBondContact O-N 3.24Å
743	E	35.4	Very low	41.7	Very low	178 Å²	178	138 Å²	138	83%	0.832	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-65.8	144.2	164.1	-74.7	177.6	149.9	0	0	111.2	K745	E743-K745 PolarHBondContact O-N 3.28Å
744	P	35.8	Very low	43.3	Very low	122 Å²	122	133.4 Å²	133.4	79%	0.792	74%	0.738	S	S	*	*			trans	-69.4	102.7	171.5	28.2	-30.3	0	0	0	109.7	R746	P744-R746 PolarHBondContact O-N 3.45Å
745	K	36.7	Very low	45.1	Very low	205 Å²	205	128.5 Å²	128.5	89%	0.891	72%	0.715	S	S	*	*			trans	-65.5	96.1	169.2	-70.8	-178.3	-179.9	176.8	0	109.9	E743	E743-K745 PolarHBondContact O-N 3.28Å
746	R	45.8	Very low	46.3	Very low	222 Å²	222	129.4 Å²	129.4	84%	0.838	71%	0.713	S	S	*	*			trans	-80	135.9	156.3	-76.3	-174.5	179.8	-153.6	-1.9	108.6	P744 V748	P744-R746 PolarHBondContact O-N 3.45Å; R746-V748 PolarHBondContact O-N 3.24Å
747	P	48.5	Very low	47.5	Very low	109 Å²	109	124.2 Å²	124.2	71%	0.708	70%	0.695	S	S	*	*			trans	-66.9	129.5	176.3	26.4	-30.9	0	0	0	109.9	I749	P747-I749 PolarHBondContact O-N 2.86Å
748	V	48.4	Very low	48.7	Very low	92 Å²	92	122.7 Å²	122.7	56%	0.558	68%	0.684	S	S	*	*			trans	-74.6	115.2	167.4	179.2	0	0	0	0	107.1	R746	R746-V748 PolarHBondContact O-N 3.24Å
749	I	59	Low	49.6	Very low	143 Å²	143	120.8 Å²	120.8	73%	0.733	68%	0.68	S	S	*	*			trans	-96.6	121.3	177.4	-61.2	172.3	0	0	0	107.2	P747	P747-I749 PolarHBondContact O-N 2.86Å
750	C	60.3	Low	50.2	Low	4 Å²	4	119.1 Å²	119.1	3%	0.027	67%	0.669	C	S	.	*			trans	-65.6	143.4	171.1	-64.4	0	0	0	0	109.3	K752 Q755 C771	C750-K752 PolarHBondContact O-N 3.43Å; C750-Q755 HydrophobicContact CB-CB 3.84Å; C750-C771 VanDerWaalsContact CA-SG 3.56Å; C750-C771 HydrophobicContact CB-CB 3.89Å; C750-C771 WeakPolarHBondContact CB-SG 3.27Å; C750-C771 WeakPolarHBondContact SG-CB 3.4Å; C750-C771 CovalentContact SG-SG 2.04Å; C750-C771 PolarHBondContact SG-SG 3.03Å
751	P	58.2	Low	50.8	Low	111 Å²	111	117.7 Å²	117.7	72%	0.721	67%	0.667	S	S	*	*	S	Bend	trans	-62.5	-16	-169.8	21.5	-32.3	0	0	0	115
752	K	58.8	Low	51.1	Low	130 Å²	130	118.3 Å²	118.3	57%	0.565	67%	0.671	S	S	*	*	S	Bend	trans	-103.7	129.7	174.4	-69.6	-176	178.5	178.4	0	111	C750 G754 Q755	C750-K752 PolarHBondContact O-N 3.43Å; K752-G754 PolarHBondContact O-N 2.86Å; K752-Q755 PolarHBondContact O-N 2.81Å
753	P	55.6	Low	51.8	Low	140 Å²	140	118.6 Å²	118.6	91%	0.909	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	130.1	173.8	-20.8	30.4	0	0	0	111.1
754	G	64.4	Low	52	Low	87 Å²	87	114 Å²	114	90%	0.897	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	101.5	-8.1	176.3	0	0	0	0	0	116.7	K752	K752-G754 PolarHBondContact O-N 2.86Å
755	Q	66.7	Low	51.9	Low	64 Å²	64	114.6 Å²	114.6	30%	0.299	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-90.4	132.8	175.8	-70.5	-172.9	-23.4	0	0	112.6	C750 K752 P772	C750-Q755 HydrophobicContact CB-CB 3.84Å; K752-Q755 PolarHBondContact O-N 2.81Å; Q755-P772 PolarHBondContact NE2-O 3.46Å
756	K	57.4	Low	52.2	Low	182 Å²	182	108.1 Å²	108.1	79%	0.791	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-103.1	134.3	172.2	-73.9	-179.5	179.7	175.2	0	110.1
757	P	55.8	Low	51.9	Low	49 Å²	49	101.7 Å²	101.7	32%	0.318	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-69.2	138.3	177.1	26.4	-31.8	0	0	0	111.2	L769	P757-L769 HydrophobicContact CB-CD2 3.84Å; P757-L769 HydrophobicContact CG-CD2 4.29Å
758	T	58.9	Low	52	Low	88 Å²	88	100.8 Å²	100.8	54%	0.54	64%	0.644	S	S	.	*	B	Isolated β-bridge	trans	-110.4	137.1	-175.6	-21.7	0	0	0	0	110.2	I770	T758-I770 PolarHBondContact N-O 2.79Å
759	K	50.2	Low	51.9	Low	185 Å²	185	100.9 Å²	100.9	80%	0.804	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-78	136.5	173	-105.6	-177	176.4	-177.5	0	110.1
760	P	49.2	Very low	51.9	Low	71 Å²	71	98.9 Å²	98.9	46%	0.461	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-68.1	155.6	169.3	-9.9	25.2	0	0	0	111.3	I770	P760-I770 HydrophobicContact CG-CD1 4.47Å
761	A	51	Low	51.7	Low	83 Å²	83	100.8 Å²	100.8	69%	0.686	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-53.6	153.4	176.6	0	0	0	0	0	113.3	G763	A761-G763 PolarHBondContact O-N 2.72Å; A761-G763 VanDerWaalsContact O-N 3.12Å
762	P	43.6	Very low	51.8	Low	142 Å²	142	98.7 Å²	98.7	92%	0.922	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	112.5	-174.6	26.4	-32.8	0	0	0	111
763	G	48.4	Very low	51.7	Low	83 Å²	83	95.9 Å²	95.9	86%	0.856	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	159.9	-16.5	177.9	0	0	0	0	0	115.9	A761	A761-G763 PolarHBondContact O-N 2.72Å; A761-G763 VanDerWaalsContact O-N 3.12Å
764	S	40	Very low	51.7	Low	82 Å²	82	94 Å²	94	57%	0.573	61%	0.612	S	S	*	*			trans	-97.6	124.9	179.1	-175.9	0	0	0	0	112.3	S766	S764-S766 VanDerWaalsContact C-N 3.26Å; S764-S766 PolarHBondContact O-N 2.92Å
765	S	34	Very low	51.3	Low	134 Å²	134	96.3 Å²	96.3	94%	0.937	60%	0.603	S	S	*	*	S	Bend	trans	-83.8	22.2	-178.2	57.8	0	0	0	0	114.5
766	S	42.4	Very low	50.5	Low	69 Å²	69	101.3 Å²	101.3	48%	0.483	63%	0.632	S	S	.	*			trans	-121.7	118.7	168.7	79.8	0	0	0	0	110.1	S764 V768	S764-S766 VanDerWaalsContact C-N 3.26Å; S764-S766 PolarHBondContact O-N 2.92Å; S766-V768 PolarHBondContact O-N 3.28Å
767	G	40	Very low	49.8	Very low	88 Å²	88	95.5 Å²	95.5	91%	0.907	62%	0.619	S	S	*	*			trans	-73.6	41.9	-176.9	0	0	0	0	0	114.3
768	V	49.4	Very low	48.8	Very low	90 Å²	90	101.2 Å²	101.2	55%	0.545	64%	0.644	S	S	.	*			trans	-88.2	119.2	-175.8	-173.8	0	0	0	0	109.9	S766	S766-V768 PolarHBondContact O-N 3.28Å
769	L	47.3	Very low	47.7	Very low	94 Å²	94	104.7 Å²	104.7	49%	0.492	66%	0.655	S	S	.	*			trans	-77.1	133.1	169.5	-82.1	141.6	0	0	0	109.5	P757	P757-L769 HydrophobicContact CB-CD2 3.84Å; P757-L769 HydrophobicContact CG-CD2 4.29Å
770	I	57.7	Low	47	Very low	101 Å²	101	103 Å²	103	52%	0.518	65%	0.653	S	S	.	*	B	Isolated β-bridge	trans	-116.1	133.3	-177.1	-54.4	173.5	0	0	0	109.5	T758 P760	T758-I770 PolarHBondContact N-O 2.79Å; P760-I770 HydrophobicContact CG-CD1 4.47Å
771	C	57	Low	46.1	Very low	43 Å²	43	104.6 Å²	104.6	29%	0.291	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-96	118.4	168.3	-65.1	0	0	0	0	108.7	C750	C750-C771 VanDerWaalsContact CA-SG 3.56Å; C750-C771 HydrophobicContact CB-CB 3.89Å; C750-C771 WeakPolarHBondContact CB-SG 3.27Å; C750-C771 WeakPolarHBondContact SG-CB 3.4Å; C750-C771 CovalentContact SG-SG 2.04Å; C750-C771 PolarHBondContact SG-SG 3.03Å
772	P	60.3	Low	45.3	Very low	67 Å²	67	105.9 Å²	105.9	44%	0.435	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-71.5	132	-177.7	25.7	-31.1	0	0	0	112.6	Q755	Q755-P772 PolarHBondContact NE2-O 3.46Å
773	T	56.9	Low	44.7	Very low	71 Å²	71	106.7 Å²	106.7	44%	0.436	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-95	153.6	168.9	50.2	0	0	0	0	110.6	D775 A777	T773-D775 PolarHBondContact O-N 3.04Å; T773-A777 PolarHBondContact OG1-O 3.31Å
774	P	56.1	Low	44	Very low	102 Å²	102	108.4 Å²	108.4	66%	0.662	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-11.7	178.9	-20.9	33.2	0	0	0	115.8
775	D	55.7	Low	43.6	Very low	134 Å²	134	110.1 Å²	110.1	72%	0.717	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	17.8	-163.5	-61.3	-42.8	0	0	0	115.5	T773 A777	T773-D775 PolarHBondContact O-N 3.04Å; D775-A777 PolarHBondContact O-N 3.43Å
776	N	48.6	Very low	43.7	Very low	169 Å²	169	109.7 Å²	109.7	90%	0.904	66%	0.656	S	S	*	*			trans	53.5	14.2	179.3	-94.7	-6.5	0	0	0	115.7
777	A	42.6	Very low	43	Very low	61 Å²	61	112.1 Å²	112.1	50%	0.504	66%	0.663	S	S	.	*			trans	-89.9	129.2	177.7	0	0	0	0	0	111.4	T773 D775 E779	T773-A777 PolarHBondContact OG1-O 3.31Å; D775-A777 PolarHBondContact O-N 3.43Å; A777-E779 PolarHBondContact O-N 2.85Å
778	I	35.4	Very low	42.5	Very low	168 Å²	168	114 Å²	114	86%	0.862	66%	0.659	S	S	*	*			trans	-79.8	95.4	173.6	-58	172.9	0	0	0	107.8
779	E	35.7	Very low	41.4	Very low	161 Å²	161	115 Å²	115	75%	0.752	67%	0.665	S	S	*	*			trans	-103.9	111.3	173.3	-136.4	179.9	-169.7	0	0	109.7	A777 V781	A777-E779 PolarHBondContact O-N 2.85Å; E779-V781 PolarHBondContact O-N 2.64Å; E779-V781 VanDerWaalsContact O-N 3.11Å
780	I	35.3	Very low	40.4	Very low	150 Å²	150	113.2 Å²	113.2	77%	0.769	66%	0.664	S	S	*	*			trans	-71.9	99.9	170.6	-60.2	171.8	0	0	0	106.3	P782	I780-P782 WeakPolarHBondContact O-CD 3.39Å
781	V	30.7	Very low	38.9	Very low	105 Å²	105	117.2 Å²	117.2	64%	0.636	68%	0.68	S	S	*	*			trans	-66.2	112.6	175.9	-178.8	0	0	0	0	109	E779 L783	E779-V781 PolarHBondContact O-N 2.64Å; E779-V781 VanDerWaalsContact O-N 3.11Å; V781-L783 PolarHBondContact O-N 3.13Å
782	P	34.8	Very low	37.6	Very low	110 Å²	110	122.3 Å²	122.3	71%	0.714	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-74.2	125.6	170.3	-1	20.2	0	0	0	107.5	I780	I780-P782 WeakPolarHBondContact O-CD 3.39Å
783	L	31.2	Very low	36.1	Very low	159 Å²	159	122 Å²	122	83%	0.832	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-62.5	137.4	167.3	-100.6	96.4	0	0	0	109.1	V781 T785	V781-L783 PolarHBondContact O-N 3.13Å; L783-T785 PolarHBondContact O-N 2.75Å
784	P	33.9	Very low	34.8	Very low	118 Å²	118	122.7 Å²	122.7	77%	0.766	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-70.8	118.4	-166.8	27.6	-33.4	0	0	0	111.5
785	T	30.2	Very low	33.5	Very low	119 Å²	119	121.6 Å²	121.6	73%	0.73	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-73.8	129.5	157.7	39.6	0	0	0	0	110.3	L783	L783-T785 PolarHBondContact O-N 2.75Å
786	P	36	Very low	32.2	Very low	125 Å²	125	120.1 Å²	120.1	81%	0.812	70%	0.695	S	S	*	*			trans	-93.7	114.1	140.6	18.5	-2	0	0	0	108.4
787	L	28.8	Very low	31.4	Very low	120 Å²	120	120.2 Å²	120.2	63%	0.628	70%	0.695	S	S	*	*			trans	-62.8	159.4	167.7	-76.1	152.2	0	0	0	110.3	T789	L787-T789 HydrophobicContact CD2-CG2 3.86Å; L787-T789 WeakPolarHBondContact CD2-OG1 3.34Å
788	P	29	Very low	30.6	Very low	127 Å²	127	123.4 Å²	123.4	83%	0.825	70%	0.699	S	S	*	*				-117.9	127.8	75.4	7.6	12.2	0	0	0	112.1	A790	P788-A790 PolarHBondContact O-N 3.31Å
789	T	26.5	Very low	30.3	Very low	112 Å²	112	119.8 Å²	119.8	69%	0.687	69%	0.694	S	S	*	*			trans	-60	116.1	156.3	6.9	0	0	0	0	107.8	L787	L787-T789 HydrophobicContact CD2-CG2 3.86Å; L787-T789 WeakPolarHBondContact CD2-OG1 3.34Å
790	A	26.4	Very low	29.9	Very low	55 Å²	55	117.9 Å²	117.9	46%	0.455	69%	0.693	S	S	.	*			trans	-103.8	102.6	159.7	0	0	0	0	0	106.9	P788 Y792	P788-A790 PolarHBondContact O-N 3.31Å; A790-Y792 HydrophobicContact CB-CD2 3.87Å; A790-Y792 HydrophobicContact CB-CE2 4.05Å; A790-Y792 PolarHBondContact O-N 2.9Å
791	E	26.8	Very low	29.6	Very low	186 Å²	186	119.1 Å²	119.1	87%	0.869	70%	0.702	S	S	*	*			trans	-63	112.1	163.7	-78.3	175	145.2	0	0	108.2
792	Y	27.8	Very low	29.3	Very low	149 Å²	149	120.7 Å²	120.7	58%	0.584	70%	0.703	S	S	*	*			trans	-132.6	145.1	169.8	-88	-82.8	0	0	0	109.9	A790 S794 R970	A790-Y792 HydrophobicContact CB-CD2 3.87Å; A790-Y792 HydrophobicContact CB-CE2 4.05Å; A790-Y792 PolarHBondContact O-N 2.9Å; Y792-S794 PolarHBondContact O-N 3.31Å; Y792-R970 WeakPolarHBondContact CD1-O 3.3Å; Y792-R970 WeakPolarHBondContact CE1-O 3.5Å
793	P	29.3	Very low	28.9	Very low	61 Å²	61	121.7 Å²	121.7	40%	0.396	71%	0.707	S	S	.	*	S	Bend	trans	-89.2	106.2	-142	33.7	-34.1	0	0	0	111.7	T971	P793-T971 HydrophobicContact CG-CG2 3.82Å
794	S	30.2	Very low	28.7	Very low	86 Å²	86	120.4 Å²	120.4	60%	0.601	70%	0.7	S	S	*	*	S	Bend	trans	-114.5	17.5	140.7	72.4	0	0	0	0	111.4	Y792	Y792-S794 PolarHBondContact O-N 3.31Å
795	S	29.1	Very low	28.2	Very low	78 Å²	78	121.9 Å²	121.9	55%	0.545	70%	0.701	S	S	.	*			trans	-136.2	17.4	-176.6	50.4	0	0	0	0	114.1	L797 E798	S795-L797 PolarHBondContact O-N 3.44Å; S795-E798 PolarHBondContact O-N 3.24Å; S795-E798 VanDerWaalsContact O-N 3.15Å
796	S	28	Very low	28.1	Very low	103 Å²	103	121.3 Å²	121.3	72%	0.72	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	36.6	-177.7	61.6	0	0	0	0	115.5
797	L	31.4	Very low	27.7	Very low	171 Å²	171	120.7 Å²	120.7	90%	0.895	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.8	5.6	160.3	-112.2	141.8	0	0	0	112.7	S795	S795-L797 PolarHBondContact O-N 3.44Å
798	E	27.4	Very low	27.7	Very low	129 Å²	129	122.2 Å²	122.2	60%	0.603	71%	0.705	S	S	*	*	S	Bend	trans	-119.4	48.8	179.8	-66.9	-174.9	159	0	0	111.8	S795 I830	S795-E798 PolarHBondContact O-N 3.24Å; S795-E798 VanDerWaalsContact O-N 3.15Å; E798-I830 VanDerWaalsContact OE1-CG2 3.25Å; E798-I830 WeakPolarHBondContact OE1-CG2 3.16Å
799	A	27.5	Very low	27.7	Very low	91 Å²	91	119.5 Å²	119.5	75%	0.752	69%	0.688	S	S	*	*	S	Bend	trans	-172.1	94.6	161	0	0	0	0	0	108.6
800	V	27.4	Very low	27.9	Very low	122 Å²	122	124.1 Å²	124.1	74%	0.739	70%	0.698	S	S	*	*			trans	158	123	152	169.5	0	0	0	0	105.7	M802	V800-M802 HydrophobicContact CG1-CB 4.23Å; V800-M802 HydrophobicContact CG1-CG 4.48Å; V800-M802 PolarHBondContact O-N 2.86Å
801	N	29.3	Very low	28.2	Very low	176 Å²	176	128.3 Å²	128.3	94%	0.941	70%	0.704	S	S	*	*	S	Bend	trans	-64	52.7	174.1	-91.9	-14.1	0	0	0	113.2
802	M	25.6	Very low	28.5	Very low	137 Å²	137	125.3 Å²	125.3	68%	0.675	69%	0.693	S	S	*	*			trans	-140.1	107.9	168.4	-76.5	-153.3	-55.2	0	0	110	V800 I804	V800-M802 HydrophobicContact CG1-CB 4.23Å; V800-M802 HydrophobicContact CG1-CG 4.48Å; V800-M802 PolarHBondContact O-N 2.86Å; M802-I804 PolarHBondContact O-N 3.4Å
803	V	25.2	Very low	28.9	Very low	132 Å²	132	124.5 Å²	124.5	80%	0.8	70%	0.697	S	S	*	*			trans	-64.8	99.4	167.4	178.3	0	0	0	0	108	L805	V803-L805 HydrophobicContact CG1-CD1 3.92Å; V803-L805 HydrophobicContact CG1-CG 4.24Å
804	I	26.4	Very low	29.1	Very low	132 Å²	132	126 Å²	126	68%	0.677	71%	0.709	S	S	*	*			trans	-114	96.6	159.3	-56.2	178.6	0	0	0	105.6	M802 P806	M802-I804 PolarHBondContact O-N 3.4Å; I804-P806 WeakPolarHBondContact O-CD 3.31Å
805	L	25	Very low	29.2	Very low	149 Å²	149	126.7 Å²	126.7	78%	0.78	71%	0.706	S	S	*	*			trans	-77.4	104	166.1	-81.6	148.1	0	0	0	107.6	V803 S807	V803-L805 HydrophobicContact CG1-CD1 3.92Å; V803-L805 HydrophobicContact CG1-CG 4.24Å; L805-S807 PolarHBondContact O-N 3.37Å
806	P	27.7	Very low	29.5	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	72%	0.72	S	S	*	*			trans	-67.8	118.8	156.7	30.6	-29.6	0	0	0	105.8	I804 L808	I804-P806 WeakPolarHBondContact O-CD 3.31Å; P806-L808 PolarHBondContact O-N 3.22Å
807	S	27.2	Very low	29.8	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	70%	0.704	S	S	*	*			trans	-52	109.3	170.9	38.3	0	0	0	0	108.8	L805 P809	L805-S807 PolarHBondContact O-N 3.37Å; S807-P809 WeakPolarHBondContact O-CD 3.24Å
808	L	28.8	Very low	30	Very low	152 Å²	152	123.3 Å²	123.3	80%	0.796	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-56.1	123.9	168	-78.5	166.6	0	0	0	106.8	P806 K810	P806-L808 PolarHBondContact O-N 3.22Å; L808-K810 PolarHBondContact O-N 3.29Å
809	P	29.9	Very low	30.2	Very low	70 Å²	70	121.8 Å²	121.8	46%	0.455	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-60.1	128.6	174.9	15.8	-17.8	0	0	0	107.8	S807 Y811	S807-P809 WeakPolarHBondContact O-CD 3.24Å; P809-Y811 PolarHBondContact O-N 2.78Å
810	K	29.4	Very low	30.5	Very low	210 Å²	210	121.6 Å²	121.6	91%	0.913	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-51	117.6	173.4	-80	-179.7	176.3	177.1	0	108.1	L808 D812	L808-K810 PolarHBondContact O-N 3.29Å; K810-D812 PolarHBondContact O-N 2.84Å
811	Y	33.4	Very low	31.2	Very low	143 Å²	143	117.4 Å²	117.4	56%	0.561	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-65.8	125.8	172.1	-84.7	-94.4	0	0	0	108.3	P809 M813	P809-Y811 PolarHBondContact O-N 2.78Å; Y811-M813 PolarHBondContact O-N 3.41Å; Y811-M813 VanDerWaalsContact O-N 3.11Å
812	D	32.9	Very low	31.7	Very low	123 Å²	123	113.5 Å²	113.5	66%	0.658	61%	0.614	S	S	*	*			trans	-69.8	104.8	169.1	-176.8	5.6	0	0	0	108.8	K810 S814	K810-D812 PolarHBondContact O-N 2.84Å; D812-S814 VanDerWaalsContact C-N 3.32Å; D812-S814 VanDerWaalsContact CG-OG 3.25Å; D812-S814 WeakPolarHBondContact OD1-CB 3.43Å; D812-S814 PolarHBondContact OD1-N 2.77Å; D812-S814 PolarHBondContact OD1-OG 3.06Å; D812-S814 PolarHBondContact OD2-OG 2.61Å
813	M	37	Very low	32.4	Very low	132 Å²	132	109.2 Å²	109.2	65%	0.65	59%	0.593	S	S	*	*			trans	-90.7	8.8	178.6	-61.2	-139.3	74.1	0	0	112.8	Y811 N815 I818	Y811-M813 PolarHBondContact O-N 3.41Å; Y811-M813 VanDerWaalsContact O-N 3.11Å; M813-N815 VanDerWaalsContact C-N 3.29Å; M813-N815 PolarHBondContact O-N 2.84Å; M813-I818 HydrophobicContact CB-CD1 4.46Å; M813-I818 HydrophobicContact CE-CD1 3.59Å; M813-I818 HydrophobicContact CE-CG2 3.76Å
814	S	33.4	Very low	33.6	Very low	93 Å²	93	104.2 Å²	104.2	65%	0.65	56%	0.561	S	S	*	*			trans	-77.9	-8.6	-174	68.9	0	0	0	0	114.8	D812	D812-S814 VanDerWaalsContact C-N 3.32Å; D812-S814 VanDerWaalsContact CG-OG 3.25Å; D812-S814 WeakPolarHBondContact OD1-CB 3.43Å; D812-S814 PolarHBondContact OD1-N 2.77Å; D812-S814 PolarHBondContact OD1-OG 3.06Å; D812-S814 PolarHBondContact OD2-OG 2.61Å
815	N	32.4	Very low	34	Very low	100 Å²	100	105.4 Å²	105.4	54%	0.535	57%	0.568	S	S	.	*	S	Bend	trans	-84.8	124.9	-177.1	-143.1	-7.2	0	0	0	111.1	M813 T817	M813-N815 VanDerWaalsContact C-N 3.29Å; M813-N815 PolarHBondContact O-N 2.84Å; N815-T817 PolarHBondContact O-N 3.06Å
816	Q	33.9	Very low	34.5	Very low	181 Å²	181	100.1 Å²	100.1	85%	0.846	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	0.4	-174.1	-76.7	176.4	-17.7	0	0	115.9
817	T	35.1	Very low	34.5	Very low	63 Å²	63	105.5 Å²	105.5	39%	0.387	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.2	-176	48.5	0	0	0	0	114.8	N815 H821	N815-T817 PolarHBondContact O-N 3.06Å; T817-H821 PolarHBondContact O-CE1 2.74Å; T817-H821 VanDerWaalsContact O-CE1 3.27Å
818	I	34.7	Very low	34.5	Very low	37 Å²	37	106.1 Å²	106.1	19%	0.19	54%	0.543	C	S	.	.	G	3₁₀ helix	trans	-82.8	-21.7	-174.9	-58.8	175.6	0	0	0	112.6	M813 D820	M813-I818 HydrophobicContact CB-CD1 4.46Å; M813-I818 HydrophobicContact CE-CD1 3.59Å; M813-I818 HydrophobicContact CE-CG2 3.76Å; I818-D820 PolarHBondContact O-N 3.12Å
819	A	31.8	Very low	34.3	Very low	96 Å²	96	105.8 Å²	105.8	79%	0.793	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-73.5	-8.3	-179.1	0	0	0	0	0	114.2
820	D	34.8	Very low	34.2	Very low	88 Å²	88	107.9 Å²	107.9	47%	0.471	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-100.7	4.3	-164.9	-84.3	-41.6	0	0	0	115.7	I818 R1071	I818-D820 PolarHBondContact O-N 3.12Å; D820-R1071 PolarHBondContact O-NH1 3.33Å; D820-R1071 IonicContact OD1-CZ 3.01Å; D820-R1071 IonicContact OD1-NH1 3.01Å; D820-R1071 PolarHBondContact OD1-NH1 2.76Å
821	H	40.7	Very low	33.9	Very low	33 Å²	33	104.7 Å²	104.7	15%	0.153	55%	0.546	C	S	.	.	S	Bend	trans	-159	147.7	179.2	50.7	-74.7	0	0	0	112	T817 H823 V1074	T817-H821 PolarHBondContact O-CE1 2.74Å; T817-H821 VanDerWaalsContact O-CE1 3.27Å; H821-H823 AromaticContact CD2-NE2 3.74Å; H821-H823 AromaticContact NE2-CE1 3.72Å; H821-H823 AromaticContact NE2-NE2 3.4Å; H821-H823 PolarHBondContact NE2-NE2 2.89Å; H821-H823 PolarHBondContact O-N 3.35Å; H821-V1074 HydrophobicContact CB-CG1 4Å
822	E	39.6	Very low	33.4	Very low	95 Å²	95	101 Å²	101	44%	0.444	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.2	113.9	179.3	-70.6	-175.1	162.8	0	0	110.8	L900 R1041	E822-L900 WeakPolarHBondContact OE2-CD1 3.17Å; E822-R1041 IonicContact OE2-CZ 3.09Å; E822-R1041 VanDerWaalsContact OE2-CZ 3.27Å; E822-R1041 IonicContact OE2-NE 3.83Å; E822-R1041 PolarHBondContact OE2-NE 2.95Å; E822-R1041 IonicContact OE2-NH2 2.65Å; E822-R1041 PolarHBondContact OE2-NH2 3.19Å
823	H	40.2	Very low	32.9	Very low	47 Å²	47	104.2 Å²	104.2	22%	0.218	56%	0.562	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.7	128.2	166.5	-72.5	-88.3	0	0	0	109.8	H821 L825 M1038	H821-H823 AromaticContact CD2-NE2 3.74Å; H821-H823 AromaticContact NE2-CE1 3.72Å; H821-H823 AromaticContact NE2-NE2 3.4Å; H821-H823 PolarHBondContact NE2-NE2 2.89Å; H821-H823 PolarHBondContact O-N 3.35Å; H823-L825 VanDerWaalsContact C-N 3.34Å; H823-L825 PolarHBondContact O-N 3.1Å; H823-M1038 WeakPolarHBondContact CE1-CE 3.43Å; H823-M1038 WeakPolarHBondContact ND1-CE 3.35Å
824	I	50.6	Low	32.2	Very low	26 Å²	26	103.6 Å²	103.6	13%	0.133	57%	0.571	C	S	.	*			trans	-80.9	90.6	172.6	-61.5	171.6	0	0	0	106.6	V826 A903 P1039 R1041	I824-V826 PolarHBondContact O-N 3.45Å; I824-A903 HydrophobicContact CD1-CB 3.59Å; I824-A903 HydrophobicContact CG2-CB 4.47Å; I824-P1039 PolarHBondContact N-O 3.08Å; I824-R1041 HydrophobicContact CD1-CB 4.09Å; I824-R1041 HydrophobicContact CD1-CG 4.08Å; I824-R1041 HydrophobicContact CG1-CG 4.28Å
825	L	34.9	Very low	31.8	Very low	157 Å²	157	104.2 Å²	104.2	82%	0.822	58%	0.581	S	S	*	*			trans	-67.7	102.8	165.7	-71.7	170.9	0	0	0	107.4	H823 R827	H823-L825 VanDerWaalsContact C-N 3.34Å; H823-L825 PolarHBondContact O-N 3.1Å; L825-R827 PolarHBondContact O-N 3.26Å; L825-R827 VanDerWaalsContact O-N 3.08Å
826	V	37.1	Very low	31.5	Very low	38 Å²	38	107.2 Å²	107.2	23%	0.23	60%	0.596	C	S	.	*			trans	-65	108.8	167.8	-176.5	0	0	0	0	105.8	I824 D828	I824-V826 PolarHBondContact O-N 3.45Å; V826-D828 VanDerWaalsContact C-N 3.34Å; V826-D828 PolarHBondContact O-N 3.31Å
827	R	27.7	Very low	31.2	Very low	220 Å²	220	103.4 Å²	103.4	83%	0.83	60%	0.595	S	S	*	*			trans	-67.6	102.2	163.4	-80.1	-172.7	175.8	111.5	-1.1	106.1	L825 N829	L825-R827 PolarHBondContact O-N 3.26Å; L825-R827 VanDerWaalsContact O-N 3.08Å; R827-N829 VanDerWaalsContact C-N 3.29Å; R827-N829 PolarHBondContact O-N 3.15Å
828	D	27	Very low	30.8	Very low	124 Å²	124	109.4 Å²	109.4	66%	0.663	62%	0.616	S	S	*	*			trans	-62.9	96.3	165.5	-72.4	-28.1	0	0	0	107.2	V826 I830	V826-D828 VanDerWaalsContact C-N 3.34Å; V826-D828 PolarHBondContact O-N 3.31Å; D828-I830 HydrophobicContact CB-CG1 4.49Å; D828-I830 PolarHBondContact O-N 3.37Å
829	N	24.1	Very low	30.4	Very low	146 Å²	146	111.4 Å²	111.4	78%	0.781	65%	0.646	S	S	*	*			trans	-74.7	76.4	165.3	-81	-5.5	0	0	0	107.5	R827	R827-N829 VanDerWaalsContact C-N 3.29Å; R827-N829 PolarHBondContact O-N 3.15Å
830	I	26.6	Very low	30.3	Very low	113 Å²	113	114.7 Å²	114.7	58%	0.579	65%	0.645	S	S	*	*			trans	-87.2	118.6	159.7	-62.3	175.9	0	0	0	106.5	E798 D828 G832	E798-I830 VanDerWaalsContact OE1-CG2 3.25Å; E798-I830 WeakPolarHBondContact OE1-CG2 3.16Å; D828-I830 HydrophobicContact CB-CG1 4.49Å; D828-I830 PolarHBondContact O-N 3.37Å; I830-G832 PolarHBondContact O-N 2.9Å
831	V	23	Very low	29.9	Very low	144 Å²	144	116.5 Å²	116.5	87%	0.873	66%	0.659	S	S	*	*			trans	-64.1	117.8	174.5	173.8	0	0	0	0	108.2
832	G	23.2	Very low	29.4	Very low	64 Å²	64	119.7 Å²	119.7	66%	0.66	69%	0.691	S	S	*	*			trans	-161.2	100.4	169.3	0	0	0	0	0	108.7	I830 S834	I830-G832 PolarHBondContact O-N 2.9Å; G832-S834 PolarHBondContact O-N 3.5Å
833	E	22.1	Very low	28.8	Very low	192 Å²	192	120.6 Å²	120.6	90%	0.897	71%	0.708	S	S	*	*			trans	-50.9	120.6	164.4	-73	170.6	134.3	0	0	109.3
834	S	23.1	Very low	28.1	Very low	119 Å²	119	124 Å²	124	83%	0.832	74%	0.735	S	S	*	*			trans	144.6	144.7	144.9	-66.6	0	0	0	0	112.7	G832	G832-S834 PolarHBondContact O-N 3.5Å
835	A	25.3	Very low	27.1	Very low	105 Å²	105	130 Å²	130	87%	0.868	77%	0.768	S	S	*	*			trans	88.3	88.4	170.5	0	0	0	0	0	117.6
836	I	25.6	Very low	26.7	Very low	164 Å²	164	130.4 Å²	130.4	84%	0.841	77%	0.769	S	S	*	*			trans	-64.5	128	160.5	-63.8	164.4	0	0	0	109.6
837	A	27.6	Very low	26.4	Very low	101 Å²	101	136.3 Å²	136.3	84%	0.835	80%	0.797	S	S	*	*			trans	-148	99.5	151.1	0	0	0	0	0	109.8
838	K	26.8	Very low	26.3	Very low	188 Å²	188	128.8 Å²	128.8	82%	0.817	79%	0.788	S	S	*	*			trans	-76.7	125.3	169.2	-79.4	178.3	175	175.3	0	109.4
839	G	27.6	Very low	26.3	Very low	80 Å²	80	128.3 Å²	128.3	83%	0.825	80%	0.802	S	S	*	*			trans	-104.8	128.9	157.3	0	0	0	0	0	109.9
840	H	28.3	Very low	26.5	Very low	165 Å²	165	125 Å²	125	76%	0.764	80%	0.802	S	S	*	*			trans	-82.2	136.8	-170.1	-90.9	-87.1	0	0	0	115
841	T	27.5	Very low	26.5	Very low	126 Å²	126	127.5 Å²	127.5	77%	0.773	82%	0.817	S	S	*	*			trans	21.5	135.9	135.5	59.4	0	0	0	0	123
842	A	28.8	Very low	26.8	Very low	100 Å²	100	126.4 Å²	126.4	83%	0.826	82%	0.816	S	S	*	*				-149.7	98.1	129.5	0	0	0	0	0	107.9
843	S	27.8	Very low	26.9	Very low	114 Å²	114	130.4 Å²	130.4	80%	0.797	82%	0.819	S	S	*	*				80	120.2	93.6	-160.1	0	0	0	0	114.2
844	C	24.7	Very low	27.1	Very low	117 Å²	117	129 Å²	129	79%	0.791	81%	0.812	S	S	*	*			trans	-72.7	141.7	169.2	-64.7	0	0	0	0	109.8
845	D	30.3	Very low	27.3	Very low	153 Å²	153	128 Å²	128	82%	0.818	81%	0.805	S	S	*	*			trans	-141.4	126.1	152.6	-92.9	-37.1	0	0	0	109.9
846	I	26.9	Very low	27.4	Very low	165 Å²	165	131.1 Å²	131.1	85%	0.846	81%	0.806	S	S	*	*			trans	-95	120	169.8	-64.4	172.2	0	0	0	106.1
847	I	30.7	Very low	27.4	Very low	162 Å²	162	129.1 Å²	129.1	83%	0.831	80%	0.796	S	S	*	*			trans	-127.1	117.9	162.5	-57.9	-179.9	0	0	0	107.5
848	G	24.9	Very low	27.6	Very low	62 Å²	62	129.8 Å²	129.8	64%	0.639	79%	0.792	S	S	*	*			trans	-88.2	180	179.7	0	0	0	0	0	114.6
849	A	28.2	Very low	27.7	Very low	114 Å²	114	124.7 Å²	124.7	94%	0.942	79%	0.793	S	S	*	*			trans	81	127.3	165.1	0	0	0	0	0	118.3
850	G	27.2	Very low	27.7	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	80%	0.799	S	S	*	*			trans	131	114.1	147.1	0	0	0	0	0	116
851	N	27.4	Very low	27.7	Very low	166 Å²	166	129.3 Å²	129.3	89%	0.888	80%	0.804	S	S	*	*			trans	-43.7	145.4	166.6	-57.3	-35	0	0	0	113.8
852	S	29	Very low	27.7	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	81%	0.807	S	S	*	*				161.7	149.6	124.5	-174.5	0	0	0	0	112.2
853	M	26.1	Very low	27.6	Very low	148 Å²	148	128 Å²	128	73%	0.729	81%	0.807	S	S	*	*			trans	-69.1	160.1	-177	-59.7	166.2	66.7	0	0	114.6
854	H	26.5	Very low	27.5	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.755	81%	0.808	S	S	*	*			trans	74.9	129.5	147.3	-75.3	-61.1	0	0	0	121.6
855	S	26.1	Very low	27.7	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	81%	0.812	S	S	*	*			trans	78.3	115.7	139.5	-171.2	0	0	0	0	117.4
856	L	26.8	Very low	27.5	Very low	170 Å²	170	133 Å²	133	89%	0.89	81%	0.808	S	S	*	*				170.7	132.3	109.7	-83.1	167.7	0	0	0	111.2
857	L	26.6	Very low	27.5	Very low	122 Å²	122	128.3 Å²	128.3	64%	0.639	80%	0.801	S	S	*	*			trans	-79.7	178.6	176.5	-94.5	171.7	0	0	0	112	N1114	L857-N1114 WeakPolarHBondContact CD1-OD1 3.28Å
858	P	32.5	Very low	27.3	Very low	115 Å²	115	128.3 Å²	128.3	75%	0.747	80%	0.802	S	S	*	*			trans	-105.3	163.7	-133.9	41.4	-37	0	0	0	115.8
859	G	28.1	Very low	27.5	Very low	82 Å²	82	134.8 Å²	134.8	85%	0.845	82%	0.816	S	S	*	*			trans	-110.8	121.6	172.9	0	0	0	0	0	113.3
860	K	26.7	Very low	27.5	Very low	216 Å²	216	137.3 Å²	137.3	94%	0.939	81%	0.811	S	S	*	*			trans	-81.3	143.1	166.7	-72.8	176.8	175.7	176	0	110.2
861	S	29.5	Very low	27.6	Very low	125 Å²	125	140.1 Å²	140.1	87%	0.874	81%	0.809	S	S	*	*			trans	-143.4	123.5	154.8	-174.5	0	0	0	0	110.4
862	S	26.2	Very low	27.6	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	80%	0.796	S	S	*	*			trans	-91.4	140.3	174.9	48.2	0	0	0	0	110.3
863	G	28.4	Very low	27.6	Very low	81 Å²	81	141.9 Å²	141.9	84%	0.835	80%	0.798	S	S	*	*			trans	-168.7	100.6	171	0	0	0	0	0	112.5
864	E	24.5	Very low	27.9	Very low	173 Å²	173	142.1 Å²	142.1	81%	0.808	80%	0.8	S	S	*	*			trans	-85	127.8	172.8	179.9	-180	-169	0	0	109.5
865	I	29.8	Very low	28	Very low	173 Å²	173	140.4 Å²	140.4	89%	0.887	80%	0.804	S	S	*	*			trans	-140.9	128.5	162.3	-57.6	-177	0	0	0	109.9
866	I	26.2	Very low	28	Very low	144 Å²	144	143.2 Å²	143.2	74%	0.738	81%	0.811	S	S	*	*			trans	-89.1	149.2	-176.7	-63.9	159.8	0	0	0	110.1
867	G	25.6	Very low	28.2	Very low	66 Å²	66	140 Å²	140	68%	0.68	81%	0.809	S	S	*	*			trans	109.6	112.1	142.2	0	0	0	0	0	119
868	N	26.1	Very low	28.2	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	82%	0.821	S	S	*	*			trans	3.5	131.7	149.4	-58.8	-13.1	0	0	0	120.5
869	E	30.4	Very low	27.9	Very low	198 Å²	198	139.2 Å²	139.2	93%	0.925	82%	0.823	S	S	*	*				-176.4	143.4	115.3	-103.4	176.5	176.2	0	0	111.4
870	I	28.3	Very low	27.8	Very low	167 Å²	167	140.4 Å²	140.4	86%	0.856	82%	0.824	S	S	*	*			trans	-94.4	134	178.8	-63.1	166.2	0	0	0	107.7
871	D	29.2	Very low	27.8	Very low	137 Å²	137	138.2 Å²	138.2	73%	0.733	82%	0.822	S	S	*	*			trans	-146.8	142.4	146.9	-161.6	12.5	0	0	0	112
872	S	26.6	Very low	27.6	Very low	89 Å²	89	139.8 Å²	139.8	62%	0.622	82%	0.819	S	S	*	*			trans	-105.6	130.1	-168.6	42.4	0	0	0	0	111
873	R	29.2	Very low	27.6	Very low	235 Å²	235	140.6 Å²	140.6	89%	0.887	82%	0.819	S	S	*	*			trans	-167.9	121.4	155	-112.8	174	-105.4	-148.8	0.5	113
874	I	31.8	Very low	27.6	Very low	152 Å²	152	144.9 Å²	144.9	78%	0.779	82%	0.817	S	S	*	*			trans	-102.8	153.8	170.7	-55.7	165.3	0	0	0	107.8
875	P	29.5	Very low	27.7	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	81%	0.812	S	S	*	*				-144.5	152.9	118.8	28.6	-8.5	0	0	0	116.2
876	D	26.8	Very low	27.5	Very low	155 Å²	155	140.1 Å²	140.1	83%	0.829	82%	0.815	S	S	*	*			trans	-61.4	151.9	177.4	-89.3	-45	0	0	0	116.4
877	A	29.9	Very low	27.7	Very low	102 Å²	102	143 Å²	143	84%	0.843	82%	0.822	S	S	*	*			trans	-155.8	117	147	0	0	0	0	0	112.2
878	T	26.7	Very low	27.8	Very low	147 Å²	147	143.5 Å²	143.5	90%	0.902	83%	0.827	S	S	*	*			trans	-69	138.3	177.5	40.6	0	0	0	0	114.6
879	G	27.4	Very low	27.9	Very low	75 Å²	75	147.4 Å²	147.4	77%	0.773	83%	0.829	S	S	*	*			trans	-169.2	109.6	166	0	0	0	0	0	112.2
880	A	25.6	Very low	27.7	Very low	106 Å²	106	146.3 Å²	146.3	88%	0.876	83%	0.83	S	S	*	*			trans	-69.1	138.3	-173.9	0	0	0	0	0	113.5
881	L	26.5	Very low	27.8	Very low	171 Å²	171	142.6 Å²	142.6	90%	0.895	82%	0.818	S	S	*	*			trans	-137.1	133.2	168.7	-93.6	161.9	0	0	0	112.7
882	I	26.1	Very low	27.7	Very low	157 Å²	157	142.5 Å²	142.5	81%	0.805	82%	0.823	S	S	*	*			trans	-75.2	141.7	-164.3	-65.1	154.9	0	0	0	111.4
883	T	26	Very low	27.7	Very low	136 Å²	136	147.2 Å²	147.2	83%	0.834	84%	0.835	S	S	*	*			trans	-86.4	126	174.3	51.4	0	0	0	0	111.5
884	E	27.8	Very low	27.6	Very low	171 Å²	171	144.2 Å²	144.2	80%	0.799	83%	0.831	S	S	*	*			trans	-126.1	134.8	166.4	-94.3	-89.6	153	0	0	109.1
885	P	26	Very low	27.4	Very low	106 Å²	106	145.5 Å²	145.5	69%	0.688	83%	0.834	S	S	*	*			trans	-89.4	122.9	-174	33.3	-29.2	0	0	0	111.6	K887	P885-K887 PolarHBondContact O-N 3.37Å
886	C	26.8	Very low	27.3	Very low	140 Å²	140	146.7 Å²	146.7	95%	0.946	83%	0.828	S	S	*	*			trans	-69.9	96.1	175.7	-67.5	0	0	0	0	111.7
887	K	29.2	Very low	27.5	Very low	205 Å²	205	149.4 Å²	149.4	89%	0.891	83%	0.828	S	S	*	*			trans	-84.1	122.4	158.8	-93.2	179.7	176.3	173.9	0	110.1	P885	P885-K887 PolarHBondContact O-N 3.37Å
888	G	28.1	Very low	28.2	Very low	76 Å²	76	148.1 Å²	148.1	78%	0.784	81%	0.805	S	S	*	*			trans	85	105.9	143	0	0	0	0	0	117.9
889	R	27.9	Very low	30	Very low	242 Å²	242	149.5 Å²	149.5	91%	0.913	80%	0.801	S	S	*	*				-156.2	129	129.1	-150.7	163.6	161.1	169.1	-7	110.9	S891	R889-S891 PolarHBondContact O-N 2.88Å; R889-S891 VanDerWaalsContact O-N 3.16Å
890	N	27.3	Very low	32	Very low	176 Å²	176	148.6 Å²	148.6	94%	0.941	78%	0.778	S	S	*	*			trans	-59.3	109.7	176.1	-74.5	-27.3	0	0	0	110.8
891	S	30.1	Very low	34.4	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	74%	0.736	S	S	*	*			trans	-134	111.6	160.3	54.4	0	0	0	0	108.5	R889	R889-S891 PolarHBondContact O-N 2.88Å; R889-S891 VanDerWaalsContact O-N 3.16Å
892	T	26.3	Very low	36.4	Very low	136 Å²	136	136 Å²	136	83%	0.834	70%	0.699	S	S	*	*	S	Bend	trans	-44.8	141.4	156.5	42.6	0	0	0	0	110.4
893	E	26.7	Very low	38.6	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.874	66%	0.661	S	S	*	*			trans	99.1	57.3	-178.3	-55	-179.3	174.9	0	0	116.3
894	H	26.9	Very low	40.6	Very low	173 Å²	173	122 Å²	122	80%	0.801	62%	0.621	S	S	*	*			trans	-94.2	109	153.6	-89.9	-73.6	0	0	0	109.3	Q896	H894-Q896 PolarHBondContact O-N 2.82Å; H894-Q896 VanDerWaalsContact O-N 3.11Å
895	H	27.8	Very low	42.8	Very low	179 Å²	179	114 Å²	114	83%	0.829	58%	0.583	S	S	*	*			trans	-55.5	112.5	165.4	-84.6	-72.4	0	0	0	109.8	Y897	H895-Y897 PolarHBondContact O-N 2.82Å
896	Q	26.9	Very low	45.6	Very low	152 Å²	152	108.9 Å²	108.9	71%	0.71	55%	0.551	S	S	*	*			trans	-65.1	101.1	173	-76.4	178.8	-49.9	0	0	109.8	H894 E898	H894-Q896 PolarHBondContact O-N 2.82Å; H894-Q896 VanDerWaalsContact O-N 3.11Å; Q896-E898 HydrophobicContact CB-CG 4.16Å; Q896-E898 PolarHBondContact O-N 3.34Å
897	Y	32.2	Very low	48.5	Very low	213 Å²	213	102.4 Å²	102.4	84%	0.835	51%	0.506	S	S	*	.			trans	-68.9	79.5	153.7	-83.6	-91.9	0	0	0	107.8	H895	H895-Y897 PolarHBondContact O-N 2.82Å
898	E	43.5	Very low	51.4	Low	75 Å²	75	92.7 Å²	92.7	35%	0.35	46%	0.464	S	S	.	.			trans	-61.9	131.9	167.9	-74.8	-174.1	167	0	0	108.3	K572 Q896 L900 Q1086	K572-E898 IonicContact NZ-OE1 2.86Å; K572-E898 PolarHBondContact NZ-OE1 3.22Å; Q896-E898 HydrophobicContact CB-CG 4.16Å; Q896-E898 PolarHBondContact O-N 3.34Å; E898-L900 PolarHBondContact O-N 2.78Å; E898-Q1086 PolarHBondContact OE2-NE2 2.04Å
899	H	64.5	Low	54.2	Low	176 Å²	176	89.4 Å²	89.4	82%	0.815	43%	0.428	S	S	*	.			trans	-57.8	107.4	-171.8	-70.7	56.8	0	0	0	111.1	W1091	H899-W1091 PolarHBondContact O-NE1 2.89Å
900	L	70.1	Confident	56.9	Low	56 Å²	56	80.7 Å²	80.7	29%	0.293	40%	0.399	S	S	.	.			trans	-66.4	157.4	177.8	-70	164.1	0	0	0	111.6	E822 E898 Y1029 W1091	E822-L900 WeakPolarHBondContact OE2-CD1 3.17Å; E898-L900 PolarHBondContact O-N 2.78Å; L900-Y1029 HydrophobicContact CD2-CE2 3.98Å; L900-W1091 HydrophobicContact CD2-CZ2 4.33Å
901	P	75.3	Confident	59.6	Low	1 Å²	1	73.5 Å²	73.5	1%	0.006	36%	0.36	C	S	.	.			trans	-70.2	148	-173.9	24.7	-22.8	0	0	0	111	F1013 Y1029 R1041 L1084 W1091	P901-F1013 HydrophobicContact CB-CE1 4.09Å; P901-F1013 HydrophobicContact CB-CZ 4.37Å; P901-Y1029 HydrophobicContact CG-CD2 4.32Å; P901-Y1029 HydrophobicContact CG-CG 4.33Å; P901-R1041 PolarHBondContact O-NH1 3.43Å; P901-L1084 HydrophobicContact CB-CD1 3.7Å; P901-L1084 HydrophobicContact CG-CD1 4.14Å; P901-W1091 HydrophobicContact CB-CB 4.09Å; P901-W1091 HydrophobicContact CB-CD2 3.7Å; P901-W1091 HydrophobicContact CB-CE3 4.22Å; P901-W1091 HydrophobicContact CB-CG 3.59Å; P901-W1091 HydrophobicContact CG-CD2 3.7Å; P901-W1091 HydrophobicContact CG-CE3 3.87Å; P901-W1091 HydrophobicContact CG-CG 4.16Å; P901-W1091 HydrophobicContact CG-CH2 4.4Å; P901-W1091 HydrophobicContact CG-CZ2 4.25Å; P901-W1091 HydrophobicContact CG-CZ3 4.21Å
902	G	68.7	Low	61.9	Low	10 Å²	10	72.8 Å²	72.8	10%	0.103	36%	0.355	C	S	.	.			trans	-70.1	178.2	169.7	0	0	0	0	0	112.6	Q1011	G902-Q1011 VanDerWaalsContact CA-OE1 3.31Å
903	A	71.8	Confident	64.2	Low	1 Å²	1	70 Å²	70	1%	0.008	35%	0.354	C	S	.	.			trans	-88.4	150.7	-176.4	0	0	0	0	0	113.4	I824 G905 Q1011 S1031 P1039	I824-A903 HydrophobicContact CD1-CB 3.59Å; I824-A903 HydrophobicContact CG2-CB 4.47Å; A903-G905 PolarHBondContact O-N 3.4Å; A903-Q1011 PolarHBondContact O-N 2.83Å; A903-S1031 WeakPolarHBondContact CA-OG 3.25Å; A903-P1039 HydrophobicContact CB-CB 3.47Å; A903-P1039 VanDerWaalsContact CB-CB 3.47Å; A903-P1039 HydrophobicContact CB-CG 4.38Å
904	S	69.8	Low	66.3	Low	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.349	C	S	.	.			trans	-84.5	90.8	164	-148.5	0	0	0	0	109.3	V906 G922 T923 S1031	S904-V906 PolarHBondContact O-N 3.49Å; S904-V906 VanDerWaalsContact O-N 3.13Å; S904-G922 PolarHBondContact OG-O 2.87Å; S904-T923 PolarHBondContact OG-OG1 3.33Å; S904-S1031 PolarHBondContact N-OG 2.8Å
905	G	72.9	Confident	68.4	Low	1 Å²	1	60.5 Å²	60.5	1%	0.01	33%	0.327	C	S	.	.			trans	-82.4	39.8	177.5	0	0	0	0	0	113.7	A903 V955 G956	A903-G905 PolarHBondContact O-N 3.4Å; G905-V955 CarbonylContact O-C 3.46Å; G905-V955 VanDerWaalsContact O-CA 3.32Å; G905-V955 WeakPolarHBondContact O-CA 3.15Å; G905-G956 CarbonylContact C-O 3.53Å; G905-G956 WeakPolarHBondContact CA-O 3.3Å; G905-G956 PolarHBondContact O-N 2.89Å
906	V	85.6	Confident	70.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122	-177.3	-176.9	0	0	0	0	110.1	S904 T921 G922 L924 V936 V953 Y954 V955 V1010	S904-V906 PolarHBondContact O-N 3.49Å; S904-V906 VanDerWaalsContact O-N 3.13Å; V906-T921 CarbonylContact O-C 3.41Å; V906-T921 WeakPolarHBondContact O-CA 3.26Å; V906-T921 WeakPolarHBondContact O-CG2 3.35Å; V906-G922 WeakPolarHBondContact CB-O 3.3Å; V906-G922 PolarHBondContact O-N 2.96Å; V906-L924 HydrophobicContact CG2-CB 4.21Å; V906-V936 HydrophobicContact CG1-CG1 3.71Å; V906-V936 HydrophobicContact CG1-CG2 4.17Å; V906-V953 HydrophobicContact CG1-CG1 3.51Å; V906-Y954 WeakPolarHBondContact CA-O 3.15Å; V906-V955 HydrophobicContact CG1-CG2 4.42Å; V906-V955 HydrophobicContact CG2-CG1 4.31Å; V906-V955 HydrophobicContact CG2-CG2 4.27Å; V906-V1010 HydrophobicContact CG2-CG1 4.17Å
907	H	87.3	Confident	73.3	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.019	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.2	-178.6	-64.1	-68.6	0	0	0	111.2	F909 V953 Y954 L959 V1033	H907-F909 HydrophobicContact CB-CD2 4.36Å; H907-F909 HydrophobicContact CB-CE2 3.61Å; H907-F909 HydrophobicContact CB-CZ 4.22Å; H907-V953 CarbonylContact O-C 3.49Å; H907-V953 WeakPolarHBondContact O-CA 3.32Å; H907-Y954 PolarHBondContact N-O 2.85Å; H907-Y954 PolarHBondContact O-N 3.37Å; H907-L959 VanDerWaalsContact CE1-CD1 3.47Å; H907-L959 WeakPolarHBondContact CE1-CD1 3.43Å; H907-V1033 WeakPolarHBondContact CE1-CG2 3.34Å; H907-V1033 WeakPolarHBondContact NE2-CG2 3.28Å
908	I	89.1	Confident	75.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.5	-178.4	-56.8	166	0	0	0	108.3	L919 C920 T938 V943 Y951 V953 L998	I908-L919 PolarHBondContact O-N 2.89Å; I908-C920 PolarHBondContact N-O 3.39Å; I908-C920 PolarHBondContact O-N 3.21Å; I908-T938 HydrophobicContact CD1-CG2 3.61Å; I908-T938 WeakPolarHBondContact CD1-OG1 3.46Å; I908-V943 HydrophobicContact CD1-CG2 4.44Å; I908-V943 HydrophobicContact CG2-CG2 3.99Å; I908-Y951 HydrophobicContact CG2-CD1 4.43Å; I908-V953 HydrophobicContact CG1-CG2 4.34Å; I908-L998 HydrophobicContact CD1-CD1 3.8Å; I908-L998 HydrophobicContact CG1-CD1 4.08Å; I908-L998 HydrophobicContact CG2-CD1 4.28Å
909	F	88	Confident	77.4	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.031	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	144	-178.7	-67.2	-94.6	0	0	0	110.9	H907 I916 E917 P918 Y951 R952 L959 L972	H907-F909 HydrophobicContact CB-CD2 4.36Å; H907-F909 HydrophobicContact CB-CE2 3.61Å; H907-F909 HydrophobicContact CB-CZ 4.22Å; F909-I916 HydrophobicContact CB-CG2 4.02Å; F909-I916 HydrophobicContact CD1-CG2 3.58Å; F909-I916 HydrophobicContact CE1-CG2 4.33Å; F909-I916 HydrophobicContact CG-CG2 4.03Å; F909-E917 CarbonylContact C-O 3.17Å; F909-E917 VanDerWaalsContact CA-O 3.28Å; F909-E917 WeakPolarHBondContact CA-O 3.44Å; F909-P918 VanDerWaalsContact CD1-CA 3.46Å; F909-P918 HydrophobicContact CD1-CB 3.94Å; F909-P918 HydrophobicContact CE1-CB 3.59Å; F909-P918 HydrophobicContact CE1-CG 4.32Å; F909-P918 HydrophobicContact CZ-CB 4.31Å; F909-Y951 WeakPolarHBondContact O-CA 3.36Å; F909-R952 PolarHBondContact N-O 3.23Å; F909-R952 PolarHBondContact O-N 2.96Å; F909-L959 HydrophobicContact CZ-CD2 4Å; F909-L972 HydrophobicContact CB-CD2 4.47Å; F909-L972 HydrophobicContact CD2-CD2 3.53Å; F909-L972 HydrophobicContact CE2-CD2 3.99Å; F909-L972 HydrophobicContact CG-CD2 4.15Å
910	M	84.7	Confident	78.6	Confident	59 Å²	59	33.2 Å²	33.2	29%	0.291	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	138.6	163.7	-157.7	177.4	-71.3	0	0	109.5	E917 L919 N950 Y951	M910-E917 PolarHBondContact N-O 2.99Å; M910-E917 PolarHBondContact O-N 3.02Å; M910-L919 HydrophobicContact CB-CD1 3.85Å; M910-L919 HydrophobicContact CB-CD2 4.1Å; M910-L919 HydrophobicContact CB-CG 4.01Å; M910-L919 HydrophobicContact CE-CD1 3.91Å; M910-L919 HydrophobicContact CE-CD2 4.13Å; M910-N950 CarbonylContact C-O 3.59Å; M910-Y951 HydrophobicContact CE-CE1 3.88Å; M910-Y951 HydrophobicContact CG-CE1 4.37Å
911	I	83.8	Confident	79.6	Confident	24 Å²	24	30.5 Å²	30.5	12%	0.123	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120	171.5	-57.4	-172.2	0	0	0	108.1	S915 N950 R952	I911-S915 WeakPolarHBondContact CA-O 3.5Å; I911-N950 PolarHBondContact N-O 2.86Å; I911-N950 WeakPolarHBondContact O-CB 3.46Å; I911-R952 HydrophobicContact CD1-CB 4.28Å; I911-R952 HydrophobicContact CD1-CG 3.51Å; I911-R952 VanDerWaalsContact CD1-CZ 3.41Å; I911-R952 HydrophobicContact CG1-CG 4.29Å
912	S	77.6	Confident	80.2	Confident	74 Å²	74	30.5 Å²	30.5	52%	0.517	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	98.2	176	-169.1	0	0	0	0	108.7	S914 S915	S912-S914 PolarHBondContact O-N 3.11Å; S912-S915 PolarHBondContact N-O 3.29Å; S912-S915 WeakPolarHBondContact O-CB 3.24Å; S912-S915 PolarHBondContact O-N 2.99Å
913	G	74.9	Confident	81.2	Confident	78 Å²	78	30 Å²	30	80%	0.804	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	-115.3	-172.3	0	0	0	0	0	111.6
914	S	70.6	Confident	81.9	Confident	111 Å²	111	30 Å²	30	78%	0.776	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-4.5	175	52.8	0	0	0	0	114	S912	S912-S914 PolarHBondContact O-N 3.11Å
915	S	72.1	Confident	82.7	Confident	48 Å²	48	32 Å²	32	34%	0.336	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	133.4	178.4	-169.1	0	0	0	0	111	I911 S912 E917	I911-S915 WeakPolarHBondContact CA-O 3.5Å; S912-S915 PolarHBondContact N-O 3.29Å; S912-S915 WeakPolarHBondContact O-CB 3.24Å; S912-S915 PolarHBondContact O-N 2.99Å; S915-E917 PolarHBondContact OG-OE1 3.29Å
916	I	76.6	Confident	83	Confident	31 Å²	31	32.9 Å²	32.9	16%	0.159	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110	172.8	-60	175.9	0	0	0	107.3	F909 V965 L968 L972	F909-I916 HydrophobicContact CB-CG2 4.02Å; F909-I916 HydrophobicContact CD1-CG2 3.58Å; F909-I916 HydrophobicContact CE1-CG2 4.33Å; F909-I916 HydrophobicContact CG-CG2 4.03Å; I916-V965 HydrophobicContact CD1-CG1 3.94Å; I916-L968 HydrophobicContact CB-CD2 4.33Å; I916-L968 HydrophobicContact CD1-CB 4.36Å; I916-L968 HydrophobicContact CD1-CD2 3.98Å; I916-L968 HydrophobicContact CD1-CG 4.08Å; I916-L968 HydrophobicContact CG2-CD2 3.86Å; I916-L972 HydrophobicContact CD1-CD1 4.08Å; I916-L972 HydrophobicContact CG2-CD1 4Å
917	E	79.7	Confident	82.6	Confident	98 Å²	98	37 Å²	37	46%	0.458	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121.4	-174.9	-69.3	177.8	-166.8	0	0	110.8	F909 M910 S915 L919	F909-E917 CarbonylContact C-O 3.17Å; F909-E917 VanDerWaalsContact CA-O 3.28Å; F909-E917 WeakPolarHBondContact CA-O 3.44Å; M910-E917 PolarHBondContact N-O 2.99Å; M910-E917 PolarHBondContact O-N 3.02Å; S915-E917 PolarHBondContact OG-OE1 3.29Å; E917-L919 PolarHBondContact O-N 3.35Å
918	P	78.2	Confident	81.8	Confident	42 Å²	42	48 Å²	48	27%	0.273	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	125.5	172.6	26.5	-32	0	0	0	109.7	F909 Y1077	F909-P918 VanDerWaalsContact CD1-CA 3.46Å; F909-P918 HydrophobicContact CD1-CB 3.94Å; F909-P918 HydrophobicContact CE1-CB 3.59Å; F909-P918 HydrophobicContact CE1-CG 4.32Å; F909-P918 HydrophobicContact CZ-CB 4.31Å; P918-Y1077 HydrophobicContact CB-CD2 4.17Å; P918-Y1077 HydrophobicContact CB-CE1 4.36Å; P918-Y1077 HydrophobicContact CB-CE2 3.87Å; P918-Y1077 HydrophobicContact CG-CE1 4.11Å; P918-Y1077 HydrophobicContact CG-CE2 3.8Å; P918-Y1077 WeakPolarHBondContact CG-OH 3.35Å; P918-Y1077 WeakPolarHBondContact O-CE1 3.43Å
919	L	84.9	Confident	80.9	Confident	44 Å²	44	52.2 Å²	52.2	23%	0.23	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-54.9	179.9	-63.4	179.1	0	0	0	111.9	I908 M910 E917 Y951	I908-L919 PolarHBondContact O-N 2.89Å; M910-L919 HydrophobicContact CB-CD1 3.85Å; M910-L919 HydrophobicContact CB-CD2 4.1Å; M910-L919 HydrophobicContact CB-CG 4.01Å; M910-L919 HydrophobicContact CE-CD1 3.91Å; M910-L919 HydrophobicContact CE-CD2 4.13Å; E917-L919 PolarHBondContact O-N 3.35Å; L919-Y951 HydrophobicContact CD1-CD1 3.91Å; L919-Y951 HydrophobicContact CD1-CE1 3.58Å
920	C	89.9	Confident	80.3	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	170.7	-163	-44.9	0	0	0	0	112	I908 C942 V1079	I908-C920 PolarHBondContact N-O 3.39Å; I908-C920 PolarHBondContact O-N 3.21Å; C920-C942 HydrophobicContact CB-CB 3.85Å; C920-C942 WeakPolarHBondContact CB-SG 3.3Å; C920-C942 WeakPolarHBondContact SG-CA 3.2Å; C920-C942 WeakPolarHBondContact SG-CB 3.48Å; C920-C942 CovalentContact SG-SG 2.01Å; C920-C942 PolarHBondContact SG-SG 2.93Å; C920-V1079 HydrophobicContact CB-CB 4.49Å; C920-V1079 VanDerWaalsContact CB-O 3.3Å; C920-V1079 WeakPolarHBondContact CB-O 3.44Å
921	T	89.7	Confident	80	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	160.5	165.4	-54.6	0	0	0	0	109.5	V906 T938 Y1077 V1079 G1080 S1081	V906-T921 CarbonylContact O-C 3.41Å; V906-T921 WeakPolarHBondContact O-CA 3.26Å; V906-T921 WeakPolarHBondContact O-CG2 3.35Å; T921-T938 PolarHBondContact O-OG1 2.67Å; T921-Y1077 PolarHBondContact N-O 3.15Å; T921-Y1077 PolarHBondContact OG1-O 2.99Å; T921-V1079 PolarHBondContact N-O 2.88Å; T921-G1080 CarbonylContact O-C 3.56Å; T921-G1080 VanDerWaalsContact O-CA 3.24Å; T921-G1080 WeakPolarHBondContact O-CA 3.34Å; T921-S1081 WeakPolarHBondContact CB-OG 3.39Å
922	G	88.8	Confident	79.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	-172.8	168.8	0	0	0	0	0	110.5	S904 V906 V937	S904-G922 PolarHBondContact OG-O 2.87Å; V906-G922 WeakPolarHBondContact CB-O 3.3Å; V906-G922 PolarHBondContact O-N 2.96Å; G922-V937 CarbonylContact C-O 3.47Å; G922-V937 WeakPolarHBondContact CA-O 3.15Å
923	T	88.9	Confident	80.2	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	136.8	174.3	-54.8	0	0	0	0	110	S904 Y925 V936 V937 F1013 P1082	S904-T923 PolarHBondContact OG-OG1 3.33Å; T923-Y925 PolarHBondContact O-N 3.07Å; T923-V936 CarbonylContact O-C 3.57Å; T923-V936 WeakPolarHBondContact O-CA 3.42Å; T923-V937 PolarHBondContact N-O 3.11Å; T923-V937 PolarHBondContact O-N 2.85Å; T923-F1013 HydrophobicContact CG2-CD2 3.99Å; T923-P1082 WeakPolarHBondContact OG1-CB 3.03Å; T923-P1082 VanDerWaalsContact OG1-CD 3.29Å; T923-P1082 WeakPolarHBondContact OG1-CD 3.38Å; T923-P1082 VanDerWaalsContact OG1-CG 3.23Å; T923-P1082 WeakPolarHBondContact OG1-CG 3.36Å
924	L	86.8	Confident	80.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	124.9	174.2	-169.3	68.3	0	0	0	109.3	V906 V936 V1006 S1012	V906-L924 HydrophobicContact CG2-CB 4.21Å; L924-V936 HydrophobicContact CD1-CG2 4.03Å; L924-V1006 HydrophobicContact CD2-CG2 3.94Å; L924-S1012 WeakPolarHBondContact O-CA 3.3Å; L924-S1012 WeakPolarHBondContact O-CB 3.01Å; L924-S1012 PolarHBondContact O-OG 2.89Å
925	Y	85.7	Confident	81.7	Confident	41 Å²	41	51 Å²	51	16%	0.161	27%	0.271	C	S	.	.			trans	-102.1	106.8	178.2	176.4	-101.5	0	0	0	110.3	T923 K927 S933 E935 V937 L1015 A1132	T923-Y925 PolarHBondContact O-N 3.07Å; Y925-K927 HydrophobicContact CE1-CG 4.27Å; Y925-S933 WeakPolarHBondContact O-CB 3.29Å; Y925-S933 PolarHBondContact O-OG 3.43Å; Y925-E935 HydrophobicContact CD1-CB 4.47Å; Y925-E935 VanDerWaalsContact CD1-OE2 3.3Å; Y925-E935 WeakPolarHBondContact CD1-OE2 3.29Å; Y925-E935 PolarHBondContact N-O 3.2Å; Y925-V937 HydrophobicContact CG-CG2 4.37Å; Y925-L1015 HydrophobicContact CD2-CD1 4.22Å; Y925-L1015 HydrophobicContact CD2-CG 4.27Å; Y925-L1015 HydrophobicContact CE2-CD1 3.67Å; Y925-L1015 HydrophobicContact CE2-CG 3.83Å; Y925-A1132 HydrophobicContact CE1-CB 4.33Å; Y925-A1132 HydrophobicContact CE2-CB 4.36Å
926	A	80.8	Confident	82.5	Confident	19 Å²	19	48.7 Å²	48.7	16%	0.157	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-101.3	131	175.9	0	0	0	0	0	109.8	V1006 S1012	A926-V1006 HydrophobicContact CB-CG2 3.87Å; A926-S1012 PolarHBondContact N-OG 2.95Å
927	K	75.8	Confident	83.1	Confident	87 Å²	87	47.5 Å²	47.5	38%	0.378	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-63	147.9	172.8	-68.5	168.7	-175.3	149.8	0	109.1	Y925 G929 Q930 E935	Y925-K927 HydrophobicContact CE1-CG 4.27Å; K927-G929 PolarHBondContact O-N 3.39Å; K927-G929 VanDerWaalsContact O-N 3.11Å; K927-Q930 HydrophobicContact CB-CG 4.17Å; K927-Q930 WeakPolarHBondContact O-CB 3.28Å; K927-Q930 PolarHBondContact O-N 3.13Å; K927-E935 IonicContact NZ-OE1 3.77Å; K927-E935 PolarHBondContact NZ-OE1 2.71Å
928	R	70.7	Confident	83.6	Confident	236 Å²	236	42.8 Å²	42.8	89%	0.891	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	121	-176.9	-169	176.1	-177.2	170.1	0.6	110.6
929	G	70.7	Confident	84.1	Confident	88 Å²	88	40.8 Å²	40.8	91%	0.907	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	88	0.3	-179.6	0	0	0	0	0	115.7	K927	K927-G929 PolarHBondContact O-N 3.39Å; K927-G929 VanDerWaalsContact O-N 3.11Å
930	Q	76.3	Confident	84.1	Confident	103 Å²	103	39.1 Å²	39.1	48%	0.481	21%	0.205	S	C	.	.			trans	-96	132.9	175.8	-63.2	-170.3	-18.8	0	0	111.4	K927	K927-Q930 HydrophobicContact CB-CG 4.17Å; K927-Q930 WeakPolarHBondContact O-CB 3.28Å; K927-Q930 PolarHBondContact O-N 3.13Å
931	A	76.7	Confident	83.8	Confident	56 Å²	56	43.3 Å²	43.3	46%	0.463	22%	0.22	S	C	.	.	S	Bend	trans	-88.1	-9.2	176.5	0	0	0	0	0	113.5	K1005 V1006	A931-K1005 WeakPolarHBondContact O-CA 3Å; A931-V1006 PolarHBondContact O-N 2.88Å
932	Y	81.5	Confident	83.7	Confident	118 Å²	118	43.8 Å²	43.8	46%	0.463	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.8	-179.6	-67.8	-96.8	0	0	0	109.7	V1004 K1005	Y932-V1004 CarbonylContact C-O 3.43Å; Y932-V1004 VanDerWaalsContact CA-O 3.27Å; Y932-V1004 WeakPolarHBondContact CA-O 3.37Å; Y932-K1005 HydrophobicContact CD1-CB 3.86Å; Y932-K1005 HydrophobicContact CD1-CG 4.33Å; Y932-K1005 HydrophobicContact CE1-CB 3.56Å; Y932-K1005 HydrophobicContact CE1-CD 4.29Å; Y932-K1005 HydrophobicContact CE1-CG 3.9Å; Y932-K1005 HydrophobicContact CE2-CG 4.36Å
933	S	84.9	Confident	83.4	Confident	5 Å²	5	43.8 Å²	43.8	4%	0.035	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	144.2	174	174.8	0	0	0	0	111.1	Y925 E935 V1004	Y925-S933 WeakPolarHBondContact O-CB 3.29Å; Y925-S933 PolarHBondContact O-OG 3.43Å; S933-E935 PolarHBondContact OG-N 3Å; S933-E935 PolarHBondContact OG-O 3.03Å; S933-V1004 PolarHBondContact N-O 2.83Å; S933-V1004 PolarHBondContact O-N 2.86Å
934	D	88.4	Confident	82.5	Confident	24 Å²	24	46.6 Å²	46.6	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	7.1	168.8	43.7	14.1	0	0	0	111.7	K999 L1000 R1003	D934-K999 CarbonylContact O-C 3.53Å; D934-K999 VanDerWaalsContact O-CA 3.32Å; D934-K999 WeakPolarHBondContact O-CA 3.46Å; D934-L1000 HydrophobicContact CB-CB 4.39Å; D934-L1000 PolarHBondContact O-N 2.74Å; D934-R1003 HydrophobicContact CB-CG 3.72Å; D934-R1003 IonicContact OD2-CZ 3.76Å; D934-R1003 IonicContact OD2-NE 2.83Å; D934-R1003 PolarHBondContact OD2-NE 2.86Å; D934-R1003 VanDerWaalsContact OD2-NE 3.14Å; D934-R1003 IonicContact OD2-NH2 3.83Å
935	E	87.8	Confident	81.5	Confident	22 Å²	22	50.8 Å²	50.8	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118	-173.2	-66.7	173.4	-164.2	0	0	110.3	Y925 K927 S933 V997	Y925-E935 HydrophobicContact CD1-CB 4.47Å; Y925-E935 VanDerWaalsContact CD1-OE2 3.3Å; Y925-E935 WeakPolarHBondContact CD1-OE2 3.29Å; Y925-E935 PolarHBondContact N-O 3.2Å; K927-E935 IonicContact NZ-OE1 3.77Å; K927-E935 PolarHBondContact NZ-OE1 2.71Å; S933-E935 PolarHBondContact OG-N 3Å; S933-E935 PolarHBondContact OG-O 3.03Å; E935-V997 HydrophobicContact CB-CG1 4.49Å
936	V	89.4	Confident	80.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.4	175.5	173.1	0	0	0	0	110	V906 T923 L924 V953 V997 L998 L1000	V906-V936 HydrophobicContact CG1-CG1 3.71Å; V906-V936 HydrophobicContact CG1-CG2 4.17Å; T923-V936 CarbonylContact O-C 3.57Å; T923-V936 WeakPolarHBondContact O-CA 3.42Å; L924-V936 HydrophobicContact CD1-CG2 4.03Å; V936-V953 HydrophobicContact CG2-CG1 4.32Å; V936-V997 CarbonylContact O-C 3.58Å; V936-V997 WeakPolarHBondContact O-CA 3.36Å; V936-L998 HydrophobicContact CB-CB 4.26Å; V936-L998 PolarHBondContact N-O 2.99Å; V936-L998 PolarHBondContact O-N 3.19Å; V936-L1000 HydrophobicContact CG2-CD1 3.94Å; V936-L1000 HydrophobicContact CG2-CD2 4.24Å; V936-L1000 HydrophobicContact CG2-CG 4.15Å
937	V	88.8	Confident	79.3	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.03	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.8	177.9	-179.1	0	0	0	0	109.5	G922 T923 Y925 T996 V997 I1096	G922-V937 CarbonylContact C-O 3.47Å; G922-V937 WeakPolarHBondContact CA-O 3.15Å; T923-V937 PolarHBondContact N-O 3.11Å; T923-V937 PolarHBondContact O-N 2.85Å; Y925-V937 HydrophobicContact CG-CG2 4.37Å; V937-T996 CarbonylContact C-O 3.51Å; V937-T996 WeakPolarHBondContact CA-O 3.34Å; V937-V997 HydrophobicContact CG2-CG2 4.33Å; V937-I1096 HydrophobicContact CG1-CD1 3.56Å; V937-I1096 HydrophobicContact CG1-CG1 4.44Å
938	T	90.8	Very high	78.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	-179.6	177.2	-169	0	0	0	0	110.9	I908 T921 C942 V943 T996 G1080 I1096	I908-T938 HydrophobicContact CD1-CG2 3.61Å; I908-T938 WeakPolarHBondContact CD1-OG1 3.46Å; T921-T938 PolarHBondContact O-OG1 2.67Å; T938-C942 HydrophobicContact CG2-CB 4.36Å; T938-V943 HydrophobicContact CG2-CG2 4.38Å; T938-T996 PolarHBondContact N-O 3.48Å; T938-T996 WeakPolarHBondContact O-CA 3.35Å; T938-T996 PolarHBondContact O-N 3.14Å; T938-G1080 WeakPolarHBondContact OG1-CA 3.22Å; T938-I1096 WeakPolarHBondContact O-CD1 3.48Å
939	A	88.3	Confident	78	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	145.3	176.9	0	0	0	0	0	111.3	R941 C942 V1079 I1096	A939-R941 PolarHBondContact O-N 2.94Å; A939-C942 WeakPolarHBondContact O-CB 3.41Å; A939-C942 PolarHBondContact O-N 2.7Å; A939-V1079 HydrophobicContact CB-CG1 3.99Å; A939-I1096 HydrophobicContact CB-CG2 3.99Å
940	S	85.1	Confident	78.5	Confident	8 Å²	8	45.7 Å²	45.7	6%	0.056	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-31.1	176.4	-66.5	0	0	0	0	113.7	C942 V943 T980 G994 M995 T996	S940-C942 PolarHBondContact O-N 2.88Å; S940-V943 CarbonylContact O-C 3.47Å; S940-V943 PolarHBondContact O-N 3.44Å; S940-T980 WeakPolarHBondContact OG-CG2 3.25Å; S940-G994 PolarHBondContact N-O 3.43Å; S940-G994 WeakPolarHBondContact OG-CA 3.47Å; S940-M995 WeakPolarHBondContact OG-CA 3.24Å; S940-M995 PolarHBondContact OG-N 3.39Å; S940-M995 PolarHBondContact OG-O 3.11Å; S940-M995 VanDerWaalsContact OG-O 3.08Å; S940-T996 WeakPolarHBondContact CA-OG1 3.18Å; S940-T996 PolarHBondContact OG-OG1 2.68Å
941	R	84.3	Confident	79.1	Confident	96 Å²	96	41.4 Å²	41.4	36%	0.362	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.3	171.7	-177.1	178.9	-61.8	-70.7	-7.2	113.1	A939 E992 D1098	A939-R941 PolarHBondContact O-N 2.94Å; R941-E992 IonicContact CZ-OE2 2.81Å; R941-E992 PolarHBondContact N-O 2.95Å; R941-E992 IonicContact NH1-OE2 3.9Å; R941-E992 PolarHBondContact NH1-OE2 3.06Å; R941-E992 IonicContact NH2-OE2 3.98Å; R941-E992 PolarHBondContact NH2-OE2 3.36Å; R941-D1098 IonicContact CZ-OD2 2.67Å; R941-D1098 IonicContact NE-OD1 3.95Å; R941-D1098 IonicContact NE-OD2 3.14Å; R941-D1098 PolarHBondContact NE-OD2 2.8Å; R941-D1098 VanDerWaalsContact NE-OD2 3.1Å; R941-D1098 IonicContact NH2-OD2 3.49Å
942	C	86.8	Confident	79.6	Confident	9 Å²	9	41.1 Å²	41.1	6%	0.061	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-48.5	179.8	-177.5	0	0	0	0	112.5	C920 T938 A939 S940 V1079	C920-C942 HydrophobicContact CB-CB 3.85Å; C920-C942 WeakPolarHBondContact CB-SG 3.3Å; C920-C942 WeakPolarHBondContact SG-CA 3.2Å; C920-C942 WeakPolarHBondContact SG-CB 3.48Å; C920-C942 CovalentContact SG-SG 2.01Å; C920-C942 PolarHBondContact SG-SG 2.93Å; T938-C942 HydrophobicContact CG2-CB 4.36Å; A939-C942 WeakPolarHBondContact O-CB 3.41Å; A939-C942 PolarHBondContact O-N 2.7Å; S940-C942 PolarHBondContact O-N 2.88Å; C942-V1079 HydrophobicContact CB-CG1 4.34Å
943	V	83	Confident	80	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-128.4	93.2	-172.3	-173	0	0	0	0	108.6	I908 T938 S940 Y951 I978 T996 L998	I908-V943 HydrophobicContact CD1-CG2 4.44Å; I908-V943 HydrophobicContact CG2-CG2 3.99Å; T938-V943 HydrophobicContact CG2-CG2 4.38Å; S940-V943 CarbonylContact O-C 3.47Å; S940-V943 PolarHBondContact O-N 3.44Å; V943-Y951 HydrophobicContact CG1-CD1 4.23Å; V943-Y951 HydrophobicContact CG1-CD2 3.74Å; V943-Y951 HydrophobicContact CG1-CE1 4.09Å; V943-Y951 HydrophobicContact CG1-CE2 3.57Å; V943-Y951 HydrophobicContact CG1-CG 4.06Å; V943-Y951 HydrophobicContact CG2-CD1 4.32Å; V943-Y951 HydrophobicContact CG2-CE1 4.36Å; V943-I978 HydrophobicContact CG1-CD1 3.73Å; V943-I978 HydrophobicContact CG1-CG1 4.48Å; V943-I978 HydrophobicContact CG1-CG2 3.97Å; V943-T996 HydrophobicContact CB-CG2 4.29Å; V943-T996 PolarHBondContact O-OG1 2.67Å; V943-L998 HydrophobicContact CB-CD2 4.22Å; V943-L998 HydrophobicContact CG1-CD2 3.91Å; V943-L998 HydrophobicContact CG2-CD1 4.32Å; V943-L998 HydrophobicContact CG2-CD2 4.21Å
944	P	69.8	Low	80	Confident	60 Å²	60	36.7 Å²	36.7	39%	0.39	22%	0.223	S	C	.	.			trans	-64.3	151.7	172.7	24.8	-33	0	0	0	111.2	S946 Y951	P944-S946 PolarHBondContact O-N 3.13Å; P944-Y951 WeakPolarHBondContact CD-OH 3.43Å
945	P	66.3	Low	79.7	Confident	89 Å²	89	36.5 Å²	36.5	58%	0.578	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-64.1	-18.7	-172.7	22.6	-31.9	0	0	0	114.1	G947	P945-G947 PolarHBondContact O-N 2.91Å
946	S	61.4	Low	78.9	Confident	120 Å²	120	35.8 Å²	35.8	84%	0.839	22%	0.221	S	C	*	.	G	3₁₀ helix	trans	-84.5	5.7	-170.4	-39.9	0	0	0	0	115.9	P944	P944-S946 PolarHBondContact O-N 3.13Å
947	G	59	Low	77.7	Confident	15 Å²	15	37.6 Å²	37.6	16%	0.155	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-119.5	25.4	-169.3	0	0	0	0	0	116.9	P945 S949 N950 Y951	P945-G947 PolarHBondContact O-N 2.91Å; G947-S949 PolarHBondContact O-N 2.69Å; G947-N950 PolarHBondContact O-N 3.42Å; G947-N950 VanDerWaalsContact O-N 3.11Å; G947-Y951 WeakPolarHBondContact O-CD2 3.34Å; G947-Y951 WeakPolarHBondContact O-CE2 3.47Å
948	G	57.5	Low	76.7	Confident	45 Å²	45	42 Å²	42	46%	0.464	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-24	-166.1	0	0	0	0	0	119.7
949	S	62.3	Low	75.5	Confident	110 Å²	110	42.9 Å²	42.9	77%	0.769	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-12.2	-176.7	55.1	0	0	0	0	115.4	G947	G947-S949 PolarHBondContact O-N 2.69Å
950	N	80.6	Confident	74.2	Confident	74 Å²	74	43.8 Å²	43.8	40%	0.396	27%	0.267	S	S	.	.	S	Bend	trans	-107.6	1.1	-164.9	-65.3	2.7	0	0	0	113.8	M910 I911 G947	M910-N950 CarbonylContact C-O 3.59Å; I911-N950 PolarHBondContact N-O 2.86Å; I911-N950 WeakPolarHBondContact O-CB 3.46Å; G947-N950 PolarHBondContact O-N 3.42Å; G947-N950 VanDerWaalsContact O-N 3.11Å
951	Y	87.5	Confident	72.9	Confident	14 Å²	14	48.9 Å²	48.9	6%	0.055	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.4	-177.4	-59.8	-77.6	0	0	0	111.9	I908 F909 M910 L919 V943 P944 G947 V975 I978	I908-Y951 HydrophobicContact CG2-CD1 4.43Å; F909-Y951 WeakPolarHBondContact O-CA 3.36Å; M910-Y951 HydrophobicContact CE-CE1 3.88Å; M910-Y951 HydrophobicContact CG-CE1 4.37Å; L919-Y951 HydrophobicContact CD1-CD1 3.91Å; L919-Y951 HydrophobicContact CD1-CE1 3.58Å; V943-Y951 HydrophobicContact CG1-CD1 4.23Å; V943-Y951 HydrophobicContact CG1-CD2 3.74Å; V943-Y951 HydrophobicContact CG1-CE1 4.09Å; V943-Y951 HydrophobicContact CG1-CE2 3.57Å; V943-Y951 HydrophobicContact CG1-CG 4.06Å; V943-Y951 HydrophobicContact CG2-CD1 4.32Å; V943-Y951 HydrophobicContact CG2-CE1 4.36Å; P944-Y951 WeakPolarHBondContact CD-OH 3.43Å; G947-Y951 WeakPolarHBondContact O-CD2 3.34Å; G947-Y951 WeakPolarHBondContact O-CE2 3.47Å; Y951-V975 WeakPolarHBondContact O-CG2 3.23Å; Y951-I978 HydrophobicContact CD2-CD1 3.67Å; Y951-I978 HydrophobicContact CE2-CD1 4.07Å
952	R	88.1	Confident	71.5	Confident	49 Å²	49	54.5 Å²	54.5	19%	0.185	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	156.2	169.6	-58.1	-160.4	-169.4	161.4	13.8	111.5	F909 I911 N969 L972 I973	F909-R952 PolarHBondContact N-O 3.23Å; F909-R952 PolarHBondContact O-N 2.96Å; I911-R952 HydrophobicContact CD1-CB 4.28Å; I911-R952 HydrophobicContact CD1-CG 3.51Å; I911-R952 VanDerWaalsContact CD1-CZ 3.41Å; I911-R952 HydrophobicContact CG1-CG 4.29Å; R952-N969 VanDerWaalsContact CZ-OD1 3.31Å; R952-N969 PolarHBondContact NH1-O 3.11Å; R952-N969 PolarHBondContact NH1-OD1 2.79Å; R952-L972 HydrophobicContact CB-CB 3.82Å; R952-L972 HydrophobicContact CB-CD1 4.3Å; R952-L972 HydrophobicContact CB-CD2 4.28Å; R952-L972 HydrophobicContact CB-CG 4.37Å; R952-L972 HydrophobicContact CG-CB 4.46Å; R952-I973 CarbonylContact C-O 3.56Å; R952-I973 WeakPolarHBondContact CA-O 3.42Å; R952-I973 WeakPolarHBondContact CB-O 3.15Å
953	V	88.9	Confident	70.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.2	-175.1	-178.5	0	0	0	0	109.8	V906 H907 I908 V936 V955 I973 V975 L998 L1000	V906-V953 HydrophobicContact CG1-CG1 3.51Å; H907-V953 CarbonylContact O-C 3.49Å; H907-V953 WeakPolarHBondContact O-CA 3.32Å; I908-V953 HydrophobicContact CG1-CG2 4.34Å; V936-V953 HydrophobicContact CG2-CG1 4.32Å; V953-V955 HydrophobicContact CG1-CG2 3.98Å; V953-I973 PolarHBondContact N-O 2.81Å; V953-I973 WeakPolarHBondContact O-CB 3.09Å; V953-I973 PolarHBondContact O-N 2.94Å; V953-V975 HydrophobicContact CG2-CG2 3.91Å; V953-L998 HydrophobicContact CG2-CD1 3.96Å; V953-L1000 HydrophobicContact CB-CD2 3.79Å; V953-L1000 HydrophobicContact CG1-CD2 4.38Å; V953-L1000 HydrophobicContact CG2-CD2 3.67Å
954	Y	86.5	Confident	69.3	Low	30 Å²	30	61 Å²	61	12%	0.118	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.5	166.2	178.6	-100.7	0	0	0	109	V906 H907 L958 P960	V906-Y954 WeakPolarHBondContact CA-O 3.15Å; H907-Y954 PolarHBondContact N-O 2.85Å; H907-Y954 PolarHBondContact O-N 3.37Å; Y954-L958 VanDerWaalsContact CE1-O 3.24Å; Y954-L958 WeakPolarHBondContact CE1-O 3.43Å; Y954-L958 PolarHBondContact OH-O 2.9Å; Y954-L958 VanDerWaalsContact OH-O 3.09Å; Y954-P960 HydrophobicContact CD2-CG 4.1Å; Y954-P960 HydrophobicContact CE1-CG 4.28Å; Y954-P960 HydrophobicContact CE2-CG 3.79Å; Y954-P960 HydrophobicContact CG-CG 4.47Å
955	V	81.2	Confident	69.1	Low	21 Å²	21	61.9 Å²	61.9	13%	0.127	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111	174	-175.9	0	0	0	0	108.4	G905 V906 V953 I973 V1004 V1010	G905-V955 CarbonylContact O-C 3.46Å; G905-V955 VanDerWaalsContact O-CA 3.32Å; G905-V955 WeakPolarHBondContact O-CA 3.15Å; V906-V955 HydrophobicContact CG1-CG2 4.42Å; V906-V955 HydrophobicContact CG2-CG1 4.31Å; V906-V955 HydrophobicContact CG2-CG2 4.27Å; V953-V955 HydrophobicContact CG1-CG2 3.98Å; V955-I973 HydrophobicContact CB-CD1 4.43Å; V955-I973 HydrophobicContact CG2-CD1 4.03Å; V955-V1004 HydrophobicContact CB-CG1 4.14Å; V955-V1004 HydrophobicContact CG1-CG1 3.9Å; V955-V1004 HydrophobicContact CG2-CG1 4.46Å; V955-V1004 HydrophobicContact CG2-CG2 4.35Å; V955-V1010 HydrophobicContact CG1-CB 4.34Å; V955-V1010 HydrophobicContact CG1-CG1 3.71Å; V955-V1010 HydrophobicContact CG1-CG2 4.09Å
956	G	72	Confident	69	Low	6 Å²	6	63.2 Å²	63.2	6%	0.062	35%	0.354	C	S	.	.	S	Bend	trans	176.3	167.3	-176.7	0	0	0	0	0	112.9	G905	G905-G956 CarbonylContact C-O 3.53Å; G905-G956 WeakPolarHBondContact CA-O 3.3Å; G905-G956 PolarHBondContact O-N 2.89Å
957	S	63.9	Low	69.2	Low	38 Å²	38	62.3 Å²	62.3	27%	0.266	34%	0.336	S	S	.	.	S	Bend	trans	-79.2	-23.6	-176.4	50.8	0	0	0	0	113.8	P1039	S957-P1039 WeakPolarHBondContact O-CD 3.32Å; S957-P1039 WeakPolarHBondContact O-CG 3.43Å
958	L	66.4	Low	69.8	Low	97 Å²	97	62.5 Å²	62.5	51%	0.508	33%	0.333	S	S	.	.	S	Bend	trans	-122.4	126.4	-174.3	-67.2	172.1	0	0	0	111.3	Y954 P960 M1038	Y954-L958 VanDerWaalsContact CE1-O 3.24Å; Y954-L958 WeakPolarHBondContact CE1-O 3.43Å; Y954-L958 PolarHBondContact OH-O 2.9Å; Y954-L958 VanDerWaalsContact OH-O 3.09Å; L958-P960 WeakPolarHBondContact O-CD 3.16Å; L958-M1038 HydrophobicContact CD2-CG 4.34Å
959	L	66.8	Low	70.3	Confident	20 Å²	20	63.6 Å²	63.6	11%	0.105	33%	0.329	C	S	.	.			trans	-71.2	123.5	178.2	-132.5	157.5	0	0	0	109.2	H907 F909 R961 V1033 G1037	H907-L959 VanDerWaalsContact CE1-CD1 3.47Å; H907-L959 WeakPolarHBondContact CE1-CD1 3.43Å; F909-L959 HydrophobicContact CZ-CD2 4Å; L959-R961 VanDerWaalsContact C-N 3.31Å; L959-R961 PolarHBondContact O-N 3.42Å; L959-V1033 HydrophobicContact CB-CG1 4.12Å; L959-V1033 HydrophobicContact CD1-CB 3.74Å; L959-V1033 HydrophobicContact CD1-CG1 3.4Å; L959-V1033 HydrophobicContact CD1-CG2 4.03Å; L959-V1033 HydrophobicContact CG-CG1 4.37Å; L959-G1037 PolarHBondContact N-O 2.81Å
960	P	61.5	Low	70.6	Confident	19 Å²	19	66.2 Å²	66.2	12%	0.123	32%	0.322	C	S	.	.			trans	-68.1	72.7	-174.1	-26.5	38	0	0	0	115.2	Y954 L958 R962 M963 L968	Y954-P960 HydrophobicContact CD2-CG 4.1Å; Y954-P960 HydrophobicContact CE1-CG 4.28Å; Y954-P960 HydrophobicContact CE2-CG 3.79Å; Y954-P960 HydrophobicContact CG-CG 4.47Å; L958-P960 WeakPolarHBondContact O-CD 3.16Å; P960-R962 VanDerWaalsContact C-N 3.27Å; P960-R962 PolarHBondContact O-N 2.84Å; P960-M963 HydrophobicContact CB-CB 4.03Å; P960-M963 HydrophobicContact CB-CE 4.1Å; P960-M963 HydrophobicContact CB-CG 3.8Å; P960-M963 HydrophobicContact CB-SD 3.68Å; P960-M963 HydrophobicContact CG-CE 4.13Å; P960-M963 HydrophobicContact CG-SD 4.02Å; P960-L968 HydrophobicContact CB-CD1 3.68Å; P960-L968 HydrophobicContact CG-CD1 3.72Å
961	R	57.2	Low	70.4	Confident	114 Å²	114	63.9 Å²	63.9	43%	0.43	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-11	-177.2	-71.9	175.4	170.6	-137.3	8.9	115	L959 C1034 Q1035 G1037	L959-R961 VanDerWaalsContact C-N 3.31Å; L959-R961 PolarHBondContact O-N 3.42Å; R961-C1034 PolarHBondContact NH2-O 3.11Å; R961-C1034 VanDerWaalsContact NH2-O 3.09Å; R961-Q1035 VanDerWaalsContact CZ-C 3.43Å; R961-Q1035 PolarHBondContact NH1-O 3.47Å; R961-Q1035 VanDerWaalsContact NH2-CA 3.28Å; R961-Q1035 PolarHBondContact NH2-O 3.06Å; R961-G1037 VanDerWaalsContact CZ-N 3.34Å
962	R	55.3	Low	70.2	Confident	214 Å²	214	63.7 Å²	63.7	81%	0.808	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.3	17.4	-176.7	-63.3	-171.1	179.7	-177.4	1.8	113.5	P960	P960-R962 VanDerWaalsContact C-N 3.27Å; P960-R962 PolarHBondContact O-N 2.84Å
963	M	60.2	Low	70.2	Confident	86 Å²	86	62.8 Å²	62.8	42%	0.424	31%	0.309	S	S	.	.			trans	-79.7	135.1	172.2	-73	-171.4	-166.6	0	0	109.5	P960 Q967 L968 T971	P960-M963 HydrophobicContact CB-CB 4.03Å; P960-M963 HydrophobicContact CB-CE 4.1Å; P960-M963 HydrophobicContact CB-CG 3.8Å; P960-M963 HydrophobicContact CB-SD 3.68Å; P960-M963 HydrophobicContact CG-CE 4.13Å; P960-M963 HydrophobicContact CG-SD 4.02Å; M963-Q967 HydrophobicContact CB-CB 4.4Å; M963-L968 HydrophobicContact CB-CB 4.3Å; M963-T971 HydrophobicContact SD-CG2 4.46Å
964	A	61.7	Low	70.1	Confident	59 Å²	59	66.7 Å²	66.7	49%	0.488	33%	0.327	S	S	.	.			trans	-54.5	144.1	166.9	0	0	0	0	0	109.4	D966 Q967 L968	A964-D966 PolarHBondContact O-N 2.87Å; A964-Q967 HydrophobicContact CB-CG 4.37Å; A964-Q967 WeakPolarHBondContact O-CB 3.3Å; A964-Q967 PolarHBondContact O-N 3.48Å; A964-L968 PolarHBondContact O-N 2.74Å
965	V	65.7	Low	70.1	Confident	80 Å²	80	65.8 Å²	65.8	49%	0.485	32%	0.324	S	S	.	.	H	α-helix	trans	-50.3	-39.8	-176.3	179.1	0	0	0	0	111	I916 Q967 L968 N969	I916-V965 HydrophobicContact CD1-CG1 3.94Å; V965-Q967 PolarHBondContact O-N 2.92Å; V965-L968 PolarHBondContact O-N 2.64Å; V965-N969 VanDerWaalsContact O-CB 3.3Å; V965-N969 WeakPolarHBondContact O-CB 3.01Å; V965-N969 PolarHBondContact O-N 3.45Å
966	D	64.4	Low	70.3	Confident	116 Å²	116	67 Å²	67	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-64.4	-39.9	179.5	-42.8	-35.2	0	0	0	113	A964 R970	A964-D966 PolarHBondContact O-N 2.87Å; D966-R970 WeakPolarHBondContact O-CG 3.35Å; D966-R970 PolarHBondContact O-N 3.3Å
967	Q	67.2	Low	70.9	Confident	102 Å²	102	68.1 Å²	68.1	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-72.4	-40.5	177.6	-66.9	-66.7	-18.7	0	0	110.6	M963 A964 V965 N969 R970 T971	M963-Q967 HydrophobicContact CB-CB 4.4Å; A964-Q967 HydrophobicContact CB-CG 4.37Å; A964-Q967 WeakPolarHBondContact O-CB 3.3Å; A964-Q967 PolarHBondContact O-N 3.48Å; V965-Q967 PolarHBondContact O-N 2.92Å; Q967-N969 VanDerWaalsContact C-N 3.33Å; Q967-N969 PolarHBondContact O-N 2.82Å; Q967-R970 PolarHBondContact O-N 3.01Å; Q967-T971 WeakPolarHBondContact O-CG2 3.48Å; Q967-T971 PolarHBondContact O-N 3.08Å
968	L	69.5	Low	71.9	Confident	18 Å²	18	67.8 Å²	67.8	9%	0.094	34%	0.343	C	S	.	.	H	α-helix	trans	-61	-45.7	173.9	-175.8	55	0	0	0	110.7	I916 P960 M963 A964 V965 R970 T971 L972	I916-L968 HydrophobicContact CB-CD2 4.33Å; I916-L968 HydrophobicContact CD1-CB 4.36Å; I916-L968 HydrophobicContact CD1-CD2 3.98Å; I916-L968 HydrophobicContact CD1-CG 4.08Å; I916-L968 HydrophobicContact CG2-CD2 3.86Å; P960-L968 HydrophobicContact CB-CD1 3.68Å; P960-L968 HydrophobicContact CG-CD1 3.72Å; M963-L968 HydrophobicContact CB-CB 4.3Å; A964-L968 PolarHBondContact O-N 2.74Å; V965-L968 PolarHBondContact O-N 2.64Å; L968-R970 PolarHBondContact O-N 2.83Å; L968-R970 VanDerWaalsContact O-N 3.17Å; L968-T971 PolarHBondContact O-N 2.94Å; L968-T971 PolarHBondContact O-OG1 2.9Å; L968-L972 HydrophobicContact CD1-CD1 4.44Å; L968-L972 HydrophobicContact CD1-CD2 4.49Å; L968-L972 HydrophobicContact CD1-CG 4.2Å; L968-L972 HydrophobicContact CG-CD1 4.04Å; L968-L972 HydrophobicContact CG-CG 4.3Å; L968-L972 VanDerWaalsContact O-CG 3.29Å; L968-L972 WeakPolarHBondContact O-CG 3.27Å; L968-L972 PolarHBondContact O-N 2.78Å; L968-L972 VanDerWaalsContact O-N 3.09Å
969	N	68.5	Low	72.7	Confident	68 Å²	68	65.6 Å²	65.6	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-31.1	179.2	-150.5	31.3	0	0	0	112.9	R952 V965 Q967	R952-N969 VanDerWaalsContact CZ-OD1 3.31Å; R952-N969 PolarHBondContact NH1-O 3.11Å; R952-N969 PolarHBondContact NH1-OD1 2.79Å; V965-N969 VanDerWaalsContact O-CB 3.3Å; V965-N969 WeakPolarHBondContact O-CB 3.01Å; V965-N969 PolarHBondContact O-N 3.45Å; Q967-N969 VanDerWaalsContact C-N 3.33Å; Q967-N969 PolarHBondContact O-N 2.82Å
970	R	69.6	Low	73.1	Confident	165 Å²	165	66.2 Å²	66.2	62%	0.623	33%	0.333	S	S	*	.	H	α-helix	trans	-76.6	-27.5	175.1	-72.5	176.2	-179.1	-161.6	0.3	113.8	Y792 D966 Q967 L968	Y792-R970 WeakPolarHBondContact CD1-O 3.3Å; Y792-R970 WeakPolarHBondContact CE1-O 3.5Å; D966-R970 WeakPolarHBondContact O-CG 3.35Å; D966-R970 PolarHBondContact O-N 3.3Å; Q967-R970 PolarHBondContact O-N 3.01Å; L968-R970 PolarHBondContact O-N 2.83Å; L968-R970 VanDerWaalsContact O-N 3.17Å
971	T	76.8	Confident	73.5	Confident	25 Å²	25	67.6 Å²	67.6	15%	0.153	34%	0.341	C	S	.	.	H	α-helix	trans	-89.2	-17.4	-179.9	59.1	0	0	0	0	113.1	P793 M963 Q967 L968	P793-T971 HydrophobicContact CG-CG2 3.82Å; M963-T971 HydrophobicContact SD-CG2 4.46Å; Q967-T971 WeakPolarHBondContact O-CG2 3.48Å; Q967-T971 PolarHBondContact O-N 3.08Å; L968-T971 PolarHBondContact O-N 2.94Å; L968-T971 PolarHBondContact O-OG1 2.9Å
972	L	83	Confident	73.8	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.052	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-77.2	124.1	179.5	-75.2	175.4	0	0	0	112	F909 I916 R952 L968	F909-L972 HydrophobicContact CB-CD2 4.47Å; F909-L972 HydrophobicContact CD2-CD2 3.53Å; F909-L972 HydrophobicContact CE2-CD2 3.99Å; F909-L972 HydrophobicContact CG-CD2 4.15Å; I916-L972 HydrophobicContact CD1-CD1 4.08Å; I916-L972 HydrophobicContact CG2-CD1 4Å; R952-L972 HydrophobicContact CB-CB 3.82Å; R952-L972 HydrophobicContact CB-CD1 4.3Å; R952-L972 HydrophobicContact CB-CD2 4.28Å; R952-L972 HydrophobicContact CB-CG 4.37Å; R952-L972 HydrophobicContact CG-CB 4.46Å; L968-L972 HydrophobicContact CD1-CD1 4.44Å; L968-L972 HydrophobicContact CD1-CD2 4.49Å; L968-L972 HydrophobicContact CD1-CG 4.2Å; L968-L972 HydrophobicContact CG-CD1 4.04Å; L968-L972 HydrophobicContact CG-CG 4.3Å; L968-L972 VanDerWaalsContact O-CG 3.29Å; L968-L972 WeakPolarHBondContact O-CG 3.27Å; L968-L972 PolarHBondContact O-N 2.78Å; L968-L972 VanDerWaalsContact O-N 3.09Å
973	I	86.9	Confident	74	Confident	31 Å²	31	53.9 Å²	53.9	16%	0.159	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.1	178.7	-56.7	157.9	0	0	0	109.4	R952 V953 V955 L1000 V1004	R952-I973 CarbonylContact C-O 3.56Å; R952-I973 WeakPolarHBondContact CA-O 3.42Å; R952-I973 WeakPolarHBondContact CB-O 3.15Å; V953-I973 PolarHBondContact N-O 2.81Å; V953-I973 WeakPolarHBondContact O-CB 3.09Å; V953-I973 PolarHBondContact O-N 2.94Å; V955-I973 HydrophobicContact CB-CD1 4.43Å; V955-I973 HydrophobicContact CG2-CD1 4.03Å; I973-L1000 HydrophobicContact CD1-CD1 4.43Å; I973-L1000 HydrophobicContact CG2-CB 3.97Å; I973-L1000 HydrophobicContact CG2-CD1 4.21Å; I973-L1000 HydrophobicContact CG2-CD2 4.25Å; I973-L1000 HydrophobicContact CG2-CG 4.36Å; I973-V1004 HydrophobicContact CD1-CG2 3.37Å
974	E	86.7	Confident	73.7	Confident	82 Å²	82	52.7 Å²	52.7	38%	0.383	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	139.8	178	-66.6	-172.1	173.4	0	0	112.5	K1001	E974-K1001 HydrophobicContact CB-CD 3.85Å; E974-K1001 HydrophobicContact CB-CG 4.14Å; E974-K1001 PolarHBondContact O-N 2.04Å; E974-K1001 WeakPolarHBondContact OE2-CD 3.22Å; E974-K1001 WeakPolarHBondContact OE2-CE 3.16Å; E974-K1001 IonicContact OE2-NZ 3.39Å; E974-K1001 PolarHBondContact OE2-NZ 2.69Å
975	V	87.6	Confident	73.2	Confident	10 Å²	10	57.2 Å²	57.2	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	126.3	170.7	-179	0	0	0	0	108.9	Y951 V953 I978 L998 L1000	Y951-V975 WeakPolarHBondContact O-CG2 3.23Å; V953-V975 HydrophobicContact CG2-CG2 3.91Å; V975-I978 HydrophobicContact CG1-CG1 3.77Å; V975-L998 HydrophobicContact CG1-CB 4.13Å; V975-L998 HydrophobicContact CG1-CD2 4.28Å; V975-L998 HydrophobicContact CG2-CB 4.42Å; V975-L998 HydrophobicContact CG2-CD1 4.27Å; V975-L1000 HydrophobicContact CG2-CD2 4.43Å
976	G	84.4	Confident	72.3	Confident	47 Å²	47	56.7 Å²	56.7	49%	0.485	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-39.4	177.7	0	0	0	0	0	112.9	K999	G976-K999 WeakPolarHBondContact CA-O 3.07Å; G976-K999 PolarHBondContact N-O 2.79Å
977	S	85.1	Confident	71.8	Confident	30 Å²	30	54.9 Å²	54.9	21%	0.21	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	150.5	176.1	63.8	0	0	0	0	111.9	Y979 K999	S977-Y979 WeakPolarHBondContact OG-CE2 3.21Å; S977-Y979 VanDerWaalsContact OG-CZ 3.31Å; S977-Y979 PolarHBondContact OG-OH 2.86Å; S977-K999 PolarHBondContact N-O 3.3Å; S977-K999 PolarHBondContact O-N 3.03Å; S977-K999 VanDerWaalsContact OG-CB 3.25Å; S977-K999 WeakPolarHBondContact OG-CB 3.4Å
978	I	84.9	Confident	71.3	Confident	31 Å²	31	56 Å²	56	16%	0.159	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.6	-178.6	-57.7	178	0	0	0	108	V943 Y951 V975 T996 L998	V943-I978 HydrophobicContact CG1-CD1 3.73Å; V943-I978 HydrophobicContact CG1-CG1 4.48Å; V943-I978 HydrophobicContact CG1-CG2 3.97Å; Y951-I978 HydrophobicContact CD2-CD1 3.67Å; Y951-I978 HydrophobicContact CE2-CD1 4.07Å; V975-I978 HydrophobicContact CG1-CG1 3.77Å; I978-T996 HydrophobicContact CG2-CG2 3.56Å; I978-L998 HydrophobicContact CB-CD2 4.35Å; I978-L998 HydrophobicContact CD1-CD2 4.47Å; I978-L998 HydrophobicContact CG1-CD2 3.9Å; I978-L998 HydrophobicContact CG2-CD2 3.96Å
979	Y	82.6	Confident	70.8	Confident	51 Å²	51	63.6 Å²	63.6	20%	0.2	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	97.8	176.5	-58.6	-72.1	0	0	0	109.1	S977 V997 K999 G1139 E1143	S977-Y979 WeakPolarHBondContact OG-CE2 3.21Å; S977-Y979 VanDerWaalsContact OG-CZ 3.31Å; S977-Y979 PolarHBondContact OG-OH 2.86Å; Y979-V997 PolarHBondContact N-O 3.35Å; Y979-V997 PolarHBondContact O-N 2.98Å; Y979-K999 HydrophobicContact CE2-CB 4.13Å; Y979-K999 HydrophobicContact CE2-CD 4.31Å; Y979-G1139 VanDerWaalsContact CE1-CA 3.42Å; Y979-E1143 PolarHBondContact OH-OE1 3.03Å
980	T	75.6	Confident	70.5	Confident	33 Å²	33	60.6 Å²	60.6	20%	0.202	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.6	177.1	-58	0	0	0	0	109	S940 T996	S940-T980 WeakPolarHBondContact OG-CG2 3.25Å; T980-T996 WeakPolarHBondContact CB-OG1 3.39Å; T980-T996 WeakPolarHBondContact CG2-OG1 3.22Å; T980-T996 PolarHBondContact OG1-OG1 2.95Å
981	T	69.3	Low	70.1	Confident	48 Å²	48	57.6 Å²	57.6	29%	0.294	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	100.4	164	65.5	0	0	0	0	108.5	G994 M995 M1135	T981-G994 WeakPolarHBondContact O-CA 3.32Å; T981-M995 PolarHBondContact N-O 3.28Å; T981-M995 PolarHBondContact O-N 3.5Å; T981-M995 WeakPolarHBondContact OG1-CE 3.17Å; T981-M995 WeakPolarHBondContact OG1-CG 3.45Å; T981-M1135 HydrophobicContact CG2-CE 3.85Å; T981-M1135 HydrophobicContact CG2-CG 3.86Å; T981-M1135 VanDerWaalsContact OG1-CE 3.3Å; T981-M1135 WeakPolarHBondContact OG1-CE 3.44Å
982	P	65.3	Low	69.8	Low	26 Å²	26	61.8 Å²	61.8	17%	0.169	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	143	162.4	31.2	-33.1	0	0	0	106.9	Y984 E985 K991	P982-Y984 PolarHBondContact O-N 2.76Å; P982-Y984 VanDerWaalsContact O-N 3.16Å; P982-E985 HydrophobicContact CG-CG 3.62Å; P982-K991 VanDerWaalsContact CB-O 3.3Å; P982-K991 WeakPolarHBondContact CB-O 3.17Å
983	F	59.8	Low	69.3	Low	14 Å²	14	61.6 Å²	61.6	6%	0.061	33%	0.328	C	S	.	.	S	Bend	trans	-60.7	-32.3	-176.4	-77.1	-101.2	0	0	0	111.1	V993 G994 V1064 V1125	F983-V993 WeakPolarHBondContact CD2-O 3.28Å; F983-V993 PolarHBondContact N-O 3.01Å; F983-V993 VanDerWaalsContact N-O 3.11Å; F983-G994 VanDerWaalsContact CD2-CA 3.48Å; F983-V1064 HydrophobicContact CD1-CG1 4.42Å; F983-V1125 HydrophobicContact CD2-CG1 4.39Å; F983-V1125 HydrophobicContact CE2-CB 4.41Å; F983-V1125 HydrophobicContact CE2-CG1 3.19Å; F983-V1125 HydrophobicContact CE2-CG2 4.43Å; F983-V1125 HydrophobicContact CZ-CG1 3.3Å
984	Y	53.7	Low	68.8	Low	61 Å²	61	60.1 Å²	60.1	24%	0.239	32%	0.321	C	S	.	.			trans	-146.8	97.6	-179.5	-57.3	-71.8	0	0	0	112.7	P488 P982 G986 Y987 L990 V1064	P488-Y984 HydrophobicContact CB-CD2 3.94Å; P488-Y984 HydrophobicContact CB-CE1 3.9Å; P488-Y984 HydrophobicContact CB-CE2 3.16Å; P488-Y984 WeakPolarHBondContact CB-OH 3.43Å; P488-Y984 HydrophobicContact CG-CD1 3.43Å; P488-Y984 VanDerWaalsContact CG-CD1 3.43Å; P488-Y984 HydrophobicContact CG-CD2 3.67Å; P488-Y984 HydrophobicContact CG-CE1 2.93Å; P488-Y984 HydrophobicContact CG-CE2 3.15Å; P488-Y984 HydrophobicContact CG-CG 3.81Å; P488-Y984 WeakPolarHBondContact CG-OH 3.09Å; P982-Y984 PolarHBondContact O-N 2.76Å; P982-Y984 VanDerWaalsContact O-N 3.16Å; Y984-G986 PolarHBondContact O-N 3.03Å; Y984-G986 VanDerWaalsContact O-N 3.1Å; Y984-Y987 PolarHBondContact O-N 3.1Å; Y984-L990 HydrophobicContact CD2-CB 4.49Å; Y984-L990 HydrophobicContact CD2-CD1 3.74Å; Y984-L990 HydrophobicContact CG-CD1 4.42Å; Y984-V1064 HydrophobicContact CE2-CG1 3.89Å
985	E	49.5	Very low	68.6	Low	153 Å²	153	56.6 Å²	56.6	72%	0.715	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.6	174.8	-71.3	-175.4	164.6	0	0	113.5	P982 Y987 K991	P982-E985 HydrophobicContact CG-CG 3.62Å; E985-Y987 VanDerWaalsContact C-N 3.35Å; E985-Y987 PolarHBondContact O-N 3.32Å; E985-K991 WeakPolarHBondContact O-CE 3.35Å
986	G	48.4	Very low	68.6	Low	69 Å²	69	56.1 Å²	56.1	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-4	-178.3	0	0	0	0	0	115.8	Y984	Y984-G986 PolarHBondContact O-N 3.03Å; Y984-G986 VanDerWaalsContact O-N 3.1Å
987	Y	54.1	Low	68.7	Low	78 Å²	78	54.2 Å²	54.2	31%	0.306	28%	0.28	S	S	.	.			trans	-125.6	108.2	-174.2	-76.7	-88.8	0	0	0	110.6	F489 Y984 E985 E989 L990 K991	F489-Y987 AromaticContact CD1-CD1 3.76Å; F489-Y987 HydrophobicContact CD1-CD1 3.76Å; F489-Y987 AromaticContact CD1-CD2 3.95Å; F489-Y987 HydrophobicContact CD1-CD2 3.95Å; F489-Y987 AromaticContact CD1-CE1 3.48Å; F489-Y987 HydrophobicContact CD1-CE1 3.48Å; F489-Y987 VanDerWaalsContact CD1-CE1 3.48Å; F489-Y987 AromaticContact CD1-CE2 3.7Å; F489-Y987 HydrophobicContact CD1-CE2 3.7Å; F489-Y987 HydrophobicContact CD1-CG 4.01Å; F489-Y987 AromaticContact CD1-CZ 3.5Å; F489-Y987 HydrophobicContact CD2-CE1 4.2Å; F489-Y987 HydrophobicContact CE1-CD1 4.01Å; F489-Y987 HydrophobicContact CE1-CD2 4.05Å; F489-Y987 AromaticContact CE1-CE1 3.25Å; F489-Y987 HydrophobicContact CE1-CE1 3.25Å; F489-Y987 AromaticContact CE1-CE2 3.31Å; F489-Y987 HydrophobicContact CE1-CE2 3.31Å; F489-Y987 HydrophobicContact CE1-CG 4.37Å; F489-Y987 AromaticContact CE1-CZ 2.88Å; F489-Y987 WeakPolarHBondContact CE1-OH 3.31Å; F489-Y987 AromaticContact CE2-CE1 3.98Å; F489-Y987 HydrophobicContact CE2-CE1 3.98Å; F489-Y987 HydrophobicContact CG-CD1 4.14Å; F489-Y987 AromaticContact CG-CE1 3.98Å; F489-Y987 HydrophobicContact CG-CE1 3.98Å; F489-Y987 AromaticContact CZ-CE1 3.52Å; F489-Y987 HydrophobicContact CZ-CE1 3.52Å; F489-Y987 HydrophobicContact CZ-CE2 4.21Å; F489-Y987 AromaticContact CZ-CZ 3.35Å; F489-Y987 WeakPolarHBondContact CZ-OH 3.02Å; Y984-Y987 PolarHBondContact O-N 3.1Å; E985-Y987 VanDerWaalsContact C-N 3.35Å; E985-Y987 PolarHBondContact O-N 3.32Å; Y987-E989 PolarHBondContact O-N 2.94Å; Y987-E989 VanDerWaalsContact O-N 3.15Å; Y987-L990 CarbonylContact O-C 3.57Å; Y987-L990 WeakPolarHBondContact O-CA 3.37Å; Y987-L990 PolarHBondContact O-N 2.82Å; Y987-K991 WeakPolarHBondContact O-CG 3.25Å; Y987-K991 PolarHBondContact O-N 2.94Å
988	D	56.7	Low	68.9	Low	125 Å²	125	52.8 Å²	52.8	67%	0.668	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-51.1	-42	-175	-67.7	-35.5	0	0	0	113.1	L990 K991	D988-L990 VanDerWaalsContact C-N 3.25Å; D988-L990 PolarHBondContact O-N 3.39Å; D988-K991 PolarHBondContact O-N 3.22Å; D988-K991 WeakPolarHBondContact OD1-CE 3.23Å; D988-K991 IonicContact OD1-NZ 3.95Å; D988-K991 PolarHBondContact OD1-NZ 3.09Å
989	E	57.3	Low	69.1	Low	179 Å²	179	53.8 Å²	53.8	84%	0.836	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-66.9	-23.8	178.9	-62.6	177.8	177.3	0	0	113.8	Y987	Y987-E989 PolarHBondContact O-N 2.94Å; Y987-E989 VanDerWaalsContact O-N 3.15Å
990	L	63.4	Low	69.4	Low	4 Å²	4	51.6 Å²	51.6	2%	0.021	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-105.1	-2.9	-179.7	-71.7	174.4	0	0	0	113.2	F489 Y984 Y987 D988 E992 V993 L1061 M1065	F489-L990 HydrophobicContact CB-CD1 3.93Å; Y984-L990 HydrophobicContact CD2-CB 4.49Å; Y984-L990 HydrophobicContact CD2-CD1 3.74Å; Y984-L990 HydrophobicContact CG-CD1 4.42Å; Y987-L990 CarbonylContact O-C 3.57Å; Y987-L990 WeakPolarHBondContact O-CA 3.37Å; Y987-L990 PolarHBondContact O-N 2.82Å; D988-L990 VanDerWaalsContact C-N 3.25Å; D988-L990 PolarHBondContact O-N 3.39Å; L990-E992 PolarHBondContact O-N 3.36Å; L990-V993 HydrophobicContact CD2-CB 4.38Å; L990-V993 PolarHBondContact O-N 3.22Å; L990-V993 VanDerWaalsContact O-O 3.06Å; L990-L1061 HydrophobicContact CD1-CD1 3.82Å; L990-L1061 HydrophobicContact CD2-CD1 3.32Å; L990-L1061 HydrophobicContact CG-CD1 3.88Å; L990-M1065 HydrophobicContact CD2-CE 4.26Å
991	K	61.2	Low	69.8	Low	103 Å²	103	55.7 Å²	55.7	45%	0.448	28%	0.28	S	S	.	.	S	Bend	trans	-62.4	-29.7	179.3	-80.9	-178.7	-177.6	171.6	0	112.7	P982 E985 Y987 D988	P982-K991 VanDerWaalsContact CB-O 3.3Å; P982-K991 WeakPolarHBondContact CB-O 3.17Å; E985-K991 WeakPolarHBondContact O-CE 3.35Å; Y987-K991 WeakPolarHBondContact O-CG 3.25Å; Y987-K991 PolarHBondContact O-N 2.94Å; D988-K991 PolarHBondContact O-N 3.22Å; D988-K991 WeakPolarHBondContact OD1-CE 3.23Å; D988-K991 IonicContact OD1-NZ 3.95Å; D988-K991 PolarHBondContact OD1-NZ 3.09Å
992	E	69.2	Low	70.5	Confident	113 Å²	113	58.3 Å²	58.3	53%	0.528	29%	0.289	S	S	.	.	S	Bend	trans	-89.8	-18.8	-179.7	-61.1	-175.1	169.1	0	0	113.2	R941 L990	R941-E992 IonicContact CZ-OE2 2.81Å; R941-E992 PolarHBondContact N-O 2.95Å; R941-E992 IonicContact NH1-OE2 3.9Å; R941-E992 PolarHBondContact NH1-OE2 3.06Å; R941-E992 IonicContact NH2-OE2 3.98Å; R941-E992 PolarHBondContact NH2-OE2 3.36Å; L990-E992 PolarHBondContact O-N 3.36Å
993	V	73.2	Confident	71.3	Confident	6 Å²	6	65 Å²	65	4%	0.036	31%	0.311	C	S	.	.			trans	-92.1	122.4	-178	-177.8	0	0	0	0	108.4	F983 L990 M1065 V1125	F983-V993 WeakPolarHBondContact CD2-O 3.28Å; F983-V993 PolarHBondContact N-O 3.01Å; F983-V993 VanDerWaalsContact N-O 3.11Å; L990-V993 HydrophobicContact CD2-CB 4.38Å; L990-V993 PolarHBondContact O-N 3.22Å; L990-V993 VanDerWaalsContact O-O 3.06Å; V993-M1065 HydrophobicContact CB-CE 4.32Å; V993-M1065 HydrophobicContact CG1-CE 3.78Å; V993-M1065 HydrophobicContact CG2-CE 3.9Å; V993-V1125 HydrophobicContact CG1-CG2 3.56Å
994	G	77.5	Confident	72.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	-179.8	-166.3	0	0	0	0	0	113.1	S940 T981 F983	S940-G994 PolarHBondContact N-O 3.43Å; S940-G994 WeakPolarHBondContact OG-CA 3.47Å; T981-G994 WeakPolarHBondContact O-CA 3.32Å; F983-G994 VanDerWaalsContact CD2-CA 3.48Å
995	M	82.6	Confident	73.4	Confident	7 Å²	7	68.1 Å²	68.1	3%	0.034	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	130	167.8	49.4	178.7	-173.9	0	0	111	S940 T981 I1096 L1127 N1131 M1135	S940-M995 WeakPolarHBondContact OG-CA 3.24Å; S940-M995 PolarHBondContact OG-N 3.39Å; S940-M995 PolarHBondContact OG-O 3.11Å; S940-M995 VanDerWaalsContact OG-O 3.08Å; T981-M995 PolarHBondContact N-O 3.28Å; T981-M995 PolarHBondContact O-N 3.5Å; T981-M995 WeakPolarHBondContact OG1-CE 3.17Å; T981-M995 WeakPolarHBondContact OG1-CG 3.45Å; M995-I1096 HydrophobicContact CB-CD1 4.09Å; M995-L1127 HydrophobicContact SD-CD2 4.19Å; M995-N1131 HydrophobicContact CE-CB 3.57Å; M995-N1131 HydrophobicContact SD-CB 3.82Å; M995-M1135 HydrophobicContact CB-CE 4.19Å; M995-M1135 HydrophobicContact CE-CE 3.93Å; M995-M1135 HydrophobicContact CE-CG 3.66Å; M995-M1135 HydrophobicContact CE-SD 3.03Å; M995-M1135 WeakPolarHBondContact CE-SD 3.21Å; M995-M1135 HydrophobicContact CG-CE 3.52Å; M995-M1135 HydrophobicContact CG-SD 3.66Å; M995-M1135 VanDerWaalsContact O-CE 3.23Å; M995-M1135 WeakPolarHBondContact O-CE 3.32Å; M995-M1135 HydrophobicContact SD-CE 4.03Å; M995-M1135 HydrophobicContact SD-SD 3.3Å
996	T	86	Confident	74.6	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	112.3	162.1	-29.2	0	0	0	0	115.7	V937 T938 S940 V943 I978 T980 L998	V937-T996 CarbonylContact C-O 3.51Å; V937-T996 WeakPolarHBondContact CA-O 3.34Å; T938-T996 PolarHBondContact N-O 3.48Å; T938-T996 WeakPolarHBondContact O-CA 3.35Å; T938-T996 PolarHBondContact O-N 3.14Å; S940-T996 WeakPolarHBondContact CA-OG1 3.18Å; S940-T996 PolarHBondContact OG-OG1 2.68Å; V943-T996 HydrophobicContact CB-CG2 4.29Å; V943-T996 PolarHBondContact O-OG1 2.67Å; I978-T996 HydrophobicContact CG2-CG2 3.56Å; T980-T996 WeakPolarHBondContact CB-OG1 3.39Å; T980-T996 WeakPolarHBondContact CG2-OG1 3.22Å; T980-T996 PolarHBondContact OG1-OG1 2.95Å; T996-L998 HydrophobicContact CG2-CD2 3.76Å; T996-L998 HydrophobicContact CG2-CG 4.49Å
997	V	87.6	Confident	75.4	Confident	8 Å²	8	62.2 Å²	62.2	5%	0.048	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.6	161.3	178.9	0	0	0	0	109.5	E935 V936 V937 Y979 M1135	E935-V997 HydrophobicContact CB-CG1 4.49Å; V936-V997 CarbonylContact O-C 3.58Å; V936-V997 WeakPolarHBondContact O-CA 3.36Å; V937-V997 HydrophobicContact CG2-CG2 4.33Å; Y979-V997 PolarHBondContact N-O 3.35Å; Y979-V997 PolarHBondContact O-N 2.98Å; V997-M1135 HydrophobicContact CB-CE 4.22Å; V997-M1135 HydrophobicContact CG2-CB 4.45Å; V997-M1135 HydrophobicContact CG2-CE 3.6Å; V997-M1135 HydrophobicContact CG2-SD 3.62Å
998	L	88.8	Confident	75.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.4	173.4	-50.5	177.7	0	0	0	108.3	I908 V936 V943 V953 V975 I978 T996	I908-L998 HydrophobicContact CD1-CD1 3.8Å; I908-L998 HydrophobicContact CG1-CD1 4.08Å; I908-L998 HydrophobicContact CG2-CD1 4.28Å; V936-L998 HydrophobicContact CB-CB 4.26Å; V936-L998 PolarHBondContact N-O 2.99Å; V936-L998 PolarHBondContact O-N 3.19Å; V943-L998 HydrophobicContact CB-CD2 4.22Å; V943-L998 HydrophobicContact CG1-CD2 3.91Å; V943-L998 HydrophobicContact CG2-CD1 4.32Å; V943-L998 HydrophobicContact CG2-CD2 4.21Å; V953-L998 HydrophobicContact CG2-CD1 3.96Å; V975-L998 HydrophobicContact CG1-CB 4.13Å; V975-L998 HydrophobicContact CG1-CD2 4.28Å; V975-L998 HydrophobicContact CG2-CB 4.42Å; V975-L998 HydrophobicContact CG2-CD1 4.27Å; I978-L998 HydrophobicContact CB-CD2 4.35Å; I978-L998 HydrophobicContact CD1-CD2 4.47Å; I978-L998 HydrophobicContact CG1-CD2 3.9Å; I978-L998 HydrophobicContact CG2-CD2 3.96Å; T996-L998 HydrophobicContact CG2-CD2 3.76Å; T996-L998 HydrophobicContact CG2-CG 4.49Å
999	K	88.9	Confident	75.1	Confident	52 Å²	52	58.1 Å²	58.1	23%	0.226	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	116	168.7	-166.8	171	-179.5	172.3	0	108.5	D934 G976 S977 Y979 E1143	D934-K999 CarbonylContact O-C 3.53Å; D934-K999 VanDerWaalsContact O-CA 3.32Å; D934-K999 WeakPolarHBondContact O-CA 3.46Å; G976-K999 WeakPolarHBondContact CA-O 3.07Å; G976-K999 PolarHBondContact N-O 2.79Å; S977-K999 PolarHBondContact N-O 3.3Å; S977-K999 PolarHBondContact O-N 3.03Å; S977-K999 VanDerWaalsContact OG-CB 3.25Å; S977-K999 WeakPolarHBondContact OG-CB 3.4Å; Y979-K999 HydrophobicContact CE2-CB 4.13Å; Y979-K999 HydrophobicContact CE2-CD 4.31Å; K999-E1143 VanDerWaalsContact CD-OE1 3.28Å; K999-E1143 WeakPolarHBondContact CD-OE1 3.13Å; K999-E1143 WeakPolarHBondContact CE-OE1 3.49Å; K999-E1143 IonicContact NZ-OE1 3.27Å; K999-E1143 PolarHBondContact NZ-OE1 3.11Å; K999-E1143 IonicContact NZ-OE2 2.93Å; K999-E1143 PolarHBondContact NZ-OE2 3.11Å
1000	L	88.5	Confident	75.5	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	145.7	177	-56	-178.2	0	0	0	109.7	D934 V936 V953 I973 V975 H1002 V1004	D934-L1000 HydrophobicContact CB-CB 4.39Å; D934-L1000 PolarHBondContact O-N 2.74Å; V936-L1000 HydrophobicContact CG2-CD1 3.94Å; V936-L1000 HydrophobicContact CG2-CD2 4.24Å; V936-L1000 HydrophobicContact CG2-CG 4.15Å; V953-L1000 HydrophobicContact CB-CD2 3.79Å; V953-L1000 HydrophobicContact CG1-CD2 4.38Å; V953-L1000 HydrophobicContact CG2-CD2 3.67Å; I973-L1000 HydrophobicContact CD1-CD1 4.43Å; I973-L1000 HydrophobicContact CG2-CB 3.97Å; I973-L1000 HydrophobicContact CG2-CD1 4.21Å; I973-L1000 HydrophobicContact CG2-CD2 4.25Å; I973-L1000 HydrophobicContact CG2-CG 4.36Å; V975-L1000 HydrophobicContact CG2-CD2 4.43Å; L1000-H1002 WeakPolarHBondContact CB-O 3.45Å; L1000-H1002 PolarHBondContact O-N 2.91Å; L1000-V1004 HydrophobicContact CD1-CG2 3.78Å
1001	K	85.5	Confident	75.8	Confident	119 Å²	119	53.4 Å²	53.4	52%	0.517	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	-26.2	173.7	-71.6	-167.2	-176.8	172.2	0	112	E974	E974-K1001 HydrophobicContact CB-CD 3.85Å; E974-K1001 HydrophobicContact CB-CG 4.14Å; E974-K1001 PolarHBondContact O-N 2.04Å; E974-K1001 WeakPolarHBondContact OE2-CD 3.22Å; E974-K1001 WeakPolarHBondContact OE2-CE 3.16Å; E974-K1001 IonicContact OE2-NZ 3.39Å; E974-K1001 PolarHBondContact OE2-NZ 2.69Å
1002	H	83.4	Confident	76.6	Confident	103 Å²	103	49.9 Å²	49.9	48%	0.477	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.4	-176.1	-59.1	2.9	0	0	0	109.5	L1000	L1000-H1002 WeakPolarHBondContact CB-O 3.45Å; L1000-H1002 PolarHBondContact O-N 2.91Å
1003	R	82.8	Confident	77.3	Confident	167 Å²	167	44.8 Å²	44.8	63%	0.63	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	138.1	177.5	-72.8	179.4	175.3	-177.9	2.5	110.7	D934	D934-R1003 HydrophobicContact CB-CG 3.72Å; D934-R1003 IonicContact OD2-CZ 3.76Å; D934-R1003 IonicContact OD2-NE 2.83Å; D934-R1003 PolarHBondContact OD2-NE 2.86Å; D934-R1003 VanDerWaalsContact OD2-NE 3.14Å; D934-R1003 IonicContact OD2-NH2 3.83Å
1004	V	80.5	Confident	77.7	Confident	25 Å²	25	47.9 Å²	47.9	15%	0.152	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.6	178.2	-170.1	0	0	0	0	109.5	Y932 S933 V955 I973 L1000	Y932-V1004 CarbonylContact C-O 3.43Å; Y932-V1004 VanDerWaalsContact CA-O 3.27Å; Y932-V1004 WeakPolarHBondContact CA-O 3.37Å; S933-V1004 PolarHBondContact N-O 2.83Å; S933-V1004 PolarHBondContact O-N 2.86Å; V955-V1004 HydrophobicContact CB-CG1 4.14Å; V955-V1004 HydrophobicContact CG1-CG1 3.9Å; V955-V1004 HydrophobicContact CG2-CG1 4.46Å; V955-V1004 HydrophobicContact CG2-CG2 4.35Å; I973-V1004 HydrophobicContact CD1-CG2 3.37Å; L1000-V1004 HydrophobicContact CD1-CG2 3.78Å
1005	K	77	Confident	78	Confident	114 Å²	114	48.9 Å²	48.9	50%	0.496	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.9	174.1	-165.9	177.4	-179.2	179.5	0	109.6	A931 Y932 I1007	A931-K1005 WeakPolarHBondContact O-CA 3Å; Y932-K1005 HydrophobicContact CD1-CB 3.86Å; Y932-K1005 HydrophobicContact CD1-CG 4.33Å; Y932-K1005 HydrophobicContact CE1-CB 3.56Å; Y932-K1005 HydrophobicContact CE1-CD 4.29Å; Y932-K1005 HydrophobicContact CE1-CG 3.9Å; Y932-K1005 HydrophobicContact CE2-CG 4.36Å; K1005-I1007 HydrophobicContact CB-CG2 4.32Å; K1005-I1007 HydrophobicContact CD-CG2 4.5Å; K1005-I1007 HydrophobicContact CG-CG2 4.37Å; K1005-I1007 PolarHBondContact O-N 2.84Å
1006	V	73.5	Confident	77.8	Confident	45 Å²	45	48.7 Å²	48.7	27%	0.273	25%	0.248	S	C	.	.			trans	-71	110.8	169.6	-173.6	0	0	0	0	107.3	L924 A926 A931 V1010	L924-V1006 HydrophobicContact CD2-CG2 3.94Å; A926-V1006 HydrophobicContact CB-CG2 3.87Å; A931-V1006 PolarHBondContact O-N 2.88Å; V1006-V1010 WeakPolarHBondContact CG1-O 3.14Å
1007	I	65.2	Low	77.1	Confident	53 Å²	53	56.6 Å²	56.6	27%	0.272	28%	0.279	S	S	.	.			trans	-109.3	157.4	-176	56.4	171.4	0	0	0	111.7	K1005 G1009 V1010	K1005-I1007 HydrophobicContact CB-CG2 4.32Å; K1005-I1007 HydrophobicContact CD-CG2 4.5Å; K1005-I1007 HydrophobicContact CG-CG2 4.37Å; K1005-I1007 PolarHBondContact O-N 2.84Å; I1007-G1009 PolarHBondContact O-N 2.82Å; I1007-V1010 HydrophobicContact CD1-CG2 4.4Å; I1007-V1010 HydrophobicContact CG1-CB 4.15Å; I1007-V1010 HydrophobicContact CG1-CG2 4.16Å; I1007-V1010 CarbonylContact O-C 3.59Å; I1007-V1010 PolarHBondContact O-N 2.83Å; I1007-V1010 VanDerWaalsContact O-O 3.07Å
1008	S	52	Low	76	Confident	103 Å²	103	58.6 Å²	58.6	72%	0.72	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	110.8	168.7	-73.8	0	0	0	0	109.4
1009	G	53.9	Low	74.6	Confident	15 Å²	15	59.1 Å²	59.1	16%	0.155	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	121.4	-27.1	-174.3	0	0	0	0	0	114	I1007	I1007-G1009 PolarHBondContact O-N 2.82Å
1010	V	65.5	Low	73.8	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	29%	0.293	C	S	.	.	S	Bend	trans	-121.2	94	171.3	-176.6	0	0	0	0	108.1	V906 V955 V1006 I1007	V906-V1010 HydrophobicContact CG2-CG1 4.17Å; V955-V1010 HydrophobicContact CG1-CB 4.34Å; V955-V1010 HydrophobicContact CG1-CG1 3.71Å; V955-V1010 HydrophobicContact CG1-CG2 4.09Å; V1006-V1010 WeakPolarHBondContact CG1-O 3.14Å; I1007-V1010 HydrophobicContact CD1-CG2 4.4Å; I1007-V1010 HydrophobicContact CG1-CB 4.15Å; I1007-V1010 HydrophobicContact CG1-CG2 4.16Å; I1007-V1010 CarbonylContact O-C 3.59Å; I1007-V1010 PolarHBondContact O-N 2.83Å; I1007-V1010 VanDerWaalsContact O-O 3.07Å
1011	Q	69.2	Low	73.3	Confident	83 Å²	83	57.4 Å²	57.4	39%	0.388	29%	0.293	S	S	.	.			trans	-87.7	141.9	-178.1	-75.2	-176.5	-3.9	0	0	111.9	G902 A903 F1013	G902-Q1011 VanDerWaalsContact CA-OE1 3.31Å; A903-Q1011 PolarHBondContact O-N 2.83Å; Q1011-F1013 HydrophobicContact CB-CE1 4.15Å; Q1011-F1013 HydrophobicContact CB-CE2 4.03Å; Q1011-F1013 HydrophobicContact CB-CZ 3.69Å
1012	S	78.7	Confident	73.3	Confident	29 Å²	29	51.9 Å²	51.9	20%	0.203	27%	0.269	C	S	.	.			trans	-93.2	140.6	162	-170.2	0	0	0	0	109.5	L924 A926	L924-S1012 WeakPolarHBondContact O-CA 3.3Å; L924-S1012 WeakPolarHBondContact O-CB 3.01Å; L924-S1012 PolarHBondContact O-OG 2.89Å; A926-S1012 PolarHBondContact N-OG 2.95Å
1013	F	82.7	Confident	73.3	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.026	26%	0.256	C	S	.	.			trans	-114.5	138.1	-178.9	-60.7	-79.2	0	0	0	110.8	P901 T923 Q1011 L1084 W1091 Q1093	P901-F1013 HydrophobicContact CB-CE1 4.09Å; P901-F1013 HydrophobicContact CB-CZ 4.37Å; T923-F1013 HydrophobicContact CG2-CD2 3.99Å; Q1011-F1013 HydrophobicContact CB-CE1 4.15Å; Q1011-F1013 HydrophobicContact CB-CE2 4.03Å; Q1011-F1013 HydrophobicContact CB-CZ 3.69Å; F1013-L1084 HydrophobicContact CB-CD2 3.9Å; F1013-L1084 HydrophobicContact CD1-CD1 4.27Å; F1013-L1084 HydrophobicContact CD1-CD2 3.7Å; F1013-L1084 HydrophobicContact CD2-CD1 4.18Å; F1013-L1084 HydrophobicContact CD2-CD2 3.49Å; F1013-L1084 VanDerWaalsContact CD2-CD2 3.49Å; F1013-L1084 HydrophobicContact CD2-CG 4.48Å; F1013-L1084 HydrophobicContact CE1-CD1 3.76Å; F1013-L1084 HydrophobicContact CE1-CD2 4.08Å; F1013-L1084 HydrophobicContact CE2-CD1 3.66Å; F1013-L1084 HydrophobicContact CE2-CD2 3.88Å; F1013-L1084 HydrophobicContact CE2-CG 4.42Å; F1013-L1084 HydrophobicContact CG-CD1 4.46Å; F1013-L1084 HydrophobicContact CG-CD2 3.38Å; F1013-L1084 HydrophobicContact CZ-CD1 3.43Å; F1013-L1084 VanDerWaalsContact CZ-CD1 3.43Å; F1013-L1084 HydrophobicContact CZ-CD2 4.16Å; F1013-L1084 HydrophobicContact CZ-CG 4.44Å; F1013-W1091 HydrophobicContact CD1-CB 4.11Å; F1013-W1091 HydrophobicContact CE1-CB 4.19Å; F1013-Q1093 HydrophobicContact CB-CB 3.93Å
1014	P	82.8	Confident	73.4	Confident	70 Å²	70	41.9 Å²	41.9	46%	0.455	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-64.8	149	172.7	28.7	-35.2	0	0	0	110.8	W1091 V1092 Q1093	P1014-W1091 WeakPolarHBondContact CD-O 3.37Å; P1014-W1091 WeakPolarHBondContact CG-O 3.41Å; P1014-V1092 HydrophobicContact CG-CG2 4.14Å; P1014-V1092 WeakPolarHBondContact O-CG1 3.42Å; P1014-Q1093 PolarHBondContact O-N 2.96Å
1015	L	83.1	Confident	73.5	Confident	22 Å²	22	49.8 Å²	49.8	12%	0.115	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-83.1	152.3	169.9	-61.9	177.6	0	0	0	110.5	Y925 Q1093 L1127 A1132	Y925-L1015 HydrophobicContact CD2-CD1 4.22Å; Y925-L1015 HydrophobicContact CD2-CG 4.27Å; Y925-L1015 HydrophobicContact CE2-CD1 3.67Å; Y925-L1015 HydrophobicContact CE2-CG 3.83Å; L1015-Q1093 HydrophobicContact CD2-CB 4.47Å; L1015-L1127 HydrophobicContact CD2-CB 4.21Å; L1015-L1127 HydrophobicContact CD2-CD1 3.82Å; L1015-L1127 HydrophobicContact CD2-CG 4.47Å; L1015-A1132 HydrophobicContact CD1-CB 3.25Å
1016	P	79.1	Confident	73.9	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.019	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-67.7	155.3	-179.7	27.2	-35	0	0	0	111.5	V1092 Q1093 F1094 L1127 G1129	P1016-V1092 HydrophobicContact CB-CG1 3.88Å; P1016-V1092 HydrophobicContact CG-CG1 4.44Å; P1016-Q1093 WeakPolarHBondContact CD-O 3.05Å; P1016-F1094 HydrophobicContact CB-CD1 3.73Å; P1016-F1094 HydrophobicContact CB-CE1 3.55Å; P1016-F1094 HydrophobicContact CB-CG 4.44Å; P1016-F1094 HydrophobicContact CB-CZ 4.15Å; P1016-F1094 HydrophobicContact CG-CD1 3.88Å; P1016-F1094 HydrophobicContact CG-CE1 4.24Å; P1016-F1094 HydrophobicContact CG-CG 4.41Å; P1016-L1127 WeakPolarHBondContact CG-O 3.2Å; P1016-G1129 WeakPolarHBondContact O-CA 3.39Å; P1016-G1129 PolarHBondContact O-N 2.93Å
1017	Y	70.9	Confident	74.6	Confident	165 Å²	165	44.5 Å²	44.5	65%	0.647	25%	0.245	S	C	*	.	P	Polyproline II helix	trans	-71.1	151.3	175.5	-65.8	-80.8	0	0	0	111.4	G1019 T1020	Y1017-G1019 PolarHBondContact O-N 2.79Å; Y1017-T1020 PolarHBondContact N-OG1 3.23Å; Y1017-T1020 VanDerWaalsContact N-OG1 3.11Å; Y1017-T1020 WeakPolarHBondContact O-CB 3.46Å; Y1017-T1020 PolarHBondContact O-N 2.9Å; Y1017-T1020 PolarHBondContact O-OG1 3.46Å
1018	S	63.8	Low	75.9	Confident	51 Å²	51	42 Å²	42	36%	0.357	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	128.9	177.8	-48.4	0	0	0	0	111.4	T1020 D1130	S1018-T1020 VanDerWaalsContact C-N 3.29Å; S1018-T1020 PolarHBondContact O-N 3.3Å; S1018-D1130 PolarHBondContact OG-OD1 2.98Å; S1018-D1130 PolarHBondContact OG-OD2 2.93Å
1019	G	60.9	Low	77.8	Confident	11 Å²	11	38.7 Å²	38.7	11%	0.113	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	-3.1	-175.8	0	0	0	0	0	115.6	Y1017	Y1017-G1019 PolarHBondContact O-N 2.79Å
1020	T	71.4	Confident	79.6	Confident	18 Å²	18	38 Å²	38	11%	0.11	20%	0.197	C	C	.	.			trans	-90.6	138.1	167.2	65.5	0	0	0	0	110.6	I569 Q575 Y1017 S1018	I569-T1020 HydrophobicContact CG1-CG2 4.44Å; Q575-T1020 VanDerWaalsContact OE1-CA 3.3Å; Y1017-T1020 PolarHBondContact N-OG1 3.23Å; Y1017-T1020 VanDerWaalsContact N-OG1 3.11Å; Y1017-T1020 WeakPolarHBondContact O-CB 3.46Å; Y1017-T1020 PolarHBondContact O-N 2.9Å; Y1017-T1020 PolarHBondContact O-OG1 3.46Å; S1018-T1020 VanDerWaalsContact C-N 3.29Å; S1018-T1020 PolarHBondContact O-N 3.3Å
1021	G	78.6	Confident	80.6	Confident	2 Å²	2	38 Å²	38	2%	0.021	20%	0.197	C	C	.	.			trans	-134.7	153.7	179.6	0	0	0	0	0	112.1	Y1066 F1094	G1021-Y1066 WeakPolarHBondContact CA-OH 3.15Å; G1021-F1094 VanDerWaalsContact C-CE1 3.47Å
1022	A	85.1	Confident	81.2	Confident	3 Å²	3	34 Å²	34	3%	0.025	18%	0.178	C	C	.	.			trans	-64	138.9	171.3	0	0	0	0	0	110	M1026 L1046 Y1066 F1094	A1022-M1026 HydrophobicContact CB-SD 4.46Å; A1022-L1046 HydrophobicContact CB-CD1 3.53Å; A1022-Y1066 HydrophobicContact CB-CD1 4.47Å; A1022-Y1066 HydrophobicContact CB-CD2 4.41Å; A1022-Y1066 HydrophobicContact CB-CE1 4.02Å; A1022-Y1066 HydrophobicContact CB-CE2 3.95Å; A1022-Y1066 PolarHBondContact N-OH 2.99Å; A1022-F1094 HydrophobicContact CB-CB 3.86Å; A1022-F1094 HydrophobicContact CB-CD1 3.84Å; A1022-F1094 HydrophobicContact CB-CD2 4.39Å; A1022-F1094 HydrophobicContact CB-CE1 4.45Å; A1022-F1094 HydrophobicContact CB-CG 3.78Å; A1022-F1094 VanDerWaalsContact N-CD1 3.26Å
1023	S	82.5	Confident	81.2	Confident	29 Å²	29	32.7 Å²	32.7	20%	0.203	17%	0.169	C	C	.	.			trans	-112.3	151.2	175.8	167	0	0	0	0	109.2	R1025 M1026	S1023-R1025 PolarHBondContact O-N 2.99Å; S1023-R1025 PolarHBondContact OG-N 3.47Å; S1023-M1026 WeakPolarHBondContact O-CB 3.4Å; S1023-M1026 PolarHBondContact O-N 3.2Å
1024	S	84.3	Confident	81	Confident	31 Å²	31	32.5 Å²	32.5	22%	0.217	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-16.4	171.2	53.7	0	0	0	0	113.6	Q1045 L1046	S1024-Q1045 PolarHBondContact O-NE2 2.85Å; S1024-L1046 WeakPolarHBondContact CA-O 3.3Å; S1024-L1046 WeakPolarHBondContact CB-O 2.93Å
1025	R	82.9	Confident	80.7	Confident	192 Å²	192	33.5 Å²	33.5	73%	0.725	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.7	177.1	-55.5	175	-168.9	-112.1	-0.9	114	E535 S1023	E535-R1025 IonicContact OE1-CZ 2.94Å; E535-R1025 IonicContact OE1-NE 2.85Å; E535-R1025 PolarHBondContact OE1-NE 3.22Å; E535-R1025 IonicContact OE1-NH2 3.59Å; E535-R1025 IonicContact OE2-CZ 3.03Å; E535-R1025 IonicContact OE2-NE 2.59Å; E535-R1025 IonicContact OE2-NH2 3.08Å; E535-R1025 PolarHBondContact OE2-NH2 2.01Å; S1023-R1025 PolarHBondContact O-N 2.99Å; S1023-R1025 PolarHBondContact OG-N 3.47Å
1026	M	86.4	Confident	80.1	Confident	9 Å²	9	34.8 Å²	34.8	4%	0.044	17%	0.172	C	C	.	.	S	Bend	trans	-82.5	141.1	179.1	-66.1	178.6	178.3	0	0	110.2	I569 V573 A1022 S1023 C1028 C1085 F1094	I569-M1026 HydrophobicContact CD1-CE 3.51Å; V573-M1026 HydrophobicContact CG1-CE 4.03Å; A1022-M1026 HydrophobicContact CB-SD 4.46Å; S1023-M1026 WeakPolarHBondContact O-CB 3.4Å; S1023-M1026 PolarHBondContact O-N 3.2Å; M1026-C1028 PolarHBondContact O-N 3.42Å; M1026-C1085 HydrophobicContact CB-CB 4.19Å; M1026-C1085 HydrophobicContact SD-CB 4.27Å; M1026-F1094 HydrophobicContact CE-CZ 4.42Å; M1026-F1094 HydrophobicContact SD-CE2 4.29Å; M1026-F1094 HydrophobicContact SD-CZ 4.21Å
1027	X	88.5	Confident	79.6	Confident	39 Å²	39	34.8 Å²	34.8	32%	0.322	17%	0.173	S	C	.	.			trans	-71.6	119.4	167.3	0	0	0	0	0	108.6	C1085 Q1086 W1091	A1027-C1085 WeakPolarHBondContact O-CA 3.23Å; A1027-Q1086 PolarHBondContact O-N 3.49Å; A1027-W1091 WeakPolarHBondContact O-CZ3 3.09Å
1028	C	92.2	Very high	79.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.5	-177.9	-60.7	0	0	0	0	111.3	M1026 Q1043 Y1044 L1046 L1083 L1084 C1085	M1026-C1028 PolarHBondContact O-N 3.42Å; C1028-Q1043 WeakPolarHBondContact O-CA 3.49Å; C1028-Y1044 PolarHBondContact O-N 3.06Å; C1028-L1046 HydrophobicContact CB-CG 4.34Å; C1028-L1046 WeakPolarHBondContact SG-CD1 3.13Å; C1028-L1083 HydrophobicContact CB-CD1 3.98Å; C1028-L1084 CarbonylContact C-O 3.02Å; C1028-L1084 WeakPolarHBondContact CA-O 3.29Å; C1028-C1085 HydrophobicContact CB-CB 4.12Å; C1028-C1085 WeakPolarHBondContact CB-SG 3.47Å; C1028-C1085 WeakPolarHBondContact SG-CB 3.35Å; C1028-C1085 CovalentContact SG-SG 2.04Å; C1028-C1085 PolarHBondContact SG-SG 3.28Å
1029	Y	91.5	Very high	80	Confident	34 Å²	34	27.1 Å²	27.1	13%	0.133	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.6	176.9	-69.3	-96.5	0	0	0	110.2	L900 P901 R1041 I1042 Q1043 L1084 W1091	L900-Y1029 HydrophobicContact CD2-CE2 3.98Å; P901-Y1029 HydrophobicContact CG-CD2 4.32Å; P901-Y1029 HydrophobicContact CG-CG 4.33Å; Y1029-R1041 HydrophobicContact CD1-CB 4.23Å; Y1029-R1041 HydrophobicContact CD1-CG 4.26Å; Y1029-I1042 CarbonylContact C-O 3.57Å; Y1029-I1042 WeakPolarHBondContact CA-O 3.46Å; Y1029-Q1043 HydrophobicContact CD1-CB 4.09Å; Y1029-Q1043 HydrophobicContact CE1-CB 3.72Å; Y1029-Q1043 HydrophobicContact CE1-CG 4.3Å; Y1029-L1084 PolarHBondContact N-O 2.85Å; Y1029-L1084 PolarHBondContact O-N 3.32Å; Y1029-W1091 AromaticContact CD2-CH2 3.57Å; Y1029-W1091 HydrophobicContact CD2-CH2 3.57Å; Y1029-W1091 AromaticContact CD2-CZ3 3.67Å; Y1029-W1091 HydrophobicContact CD2-CZ3 3.67Å; Y1029-W1091 AromaticContact CE2-CH2 3.64Å; Y1029-W1091 HydrophobicContact CE2-CH2 3.64Å; Y1029-W1091 HydrophobicContact CE2-CZ2 4.47Å; Y1029-W1091 HydrophobicContact CE2-CZ3 4.2Å
1030	V	90.9	Very high	80.8	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.6	166	-177.7	0	0	0	0	107.5	R1041 I1042 Y1044 L1075 P1082 L1083 Y1097 F1124	V1030-R1041 WeakPolarHBondContact O-CA 3.44Å; V1030-I1042 PolarHBondContact N-O 3.34Å; V1030-I1042 PolarHBondContact O-N 3.04Å; V1030-Y1044 HydrophobicContact CB-CD2 3.8Å; V1030-Y1044 HydrophobicContact CB-CE2 3.79Å; V1030-Y1044 HydrophobicContact CG2-CD1 4.44Å; V1030-Y1044 HydrophobicContact CG2-CD2 3.31Å; V1030-Y1044 HydrophobicContact CG2-CE2 3.59Å; V1030-Y1044 HydrophobicContact CG2-CG 3.78Å; V1030-L1075 HydrophobicContact CB-CD1 4.18Å; V1030-L1075 HydrophobicContact CG1-CD1 3.53Å; V1030-P1082 WeakPolarHBondContact CA-O 3.48Å; V1030-L1083 HydrophobicContact CG2-CD1 3.98Å; V1030-Y1097 HydrophobicContact CG1-CD2 4.28Å; V1030-F1124 HydrophobicContact CG2-CE1 3.42Å; V1030-F1124 VanDerWaalsContact CG2-CE1 3.42Å; V1030-F1124 HydrophobicContact CG2-CZ 3.65Å
1031	S	86.8	Confident	81.4	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.007	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.3	175.3	-176.4	0	0	0	0	111	A903 S904 V1040 S1081 P1082	A903-S1031 WeakPolarHBondContact CA-OG 3.25Å; S904-S1031 PolarHBondContact N-OG 2.8Å; S1031-V1040 WeakPolarHBondContact CA-O 3.48Å; S1031-V1040 PolarHBondContact OG-O 2.9Å; S1031-S1081 VanDerWaalsContact O-CB 3.28Å; S1031-S1081 WeakPolarHBondContact O-CB 3.28Å; S1031-S1081 PolarHBondContact O-OG 2.81Å; S1031-P1082 WeakPolarHBondContact O-CD 3.43Å
1032	G	83.3	Confident	81.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	-148.7	173.9	0	0	0	0	0	109.6	P1039 V1040	G1032-P1039 WeakPolarHBondContact O-CA 3.32Å; G1032-V1040 PolarHBondContact N-O 2.86Å; G1032-V1040 PolarHBondContact O-N 3.48Å; G1032-V1040 VanDerWaalsContact O-O 3.12Å
1033	V	78.3	Confident	81.9	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142.8	-179.6	165.3	0	0	0	0	111.4	H907 L959 G1037 M1038 L1075 Q1076	H907-V1033 WeakPolarHBondContact CE1-CG2 3.34Å; H907-V1033 WeakPolarHBondContact NE2-CG2 3.28Å; L959-V1033 HydrophobicContact CB-CG1 4.12Å; L959-V1033 HydrophobicContact CD1-CB 3.74Å; L959-V1033 HydrophobicContact CD1-CG1 3.4Å; L959-V1033 HydrophobicContact CD1-CG2 4.03Å; L959-V1033 HydrophobicContact CG-CG1 4.37Å; V1033-G1037 VanDerWaalsContact CG1-CA 3.44Å; V1033-M1038 CarbonylContact C-O 3.13Å; V1033-M1038 VanDerWaalsContact CA-O 3.32Å; V1033-M1038 WeakPolarHBondContact CA-O 3.38Å; V1033-M1038 WeakPolarHBondContact CG1-O 3.48Å; V1033-L1075 CarbonylContact O-C 3.56Å; V1033-L1075 WeakPolarHBondContact O-CA 3.38Å; V1033-Q1076 PolarHBondContact O-N 2.91Å
1034	C	78.2	Confident	82.3	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.014	15%	0.152	C	C	.	.			trans	-85.6	179.2	177.1	73.7	0	0	0	0	113.7	R961 H1036 G1037 M1038 V1040 V1074	R961-C1034 PolarHBondContact NH2-O 3.11Å; R961-C1034 VanDerWaalsContact NH2-O 3.09Å; C1034-H1036 PolarHBondContact O-N 3.11Å; C1034-H1036 PolarHBondContact SG-N 2.86Å; C1034-H1036 VanDerWaalsContact SG-N 3.41Å; C1034-G1037 PolarHBondContact O-N 3.14Å; C1034-M1038 PolarHBondContact N-O 3.35Å; C1034-V1040 HydrophobicContact CB-CB 4.47Å; C1034-V1040 HydrophobicContact CB-CG1 3.71Å; C1034-V1040 HydrophobicContact CB-CG2 3.91Å; C1034-V1074 WeakPolarHBondContact CA-O 3.33Å; C1034-V1074 WeakPolarHBondContact CB-O 3.5Å
1035	Q	75.5	Confident	82.6	Confident	90 Å²	90	35 Å²	35	42%	0.421	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	0.5	175.8	74.6	170.7	16.3	0	0	115.7	R961 Q1076	R961-Q1035 VanDerWaalsContact CZ-C 3.43Å; R961-Q1035 PolarHBondContact NH1-O 3.47Å; R961-Q1035 VanDerWaalsContact NH2-CA 3.28Å; R961-Q1035 PolarHBondContact NH2-O 3.06Å; Q1035-Q1076 HydrophobicContact CB-CG 4.42Å
1036	H	71	Confident	83	Confident	50 Å²	50	26 Å²	26	23%	0.231	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	0.8	173.8	-54.1	114.5	0	0	0	112.5	C1034 M1038	C1034-H1036 PolarHBondContact O-N 3.11Å; C1034-H1036 PolarHBondContact SG-N 2.86Å; C1034-H1036 VanDerWaalsContact SG-N 3.41Å; H1036-M1038 VanDerWaalsContact C-N 3.26Å; H1036-M1038 HydrophobicContact CB-CE 3.66Å; H1036-M1038 HydrophobicContact CB-CG 4.48Å
1037	G	68.1	Low	83.2	Confident	3 Å²	3	27 Å²	27	3%	0.031	13%	0.133	C	C	.	.	S	Bend	trans	80.5	7.9	-175.9	0	0	0	0	0	113.6	L959 R961 V1033 C1034	L959-G1037 PolarHBondContact N-O 2.81Å; R961-G1037 VanDerWaalsContact CZ-N 3.34Å; V1033-G1037 VanDerWaalsContact CG1-CA 3.44Å; C1034-G1037 PolarHBondContact O-N 3.14Å
1038	M	70.2	Confident	83.1	Confident	48 Å²	48	27 Å²	27	24%	0.236	13%	0.129	C	C	.	.			trans	-93	146.4	179.7	-66.8	-171.6	-80.3	0	0	111.6	H823 L958 V1033 C1034 H1036 V1040	H823-M1038 WeakPolarHBondContact CE1-CE 3.43Å; H823-M1038 WeakPolarHBondContact ND1-CE 3.35Å; L958-M1038 HydrophobicContact CD2-CG 4.34Å; V1033-M1038 CarbonylContact C-O 3.13Å; V1033-M1038 VanDerWaalsContact CA-O 3.32Å; V1033-M1038 WeakPolarHBondContact CA-O 3.38Å; V1033-M1038 WeakPolarHBondContact CG1-O 3.48Å; C1034-M1038 PolarHBondContact N-O 3.35Å; H1036-M1038 VanDerWaalsContact C-N 3.26Å; H1036-M1038 HydrophobicContact CB-CE 3.66Å; H1036-M1038 HydrophobicContact CB-CG 4.48Å; M1038-V1040 PolarHBondContact O-N 3.28Å
1039	P	73.1	Confident	82.8	Confident	7 Å²	7	28 Å²	28	5%	0.045	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.4	177.4	29.2	-25.3	0	0	0	109.5	I824 A903 S957 G1032	I824-P1039 PolarHBondContact N-O 3.08Å; A903-P1039 HydrophobicContact CB-CB 3.47Å; A903-P1039 VanDerWaalsContact CB-CB 3.47Å; A903-P1039 HydrophobicContact CB-CG 4.38Å; S957-P1039 WeakPolarHBondContact O-CD 3.32Å; S957-P1039 WeakPolarHBondContact O-CG 3.43Å; G1032-P1039 WeakPolarHBondContact O-CA 3.32Å
1040	V	78.2	Confident	82.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	156.7	-178	-61.3	0	0	0	0	110.2	S1031 G1032 C1034 M1038 L1075	S1031-V1040 WeakPolarHBondContact CA-O 3.48Å; S1031-V1040 PolarHBondContact OG-O 2.9Å; G1032-V1040 PolarHBondContact N-O 2.86Å; G1032-V1040 PolarHBondContact O-N 3.48Å; G1032-V1040 VanDerWaalsContact O-O 3.12Å; C1034-V1040 HydrophobicContact CB-CB 4.47Å; C1034-V1040 HydrophobicContact CB-CG1 3.71Å; C1034-V1040 HydrophobicContact CB-CG2 3.91Å; M1038-V1040 PolarHBondContact O-N 3.28Å; V1040-L1075 HydrophobicContact CG2-CD2 3.48Å; V1040-L1075 VanDerWaalsContact CG2-CD2 3.48Å
1041	R	84.1	Confident	82.2	Confident	38 Å²	38	32.7 Å²	32.7	14%	0.143	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.1	168.3	59.2	174.5	175	-125.7	-5.7	109.4	E822 I824 P901 Y1029 V1030	E822-R1041 IonicContact OE2-CZ 3.09Å; E822-R1041 VanDerWaalsContact OE2-CZ 3.27Å; E822-R1041 IonicContact OE2-NE 3.83Å; E822-R1041 PolarHBondContact OE2-NE 2.95Å; E822-R1041 IonicContact OE2-NH2 2.65Å; E822-R1041 PolarHBondContact OE2-NH2 3.19Å; I824-R1041 HydrophobicContact CD1-CB 4.09Å; I824-R1041 HydrophobicContact CD1-CG 4.08Å; I824-R1041 HydrophobicContact CG1-CG 4.28Å; P901-R1041 PolarHBondContact O-NH1 3.43Å; Y1029-R1041 HydrophobicContact CD1-CB 4.23Å; Y1029-R1041 HydrophobicContact CD1-CG 4.26Å; V1030-R1041 WeakPolarHBondContact O-CA 3.44Å
1042	I	84.5	Confident	82.2	Confident	8 Å²	8	32.7 Å²	32.7	4%	0.041	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.3	179.5	-53.6	-179.7	0	0	0	108.1	Y1029 V1030 Y1044 R1071 V1074 L1075	Y1029-I1042 CarbonylContact C-O 3.57Å; Y1029-I1042 WeakPolarHBondContact CA-O 3.46Å; V1030-I1042 PolarHBondContact N-O 3.34Å; V1030-I1042 PolarHBondContact O-N 3.04Å; I1042-Y1044 HydrophobicContact CB-CD2 4.36Å; I1042-Y1044 HydrophobicContact CB-CE2 4.13Å; I1042-Y1044 HydrophobicContact CG2-CD2 4.19Å; I1042-Y1044 HydrophobicContact CG2-CE2 3.96Å; I1042-Y1044 PolarHBondContact O-N 2.93Å; I1042-R1071 HydrophobicContact CG2-CB 4.35Å; I1042-V1074 HydrophobicContact CD1-CB 3.35Å; I1042-V1074 HydrophobicContact CD1-CG1 3.36Å; I1042-V1074 HydrophobicContact CD1-CG2 4.26Å; I1042-V1074 HydrophobicContact CG1-CB 4.34Å; I1042-V1074 HydrophobicContact CG1-CG1 3.87Å; I1042-L1075 HydrophobicContact CD1-CD1 4.09Å; I1042-L1075 HydrophobicContact CD1-CD2 3.73Å; I1042-L1075 HydrophobicContact CD1-CG 3.46Å; I1042-L1075 VanDerWaalsContact CD1-CG 3.46Å; I1042-L1075 HydrophobicContact CG1-CD2 4.13Å; I1042-L1075 HydrophobicContact CG1-CG 4.3Å
1043	Q	89	Confident	82.2	Confident	113 Å²	113	33.8 Å²	33.8	53%	0.528	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	130.1	172.9	-171.7	175.1	-6.9	0	0	110	C1028 Y1029	C1028-Q1043 WeakPolarHBondContact O-CA 3.49Å; Y1029-Q1043 HydrophobicContact CD1-CB 4.09Å; Y1029-Q1043 HydrophobicContact CE1-CB 3.72Å; Y1029-Q1043 HydrophobicContact CE1-CG 4.3Å
1044	Y	90.7	Very high	82.4	Confident	10 Å²	10	40.6 Å²	40.6	4%	0.039	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.1	172.5	-90.8	-104	0	0	0	109.2	C1028 V1030 I1042 V1069 Y1097 A1122 F1124	C1028-Y1044 PolarHBondContact O-N 3.06Å; V1030-Y1044 HydrophobicContact CB-CD2 3.8Å; V1030-Y1044 HydrophobicContact CB-CE2 3.79Å; V1030-Y1044 HydrophobicContact CG2-CD1 4.44Å; V1030-Y1044 HydrophobicContact CG2-CD2 3.31Å; V1030-Y1044 HydrophobicContact CG2-CE2 3.59Å; V1030-Y1044 HydrophobicContact CG2-CG 3.78Å; I1042-Y1044 HydrophobicContact CB-CD2 4.36Å; I1042-Y1044 HydrophobicContact CB-CE2 4.13Å; I1042-Y1044 HydrophobicContact CG2-CD2 4.19Å; I1042-Y1044 HydrophobicContact CG2-CE2 3.96Å; I1042-Y1044 PolarHBondContact O-N 2.93Å; Y1044-V1069 WeakPolarHBondContact CA-O 3.49Å; Y1044-Y1097 HydrophobicContact CE1-CE2 4.48Å; Y1044-A1122 HydrophobicContact CD1-CB 4.41Å; Y1044-A1122 HydrophobicContact CE1-CB 3.63Å; Y1044-F1124 AromaticContact CD1-CE2 3.99Å; Y1044-F1124 HydrophobicContact CD1-CE2 3.99Å; Y1044-F1124 AromaticContact CD1-CZ 3.61Å; Y1044-F1124 HydrophobicContact CD1-CZ 3.61Å; Y1044-F1124 HydrophobicContact CE1-CE2 4.38Å; Y1044-F1124 AromaticContact CE1-CZ 3.83Å; Y1044-F1124 HydrophobicContact CE1-CZ 3.83Å; Y1044-F1124 HydrophobicContact CG-CZ 4.07Å
1045	Q	91.1	Very high	82.6	Confident	89 Å²	89	45.8 Å²	45.8	42%	0.416	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	110.1	171.1	-179.3	54.9	58.9	0	0	108.1	S1024 L1047 G1068 V1069	S1024-Q1045 PolarHBondContact O-NE2 2.85Å; Q1045-L1047 PolarHBondContact O-N 3.24Å; Q1045-G1068 CarbonylContact O-C 3.58Å; Q1045-G1068 WeakPolarHBondContact O-CA 3.32Å; Q1045-V1069 HydrophobicContact CB-CG2 3.98Å; Q1045-V1069 PolarHBondContact N-O 2.92Å; Q1045-V1069 PolarHBondContact O-N 3.41Å
1046	L	91.5	Very high	82.9	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.4	174.3	-68.2	-175.1	0	0	0	110	A1022 S1024 C1028 L1083 F1124	A1022-L1046 HydrophobicContact CB-CD1 3.53Å; S1024-L1046 WeakPolarHBondContact CA-O 3.3Å; S1024-L1046 WeakPolarHBondContact CB-O 2.93Å; C1028-L1046 HydrophobicContact CB-CG 4.34Å; C1028-L1046 WeakPolarHBondContact SG-CD1 3.13Å; L1046-L1083 HydrophobicContact CD1-CD2 4.28Å; L1046-L1083 HydrophobicContact CD2-CD1 4.25Å; L1046-L1083 HydrophobicContact CD2-CD2 3.91Å; L1046-F1124 HydrophobicContact CD2-CD2 4.43Å; L1046-F1124 HydrophobicContact CD2-CE2 4.45Å
1047	L	90.4	Very high	83.3	Confident	29 Å²	29	41.4 Å²	41.4	15%	0.152	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-89.9	152.4	176.3	-62.9	-173.9	0	0	0	110	Q1045 E1051 C1067 V1069	Q1045-L1047 PolarHBondContact O-N 3.24Å; L1047-E1051 HydrophobicContact CB-CB 3.97Å; L1047-E1051 HydrophobicContact CD1-CB 4.35Å; L1047-C1067 PolarHBondContact N-O 2.93Å; L1047-V1069 HydrophobicContact CD1-CG1 4.05Å; L1047-V1069 HydrophobicContact CD2-CG2 4.28Å; L1047-V1069 HydrophobicContact CG-CG1 4.47Å
1048	T	87.2	Confident	83.6	Confident	41 Å²	41	47 Å²	47	25%	0.252	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-66.3	154.9	170.8	62.9	0	0	0	0	110.4	T1050 E1051 C1052	T1048-T1050 PolarHBondContact O-N 2.85Å; T1048-T1050 VanDerWaalsContact O-N 3.12Å; T1048-E1051 WeakPolarHBondContact CB-OE2 3.48Å; T1048-E1051 WeakPolarHBondContact CG2-OE2 3.24Å; T1048-E1051 PolarHBondContact N-OE2 2.83Å; T1048-E1051 PolarHBondContact O-N 3.02Å; T1048-E1051 VanDerWaalsContact O-N 3.08Å; T1048-E1051 VanDerWaalsContact OG1-CG 3.28Å; T1048-E1051 WeakPolarHBondContact OG1-CG 3.49Å; T1048-E1051 PolarHBondContact OG1-N 2.58Å; T1048-E1051 PolarHBondContact OG1-OE2 3.42Å; T1048-C1052 PolarHBondContact O-N 3.02Å; T1048-C1052 PolarHBondContact O-SG 3.14Å
1049	P	84.7	Confident	83.8	Confident	21 Å²	21	51 Å²	51	14%	0.136	26%	0.257	C	S	.	.	H	α-helix	trans	-52.2	-35.3	176.4	-31.1	38.5	0	0	0	114	I508 M510 K1053 F1060 P1062	I508-P1049 HydrophobicContact CG2-CB 3.92Å; M510-P1049 HydrophobicContact CE-CG 3.93Å; M510-P1049 HydrophobicContact CG-CB 4.37Å; M510-P1049 HydrophobicContact CG-CG 3.55Å; M510-P1049 HydrophobicContact SD-CG 3.71Å; P1049-K1053 WeakPolarHBondContact O-CB 3.49Å; P1049-K1053 PolarHBondContact O-N 2.99Å; P1049-F1060 HydrophobicContact CB-CE1 4.21Å; P1049-P1062 HydrophobicContact CB-CB 4.24Å
1050	T	82.8	Confident	84.3	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.35	26%	0.255	S	S	.	.	H	α-helix	trans	-65.3	-49.4	176.2	-50.3	0	0	0	0	111.7	T1048 K1053 Q1054	T1048-T1050 PolarHBondContact O-N 2.85Å; T1048-T1050 VanDerWaalsContact O-N 3.12Å; T1050-K1053 PolarHBondContact O-N 3.28Å; T1050-Q1054 WeakPolarHBondContact O-CG 2.79Å; T1050-Q1054 PolarHBondContact O-N 2.57Å
1051	E	87	Confident	84.4	Confident	75 Å²	75	51.7 Å²	51.7	35%	0.35	26%	0.26	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176.5	-70.8	159.5	158	0	0	110.8	L1047 T1048 K1053 Q1054 H1055	L1047-E1051 HydrophobicContact CB-CB 3.97Å; L1047-E1051 HydrophobicContact CD1-CB 4.35Å; T1048-E1051 WeakPolarHBondContact CB-OE2 3.48Å; T1048-E1051 WeakPolarHBondContact CG2-OE2 3.24Å; T1048-E1051 PolarHBondContact N-OE2 2.83Å; T1048-E1051 PolarHBondContact O-N 3.02Å; T1048-E1051 VanDerWaalsContact O-N 3.08Å; T1048-E1051 VanDerWaalsContact OG1-CG 3.28Å; T1048-E1051 WeakPolarHBondContact OG1-CG 3.49Å; T1048-E1051 PolarHBondContact OG1-N 2.58Å; T1048-E1051 PolarHBondContact OG1-OE2 3.42Å; E1051-K1053 VanDerWaalsContact C-N 3.32Å; E1051-K1053 PolarHBondContact O-N 2.77Å; E1051-Q1054 WeakPolarHBondContact O-CB 3.15Å; E1051-Q1054 PolarHBondContact O-N 3.42Å; E1051-Q1054 VanDerWaalsContact O-N 3.11Å; E1051-H1055 PolarHBondContact O-CD2 3.48Å; E1051-H1055 PolarHBondContact O-N 2.67Å
1052	C	87.9	Confident	84.3	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-45.5	175.5	-60.2	0	0	0	0	111.6	T1048 Q1054 H1055 L1056 F1060 C1067	T1048-C1052 PolarHBondContact O-N 3.02Å; T1048-C1052 PolarHBondContact O-SG 3.14Å; C1052-Q1054 VanDerWaalsContact C-N 3.33Å; C1052-Q1054 PolarHBondContact O-N 2.82Å; C1052-H1055 PolarHBondContact O-N 2.79Å; C1052-L1056 VanDerWaalsContact O-CB 3.3Å; C1052-L1056 WeakPolarHBondContact O-CB 2.91Å; C1052-L1056 PolarHBondContact O-N 2.78Å; C1052-F1060 HydrophobicContact CB-CD1 3.45Å; C1052-F1060 VanDerWaalsContact CB-CD1 3.45Å; C1052-F1060 HydrophobicContact CB-CD2 3.81Å; C1052-F1060 HydrophobicContact CB-CE1 3.34Å; C1052-F1060 HydrophobicContact CB-CE2 3.71Å; C1052-F1060 HydrophobicContact CB-CG 3.68Å; C1052-F1060 HydrophobicContact CB-CZ 3.46Å; C1052-F1060 VanDerWaalsContact CB-CZ 3.46Å; C1052-C1067 HydrophobicContact CB-CB 3.9Å; C1052-C1067 WeakPolarHBondContact SG-CB 3.3Å; C1052-C1067 PolarHBondContact SG-SG 2.89Å
1053	K	82.4	Confident	83.9	Confident	22 Å²	22	50.2 Å²	50.2	10%	0.096	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-36.4	177.5	-171.1	75.3	-169.7	173.9	0	111.8	I508 P1049 T1050 E1051 G1057 D1058 F1060	I508-K1053 HydrophobicContact CD1-CB 4.46Å; I508-K1053 HydrophobicContact CD1-CD 4.23Å; I508-K1053 HydrophobicContact CD1-CG 4.37Å; P1049-K1053 WeakPolarHBondContact O-CB 3.49Å; P1049-K1053 PolarHBondContact O-N 2.99Å; T1050-K1053 PolarHBondContact O-N 3.28Å; E1051-K1053 VanDerWaalsContact C-N 3.32Å; E1051-K1053 PolarHBondContact O-N 2.77Å; K1053-G1057 VanDerWaalsContact CD-O 3.27Å; K1053-G1057 WeakPolarHBondContact CD-O 3.36Å; K1053-G1057 VanDerWaalsContact CE-O 3.31Å; K1053-G1057 WeakPolarHBondContact CE-O 3.31Å; K1053-G1057 PolarHBondContact NZ-O 3.03Å; K1053-G1057 VanDerWaalsContact O-CA 3.24Å; K1053-G1057 WeakPolarHBondContact O-CA 3.29Å; K1053-G1057 PolarHBondContact O-N 3.46Å; K1053-D1058 IonicContact NZ-OD1 2.74Å; K1053-D1058 PolarHBondContact NZ-OD1 2.75Å; K1053-F1060 HydrophobicContact CB-CD1 4.45Å
1054	Q	82.3	Confident	83.4	Confident	145 Å²	145	45 Å²	45	68%	0.678	23%	0.232	S	C	*	.	H	α-helix	trans	-64.4	-41.6	175	-72.6	171.3	-5.5	0	0	112	T1050 E1051 C1052	T1050-Q1054 WeakPolarHBondContact O-CG 2.79Å; T1050-Q1054 PolarHBondContact O-N 2.57Å; E1051-Q1054 WeakPolarHBondContact O-CB 3.15Å; E1051-Q1054 PolarHBondContact O-N 3.42Å; E1051-Q1054 VanDerWaalsContact O-N 3.11Å; C1052-Q1054 VanDerWaalsContact C-N 3.33Å; C1052-Q1054 PolarHBondContact O-N 2.82Å
1055	H	82.4	Confident	83.1	Confident	110 Å²	110	45 Å²	45	51%	0.509	23%	0.232	S	C	.	.	H	α-helix	trans	-77.7	-37.5	180	-74.3	-71.6	0	0	0	113.9	E1051 C1052 V1121	E1051-H1055 PolarHBondContact O-CD2 3.48Å; E1051-H1055 PolarHBondContact O-N 2.67Å; C1052-H1055 PolarHBondContact O-N 2.79Å; H1055-V1121 HydrophobicContact CB-CG1 4.48Å; H1055-V1121 HydrophobicContact CB-CG2 4.24Å
1056	L	82.4	Confident	83.1	Confident	18 Å²	18	41.5 Å²	41.5	9%	0.094	22%	0.215	C	C	.	.	H	α-helix	trans	-111.6	-11.5	-168.1	-59.2	-179.2	0	0	0	114.3	C1052 D1058 K1059 F1060 C1067 F1101 V1121 L1123	C1052-L1056 VanDerWaalsContact O-CB 3.3Å; C1052-L1056 WeakPolarHBondContact O-CB 2.91Å; C1052-L1056 PolarHBondContact O-N 2.78Å; L1056-D1058 PolarHBondContact O-N 2.88Å; L1056-K1059 WeakPolarHBondContact O-CB 3.44Å; L1056-K1059 PolarHBondContact O-N 2.92Å; L1056-F1060 HydrophobicContact CB-CB 3.81Å; L1056-F1060 HydrophobicContact CD1-CB 4.09Å; L1056-F1060 HydrophobicContact CD1-CD2 4.42Å; L1056-C1067 HydrophobicContact CD1-CB 3.97Å; L1056-F1101 HydrophobicContact CD1-CD2 4.41Å; L1056-F1101 HydrophobicContact CD1-CE2 4.33Å; L1056-F1101 HydrophobicContact CD2-CB 4.15Å; L1056-F1101 HydrophobicContact CD2-CD2 3.27Å; L1056-F1101 HydrophobicContact CD2-CE2 3.76Å; L1056-F1101 HydrophobicContact CD2-CG 3.88Å; L1056-F1101 HydrophobicContact CG-CD2 4.44Å; L1056-V1121 HydrophobicContact CD1-CG1 4.01Å; L1056-V1121 HydrophobicContact CD2-CB 4.28Å; L1056-V1121 HydrophobicContact CD2-CG1 3.91Å; L1056-V1121 HydrophobicContact CG-CG1 4.04Å; L1056-L1123 HydrophobicContact CD1-CD1 4.34Å; L1056-L1123 HydrophobicContact CD1-CD2 3.51Å; L1056-L1123 HydrophobicContact CD1-CG 3.84Å
1057	G	79.8	Confident	83.1	Confident	30 Å²	30	41.3 Å²	41.3	31%	0.309	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	58.5	-132.5	-179	0	0	0	0	0	112.6	K1053 K1059 F1060	K1053-G1057 VanDerWaalsContact CD-O 3.27Å; K1053-G1057 WeakPolarHBondContact CD-O 3.36Å; K1053-G1057 VanDerWaalsContact CE-O 3.31Å; K1053-G1057 WeakPolarHBondContact CE-O 3.31Å; K1053-G1057 PolarHBondContact NZ-O 3.03Å; K1053-G1057 VanDerWaalsContact O-CA 3.24Å; K1053-G1057 WeakPolarHBondContact O-CA 3.29Å; K1053-G1057 PolarHBondContact O-N 3.46Å; G1057-K1059 PolarHBondContact O-N 2.91Å; G1057-F1060 PolarHBondContact O-N 2.68Å
1058	D	73.3	Confident	83.2	Confident	122 Å²	122	40 Å²	40	65%	0.652	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-72.3	-8.4	-177.7	-62.2	-33.5	0	0	0	114.8	K1053 L1056 F1060	K1053-D1058 IonicContact NZ-OD1 2.74Å; K1053-D1058 PolarHBondContact NZ-OD1 2.75Å; L1056-D1058 PolarHBondContact O-N 2.88Å; D1058-F1060 VanDerWaalsContact C-N 3.32Å
1059	K	75.7	Confident	83.3	Confident	132 Å²	132	39.2 Å²	39.2	57%	0.574	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-75.6	-21	175.6	-56.7	-176.2	-178.1	-178.9	0	113.2	L1056 G1057 F1101	L1056-K1059 WeakPolarHBondContact O-CB 3.44Å; L1056-K1059 PolarHBondContact O-N 2.92Å; G1057-K1059 PolarHBondContact O-N 2.91Å; K1059-F1101 HydrophobicContact CB-CZ 4.25Å; K1059-F1101 HydrophobicContact CD-CD1 4.45Å; K1059-F1101 HydrophobicContact CD-CE1 3.6Å; K1059-F1101 HydrophobicContact CD-CZ 3.69Å
1060	F	83.2	Confident	83.3	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.009	20%	0.199	C	C	.	.			trans	-92.1	124.3	179.1	176	-110.7	0	0	0	111.6	P1049 C1052 K1053 L1056 G1057 D1058 P1062 M1065 C1067 L1123	P1049-F1060 HydrophobicContact CB-CE1 4.21Å; C1052-F1060 HydrophobicContact CB-CD1 3.45Å; C1052-F1060 VanDerWaalsContact CB-CD1 3.45Å; C1052-F1060 HydrophobicContact CB-CD2 3.81Å; C1052-F1060 HydrophobicContact CB-CE1 3.34Å; C1052-F1060 HydrophobicContact CB-CE2 3.71Å; C1052-F1060 HydrophobicContact CB-CG 3.68Å; C1052-F1060 HydrophobicContact CB-CZ 3.46Å; C1052-F1060 VanDerWaalsContact CB-CZ 3.46Å; K1053-F1060 HydrophobicContact CB-CD1 4.45Å; L1056-F1060 HydrophobicContact CB-CB 3.81Å; L1056-F1060 HydrophobicContact CD1-CB 4.09Å; L1056-F1060 HydrophobicContact CD1-CD2 4.42Å; G1057-F1060 PolarHBondContact O-N 2.68Å; D1058-F1060 VanDerWaalsContact C-N 3.32Å; F1060-P1062 HydrophobicContact CD1-CB 4.48Å; F1060-P1062 HydrophobicContact CE1-CB 3.67Å; F1060-P1062 HydrophobicContact CE1-CG 4.42Å; F1060-P1062 HydrophobicContact CZ-CB 4.04Å; F1060-M1065 HydrophobicContact CD2-CB 4.13Å; F1060-M1065 HydrophobicContact CE2-CB 3.96Å; F1060-M1065 WeakPolarHBondContact CE2-O 3.47Å; F1060-C1067 HydrophobicContact CD2-CB 4.2Å; F1060-C1067 HydrophobicContact CE2-CB 4.09Å; F1060-L1123 HydrophobicContact CD2-CD2 3.74Å; F1060-L1123 HydrophobicContact CE2-CD2 4.39Å
1061	L	79.9	Confident	83.1	Confident	19 Å²	19	42 Å²	42	10%	0.099	21%	0.206	C	C	.	.			trans	-114.6	98.9	178.3	-63	174.9	0	0	0	109.9	L990 S1063 V1064 M1065	L990-L1061 HydrophobicContact CD1-CD1 3.82Å; L990-L1061 HydrophobicContact CD2-CD1 3.32Å; L990-L1061 HydrophobicContact CG-CD1 3.88Å; L1061-S1063 PolarHBondContact O-N 3.42Å; L1061-V1064 HydrophobicContact CB-CG2 3.55Å; L1061-V1064 HydrophobicContact CD1-CG2 4.28Å; L1061-V1064 PolarHBondContact O-N 2.67Å; L1061-M1065 HydrophobicContact CB-SD 4.15Å; L1061-M1065 PolarHBondContact O-N 2.9Å
1062	P	82.2	Confident	82.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.8	-169.4	25.5	-36.7	0	0	0	113.8	I508 M510 P1049 F1060 V1064 K1126	I508-P1062 HydrophobicContact CD1-CG 3.83Å; I508-P1062 HydrophobicContact CG1-CG 4.05Å; M510-P1062 HydrophobicContact CG-CB 4.02Å; M510-P1062 VanDerWaalsContact CG-O 3.29Å; M510-P1062 WeakPolarHBondContact CG-O 3.31Å; P1049-P1062 HydrophobicContact CB-CB 4.24Å; F1060-P1062 HydrophobicContact CD1-CB 4.48Å; F1060-P1062 HydrophobicContact CE1-CB 3.67Å; F1060-P1062 HydrophobicContact CE1-CG 4.42Å; F1060-P1062 HydrophobicContact CZ-CB 4.04Å; P1062-V1064 VanDerWaalsContact C-N 3.33Å; P1062-K1126 VanDerWaalsContact O-CE 3.3Å; P1062-K1126 WeakPolarHBondContact O-CE 3.32Å; P1062-K1126 PolarHBondContact O-NZ 3.32Å
1063	S	75.9	Confident	81.5	Confident	15 Å²	15	47.5 Å²	47.5	11%	0.105	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-22	179.5	-57.1	0	0	0	0	112.9	L1061	L1061-S1063 PolarHBondContact O-N 3.42Å
1064	V	77.8	Confident	81.3	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.024	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-12.1	-170.5	-63.5	0	0	0	0	114.1	P488 F983 Y984 L1061 P1062 K1126	P488-V1064 HydrophobicContact CB-CG1 3.94Å; F983-V1064 HydrophobicContact CD1-CG1 4.42Å; Y984-V1064 HydrophobicContact CE2-CG1 3.89Å; L1061-V1064 HydrophobicContact CB-CG2 3.55Å; L1061-V1064 HydrophobicContact CD1-CG2 4.28Å; L1061-V1064 PolarHBondContact O-N 2.67Å; P1062-V1064 VanDerWaalsContact C-N 3.33Å; V1064-K1126 WeakPolarHBondContact O-CG 3.27Å; V1064-K1126 PolarHBondContact O-N 2.83Å
1065	M	86.1	Confident	81.3	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.039	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	144.2	-179.3	-65.9	159.8	-176.1	0	0	112	L990 V993 F1060 L1061 L1123 F1124 K1126	L990-M1065 HydrophobicContact CD2-CE 4.26Å; V993-M1065 HydrophobicContact CB-CE 4.32Å; V993-M1065 HydrophobicContact CG1-CE 3.78Å; V993-M1065 HydrophobicContact CG2-CE 3.9Å; F1060-M1065 HydrophobicContact CD2-CB 4.13Å; F1060-M1065 HydrophobicContact CE2-CB 3.96Å; F1060-M1065 WeakPolarHBondContact CE2-O 3.47Å; L1061-M1065 HydrophobicContact CB-SD 4.15Å; L1061-M1065 PolarHBondContact O-N 2.9Å; M1065-L1123 HydrophobicContact CB-CD2 4.07Å; M1065-L1123 HydrophobicContact CG-CD2 4.4Å; M1065-L1123 HydrophobicContact SD-CD1 3.98Å; M1065-L1123 HydrophobicContact SD-CD2 4.06Å; M1065-F1124 CarbonylContact C-O 3.47Å; M1065-F1124 VanDerWaalsContact CA-O 3.23Å; M1065-F1124 WeakPolarHBondContact CA-O 3.12Å; M1065-K1126 WeakPolarHBondContact O-CE 3.42Å
1066	Y	90.9	Very high	81.3	Confident	16 Å²	16	38.9 Å²	38.9	6%	0.063	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	157.2	153.4	-60.2	-65	0	0	0	108.9	M510 G1021 A1022 L1083 F1094 F1124 K1126	M510-Y1066 HydrophobicContact SD-CD1 4.42Å; M510-Y1066 HydrophobicContact SD-CE1 4.11Å; G1021-Y1066 WeakPolarHBondContact CA-OH 3.15Å; A1022-Y1066 HydrophobicContact CB-CD1 4.47Å; A1022-Y1066 HydrophobicContact CB-CD2 4.41Å; A1022-Y1066 HydrophobicContact CB-CE1 4.02Å; A1022-Y1066 HydrophobicContact CB-CE2 3.95Å; A1022-Y1066 PolarHBondContact N-OH 2.99Å; Y1066-L1083 HydrophobicContact CD2-CD2 4.25Å; Y1066-F1094 HydrophobicContact CE2-CB 4.27Å; Y1066-F1124 PolarHBondContact N-O 3.45Å; Y1066-F1124 PolarHBondContact O-N 2.99Å; Y1066-K1126 HydrophobicContact CD1-CD 4.47Å; Y1066-K1126 HydrophobicContact CD1-CG 4.5Å; Y1066-K1126 HydrophobicContact CD2-CD 4.37Å; Y1066-K1126 HydrophobicContact CD2-CG 3.65Å; Y1066-K1126 HydrophobicContact CE1-CD 4.04Å; Y1066-K1126 VanDerWaalsContact CE1-CE 3.46Å; Y1066-K1126 HydrophobicContact CE1-CG 4.36Å; Y1066-K1126 HydrophobicContact CE2-CB 4.13Å; Y1066-K1126 HydrophobicContact CE2-CD 3.93Å; Y1066-K1126 HydrophobicContact CE2-CG 3.48Å; Y1066-K1126 VanDerWaalsContact CE2-CG 3.48Å; Y1066-K1126 HydrophobicContact CG-CG 4.15Å
1067	C	91.6	Very high	81.4	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.007	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.2	165.9	134.1	0	0	0	0	109.8	L1047 C1052 L1056 F1060 V1121 A1122 L1123	L1047-C1067 PolarHBondContact N-O 2.93Å; C1052-C1067 HydrophobicContact CB-CB 3.9Å; C1052-C1067 WeakPolarHBondContact SG-CB 3.3Å; C1052-C1067 PolarHBondContact SG-SG 2.89Å; L1056-C1067 HydrophobicContact CD1-CB 3.97Å; F1060-C1067 HydrophobicContact CD2-CB 4.2Å; F1060-C1067 HydrophobicContact CE2-CB 4.09Å; C1067-V1121 HydrophobicContact CB-CG1 4.38Å; C1067-V1121 WeakPolarHBondContact SG-CG1 3.5Å; C1067-A1122 WeakPolarHBondContact CA-O 3.4Å; C1067-L1123 HydrophobicContact CB-CD2 3.84Å
1068	G	91.5	Very high	81.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	157.4	-179	0	0	0	0	0	111.4	Q1045 A1122	Q1045-G1068 CarbonylContact O-C 3.58Å; Q1045-G1068 WeakPolarHBondContact O-CA 3.32Å; G1068-A1122 PolarHBondContact N-O 2.89Å; G1068-A1122 PolarHBondContact O-N 2.83Å
1069	V	89.9	Confident	82.7	Confident	25 Å²	25	38 Å²	38	15%	0.152	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	141	174.8	-68.8	0	0	0	0	109.8	Y1044 Q1045 L1047 V1121	Y1044-V1069 WeakPolarHBondContact CA-O 3.49Å; Q1045-V1069 HydrophobicContact CB-CG2 3.98Å; Q1045-V1069 PolarHBondContact N-O 2.92Å; Q1045-V1069 PolarHBondContact O-N 3.41Å; L1047-V1069 HydrophobicContact CD1-CG1 4.05Å; L1047-V1069 HydrophobicContact CD2-CG2 4.28Å; L1047-V1069 HydrophobicContact CG-CG1 4.47Å; V1069-V1121 HydrophobicContact CG1-CG2 4.04Å
1070	G	84.2	Confident	83.4	Confident	7 Å²	7	31.8 Å²	31.8	7%	0.072	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	169.3	178.2	0	0	0	0	0	111.1	K1072	G1070-K1072 PolarHBondContact O-N 3.24Å
1071	R	78	Confident	83.8	Confident	130 Å²	130	31.7 Å²	31.7	49%	0.491	16%	0.155	S	C	.	.			trans	-65.7	129.6	-178.8	-66.2	-176.5	178.8	-156	-10	110.9	D820 I1042 V1074	D820-R1071 PolarHBondContact O-NH1 3.33Å; D820-R1071 IonicContact OD1-CZ 3.01Å; D820-R1071 IonicContact OD1-NH1 3.01Å; D820-R1071 PolarHBondContact OD1-NH1 2.76Å; I1042-R1071 HydrophobicContact CG2-CB 4.35Å; R1071-V1074 HydrophobicContact CB-CG2 3.98Å
1072	K	70.7	Confident	84.4	Confident	56 Å²	56	30.8 Å²	30.8	24%	0.243	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	152.6	179.2	-175.4	174.9	-165.6	137.7	0	112.4	G1070 V1074 P1118 D1120	G1070-K1072 PolarHBondContact O-N 3.24Å; K1072-V1074 PolarHBondContact O-N 2.94Å; K1072-P1118 WeakPolarHBondContact CB-O 3.44Å; K1072-P1118 HydrophobicContact CD-CG 4.03Å; K1072-D1120 VanDerWaalsContact CD-OD2 3.31Å; K1072-D1120 WeakPolarHBondContact CD-OD2 3.47Å; K1072-D1120 WeakPolarHBondContact CE-OD2 3.46Å; K1072-D1120 VanDerWaalsContact CG-OD2 3.31Å; K1072-D1120 WeakPolarHBondContact CG-OD2 3.48Å; K1072-D1120 VanDerWaalsContact NZ-CG 3.34Å; K1072-D1120 IonicContact NZ-OD1 2.98Å; K1072-D1120 PolarHBondContact NZ-OD1 3.5Å; K1072-D1120 IonicContact NZ-OD2 2.69Å; K1072-D1120 PolarHBondContact NZ-OD2 3.26Å
1073	N	70.8	Confident	84.9	Confident	135 Å²	135	30.8 Å²	30.8	72%	0.722	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	5.9	171	-63.4	-21	0	0	0	117.1
1074	V	77.7	Confident	85.7	Confident	22 Å²	22	30 Å²	30	13%	0.133	15%	0.145	C	C	.	.	S	Bend	trans	-79.1	-37	177.2	179.1	0	0	0	0	111.2	H821 C1034 I1042 R1071 K1072	H821-V1074 HydrophobicContact CB-CG1 4Å; C1034-V1074 WeakPolarHBondContact CA-O 3.33Å; C1034-V1074 WeakPolarHBondContact CB-O 3.5Å; I1042-V1074 HydrophobicContact CD1-CB 3.35Å; I1042-V1074 HydrophobicContact CD1-CG1 3.36Å; I1042-V1074 HydrophobicContact CD1-CG2 4.26Å; I1042-V1074 HydrophobicContact CG1-CB 4.34Å; I1042-V1074 HydrophobicContact CG1-CG1 3.87Å; R1071-V1074 HydrophobicContact CB-CG2 3.98Å; K1072-V1074 PolarHBondContact O-N 2.94Å
1075	L	83	Confident	86.4	Confident	19 Å²	19	29.9 Å²	29.9	10%	0.099	14%	0.144	C	C	.	.	S	Bend	trans	-91.8	131.6	174.5	-60.1	178.1	0	0	0	111.3	V1030 V1033 V1040 I1042 P1078	V1030-L1075 HydrophobicContact CB-CD1 4.18Å; V1030-L1075 HydrophobicContact CG1-CD1 3.53Å; V1033-L1075 CarbonylContact O-C 3.56Å; V1033-L1075 WeakPolarHBondContact O-CA 3.38Å; V1040-L1075 HydrophobicContact CG2-CD2 3.48Å; V1040-L1075 VanDerWaalsContact CG2-CD2 3.48Å; I1042-L1075 HydrophobicContact CD1-CD1 4.09Å; I1042-L1075 HydrophobicContact CD1-CD2 3.73Å; I1042-L1075 HydrophobicContact CD1-CG 3.46Å; I1042-L1075 VanDerWaalsContact CD1-CG 3.46Å; I1042-L1075 HydrophobicContact CG1-CD2 4.13Å; I1042-L1075 HydrophobicContact CG1-CG 4.3Å; L1075-P1078 HydrophobicContact CB-CB 3.93Å; L1075-P1078 HydrophobicContact CD1-CB 4.1Å
1076	Q	81.5	Confident	86.5	Confident	56 Å²	56	32 Å²	32	26%	0.262	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-87.3	138.8	161	-69.5	-158.6	-13.7	0	0	110.3	V1033 Q1035	V1033-Q1076 PolarHBondContact O-N 2.91Å; Q1035-Q1076 HydrophobicContact CB-CG 4.42Å
1077	Y	85.3	Confident	86	Confident	90 Å²	90	31.7 Å²	31.7	35%	0.353	15%	0.154	S	C	.	.	S	Bend	trans	49.3	52.2	178.9	-43.9	-73.4	0	0	0	112.9	P918 T921 V1079	P918-Y1077 HydrophobicContact CB-CD2 4.17Å; P918-Y1077 HydrophobicContact CB-CE1 4.36Å; P918-Y1077 HydrophobicContact CB-CE2 3.87Å; P918-Y1077 HydrophobicContact CG-CE1 4.11Å; P918-Y1077 HydrophobicContact CG-CE2 3.8Å; P918-Y1077 WeakPolarHBondContact CG-OH 3.35Å; P918-Y1077 WeakPolarHBondContact O-CE1 3.43Å; T921-Y1077 PolarHBondContact N-O 3.15Å; T921-Y1077 PolarHBondContact OG1-O 2.99Å; Y1077-V1079 PolarHBondContact O-N 3.38Å
1078	P	89.4	Confident	85	Confident	28 Å²	28	34.8 Å²	34.8	18%	0.182	18%	0.176	C	C	.	.			trans	-66.5	-21.1	-172.7	28.2	-36.1	0	0	0	113.1	L1075 G1080 S1081 Y1097	L1075-P1078 HydrophobicContact CB-CB 3.93Å; L1075-P1078 HydrophobicContact CD1-CB 4.1Å; P1078-G1080 PolarHBondContact O-N 3.34Å; P1078-S1081 WeakPolarHBondContact CA-OG 3.18Å; P1078-S1081 WeakPolarHBondContact O-CB 3.4Å; P1078-S1081 PolarHBondContact O-N 3.18Å; P1078-S1081 PolarHBondContact O-OG 3.12Å; P1078-Y1097 HydrophobicContact CB-CD1 3.91Å; P1078-Y1097 HydrophobicContact CB-CD2 4.31Å; P1078-Y1097 HydrophobicContact CB-CE1 3.77Å; P1078-Y1097 HydrophobicContact CB-CE2 4.19Å; P1078-Y1097 HydrophobicContact CB-CG 4.19Å; P1078-Y1097 HydrophobicContact CG-CD1 4.28Å; P1078-Y1097 HydrophobicContact CG-CE1 3.74Å; P1078-Y1097 WeakPolarHBondContact O-CB 3.05Å
1079	V	90.7	Very high	84.2	Confident	34 Å²	34	37.9 Å²	37.9	21%	0.206	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	130.9	176.2	-175.1	0	0	0	0	109.7	C920 T921 A939 C942 Y1077 S1081 D1098	C920-V1079 HydrophobicContact CB-CB 4.49Å; C920-V1079 VanDerWaalsContact CB-O 3.3Å; C920-V1079 WeakPolarHBondContact CB-O 3.44Å; T921-V1079 PolarHBondContact N-O 2.88Å; A939-V1079 HydrophobicContact CB-CG1 3.99Å; C942-V1079 HydrophobicContact CB-CG1 4.34Å; Y1077-V1079 PolarHBondContact O-N 3.38Å; V1079-S1081 VanDerWaalsContact C-N 3.3Å; V1079-S1081 PolarHBondContact O-N 3Å; V1079-D1098 WeakPolarHBondContact CG2-O 3.36Å
1080	G	90.5	Very high	83.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	83	-5.8	-176.6	0	0	0	0	0	115.7	T921 T938 P1078 I1096 Y1097	T921-G1080 CarbonylContact O-C 3.56Å; T921-G1080 VanDerWaalsContact O-CA 3.24Å; T921-G1080 WeakPolarHBondContact O-CA 3.34Å; T938-G1080 WeakPolarHBondContact OG1-CA 3.22Å; P1078-G1080 PolarHBondContact O-N 3.34Å; G1080-I1096 VanDerWaalsContact CA-CG2 3.47Å; G1080-Y1097 PolarHBondContact N-O 2.99Å
1081	S	91.9	Very high	83.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.226	C	C	.	.			trans	-64.6	141.7	177.6	-61.4	0	0	0	0	112	T921 S1031 P1078 V1079 Y1097	T921-S1081 WeakPolarHBondContact CB-OG 3.39Å; S1031-S1081 VanDerWaalsContact O-CB 3.28Å; S1031-S1081 WeakPolarHBondContact O-CB 3.28Å; S1031-S1081 PolarHBondContact O-OG 2.81Å; P1078-S1081 WeakPolarHBondContact CA-OG 3.18Å; P1078-S1081 WeakPolarHBondContact O-CB 3.4Å; P1078-S1081 PolarHBondContact O-N 3.18Å; P1078-S1081 PolarHBondContact O-OG 3.12Å; V1079-S1081 VanDerWaalsContact C-N 3.3Å; V1079-S1081 PolarHBondContact O-N 3Å; S1081-Y1097 WeakPolarHBondContact O-CB 3.22Å; S1081-Y1097 PolarHBondContact O-N 2.8Å
1082	P	92.6	Very high	84.3	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	134.9	179.7	29.8	-34.9	0	0	0	112	T923 V1030 S1031 L1084 Q1093	T923-P1082 WeakPolarHBondContact OG1-CB 3.03Å; T923-P1082 VanDerWaalsContact OG1-CD 3.29Å; T923-P1082 WeakPolarHBondContact OG1-CD 3.38Å; T923-P1082 VanDerWaalsContact OG1-CG 3.23Å; T923-P1082 WeakPolarHBondContact OG1-CG 3.36Å; V1030-P1082 WeakPolarHBondContact CA-O 3.48Å; S1031-P1082 WeakPolarHBondContact O-CD 3.43Å; P1082-L1084 HydrophobicContact CB-CD2 3.84Å; P1082-L1084 HydrophobicContact CB-CG 4.14Å; P1082-L1084 HydrophobicContact CG-CD1 4.49Å; P1082-L1084 HydrophobicContact CG-CD2 4.33Å; P1082-L1084 HydrophobicContact CG-CG 4.32Å; P1082-Q1093 HydrophobicContact CB-CG 3.72Å
1083	L	93.4	Very high	85.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105.8	163.6	178.1	71.3	0	0	0	109	C1028 V1030 L1046 Y1066 Q1093 F1094 G1095 F1124	C1028-L1083 HydrophobicContact CB-CD1 3.98Å; V1030-L1083 HydrophobicContact CG2-CD1 3.98Å; L1046-L1083 HydrophobicContact CD1-CD2 4.28Å; L1046-L1083 HydrophobicContact CD2-CD1 4.25Å; L1046-L1083 HydrophobicContact CD2-CD2 3.91Å; Y1066-L1083 HydrophobicContact CD2-CD2 4.25Å; L1083-Q1093 CarbonylContact O-C 3.58Å; L1083-Q1093 WeakPolarHBondContact O-CA 3.45Å; L1083-F1094 PolarHBondContact O-N 3.35Å; L1083-G1095 PolarHBondContact N-O 3.05Å; L1083-F1124 HydrophobicContact CB-CD1 3.71Å; L1083-F1124 HydrophobicContact CB-CE1 4.07Å; L1083-F1124 HydrophobicContact CB-CG 4.28Å; L1083-F1124 HydrophobicContact CD1-CD1 4.19Å; L1083-F1124 HydrophobicContact CD1-CE1 3.93Å; L1083-F1124 HydrophobicContact CD1-CE2 4.39Å; L1083-F1124 HydrophobicContact CD1-CZ 4.04Å; L1083-F1124 HydrophobicContact CD2-CB 4.04Å; L1083-F1124 HydrophobicContact CD2-CD1 4.11Å; L1083-F1124 HydrophobicContact CD2-CD2 4.18Å; L1083-F1124 HydrophobicContact CD2-CG 3.85Å; L1083-F1124 HydrophobicContact CG-CD1 4.21Å; L1083-F1124 HydrophobicContact CG-CE1 4.42Å; L1083-F1124 HydrophobicContact CG-CG 4.44Å
1084	L	92.2	Very high	86.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.9	-175.6	-56.2	176.2	0	0	0	109.6	P901 F1013 C1028 Y1029 P1082 W1091 V1092 Q1093	P901-L1084 HydrophobicContact CB-CD1 3.7Å; P901-L1084 HydrophobicContact CG-CD1 4.14Å; F1013-L1084 HydrophobicContact CB-CD2 3.9Å; F1013-L1084 HydrophobicContact CD1-CD1 4.27Å; F1013-L1084 HydrophobicContact CD1-CD2 3.7Å; F1013-L1084 HydrophobicContact CD2-CD1 4.18Å; F1013-L1084 HydrophobicContact CD2-CD2 3.49Å; F1013-L1084 VanDerWaalsContact CD2-CD2 3.49Å; F1013-L1084 HydrophobicContact CD2-CG 4.48Å; F1013-L1084 HydrophobicContact CE1-CD1 3.76Å; F1013-L1084 HydrophobicContact CE1-CD2 4.08Å; F1013-L1084 HydrophobicContact CE2-CD1 3.66Å; F1013-L1084 HydrophobicContact CE2-CD2 3.88Å; F1013-L1084 HydrophobicContact CE2-CG 4.42Å; F1013-L1084 HydrophobicContact CG-CD1 4.46Å; F1013-L1084 HydrophobicContact CG-CD2 3.38Å; F1013-L1084 HydrophobicContact CZ-CD1 3.43Å; F1013-L1084 VanDerWaalsContact CZ-CD1 3.43Å; F1013-L1084 HydrophobicContact CZ-CD2 4.16Å; F1013-L1084 HydrophobicContact CZ-CG 4.44Å; C1028-L1084 CarbonylContact C-O 3.02Å; C1028-L1084 WeakPolarHBondContact CA-O 3.29Å; Y1029-L1084 PolarHBondContact N-O 2.85Å; Y1029-L1084 PolarHBondContact O-N 3.32Å; P1082-L1084 HydrophobicContact CB-CD2 3.84Å; P1082-L1084 HydrophobicContact CB-CG 4.14Å; P1082-L1084 HydrophobicContact CG-CD1 4.49Å; P1082-L1084 HydrophobicContact CG-CD2 4.33Å; P1082-L1084 HydrophobicContact CG-CG 4.32Å; L1084-W1091 HydrophobicContact CB-CE3 4.23Å; L1084-V1092 WeakPolarHBondContact CA-O 3.28Å; L1084-Q1093 HydrophobicContact CD2-CB 3.96Å; L1084-Q1093 HydrophobicContact CD2-CG 4.32Å
1085	C	92	Very high	86.7	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.7	175.7	-53.8	0	0	0	0	111.2	M1026 X1027 C1028 S1087 V1092 F1094	M1026-C1085 HydrophobicContact CB-CB 4.19Å; M1026-C1085 HydrophobicContact SD-CB 4.27Å; A1027-C1085 WeakPolarHBondContact O-CA 3.23Å; C1028-C1085 HydrophobicContact CB-CB 4.12Å; C1028-C1085 WeakPolarHBondContact CB-SG 3.47Å; C1028-C1085 WeakPolarHBondContact SG-CB 3.35Å; C1028-C1085 CovalentContact SG-SG 2.04Å; C1028-C1085 PolarHBondContact SG-SG 3.28Å; C1085-S1087 PolarHBondContact O-N 3Å; C1085-V1092 PolarHBondContact N-O 3.32Å; C1085-V1092 PolarHBondContact O-N 2.8Å; C1085-F1094 HydrophobicContact CB-CD2 3.56Å; C1085-F1094 HydrophobicContact CB-CE2 3.86Å
1086	Q	88.4	Confident	87.1	Confident	52 Å²	52	24.8 Å²	24.8	24%	0.243	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120	179.7	-160.9	-173.4	25.2	0	0	110.8	E898 X1027 W1091	E898-Q1086 PolarHBondContact OE2-NE2 2.04Å; A1027-Q1086 PolarHBondContact O-N 3.49Å; Q1086-W1091 HydrophobicContact CB-CE3 4.26Å; Q1086-W1091 HydrophobicContact CB-CH2 3.95Å; Q1086-W1091 HydrophobicContact CB-CZ2 4.36Å; Q1086-W1091 HydrophobicContact CB-CZ3 3.9Å; Q1086-W1091 HydrophobicContact CG-CZ2 4.44Å
1087	S	80.3	Confident	87.6	Confident	10 Å²	10	22.6 Å²	22.6	7%	0.07	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	128	-179.7	-179.7	0	0	0	0	109.3	I569 C1085 G1089 S1090	I569-S1087 WeakPolarHBondContact CG2-OG 3.44Å; C1085-S1087 PolarHBondContact O-N 3Å; S1087-G1089 VanDerWaalsContact C-N 3.26Å; S1087-G1089 PolarHBondContact O-N 3.49Å; S1087-S1090 CarbonylContact C-O 3.59Å; S1087-S1090 PolarHBondContact N-O 2.76Å; S1087-S1090 CarbonylContact O-C 3.51Å; S1087-S1090 PolarHBondContact O-N 2.92Å
1088	S	71.9	Confident	87.8	Confident	66 Å²	66	18.5 Å²	18.5	46%	0.462	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	34.3	-177.2	-52.8	0	0	0	0	117	I569 N570 S1090	I569-S1088 PolarHBondContact O-OG 2.8Å; N570-S1088 WeakPolarHBondContact CB-OG 3.43Å; N570-S1088 PolarHBondContact ND2-N 3.11Å; S1088-S1090 PolarHBondContact O-N 2.74Å
1089	G	73.1	Confident	87.7	Confident	65 Å²	65	19.4 Å²	19.4	67%	0.67	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.8	7.6	-177.5	0	0	0	0	0	113.6	S1087	S1087-G1089 VanDerWaalsContact C-N 3.26Å; S1087-G1089 PolarHBondContact O-N 3.49Å
1090	S	80	Confident	87.4	Confident	68 Å²	68	19.9 Å²	19.9	48%	0.476	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	158.1	175.4	-61.3	0	0	0	0	110.4	S1087 S1088	S1087-S1090 CarbonylContact C-O 3.59Å; S1087-S1090 PolarHBondContact N-O 2.76Å; S1087-S1090 CarbonylContact O-C 3.51Å; S1087-S1090 PolarHBondContact O-N 2.92Å; S1088-S1090 PolarHBondContact O-N 2.74Å
1091	W	86.6	Confident	86.6	Confident	33 Å²	33	22.1 Å²	22.1	13%	0.125	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.3	172	-67.6	100.6	0	0	0	109.9	H899 L900 P901 F1013 P1014 X1027 Y1029 L1084 Q1086	H899-W1091 PolarHBondContact O-NE1 2.89Å; L900-W1091 HydrophobicContact CD2-CZ2 4.33Å; P901-W1091 HydrophobicContact CB-CB 4.09Å; P901-W1091 HydrophobicContact CB-CD2 3.7Å; P901-W1091 HydrophobicContact CB-CE3 4.22Å; P901-W1091 HydrophobicContact CB-CG 3.59Å; P901-W1091 HydrophobicContact CG-CD2 3.7Å; P901-W1091 HydrophobicContact CG-CE3 3.87Å; P901-W1091 HydrophobicContact CG-CG 4.16Å; P901-W1091 HydrophobicContact CG-CH2 4.4Å; P901-W1091 HydrophobicContact CG-CZ2 4.25Å; P901-W1091 HydrophobicContact CG-CZ3 4.21Å; F1013-W1091 HydrophobicContact CD1-CB 4.11Å; F1013-W1091 HydrophobicContact CE1-CB 4.19Å; P1014-W1091 WeakPolarHBondContact CD-O 3.37Å; P1014-W1091 WeakPolarHBondContact CG-O 3.41Å; A1027-W1091 WeakPolarHBondContact O-CZ3 3.09Å; Y1029-W1091 AromaticContact CD2-CH2 3.57Å; Y1029-W1091 HydrophobicContact CD2-CH2 3.57Å; Y1029-W1091 AromaticContact CD2-CZ3 3.67Å; Y1029-W1091 HydrophobicContact CD2-CZ3 3.67Å; Y1029-W1091 AromaticContact CE2-CH2 3.64Å; Y1029-W1091 HydrophobicContact CE2-CH2 3.64Å; Y1029-W1091 HydrophobicContact CE2-CZ2 4.47Å; Y1029-W1091 HydrophobicContact CE2-CZ3 4.2Å; L1084-W1091 HydrophobicContact CB-CE3 4.23Å; Q1086-W1091 HydrophobicContact CB-CE3 4.26Å; Q1086-W1091 HydrophobicContact CB-CH2 3.95Å; Q1086-W1091 HydrophobicContact CB-CZ2 4.36Å; Q1086-W1091 HydrophobicContact CB-CZ3 3.9Å; Q1086-W1091 HydrophobicContact CG-CZ2 4.44Å
1092	V	87.8	Confident	85.1	Confident	14 Å²	14	26.8 Å²	26.8	9%	0.085	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.2	-177	177.6	0	0	0	0	108.7	P1014 P1016 L1084 C1085 F1094	P1014-V1092 HydrophobicContact CG-CG2 4.14Å; P1014-V1092 WeakPolarHBondContact O-CG1 3.42Å; P1016-V1092 HydrophobicContact CB-CG1 3.88Å; P1016-V1092 HydrophobicContact CG-CG1 4.44Å; L1084-V1092 WeakPolarHBondContact CA-O 3.28Å; C1085-V1092 PolarHBondContact N-O 3.32Å; C1085-V1092 PolarHBondContact O-N 2.8Å; V1092-F1094 HydrophobicContact CB-CD2 4.09Å; V1092-F1094 HydrophobicContact CB-CE2 3.74Å; V1092-F1094 HydrophobicContact CB-CZ 4.5Å; V1092-F1094 HydrophobicContact CG1-CD2 4.06Å; V1092-F1094 HydrophobicContact CG1-CE2 3.85Å; V1092-F1094 HydrophobicContact CG1-CZ 4.28Å; V1092-F1094 WeakPolarHBondContact O-CD2 3.43Å; V1092-F1094 PolarHBondContact O-N 2.9Å
1093	Q	90.5	Very high	83.3	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.019	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	95.8	178.3	-174	-175.9	-12.2	0	0	110.5	F1013 P1014 L1015 P1016 P1082 L1083 L1084 L1127	F1013-Q1093 HydrophobicContact CB-CB 3.93Å; P1014-Q1093 PolarHBondContact O-N 2.96Å; L1015-Q1093 HydrophobicContact CD2-CB 4.47Å; P1016-Q1093 WeakPolarHBondContact CD-O 3.05Å; P1082-Q1093 HydrophobicContact CB-CG 3.72Å; L1083-Q1093 CarbonylContact O-C 3.58Å; L1083-Q1093 WeakPolarHBondContact O-CA 3.45Å; L1084-Q1093 HydrophobicContact CD2-CB 3.96Å; L1084-Q1093 HydrophobicContact CD2-CG 4.32Å; Q1093-L1127 HydrophobicContact CG-CD1 3.76Å
1094	F	89.8	Confident	80.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-17.5	-179.3	-80.3	-89.5	0	0	0	114	P1016 G1021 A1022 M1026 Y1066 L1083 C1085 V1092 L1127	P1016-F1094 HydrophobicContact CB-CD1 3.73Å; P1016-F1094 HydrophobicContact CB-CE1 3.55Å; P1016-F1094 HydrophobicContact CB-CG 4.44Å; P1016-F1094 HydrophobicContact CB-CZ 4.15Å; P1016-F1094 HydrophobicContact CG-CD1 3.88Å; P1016-F1094 HydrophobicContact CG-CE1 4.24Å; P1016-F1094 HydrophobicContact CG-CG 4.41Å; G1021-F1094 VanDerWaalsContact C-CE1 3.47Å; A1022-F1094 HydrophobicContact CB-CB 3.86Å; A1022-F1094 HydrophobicContact CB-CD1 3.84Å; A1022-F1094 HydrophobicContact CB-CD2 4.39Å; A1022-F1094 HydrophobicContact CB-CE1 4.45Å; A1022-F1094 HydrophobicContact CB-CG 3.78Å; A1022-F1094 VanDerWaalsContact N-CD1 3.26Å; M1026-F1094 HydrophobicContact CE-CZ 4.42Å; M1026-F1094 HydrophobicContact SD-CE2 4.29Å; M1026-F1094 HydrophobicContact SD-CZ 4.21Å; Y1066-F1094 HydrophobicContact CE2-CB 4.27Å; L1083-F1094 PolarHBondContact O-N 3.35Å; C1085-F1094 HydrophobicContact CB-CD2 3.56Å; C1085-F1094 HydrophobicContact CB-CE2 3.86Å; V1092-F1094 HydrophobicContact CB-CD2 4.09Å; V1092-F1094 HydrophobicContact CB-CE2 3.74Å; V1092-F1094 HydrophobicContact CB-CZ 4.5Å; V1092-F1094 HydrophobicContact CG1-CD2 4.06Å; V1092-F1094 HydrophobicContact CG1-CE2 3.85Å; V1092-F1094 HydrophobicContact CG1-CZ 4.28Å; V1092-F1094 WeakPolarHBondContact O-CD2 3.43Å; V1092-F1094 PolarHBondContact O-N 2.9Å; F1094-L1127 PolarHBondContact O-N 3.28Å
1095	G	90.6	Very high	78.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	177.9	179.3	0	0	0	0	0	115.3	L1083 V1125	L1083-G1095 PolarHBondContact N-O 3.05Å; G1095-V1125 CarbonylContact C-O 3.49Å; G1095-V1125 WeakPolarHBondContact CA-O 3.4Å
1096	I	91.3	Very high	75.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.3	178	-52.3	177.7	0	0	0	107.7	V937 T938 A939 M995 G1080 D1098 F1124 V1125 L1127	V937-I1096 HydrophobicContact CG1-CD1 3.56Å; V937-I1096 HydrophobicContact CG1-CG1 4.44Å; T938-I1096 WeakPolarHBondContact O-CD1 3.48Å; A939-I1096 HydrophobicContact CB-CG2 3.99Å; M995-I1096 HydrophobicContact CB-CD1 4.09Å; G1080-I1096 VanDerWaalsContact CA-CG2 3.47Å; I1096-D1098 PolarHBondContact O-N 2.89Å; I1096-F1124 CarbonylContact O-C 3.51Å; I1096-F1124 VanDerWaalsContact O-CA 3.24Å; I1096-F1124 WeakPolarHBondContact O-CA 3.08Å; I1096-V1125 HydrophobicContact CB-CB 4.3Å; I1096-V1125 PolarHBondContact N-O 2.69Å; I1096-V1125 PolarHBondContact O-N 2.9Å; I1096-L1127 HydrophobicContact CD1-CD1 4.2Å; I1096-L1127 HydrophobicContact CD1-CD2 3.97Å; I1096-L1127 HydrophobicContact CD1-CG 4.37Å; I1096-L1127 HydrophobicContact CG1-CD1 3.64Å; I1096-L1127 HydrophobicContact CG1-CD2 4.18Å; I1096-L1127 HydrophobicContact CG1-CG 4.02Å
1097	Y	92.6	Very high	72.9	Confident	11 Å²	11	59.9 Å²	59.9	4%	0.043	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	123.6	175.3	-169.7	-69.5	0	0	0	110	V1030 Y1044 P1078 G1080 S1081 S1100 A1122 F1124	V1030-Y1097 HydrophobicContact CG1-CD2 4.28Å; Y1044-Y1097 HydrophobicContact CE1-CE2 4.48Å; P1078-Y1097 HydrophobicContact CB-CD1 3.91Å; P1078-Y1097 HydrophobicContact CB-CD2 4.31Å; P1078-Y1097 HydrophobicContact CB-CE1 3.77Å; P1078-Y1097 HydrophobicContact CB-CE2 4.19Å; P1078-Y1097 HydrophobicContact CB-CG 4.19Å; P1078-Y1097 HydrophobicContact CG-CD1 4.28Å; P1078-Y1097 HydrophobicContact CG-CE1 3.74Å; P1078-Y1097 WeakPolarHBondContact O-CB 3.05Å; G1080-Y1097 PolarHBondContact N-O 2.99Å; S1081-Y1097 WeakPolarHBondContact O-CB 3.22Å; S1081-Y1097 PolarHBondContact O-N 2.8Å; Y1097-S1100 VanDerWaalsContact OH-CB 3.29Å; Y1097-S1100 WeakPolarHBondContact OH-CB 3.4Å; Y1097-S1100 PolarHBondContact OH-OG 3.13Å; Y1097-A1122 HydrophobicContact CD2-CB 4.22Å; Y1097-A1122 HydrophobicContact CE2-CB 3.48Å; Y1097-A1122 VanDerWaalsContact CE2-CB 3.48Å; Y1097-F1124 HydrophobicContact CD2-CD1 4.25Å; Y1097-F1124 AromaticContact CD2-CE1 3.5Å; Y1097-F1124 HydrophobicContact CD2-CE1 3.5Å; Y1097-F1124 VanDerWaalsContact CD2-CE1 3.5Å; Y1097-F1124 AromaticContact CD2-CZ 3.94Å; Y1097-F1124 HydrophobicContact CD2-CZ 3.94Å; Y1097-F1124 HydrophobicContact CE2-CE1 4.37Å; Y1097-F1124 HydrophobicContact CE2-CZ 4.39Å; Y1097-F1124 HydrophobicContact CG-CD1 4.48Å; Y1097-F1124 HydrophobicContact CG-CE1 4.13Å
1098	D	88.9	Confident	70.5	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-58.9	179.7	-165.9	76.5	0	0	0	111.5	R941 V1079 I1096 L1123 V1125	R941-D1098 IonicContact CZ-OD2 2.67Å; R941-D1098 IonicContact NE-OD1 3.95Å; R941-D1098 IonicContact NE-OD2 3.14Å; R941-D1098 PolarHBondContact NE-OD2 2.8Å; R941-D1098 VanDerWaalsContact NE-OD2 3.1Å; R941-D1098 IonicContact NH2-OD2 3.49Å; V1079-D1098 WeakPolarHBondContact CG2-O 3.36Å; I1096-D1098 PolarHBondContact O-N 2.89Å; D1098-L1123 PolarHBondContact N-O 2.89Å; D1098-V1125 HydrophobicContact CB-CG2 4.1Å
1099	H	87.3	Confident	68.5	Low	48 Å²	48	67.4 Å²	67.4	22%	0.222	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	166.9	177.3	61.1	-79	0	0	0	111.2	F1101 L1123	H1099-F1101 AromaticContact CD2-CE1 3.99Å; H1099-F1101 AromaticContact CD2-CE2 3.65Å; H1099-F1101 AromaticContact CD2-CZ 3.5Å; H1099-F1101 VanDerWaalsContact CD2-CZ 3.5Å; H1099-F1101 WeakPolarHBondContact CD2-CZ 3.37Å; H1099-F1101 AromaticContact NE2-CE1 3.83Å; H1099-F1101 AromaticContact NE2-CE2 3.35Å; H1099-F1101 WeakPolarHBondContact NE2-CE2 3.34Å; H1099-F1101 AromaticContact NE2-CZ 3.01Å; H1099-F1101 WeakPolarHBondContact NE2-CZ 3.34Å; H1099-L1123 PolarHBondContact O-N 3.03Å
1100	S	83.8	Confident	66.6	Low	44 Å²	44	67.8 Å²	67.8	31%	0.308	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	159.3	170.9	58.5	0	0	0	0	112.4	Y1097 V1121	Y1097-S1100 VanDerWaalsContact OH-CB 3.29Å; Y1097-S1100 WeakPolarHBondContact OH-CB 3.4Å; Y1097-S1100 PolarHBondContact OH-OG 3.13Å; S1100-V1121 WeakPolarHBondContact CA-O 3.09Å
1101	F	73.9	Confident	64.3	Low	46 Å²	46	74.4 Å²	74.4	20%	0.202	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	138.9	167.4	-56.8	-87.8	0	0	0	109.6	L1056 K1059 H1099 A1103 V1121 L1123	L1056-F1101 HydrophobicContact CD1-CD2 4.41Å; L1056-F1101 HydrophobicContact CD1-CE2 4.33Å; L1056-F1101 HydrophobicContact CD2-CB 4.15Å; L1056-F1101 HydrophobicContact CD2-CD2 3.27Å; L1056-F1101 HydrophobicContact CD2-CE2 3.76Å; L1056-F1101 HydrophobicContact CD2-CG 3.88Å; L1056-F1101 HydrophobicContact CG-CD2 4.44Å; K1059-F1101 HydrophobicContact CB-CZ 4.25Å; K1059-F1101 HydrophobicContact CD-CD1 4.45Å; K1059-F1101 HydrophobicContact CD-CE1 3.6Å; K1059-F1101 HydrophobicContact CD-CZ 3.69Å; H1099-F1101 AromaticContact CD2-CE1 3.99Å; H1099-F1101 AromaticContact CD2-CE2 3.65Å; H1099-F1101 AromaticContact CD2-CZ 3.5Å; H1099-F1101 VanDerWaalsContact CD2-CZ 3.5Å; H1099-F1101 WeakPolarHBondContact CD2-CZ 3.37Å; H1099-F1101 AromaticContact NE2-CE1 3.83Å; H1099-F1101 AromaticContact NE2-CE2 3.35Å; H1099-F1101 WeakPolarHBondContact NE2-CE2 3.34Å; H1099-F1101 AromaticContact NE2-CZ 3.01Å; H1099-F1101 WeakPolarHBondContact NE2-CZ 3.34Å; F1101-A1103 PolarHBondContact O-N 2.87Å; F1101-V1121 PolarHBondContact N-O 2.99Å; F1101-V1121 PolarHBondContact O-N 2.93Å; F1101-L1123 HydrophobicContact CE2-CD1 3.53Å; F1101-L1123 HydrophobicContact CE2-CG 4Å; F1101-L1123 HydrophobicContact CZ-CD1 4.15Å
1102	T	61.3	Low	61.9	Low	98 Å²	98	77.3 Å²	77.3	60%	0.601	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	117.8	165.4	-38.8	0	0	0	0	108	R1104	T1102-R1104 PolarHBondContact O-N 2.7Å; T1102-R1104 VanDerWaalsContact O-N 3.09Å
1103	A	53.2	Low	59.3	Low	34 Å²	34	85.2 Å²	85.2	28%	0.281	46%	0.463	S	S	.	.			trans	-58.9	116.5	172.4	0	0	0	0	0	108.4	F1101 H1105	F1101-A1103 PolarHBondContact O-N 2.87Å; A1103-H1105 PolarHBondContact O-N 2.93Å
1104	R	42.6	Very low	56.5	Low	242 Å²	242	90.4 Å²	90.4	91%	0.913	49%	0.491	S	S	*	.			trans	-70.6	102.6	170.8	-79.5	-175.4	-178.7	171.7	-0.4	107.3	T1102 S1106	T1102-R1104 PolarHBondContact O-N 2.7Å; T1102-R1104 VanDerWaalsContact O-N 3.09Å; R1104-S1106 PolarHBondContact O-N 2.86Å
1105	H	41.3	Very low	53.8	Low	151 Å²	151	99.1 Å²	99.1	70%	0.699	53%	0.532	S	S	*	.			trans	-65	98.6	165.1	-79.2	-50.4	0	0	0	109	A1103 Y1107	A1103-H1105 PolarHBondContact O-N 2.93Å; H1105-Y1107 VanDerWaalsContact C-N 3.29Å; H1105-Y1107 PolarHBondContact O-N 2.83Å
1106	S	30.4	Very low	51.2	Low	108 Å²	108	106.2 Å²	106.2	76%	0.755	57%	0.569	S	S	*	*			trans	-88.8	71.8	161.7	60.8	0	0	0	0	108.8	R1104	R1104-S1106 PolarHBondContact O-N 2.86Å
1107	Y	33.8	Very low	48.8	Very low	212 Å²	212	110.9 Å²	110.9	83%	0.831	60%	0.599	S	S	*	*			trans	-123.5	112.6	156.6	-80.1	-77.5	0	0	0	107.5	H1105	H1105-Y1107 VanDerWaalsContact C-N 3.29Å; H1105-Y1107 PolarHBondContact O-N 2.83Å
1108	A	29.1	Very low	46.5	Very low	85 Å²	85	113.7 Å²	113.7	70%	0.702	62%	0.619	S	S	*	*			trans	-68.8	146.8	164.7	0	0	0	0	0	108.8
1109	T	31.1	Very low	45.2	Very low	149 Å²	149	119 Å²	119	91%	0.914	64%	0.643	S	S	*	*			trans	82.5	117.2	164	65.3	0	0	0	0	118.6
1110	G	32.9	Very low	44.4	Very low	73 Å²	73	117.3 Å²	117.3	75%	0.753	64%	0.636	S	S	*	*			trans	118.6	87.5	150.7	0	0	0	0	0	114.9	S1112	G1110-S1112 PolarHBondContact O-N 2.72Å; G1110-S1112 VanDerWaalsContact O-N 3.14Å
1111	E	31.4	Very low	44.5	Very low	208 Å²	208	115.4 Å²	115.4	97%	0.972	62%	0.623	S	S	*	*			trans	-54.1	113.2	164.4	-70.6	172.1	156.5	0	0	109.8
1112	S	35.6	Very low	45.3	Very low	93 Å²	93	113.2 Å²	113.2	65%	0.65	61%	0.613	S	S	*	*			trans	-138.3	107.1	161.6	-176.5	0	0	0	0	107.4	G1110 N1114	G1110-S1112 PolarHBondContact O-N 2.72Å; G1110-S1112 VanDerWaalsContact O-N 3.14Å; S1112-N1114 VanDerWaalsContact C-N 3.32Å; S1112-N1114 PolarHBondContact O-N 2.96Å
1113	E	33.1	Very low	46.6	Very low	181 Å²	181	108.7 Å²	108.7	85%	0.846	59%	0.585	S	S	*	*	S	Bend	trans	-63.5	87.6	176.2	-65.1	-179.5	141.9	0	0	110.1
1114	N	33.5	Very low	48.5	Very low	112 Å²	112	107 Å²	107	60%	0.599	57%	0.572	S	S	*	*			trans	-166.9	41.9	161.8	-93	-35.8	0	0	0	109.5	L857 S1112 L1116	L857-N1114 WeakPolarHBondContact CD1-OD1 3.28Å; S1112-N1114 VanDerWaalsContact C-N 3.32Å; S1112-N1114 PolarHBondContact O-N 2.96Å; N1114-L1116 PolarHBondContact O-N 2.62Å
1115	E	31.2	Very low	50.6	Low	184 Å²	184	95.5 Å²	95.5	86%	0.86	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-69.5	120.3	-172.7	-75.6	-170.5	144.1	0	0	112.2
1116	L	37.1	Very low	52.7	Low	148 Å²	148	89 Å²	89	78%	0.775	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-54.7	142	164	-82.5	87.4	0	0	0	109.5	N1114	N1114-L1116 PolarHBondContact O-N 2.62Å
1117	P	41.2	Very low	55	Low	99 Å²	99	83.9 Å²	83.9	64%	0.643	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-56.9	137.4	179.5	22.6	-31.7	0	0	0	110.3	E1119	P1117-E1119 PolarHBondContact O-N 3.26Å; P1117-E1119 VanDerWaalsContact O-N 3.11Å
1118	P	44.5	Very low	56.6	Low	69 Å²	69	74.7 Å²	74.7	45%	0.448	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-60.3	118.6	-175	22.4	-32.3	0	0	0	110.1	K1072 D1120	K1072-P1118 WeakPolarHBondContact CB-O 3.44Å; K1072-P1118 HydrophobicContact CD-CG 4.03Å; P1118-D1120 PolarHBondContact O-N 2.95Å
1119	E	60.3	Low	57.9	Low	115 Å²	115	71.9 Å²	71.9	54%	0.537	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-72.5	125	173.4	-63.3	-164.9	161.5	0	0	109.4	P1117	P1117-E1119 PolarHBondContact O-N 3.26Å; P1117-E1119 VanDerWaalsContact O-N 3.11Å
1120	D	71	Confident	59	Low	13 Å²	13	67.2 Å²	67.2	7%	0.07	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	138.6	174.8	-83.1	-8.1	0	0	0	109.5	K1072 P1118 A1122	K1072-D1120 VanDerWaalsContact CD-OD2 3.31Å; K1072-D1120 WeakPolarHBondContact CD-OD2 3.47Å; K1072-D1120 WeakPolarHBondContact CE-OD2 3.46Å; K1072-D1120 VanDerWaalsContact CG-OD2 3.31Å; K1072-D1120 WeakPolarHBondContact CG-OD2 3.48Å; K1072-D1120 VanDerWaalsContact NZ-CG 3.34Å; K1072-D1120 IonicContact NZ-OD1 2.98Å; K1072-D1120 PolarHBondContact NZ-OD1 3.5Å; K1072-D1120 IonicContact NZ-OD2 2.69Å; K1072-D1120 PolarHBondContact NZ-OD2 3.26Å; P1118-D1120 PolarHBondContact O-N 2.95Å; D1120-A1122 PolarHBondContact O-N 3.22Å
1121	V	85.8	Confident	59.9	Low	4 Å²	4	64.2 Å²	64.2	2%	0.024	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	108.7	173.7	-177.5	0	0	0	0	107.9	H1055 L1056 C1067 V1069 S1100 F1101	H1055-V1121 HydrophobicContact CB-CG1 4.48Å; H1055-V1121 HydrophobicContact CB-CG2 4.24Å; L1056-V1121 HydrophobicContact CD1-CG1 4.01Å; L1056-V1121 HydrophobicContact CD2-CB 4.28Å; L1056-V1121 HydrophobicContact CD2-CG1 3.91Å; L1056-V1121 HydrophobicContact CG-CG1 4.04Å; C1067-V1121 HydrophobicContact CB-CG1 4.38Å; C1067-V1121 WeakPolarHBondContact SG-CG1 3.5Å; V1069-V1121 HydrophobicContact CG1-CG2 4.04Å; S1100-V1121 WeakPolarHBondContact CA-O 3.09Å; F1101-V1121 PolarHBondContact N-O 2.99Å; F1101-V1121 PolarHBondContact O-N 2.93Å
1122	A	89.9	Confident	60.6	Low	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.7	179	0	0	0	0	0	111.7	Y1044 C1067 G1068 Y1097 D1120 F1124	Y1044-A1122 HydrophobicContact CD1-CB 4.41Å; Y1044-A1122 HydrophobicContact CE1-CB 3.63Å; C1067-A1122 WeakPolarHBondContact CA-O 3.4Å; G1068-A1122 PolarHBondContact N-O 2.89Å; G1068-A1122 PolarHBondContact O-N 2.83Å; Y1097-A1122 HydrophobicContact CD2-CB 4.22Å; Y1097-A1122 HydrophobicContact CE2-CB 3.48Å; Y1097-A1122 VanDerWaalsContact CE2-CB 3.48Å; D1120-A1122 PolarHBondContact O-N 3.22Å; A1122-F1124 HydrophobicContact CB-CE2 3.81Å; A1122-F1124 HydrophobicContact CB-CZ 3.86Å
1123	L	90.6	Very high	61.2	Low	2 Å²	2	51.9 Å²	51.9	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.3	169.4	-79.7	180	0	0	0	111	L1056 F1060 M1065 C1067 D1098 H1099 F1101	L1056-L1123 HydrophobicContact CD1-CD1 4.34Å; L1056-L1123 HydrophobicContact CD1-CD2 3.51Å; L1056-L1123 HydrophobicContact CD1-CG 3.84Å; F1060-L1123 HydrophobicContact CD2-CD2 3.74Å; F1060-L1123 HydrophobicContact CE2-CD2 4.39Å; M1065-L1123 HydrophobicContact CB-CD2 4.07Å; M1065-L1123 HydrophobicContact CG-CD2 4.4Å; M1065-L1123 HydrophobicContact SD-CD1 3.98Å; M1065-L1123 HydrophobicContact SD-CD2 4.06Å; C1067-L1123 HydrophobicContact CB-CD2 3.84Å; D1098-L1123 PolarHBondContact N-O 2.89Å; H1099-L1123 PolarHBondContact O-N 3.03Å; F1101-L1123 HydrophobicContact CE2-CD1 3.53Å; F1101-L1123 HydrophobicContact CE2-CG 4Å; F1101-L1123 HydrophobicContact CZ-CD1 4.15Å
1124	F	91.4	Very high	61.9	Low	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126.6	175.8	-55.1	-90.2	0	0	0	109.9	V1030 Y1044 L1046 M1065 Y1066 L1083 I1096 Y1097 A1122	V1030-F1124 HydrophobicContact CG2-CE1 3.42Å; V1030-F1124 VanDerWaalsContact CG2-CE1 3.42Å; V1030-F1124 HydrophobicContact CG2-CZ 3.65Å; Y1044-F1124 AromaticContact CD1-CE2 3.99Å; Y1044-F1124 HydrophobicContact CD1-CE2 3.99Å; Y1044-F1124 AromaticContact CD1-CZ 3.61Å; Y1044-F1124 HydrophobicContact CD1-CZ 3.61Å; Y1044-F1124 HydrophobicContact CE1-CE2 4.38Å; Y1044-F1124 AromaticContact CE1-CZ 3.83Å; Y1044-F1124 HydrophobicContact CE1-CZ 3.83Å; Y1044-F1124 HydrophobicContact CG-CZ 4.07Å; L1046-F1124 HydrophobicContact CD2-CD2 4.43Å; L1046-F1124 HydrophobicContact CD2-CE2 4.45Å; M1065-F1124 CarbonylContact C-O 3.47Å; M1065-F1124 VanDerWaalsContact CA-O 3.23Å; M1065-F1124 WeakPolarHBondContact CA-O 3.12Å; Y1066-F1124 PolarHBondContact N-O 3.45Å; Y1066-F1124 PolarHBondContact O-N 2.99Å; L1083-F1124 HydrophobicContact CB-CD1 3.71Å; L1083-F1124 HydrophobicContact CB-CE1 4.07Å; L1083-F1124 HydrophobicContact CB-CG 4.28Å; L1083-F1124 HydrophobicContact CD1-CD1 4.19Å; L1083-F1124 HydrophobicContact CD1-CE1 3.93Å; L1083-F1124 HydrophobicContact CD1-CE2 4.39Å; L1083-F1124 HydrophobicContact CD1-CZ 4.04Å; L1083-F1124 HydrophobicContact CD2-CB 4.04Å; L1083-F1124 HydrophobicContact CD2-CD1 4.11Å; L1083-F1124 HydrophobicContact CD2-CD2 4.18Å; L1083-F1124 HydrophobicContact CD2-CG 3.85Å; L1083-F1124 HydrophobicContact CG-CD1 4.21Å; L1083-F1124 HydrophobicContact CG-CE1 4.42Å; L1083-F1124 HydrophobicContact CG-CG 4.44Å; I1096-F1124 CarbonylContact O-C 3.51Å; I1096-F1124 VanDerWaalsContact O-CA 3.24Å; I1096-F1124 WeakPolarHBondContact O-CA 3.08Å; Y1097-F1124 HydrophobicContact CD2-CD1 4.25Å; Y1097-F1124 AromaticContact CD2-CE1 3.5Å; Y1097-F1124 HydrophobicContact CD2-CE1 3.5Å; Y1097-F1124 VanDerWaalsContact CD2-CE1 3.5Å; Y1097-F1124 AromaticContact CD2-CZ 3.94Å; Y1097-F1124 HydrophobicContact CD2-CZ 3.94Å; Y1097-F1124 HydrophobicContact CE2-CE1 4.37Å; Y1097-F1124 HydrophobicContact CE2-CZ 4.39Å; Y1097-F1124 HydrophobicContact CG-CD1 4.48Å; Y1097-F1124 HydrophobicContact CG-CE1 4.13Å; A1122-F1124 HydrophobicContact CB-CE2 3.81Å; A1122-F1124 HydrophobicContact CB-CZ 3.86Å
1125	V	87.7	Confident	62.6	Low	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	129.8	168.7	163.5	0	0	0	0	109.7	F983 V993 G1095 I1096 D1098	F983-V1125 HydrophobicContact CD2-CG1 4.39Å; F983-V1125 HydrophobicContact CE2-CB 4.41Å; F983-V1125 HydrophobicContact CE2-CG1 3.19Å; F983-V1125 HydrophobicContact CE2-CG2 4.43Å; F983-V1125 HydrophobicContact CZ-CG1 3.3Å; V993-V1125 HydrophobicContact CG1-CG2 3.56Å; G1095-V1125 CarbonylContact C-O 3.49Å; G1095-V1125 WeakPolarHBondContact CA-O 3.4Å; I1096-V1125 HydrophobicContact CB-CB 4.3Å; I1096-V1125 PolarHBondContact N-O 2.69Å; I1096-V1125 PolarHBondContact O-N 2.9Å; D1098-V1125 HydrophobicContact CB-CG2 4.1Å
1126	K	84.3	Confident	63.4	Low	13 Å²	13	36.4 Å²	36.4	6%	0.057	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138.9	179.9	-64.3	-169.2	-177	-175.5	0	113.1	M510 P1062 V1064 M1065 Y1066	M510-K1126 PolarHBondContact SD-NZ 2.98Å; P1062-K1126 VanDerWaalsContact O-CE 3.3Å; P1062-K1126 WeakPolarHBondContact O-CE 3.32Å; P1062-K1126 PolarHBondContact O-NZ 3.32Å; V1064-K1126 WeakPolarHBondContact O-CG 3.27Å; V1064-K1126 PolarHBondContact O-N 2.83Å; M1065-K1126 WeakPolarHBondContact O-CE 3.42Å; Y1066-K1126 HydrophobicContact CD1-CD 4.47Å; Y1066-K1126 HydrophobicContact CD1-CG 4.5Å; Y1066-K1126 HydrophobicContact CD2-CD 4.37Å; Y1066-K1126 HydrophobicContact CD2-CG 3.65Å; Y1066-K1126 HydrophobicContact CE1-CD 4.04Å; Y1066-K1126 VanDerWaalsContact CE1-CE 3.46Å; Y1066-K1126 HydrophobicContact CE1-CG 4.36Å; Y1066-K1126 HydrophobicContact CE2-CB 4.13Å; Y1066-K1126 HydrophobicContact CE2-CD 3.93Å; Y1066-K1126 HydrophobicContact CE2-CG 3.48Å; Y1066-K1126 VanDerWaalsContact CE2-CG 3.48Å; Y1066-K1126 HydrophobicContact CG-CG 4.15Å
1127	L	80.2	Confident	63.7	Low	2 Å²	2	34.5 Å²	34.5	1%	0.01	20%	0.203	C	C	.	.			trans	-110.2	146.9	170.2	-66.6	171	0	0	0	110.9	M995 L1015 P1016 Q1093 F1094 I1096	M995-L1127 HydrophobicContact SD-CD2 4.19Å; L1015-L1127 HydrophobicContact CD2-CB 4.21Å; L1015-L1127 HydrophobicContact CD2-CD1 3.82Å; L1015-L1127 HydrophobicContact CD2-CG 4.47Å; P1016-L1127 WeakPolarHBondContact CG-O 3.2Å; Q1093-L1127 HydrophobicContact CG-CD1 3.76Å; F1094-L1127 PolarHBondContact O-N 3.28Å; I1096-L1127 HydrophobicContact CD1-CD1 4.2Å; I1096-L1127 HydrophobicContact CD1-CD2 3.97Å; I1096-L1127 HydrophobicContact CD1-CG 4.37Å; I1096-L1127 HydrophobicContact CG1-CD1 3.64Å; I1096-L1127 HydrophobicContact CG1-CD2 4.18Å; I1096-L1127 HydrophobicContact CG1-CG 4.02Å
1128	E	67.7	Low	63.4	Low	18 Å²	18	32.4 Å²	32.4	8%	0.084	19%	0.194	C	C	.	.			trans	-141.4	151.3	175.1	-68.7	-165.6	-172.4	0	0	107.2	R513 D1130 N1131	R513-E1128 HydrophobicContact CB-CG 4.38Å; R513-E1128 WeakPolarHBondContact CB-OE1 3.4Å; R513-E1128 VanDerWaalsContact CB-OE2 3.3Å; R513-E1128 WeakPolarHBondContact CB-OE2 3.45Å; R513-E1128 PolarHBondContact N-OE1 2.85Å; R513-E1128 VanDerWaalsContact N-OE1 3.07Å; E1128-D1130 PolarHBondContact O-N 3.23Å; E1128-D1130 VanDerWaalsContact O-N 3.13Å; E1128-N1131 PolarHBondContact N-ND2 3.09Å; E1128-N1131 WeakPolarHBondContact O-CB 3.4Å; E1128-N1131 PolarHBondContact O-N 2.76Å; E1128-N1131 PolarHBondContact O-ND2 3.5Å
1129	G	56.2	Low	63.4	Low	26 Å²	26	29.2 Å²	29.2	27%	0.268	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-26	-170.7	0	0	0	0	0	113.9	P1016 N1131	P1016-G1129 WeakPolarHBondContact O-CA 3.39Å; P1016-G1129 PolarHBondContact O-N 2.93Å; G1129-N1131 VanDerWaalsContact C-N 3.27Å; G1129-N1131 PolarHBondContact O-N 2.9Å
1130	D	53.2	Low	62.6	Low	52 Å²	52	26.1 Å²	26.1	28%	0.278	17%	0.167	S	C	.	.	H	α-helix	trans	-71.2	-22.4	175.5	-68.2	-28.3	0	0	0	112.6	N514 S1018 E1128 Q1134	N514-D1130 PolarHBondContact ND2-OD2 3.09Å; S1018-D1130 PolarHBondContact OG-OD1 2.98Å; S1018-D1130 PolarHBondContact OG-OD2 2.93Å; E1128-D1130 PolarHBondContact O-N 3.23Å; E1128-D1130 VanDerWaalsContact O-N 3.13Å; D1130-Q1134 WeakPolarHBondContact O-CB 3.32Å; D1130-Q1134 WeakPolarHBondContact O-CG 3.2Å; D1130-Q1134 PolarHBondContact O-N 3.22Å
1131	N	52	Low	61.1	Low	10 Å²	10	29.8 Å²	29.8	5%	0.053	19%	0.186	C	C	.	.	H	α-helix	trans	-71.6	-54.9	-166.7	-62.1	-17.4	0	0	0	112.9	R513 M995 E1128 G1129 G1133 M1135	R513-N1131 PolarHBondContact NH1-ND2 3.04Å; R513-N1131 PolarHBondContact NH1-OD1 3Å; M995-N1131 HydrophobicContact CE-CB 3.57Å; M995-N1131 HydrophobicContact SD-CB 3.82Å; E1128-N1131 PolarHBondContact N-ND2 3.09Å; E1128-N1131 WeakPolarHBondContact O-CB 3.4Å; E1128-N1131 PolarHBondContact O-N 2.76Å; E1128-N1131 PolarHBondContact O-ND2 3.5Å; G1129-N1131 VanDerWaalsContact C-N 3.27Å; G1129-N1131 PolarHBondContact O-N 2.9Å; N1131-G1133 VanDerWaalsContact C-N 3.35Å; N1131-M1135 VanDerWaalsContact O-CG 3.28Å; N1131-M1135 WeakPolarHBondContact O-CG 3.13Å; N1131-M1135 PolarHBondContact O-N 3.41Å
1132	A	47.1	Very low	58.9	Low	5 Å²	5	31.5 Å²	31.5	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-73.6	-31.8	178.2	0	0	0	0	0	111.5	Y925 L1015 M1135 A1136	Y925-A1132 HydrophobicContact CE1-CB 4.33Å; Y925-A1132 HydrophobicContact CE2-CB 4.36Å; L1015-A1132 HydrophobicContact CD1-CB 3.25Å; A1132-M1135 PolarHBondContact O-N 3.27Å; A1132-A1136 WeakPolarHBondContact O-CB 3.47Å; A1132-A1136 PolarHBondContact O-N 3.26Å
1133	G	48.1	Very low	56.9	Low	36 Å²	36	34.9 Å²	34.9	37%	0.371	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-46.5	174.6	0	0	0	0	0	112.2	N1131 L1137	N1131-G1133 VanDerWaalsContact C-N 3.35Å; G1133-L1137 VanDerWaalsContact O-CB 3.27Å; G1133-L1137 WeakPolarHBondContact O-CB 3.47Å; G1133-L1137 PolarHBondContact O-N 3.09Å
1134	Q	47.4	Very low	54.7	Low	123 Å²	123	42.9 Å²	42.9	58%	0.575	25%	0.247	S	C	*	.	H	α-helix	trans	-69.9	-36.6	177.4	-73.3	178	19.7	0	0	112.5	D1130 L1137 A1138	D1130-Q1134 WeakPolarHBondContact O-CB 3.32Å; D1130-Q1134 WeakPolarHBondContact O-CG 3.2Å; D1130-Q1134 PolarHBondContact O-N 3.22Å; Q1134-L1137 PolarHBondContact O-N 2.96Å; Q1134-A1138 VanDerWaalsContact O-CB 3.3Å; Q1134-A1138 WeakPolarHBondContact O-CB 3.29Å; Q1134-A1138 PolarHBondContact O-N 2.85Å
1135	M	48.9	Very low	52.3	Low	8 Å²	8	50.4 Å²	50.4	4%	0.039	28%	0.28	C	S	.	.	H	α-helix	trans	-68.1	-42.9	174	-72.8	167.9	105.6	0	0	112.7	T981 M995 V997 N1131 A1132 L1137 A1138 G1139	T981-M1135 HydrophobicContact CG2-CE 3.85Å; T981-M1135 HydrophobicContact CG2-CG 3.86Å; T981-M1135 VanDerWaalsContact OG1-CE 3.3Å; T981-M1135 WeakPolarHBondContact OG1-CE 3.44Å; M995-M1135 HydrophobicContact CB-CE 4.19Å; M995-M1135 HydrophobicContact CE-CE 3.93Å; M995-M1135 HydrophobicContact CE-CG 3.66Å; M995-M1135 HydrophobicContact CE-SD 3.03Å; M995-M1135 WeakPolarHBondContact CE-SD 3.21Å; M995-M1135 HydrophobicContact CG-CE 3.52Å; M995-M1135 HydrophobicContact CG-SD 3.66Å; M995-M1135 VanDerWaalsContact O-CE 3.23Å; M995-M1135 WeakPolarHBondContact O-CE 3.32Å; M995-M1135 HydrophobicContact SD-CE 4.03Å; M995-M1135 HydrophobicContact SD-SD 3.3Å; V997-M1135 HydrophobicContact CB-CE 4.22Å; V997-M1135 HydrophobicContact CG2-CB 4.45Å; V997-M1135 HydrophobicContact CG2-CE 3.6Å; V997-M1135 HydrophobicContact CG2-SD 3.62Å; N1131-M1135 VanDerWaalsContact O-CG 3.28Å; N1131-M1135 WeakPolarHBondContact O-CG 3.13Å; N1131-M1135 PolarHBondContact O-N 3.41Å; A1132-M1135 PolarHBondContact O-N 3.27Å; M1135-L1137 PolarHBondContact O-N 3.25Å; M1135-A1138 PolarHBondContact O-N 2.96Å; M1135-G1139 PolarHBondContact O-N 3.34Å
1136	A	45.9	Very low	50.2	Low	21 Å²	21	55.7 Å²	55.7	17%	0.174	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-36.1	175.2	0	0	0	0	0	110.6	A1132 A1140	A1132-A1136 WeakPolarHBondContact O-CB 3.47Å; A1132-A1136 PolarHBondContact O-N 3.26Å; A1136-A1140 VanDerWaalsContact O-CB 3.32Å; A1136-A1140 WeakPolarHBondContact O-CB 3.42Å; A1136-A1140 PolarHBondContact O-N 2.59Å
1137	L	43.6	Very low	48.2	Very low	109 Å²	109	57.3 Å²	57.3	57%	0.571	32%	0.324	S	S	*	.	H	α-helix	trans	-68.4	-42.1	172.7	-166.9	73.7	0	0	0	112.1	G1133 Q1134 M1135 G1139 A1140 L1141	G1133-L1137 VanDerWaalsContact O-CB 3.27Å; G1133-L1137 WeakPolarHBondContact O-CB 3.47Å; G1133-L1137 PolarHBondContact O-N 3.09Å; Q1134-L1137 PolarHBondContact O-N 2.96Å; M1135-L1137 PolarHBondContact O-N 3.25Å; L1137-G1139 VanDerWaalsContact C-N 3.34Å; L1137-A1140 PolarHBondContact O-N 3.17Å; L1137-L1141 HydrophobicContact CG-CD1 4.28Å; L1137-L1141 WeakPolarHBondContact O-CB 3.21Å; L1137-L1141 VanDerWaalsContact O-CG 3.26Å; L1137-L1141 WeakPolarHBondContact O-CG 3.48Å; L1137-L1141 PolarHBondContact O-N 3.48Å
1138	A	36.6	Very low	46.4	Very low	55 Å²	55	62 Å²	62	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-40.4	176	0	0	0	0	0	111.4	Q1134 M1135 L1141 A1142	Q1134-A1138 VanDerWaalsContact O-CB 3.3Å; Q1134-A1138 WeakPolarHBondContact O-CB 3.29Å; Q1134-A1138 PolarHBondContact O-N 2.85Å; M1135-A1138 PolarHBondContact O-N 2.96Å; A1138-L1141 PolarHBondContact O-N 3.34Å; A1138-A1142 WeakPolarHBondContact O-CB 3.33Å; A1138-A1142 PolarHBondContact O-N 3.42Å
1139	G	42.7	Very low	45.1	Very low	2 Å²	2	68.6 Å²	68.6	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-63.1	-45.9	171.8	0	0	0	0	0	112.1	Y979 M1135 L1137 L1141 A1142 E1143	Y979-G1139 VanDerWaalsContact CE1-CA 3.42Å; M1135-G1139 PolarHBondContact O-N 3.34Å; L1137-G1139 VanDerWaalsContact C-N 3.34Å; G1139-L1141 VanDerWaalsContact C-N 3.31Å; G1139-L1141 PolarHBondContact O-N 3.06Å; G1139-A1142 PolarHBondContact O-N 3.23Å; G1139-E1143 WeakPolarHBondContact O-CB 3.47Å; G1139-E1143 WeakPolarHBondContact O-CG 3.41Å; G1139-E1143 PolarHBondContact O-N 2.98Å
1140	A	44.9	Very low	44.4	Very low	49 Å²	49	74 Å²	74	41%	0.405	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-34.4	175.7	0	0	0	0	0	113	A1136 L1137 R1144	A1136-A1140 VanDerWaalsContact O-CB 3.32Å; A1136-A1140 WeakPolarHBondContact O-CB 3.42Å; A1136-A1140 PolarHBondContact O-N 2.59Å; L1137-A1140 PolarHBondContact O-N 3.17Å; A1140-R1144 WeakPolarHBondContact O-CB 3.46Å; A1140-R1144 PolarHBondContact O-N 3.07Å
1141	L	39.6	Very low	43.9	Very low	91 Å²	91	75.3 Å²	75.3	48%	0.476	40%	0.396	S	S	.	.	H	α-helix	trans	-73.4	-37.3	175	-73.7	170	0	0	0	112.1	L1137 A1138 G1139 R1144 K1145	L1137-L1141 HydrophobicContact CG-CD1 4.28Å; L1137-L1141 WeakPolarHBondContact O-CB 3.21Å; L1137-L1141 VanDerWaalsContact O-CG 3.26Å; L1137-L1141 WeakPolarHBondContact O-CG 3.48Å; L1137-L1141 PolarHBondContact O-N 3.48Å; A1138-L1141 PolarHBondContact O-N 3.34Å; G1139-L1141 VanDerWaalsContact C-N 3.31Å; G1139-L1141 PolarHBondContact O-N 3.06Å; L1141-R1144 PolarHBondContact O-N 3.19Å; L1141-K1145 WeakPolarHBondContact O-CG 3.44Å; L1141-K1145 PolarHBondContact O-N 3.25Å
1142	A	38.7	Very low	43.4	Very low	40 Å²	40	81.2 Å²	81.2	33%	0.331	42%	0.422	S	S	.	.	H	α-helix	trans	-66.5	-41.9	173.7	0	0	0	0	0	111.3	A1138 G1139 K1145 N1146	A1138-A1142 WeakPolarHBondContact O-CB 3.33Å; A1138-A1142 PolarHBondContact O-N 3.42Å; G1139-A1142 PolarHBondContact O-N 3.23Å; A1142-K1145 PolarHBondContact O-N 3.36Å; A1142-N1146 WeakPolarHBondContact O-CB 3.41Å; A1142-N1146 PolarHBondContact O-N 3.26Å
1143	E	48.4	Very low	43.2	Very low	71 Å²	71	85.3 Å²	85.3	33%	0.332	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-40	172.4	-77.4	175.3	-170.4	0	0	111.8	Y979 K999 G1139 N1146 A1147	Y979-E1143 PolarHBondContact OH-OE1 3.03Å; K999-E1143 VanDerWaalsContact CD-OE1 3.28Å; K999-E1143 WeakPolarHBondContact CD-OE1 3.13Å; K999-E1143 WeakPolarHBondContact CE-OE1 3.49Å; K999-E1143 IonicContact NZ-OE1 3.27Å; K999-E1143 PolarHBondContact NZ-OE1 3.11Å; K999-E1143 IonicContact NZ-OE2 2.93Å; K999-E1143 PolarHBondContact NZ-OE2 3.11Å; G1139-E1143 WeakPolarHBondContact O-CB 3.47Å; G1139-E1143 WeakPolarHBondContact O-CG 3.41Å; G1139-E1143 PolarHBondContact O-N 2.98Å; E1143-N1146 PolarHBondContact O-N 3.4Å; E1143-A1147 WeakPolarHBondContact O-CB 3.44Å; E1143-A1147 PolarHBondContact O-N 2.8Å
1144	R	44.7	Very low	43.1	Very low	169 Å²	169	88.6 Å²	88.6	64%	0.638	45%	0.446	S	S	*	.	H	α-helix	trans	-62	-45.8	172	-105.1	-177.3	178.4	174.4	0.8	112.3	A1140 L1141 N1146 A1147 D1148	A1140-R1144 WeakPolarHBondContact O-CB 3.46Å; A1140-R1144 PolarHBondContact O-N 3.07Å; L1141-R1144 PolarHBondContact O-N 3.19Å; R1144-N1146 VanDerWaalsContact C-N 3.32Å; R1144-N1146 PolarHBondContact O-N 3.06Å; R1144-A1147 PolarHBondContact O-N 3.04Å; R1144-D1148 VanDerWaalsContact O-CB 3.24Å; R1144-D1148 WeakPolarHBondContact O-CB 3.13Å; R1144-D1148 PolarHBondContact O-N 2.91Å
1145	K	40.4	Very low	42.9	Very low	159 Å²	159	91.4 Å²	91.4	69%	0.691	45%	0.451	S	S	*	.	H	α-helix	trans	-63.4	-38.2	177.2	-78.6	-175	176.8	-176.5	0	112.3	L1141 A1142 R1149	L1141-K1145 WeakPolarHBondContact O-CG 3.44Å; L1141-K1145 PolarHBondContact O-N 3.25Å; A1142-K1145 PolarHBondContact O-N 3.36Å; K1145-R1149 WeakPolarHBondContact O-CB 3.24Å; K1145-R1149 PolarHBondContact O-N 2.86Å
1146	N	42.9	Very low	42.4	Very low	111 Å²	111	96.5 Å²	96.5	59%	0.594	48%	0.478	S	S	*	.	H	α-helix	trans	-71.2	-40.2	175.3	-82.3	-15.9	0	0	0	111.9	A1142 E1143 R1144 R1149 F1150	A1142-N1146 WeakPolarHBondContact O-CB 3.41Å; A1142-N1146 PolarHBondContact O-N 3.26Å; E1143-N1146 PolarHBondContact O-N 3.4Å; R1144-N1146 VanDerWaalsContact C-N 3.32Å; R1144-N1146 PolarHBondContact O-N 3.06Å; N1146-R1149 PolarHBondContact O-N 3.16Å; N1146-F1150 VanDerWaalsContact O-CB 3.31Å; N1146-F1150 WeakPolarHBondContact O-CB 3.47Å; N1146-F1150 PolarHBondContact O-N 3.04Å
1147	A	43.7	Very low	42.4	Very low	47 Å²	47	102.5 Å²	102.5	39%	0.388	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-38.7	175.2	0	0	0	0	0	112.1	E1143 R1144 F1150 N1151	E1143-A1147 WeakPolarHBondContact O-CB 3.44Å; E1143-A1147 PolarHBondContact O-N 2.8Å; R1144-A1147 PolarHBondContact O-N 3.04Å; A1147-F1150 PolarHBondContact O-N 3.08Å; A1147-N1151 VanDerWaalsContact O-CB 3.25Å; A1147-N1151 WeakPolarHBondContact O-CB 3.25Å; A1147-N1151 VanDerWaalsContact O-CG 3.3Å; A1147-N1151 PolarHBondContact O-N 3.15Å; A1147-N1151 PolarHBondContact O-ND2 2.87Å; A1147-N1151 VanDerWaalsContact O-ND2 3.11Å
1148	D	42.3	Very low	42.5	Very low	100 Å²	100	101.4 Å²	101.4	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-68.9	-38.5	174.8	-71.8	-24.1	0	0	0	110.7	R1144 N1151 F1152	R1144-D1148 VanDerWaalsContact O-CB 3.24Å; R1144-D1148 WeakPolarHBondContact O-CB 3.13Å; R1144-D1148 PolarHBondContact O-N 2.91Å; D1148-N1151 PolarHBondContact O-N 3.47Å; D1148-F1152 WeakPolarHBondContact O-CB 3.05Å; D1148-F1152 PolarHBondContact O-N 3.39Å
1149	R	39.1	Very low	42.3	Very low	157 Å²	157	103.1 Å²	103.1	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-67.2	-40.3	172.5	-173.8	174.6	171.7	179.7	-2.5	112.1	K1145 N1146 F1152 E1153	K1145-R1149 WeakPolarHBondContact O-CB 3.24Å; K1145-R1149 PolarHBondContact O-N 2.86Å; N1146-R1149 PolarHBondContact O-N 3.16Å; R1149-F1152 PolarHBondContact O-N 3.39Å; R1149-E1153 IonicContact CZ-OE1 2.72Å; R1149-E1153 IonicContact NE-OE1 3.91Å; R1149-E1153 PolarHBondContact NE-OE1 2.92Å; R1149-E1153 IonicContact NH2-OE1 3.92Å; R1149-E1153 WeakPolarHBondContact O-CB 3.09Å; R1149-E1153 WeakPolarHBondContact O-CG 3.21Å; R1149-E1153 PolarHBondContact O-N 2.58Å
1150	F	41.4	Very low	41.9	Very low	138 Å²	138	108 Å²	108	61%	0.605	55%	0.547	S	S	*	.	H	α-helix	trans	-68.1	-38.4	176.2	-142.3	-90.2	0	0	0	111.4	N1146 A1147 Q1154	N1146-F1150 VanDerWaalsContact O-CB 3.31Å; N1146-F1150 WeakPolarHBondContact O-CB 3.47Å; N1146-F1150 PolarHBondContact O-N 3.04Å; A1147-F1150 PolarHBondContact O-N 3.08Å; F1150-Q1154 HydrophobicContact CD1-CG 4.23Å; F1150-Q1154 HydrophobicContact CE1-CG 4.43Å; F1150-Q1154 VanDerWaalsContact O-CB 3.25Å; F1150-Q1154 WeakPolarHBondContact O-CB 3.34Å; F1150-Q1154 WeakPolarHBondContact O-CG 3.3Å; F1150-Q1154 PolarHBondContact O-N 3.26Å
1151	N	44.7	Very low	41.5	Very low	80 Å²	80	112.8 Å²	112.8	43%	0.428	57%	0.565	S	S	.	*	H	α-helix	trans	-70.3	-33.9	172.9	-79.8	-40.9	0	0	0	112.4	A1147 D1148 R1155	A1147-N1151 VanDerWaalsContact O-CB 3.25Å; A1147-N1151 WeakPolarHBondContact O-CB 3.25Å; A1147-N1151 VanDerWaalsContact O-CG 3.3Å; A1147-N1151 PolarHBondContact O-N 3.15Å; A1147-N1151 PolarHBondContact O-ND2 2.87Å; A1147-N1151 VanDerWaalsContact O-ND2 3.11Å; D1148-N1151 PolarHBondContact O-N 3.47Å; N1151-R1155 VanDerWaalsContact O-CB 3.29Å; N1151-R1155 WeakPolarHBondContact O-CB 3.4Å; N1151-R1155 VanDerWaalsContact O-CG 3.28Å; N1151-R1155 WeakPolarHBondContact O-CG 3.48Å; N1151-R1155 PolarHBondContact O-N 3.11Å
1152	F	41.3	Very low	41.1	Very low	135 Å²	135	117.7 Å²	117.7	59%	0.592	59%	0.588	S	S	*	*	H	α-helix	trans	-71.3	-42.7	175.4	-168.7	-102	0	0	0	111	D1148 R1149 R1155 L1156	D1148-F1152 WeakPolarHBondContact O-CB 3.05Å; D1148-F1152 PolarHBondContact O-N 3.39Å; R1149-F1152 PolarHBondContact O-N 3.39Å; F1152-R1155 PolarHBondContact O-N 3.32Å; F1152-L1156 HydrophobicContact CD1-CD1 3.57Å; F1152-L1156 HydrophobicContact CD1-CG 4.41Å; F1152-L1156 HydrophobicContact CE1-CD1 3.36Å; F1152-L1156 HydrophobicContact CE1-CG 4.25Å; F1152-L1156 HydrophobicContact CG-CD1 4.45Å; F1152-L1156 HydrophobicContact CZ-CD1 4.09Å; F1152-L1156 WeakPolarHBondContact O-CB 3.37Å; F1152-L1156 WeakPolarHBondContact O-CG 3.48Å; F1152-L1156 PolarHBondContact O-N 2.93Å
1153	E	42.4	Very low	41	Very low	91 Å²	91	123.8 Å²	123.8	43%	0.425	61%	0.61	S	S	.	*	H	α-helix	trans	-67.6	-39	172.9	-72.6	-171	-163.6	0	0	111.6	R1149 R1155 L1156 I1157	R1149-E1153 IonicContact CZ-OE1 2.72Å; R1149-E1153 IonicContact NE-OE1 3.91Å; R1149-E1153 PolarHBondContact NE-OE1 2.92Å; R1149-E1153 IonicContact NH2-OE1 3.92Å; R1149-E1153 WeakPolarHBondContact O-CB 3.09Å; R1149-E1153 WeakPolarHBondContact O-CG 3.21Å; R1149-E1153 PolarHBondContact O-N 2.58Å; E1153-R1155 PolarHBondContact O-N 2.95Å; E1153-L1156 PolarHBondContact O-N 3.23Å; E1153-I1157 WeakPolarHBondContact O-CB 3.15Å; E1153-I1157 WeakPolarHBondContact O-CD1 3.06Å; E1153-I1157 WeakPolarHBondContact O-CG1 3.25Å; E1153-I1157 PolarHBondContact O-N 3.06Å
1154	Q	44.9	Very low	40.2	Very low	105 Å²	105	127.7 Å²	127.7	49%	0.491	63%	0.63	S	S	.	*	H	α-helix	trans	-67.5	-33.3	172.5	-80.9	-174.9	-24.6	0	0	113.3	F1150 I1157 S1158	F1150-Q1154 HydrophobicContact CD1-CG 4.23Å; F1150-Q1154 HydrophobicContact CE1-CG 4.43Å; F1150-Q1154 VanDerWaalsContact O-CB 3.25Å; F1150-Q1154 WeakPolarHBondContact O-CB 3.34Å; F1150-Q1154 WeakPolarHBondContact O-CG 3.3Å; F1150-Q1154 PolarHBondContact O-N 3.26Å; Q1154-I1157 PolarHBondContact O-N 2.99Å; Q1154-S1158 WeakPolarHBondContact O-CB 3.45Å; Q1154-S1158 PolarHBondContact O-N 2.93Å; Q1154-S1158 VanDerWaalsContact O-N 3.15Å; Q1154-S1158 PolarHBondContact O-OG 3.04Å
1155	R	43.8	Very low	39.7	Very low	181 Å²	181	127.1 Å²	127.1	68%	0.683	64%	0.639	S	S	*	*	H	α-helix	trans	-72.3	-34.9	173.3	-80.1	-177.9	-166.4	-174.7	4.6	112.8	N1151 F1152 E1153 I1157 S1158 S1159	N1151-R1155 VanDerWaalsContact O-CB 3.29Å; N1151-R1155 WeakPolarHBondContact O-CB 3.4Å; N1151-R1155 VanDerWaalsContact O-CG 3.28Å; N1151-R1155 WeakPolarHBondContact O-CG 3.48Å; N1151-R1155 PolarHBondContact O-N 3.11Å; F1152-R1155 PolarHBondContact O-N 3.32Å; E1153-R1155 PolarHBondContact O-N 2.95Å; R1155-I1157 VanDerWaalsContact C-N 3.3Å; R1155-S1158 WeakPolarHBondContact CA-OG 3.19Å; R1155-S1158 PolarHBondContact O-N 2.74Å; R1155-S1159 PolarHBondContact O-N 3.23Å; R1155-S1159 PolarHBondContact O-OG 3.22Å
1156	L	39.7	Very low	39.3	Very low	115 Å²	115	128.3 Å²	128.3	60%	0.602	65%	0.647	S	S	*	*	H	α-helix	trans	-69.5	-27.8	172.5	-77.4	168.6	0	0	0	112.5	F1152 E1153	F1152-L1156 HydrophobicContact CD1-CD1 3.57Å; F1152-L1156 HydrophobicContact CD1-CG 4.41Å; F1152-L1156 HydrophobicContact CE1-CD1 3.36Å; F1152-L1156 HydrophobicContact CE1-CG 4.25Å; F1152-L1156 HydrophobicContact CG-CD1 4.45Å; F1152-L1156 HydrophobicContact CZ-CD1 4.09Å; F1152-L1156 WeakPolarHBondContact O-CB 3.37Å; F1152-L1156 WeakPolarHBondContact O-CG 3.48Å; F1152-L1156 PolarHBondContact O-N 2.93Å; E1153-L1156 PolarHBondContact O-N 3.23Å
1157	I	45.4	Very low	38.9	Very low	147 Å²	147	126.2 Å²	126.2	75%	0.754	65%	0.652	S	S	*	*	H	α-helix	trans	-84.7	-11.6	175.3	-64.1	163.4	0	0	0	112	E1153 Q1154 R1155	E1153-I1157 WeakPolarHBondContact O-CB 3.15Å; E1153-I1157 WeakPolarHBondContact O-CD1 3.06Å; E1153-I1157 WeakPolarHBondContact O-CG1 3.25Å; E1153-I1157 PolarHBondContact O-N 3.06Å; Q1154-I1157 PolarHBondContact O-N 2.99Å; R1155-I1157 VanDerWaalsContact C-N 3.3Å
1158	S	44.6	Very low	38.4	Very low	86 Å²	86	130.4 Å²	130.4	60%	0.601	67%	0.673	S	S	*	*	H	α-helix	trans	-117.4	7	-175.7	55.9	0	0	0	0	116.1	Q1154 R1155	Q1154-S1158 WeakPolarHBondContact O-CB 3.45Å; Q1154-S1158 PolarHBondContact O-N 2.93Å; Q1154-S1158 VanDerWaalsContact O-N 3.15Å; Q1154-S1158 PolarHBondContact O-OG 3.04Å; R1155-S1158 WeakPolarHBondContact CA-OG 3.19Å; R1155-S1158 PolarHBondContact O-N 2.74Å
1159	S	33.8	Very low	38	Very low	92 Å²	92	131.4 Å²	131.4	64%	0.643	68%	0.682	S	S	*	*			trans	-112.1	114	170.3	-64.8	0	0	0	0	110.8	R1155	R1155-S1159 PolarHBondContact O-N 3.23Å; R1155-S1159 PolarHBondContact O-OG 3.22Å
1160	P	33	Very low	37.7	Very low	105 Å²	105	130.9 Å²	130.9	68%	0.682	69%	0.69	S	S	*	*			trans	-77.3	150.7	162.2	33.5	-27.6	0	0	0	109
1161	D	36.3	Very low	37.3	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	72%	0.722	S	S	*	*			trans	77.7	91.4	169.5	-48.1	-30.7	0	0	0	117.7
1162	M	32.3	Very low	37	Very low	194 Å²	194	138.7 Å²	138.7	96%	0.956	74%	0.736	S	S	*	*				-176.4	120.7	119	-110.3	-176.6	-77	0	0	113.1
1163	E	35.9	Very low	36.7	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	74%	0.744	S	S	*	*			trans	-65.5	150.3	165.7	-82.6	-179.7	130.1	0	0	113.4
1164	M	32	Very low	36.4	Very low	153 Å²	153	141.5 Å²	141.5	75%	0.754	76%	0.762	S	S	*	*			trans	50.5	113	144.6	-63.5	-158.8	-55.6	0	0	119.4
1165	L	34.1	Very low	35.9	Very low	156 Å²	156	143.6 Å²	143.6	82%	0.817	78%	0.778	S	S	*	*				177.9	150.5	101.6	-94.8	159	0	0	0	112.1
1166	E	33	Very low	35.4	Very low	184 Å²	184	141.3 Å²	141.3	86%	0.86	78%	0.783	S	S	*	*			trans	-59.6	158.7	-172.4	-60.7	166.7	128.7	0	0	115.3
1167	G	33.5	Very low	35.2	Very low	68 Å²	68	143.1 Å²	143.1	70%	0.701	80%	0.796	S	S	*	*			trans	122.4	136.3	135	0	0	0	0	0	115.6
1168	T	33.6	Very low	34.4	Very low	134 Å²	134	142.8 Å²	142.8	82%	0.822	80%	0.799	S	S	*	*			trans	96.9	83.1	161.3	-11.9	0	0	0	0	117.5
1169	T	33.3	Very low	33.6	Very low	121 Å²	121	147.2 Å²	147.2	74%	0.742	81%	0.814	S	S	*	*				51.3	134.2	117.2	-29.6	0	0	0	0	120.4
1170	I	32.2	Very low	33.6	Very low	147 Å²	147	151.8 Å²	151.8	75%	0.754	83%	0.828	S	S	*	*			trans	95.1	89.7	152.2	-39.1	177.6	0	0	0	116.5
1171	L	34.5	Very low	33.7	Very low	242 Å²	242	156 Å²	156	100%	1.267	84%	0.841	S	S	*	*				-171.1	0	114.1	-99.9	164.4	0	0	0	112.2

Retrieved 1,171 of 1,171 residues in 4157.2 ms (Link to these results)

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