A0A077Z3X9_TRITR Loading...

1-phosphatidylinositol-3-phosphate 5-kinase

AlphaFold DB , UniProt , Accession A0A077Z3X9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,475 aa.

						>A0A077Z3X9_TRITR|A0A077Z3X9
MIGSGKTAVSNDESSLRIQHAHHSGSSLPPFEGEAEDQREAGAANDNLADYNRSNFRQCWMPDSRGKVCYECREKFTTFRRKHHCRICGQIFCSRCCSLEVSGRLFGYTTDLRVCNFCHNMVRNNRLTTRTGNPNSGKSKKDLFRSVPDMGTPFSGFASDSNASYSAEALLKRDIVSKREHSAPLANASSLDDDGDSCLIEESAADGHFENFVDDPEPEWLREIQAADLNVDFLNHYSILSSSTPDQVARSSREDLDGVGGGKFDVQVQVSQNQPATTDGRGSGDASPLPLVRSPRAHPLAPSPLRPIVADTMHIFLEKLGRQLEYLLHIEDVPFDPWRDIIMQLAEQVAFTVQPETKTNGDDMSILSYVHVKTIRRCLQPSADLVYGTVCTKGVLRQHMLQRIRLPKILMIQGPIEYERTKGKFCSIDAIIMQESYHLRQVVHKVLAHQPDILIVEDSVASTAQELFSQSGLTVLHNVKRSAIQRIARCTRCDVVHSVEFKSRMGRCGLFRTEQVTLLDGSTKMLCRFEDCPPQLGCTILLSGPCKWQLYVVKKILKHLIASIYSARLEVEMLDSLQAVSVKESATFEHVSCRTCLTMLEEGSCGNESAGFPRDLIKCSPFIHPFPSKKRPSSSVVSWAEFCNDCTNPEFVSRKRLSLPLHPFIVQPLKRKANHLDTRRLLADYRAQGGKLLTKSFKSQCSNNTQSTAGALKALEGQMWFTNWRHPFAYCRFTALLSSYLLKSGVPSRYCINPHTFSVKLYGPTDLPLGVYLEDYCLDADCQCPREGCEEKMVNHIRRFVLGSTSVEVSVHAMGVPPNSLSEESGSGNQIVLWSWCRHCKASTSERKMTQQFWQLSFATFLDYLFHGVRLSSVLAEETCDHCLFHDHVQFFARQNTLVSFRCQPISLFSTSFASLSLADEQERVTEEEFLSEVELVEQKADYLFNQMLKSVAIIVAQCETVGCAQQIANLVSELQSVHESAQRSFVDEMERLRAVVATLKKDENGFSRLQSKWREVEDSLVICHRILAAQMFAWNCIVCDFVACPLKSRWSDREADSTGKFVPDDLNGSAFDKNHNGSTSEDIPTRKQLSEELKAMQKVVAAAQLNSPFIPEQHFCLPIGKVPVAVDERQPGTIIAYALATNEYQDFVDSLGMDSEDIQSLLKEAASSSSSPEGKACLSESTTIPLEVQFSDSAAQFYCKMYFPKLFLALRTLLFPFDESTFVRSLASCERWQPTGGKSGAKFFRTRDRRFILKQMSHFELQSFVRFAPQYFAHVAASANLNGEEKSVSSLVKIFGAYRIGFKNSQTNAAFKTDLIVMEYLFYGRDVRQVYDLKGSQRNRHTSERLKQSTSTDLVLLDQNLMEKVCLESFYLNSASKAKLDEAIRNDTVFLSANHIMDYSLLMGVDQGNSVLLLGIIDYLRAYTWDKRIESWVKSVSVSGQLPTVVSPELYRLRFVESMDIYFPASPDRSGNVY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.4	Very low	31.2	Very low	233 Å²	233	134.5 Å²	134.5	100%	1.148	82%	0.823	S	S	*	*				0	108.7	0	-56.1	171.1	-173.4	0	0	105
2	I	31.1	Very low	31.1	Very low	177 Å²	177	135.4 Å²	135.4	91%	0.908	82%	0.819	S	S	*	*			cis	77.9	116.5	48.7	-57.3	176.9	0	0	0	112.3
3	G	29.2	Very low	31.1	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	82%	0.821	S	S	*	*			trans	97.3	111.3	176.4	0	0	0	0	0	113.7
4	S	32.8	Very low	31.2	Very low	132 Å²	132	137.1 Å²	137.1	92%	0.923	82%	0.819	S	S	*	*			cis	94.4	105.3	2.3	-41	0	0	0	0	118.9
5	G	32	Very low	31.2	Very low	68 Å²	68	135 Å²	135	70%	0.701	81%	0.814	S	S	*	*			trans	172.5	107.3	164.6	0	0	0	0	0	111.3
6	K	32.8	Very low	31.1	Very low	211 Å²	211	137.9 Å²	137.9	92%	0.917	82%	0.822	S	S	*	*				67	134.3	88.5	-68.9	179.2	-179.9	-178.9	0	113.7
7	T	33.2	Very low	31	Very low	131 Å²	131	140.9 Å²	140.9	80%	0.804	82%	0.816	S	S	*	*			cis	-120.7	-170.6	5.7	55.9	0	0	0	0	110.8
8	A	30.6	Very low	31	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	82%	0.818	S	S	*	*			cis	74.1	146.5	17.1	0	0	0	0	0	116.2
9	V	31.3	Very low	30.8	Very low	141 Å²	141	140.5 Å²	140.5	86%	0.855	80%	0.801	S	S	*	*			cis	-134.9	-175.5	11.7	-173.2	0	0	0	0	110.3
10	S	27.8	Very low	30.8	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	80%	0.798	S	S	*	*			trans	-113.5	-175.8	-174.5	58.6	0	0	0	0	115.8
11	N	31.9	Very low	30.7	Very low	143 Å²	143	137.9 Å²	137.9	77%	0.765	79%	0.786	S	S	*	*			trans	105.8	150.6	161.5	-59.4	14.8	0	0	0	116.8
12	D	30.6	Very low	30.7	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	77%	0.767	S	S	*	*			cis	-167	176.8	-36.7	-148.4	-25.4	0	0	0	109.4
13	E	30.7	Very low	30.7	Very low	180 Å²	180	133.6 Å²	133.6	84%	0.841	76%	0.759	S	S	*	*			trans	68.5	152.7	173.5	-54.8	-159.5	125.3	0	0	117
14	S	32.8	Very low	30.7	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	76%	0.764	S	S	*	*			cis	-137.1	157.6	12.2	61.6	0	0	0	0	114.1
15	S	30.5	Very low	30.4	Very low	105 Å²	105	133 Å²	133	73%	0.734	76%	0.756	S	S	*	*			trans	-84.3	162	-164.3	-39.3	0	0	0	0	117
16	L	30	Very low	30.3	Very low	181 Å²	181	135.3 Å²	135.3	95%	0.948	76%	0.762	S	S	*	*			trans	-143.6	146.6	135.5	-107.9	172.3	0	0	0	110.6
17	R	28.7	Very low	30.2	Very low	190 Å²	190	130.5 Å²	130.5	72%	0.717	76%	0.755	S	S	*	*			trans	-116.2	138.2	-162.7	-73.1	175.1	157.6	152.8	-1.9	115.3	Q19	R17-Q19 VanDerWaalsContact CG-OE1 3.31Å
18	I	31.3	Very low	29.7	Very low	165 Å²	165	132 Å²	132	85%	0.846	76%	0.757	S	S	*	*			trans	-157.8	123.3	140.7	-67	-164	0	0	0	104.9
19	Q	28.2	Very low	30.4	Very low	109 Å²	109	133.5 Å²	133.5	51%	0.509	76%	0.76	S	S	.	*			cis	62.9	109.9	3.3	-70.6	-173.5	-103.6	0	0	114.7	R17	R17-Q19 VanDerWaalsContact CG-OE1 3.31Å
20	H	29.8	Very low	30.3	Very low	157 Å²	157	132.6 Å²	132.6	73%	0.727	76%	0.757	S	S	*	*			cis	-159.6	180	26.1	-99.3	-72	0	0	0	109.4
21	A	29.8	Very low	30.1	Very low	68 Å²	68	137.8 Å²	137.8	56%	0.562	77%	0.768	S	S	*	*			cis	-168.4	155.8	2.1	0	0	0	0	0	112.1
22	H	29.2	Very low	30	Very low	161 Å²	161	140.1 Å²	140.1	75%	0.745	77%	0.774	S	S	*	*			trans	53.9	156.6	147.8	-59.9	-58.1	0	0	0	121.1
23	H	32.4	Very low	29.8	Very low	160 Å²	160	136.6 Å²	136.6	74%	0.741	77%	0.772	S	S	*	*			cis	-145.1	134.7	14.3	-126.5	-64.2	0	0	0	113.6
24	S	27.7	Very low	29.6	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	78%	0.777	S	S	*	*			trans	13.5	135.1	150.7	56.4	0	0	0	0	123.8
25	G	28.4	Very low	29.4	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	77%	0.773	S	S	*	*			trans	178.5	102.2	155.6	0	0	0	0	0	116.5
26	S	29.9	Very low	29.2	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	78%	0.777	S	S	*	*			trans	-4.5	151.5	157.7	54.1	0	0	0	0	121.5
27	S	29.6	Very low	29.2	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	77%	0.77	S	S	*	*			cis	-175.8	161.4	-7.5	47.9	0	0	0	0	110.2
28	L	22.5	Very low	29.3	Very low	164 Å²	164	137 Å²	137	86%	0.859	77%	0.773	S	S	*	*			trans	-96.7	-176.8	167.1	-75.2	168.4	0	0	0	110.9
29	P	45.2	Very low	29.1	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	78%	0.776	S	S	*	*				-99	-161	-119.8	31	-6.9	0	0	0	112.8
30	P	30	Very low	29.2	Very low	122 Å²	122	144.9 Å²	144.9	79%	0.792	80%	0.795	S	S	*	*				-148.4	-173.8	101.4	41.4	-25.6	0	0	0	115.9
31	F	23.3	Very low	28.9	Very low	203 Å²	203	142.1 Å²	142.1	89%	0.89	80%	0.8	S	S	*	*			trans	-83.9	152	169.1	-113.4	-115.9	0	0	0	112.1
32	E	29.5	Very low	28.7	Very low	192 Å²	192	143.1 Å²	143.1	90%	0.897	82%	0.817	S	S	*	*			trans	-169.3	142.4	152.4	-99.7	157.6	-152.6	0	0	103.9
33	G	25.8	Very low	28.6	Very low	71 Å²	71	140.2 Å²	140.2	73%	0.732	82%	0.821	S	S	*	*			cis	108.6	122.7	36.2	0	0	0	0	0	107.7
34	E	27.5	Very low	28.5	Very low	201 Å²	201	137 Å²	137	94%	0.939	82%	0.822	S	S	*	*			cis	-149.5	-173.6	2.8	-66.6	-174.5	117.7	0	0	111.7
35	A	27.3	Very low	28.7	Very low	88 Å²	88	138.9 Å²	138.9	73%	0.727	82%	0.824	S	S	*	*			trans	-67.7	-176.9	173.9	0	0	0	0	0	113.1
36	E	28.1	Very low	29.5	Very low	173 Å²	173	139.5 Å²	139.5	81%	0.808	81%	0.809	S	S	*	*			cis	-165.2	164.5	-15.8	-125.4	176.9	161.9	0	0	107.6
37	D	29.1	Very low	30.7	Very low	150 Å²	150	140.2 Å²	140.2	80%	0.802	80%	0.804	S	S	*	*				-173.2	154.5	129.9	-147.8	-18.2	0	0	0	111.2
38	Q	30.5	Very low	31.7	Very low	166 Å²	166	136.7 Å²	136.7	78%	0.776	78%	0.776	S	S	*	*			trans	-134.2	130	172.6	-67.6	-171.2	42.5	0	0	112
39	R	27	Very low	33.7	Very low	243 Å²	243	131.3 Å²	131.3	92%	0.917	76%	0.755	S	S	*	*			trans	-139.1	154	153.5	-72.2	-160.5	178.7	-155	-2.6	112.2
40	E	29.7	Very low	35	Very low	197 Å²	197	128.4 Å²	128.4	92%	0.921	73%	0.733	S	S	*	*			trans	-78.9	133.6	-159.3	-54.4	163.4	103.4	0	0	114.2
41	A	24.2	Very low	37.1	Very low	100 Å²	100	122.9 Å²	122.9	83%	0.826	70%	0.697	S	S	*	*			trans	-168.3	92	148	0	0	0	0	0	112.4
42	G	25.4	Very low	39.2	Very low	89 Å²	89	116.7 Å²	116.7	92%	0.918	67%	0.673	S	S	*	*			trans	38.2	94.3	155	0	0	0	0	0	120.1
43	A	27.8	Very low	40.9	Very low	99 Å²	99	118 Å²	118	82%	0.818	67%	0.67	S	S	*	*			trans	-135	141.9	157.3	0	0	0	0	0	110.6
44	A	30.8	Very low	42.8	Very low	93 Å²	93	115.6 Å²	115.6	77%	0.769	64%	0.641	S	S	*	*			trans	-70.6	139.1	174.1	0	0	0	0	0	110.4	D46	A44-D46 VanDerWaalsContact C-N 3.29Å; A44-D46 PolarHBondContact O-N 3.18Å
45	N	31.5	Very low	44	Very low	150 Å²	150	111.5 Å²	111.5	80%	0.802	63%	0.626	S	S	*	*			trans	-72.5	81.4	-179.7	-167.4	-1.5	0	0	0	111	N47	N45-N47 PolarHBondContact O-N 3.43Å; N45-N47 VanDerWaalsContact O-N 3.11Å
46	D	45.3	Very low	45.3	Very low	87 Å²	87	112 Å²	112	47%	0.465	61%	0.612	S	S	.	*			trans	-80.5	91.8	-175.1	-158.4	6.8	0	0	0	109.8	A44 L48	A44-D46 VanDerWaalsContact C-N 3.29Å; A44-D46 PolarHBondContact O-N 3.18Å; D46-L48 VanDerWaalsContact C-N 3.34Å; D46-L48 HydrophobicContact CB-CD1 4.23Å; D46-L48 HydrophobicContact CB-CG 4.19Å; D46-L48 WeakPolarHBondContact O-CG 3.28Å; D46-L48 PolarHBondContact O-N 3.36Å
47	N	53.8	Low	46.8	Very low	132 Å²	132	109.1 Å²	109.1	71%	0.706	59%	0.594	S	S	*	*			trans	-61.7	93.1	174.9	-103.7	-39.4	0	0	0	110.2	N45 K140	N45-N47 PolarHBondContact O-N 3.43Å; N45-N47 VanDerWaalsContact O-N 3.11Å; N47-K140 PolarHBondContact O-NZ 3.1Å
48	L	51	Low	48.1	Very low	36 Å²	36	108.4 Å²	108.4	19%	0.188	59%	0.585	C	S	.	*			trans	-120.3	130.9	-177.7	-64.2	174.2	0	0	0	109.6	D46 R104 G107 T109	D46-L48 VanDerWaalsContact C-N 3.34Å; D46-L48 HydrophobicContact CB-CD1 4.23Å; D46-L48 HydrophobicContact CB-CG 4.19Å; D46-L48 WeakPolarHBondContact O-CG 3.28Å; D46-L48 PolarHBondContact O-N 3.36Å; L48-R104 HydrophobicContact CD1-CB 4.41Å; L48-R104 HydrophobicContact CD1-CG 3.84Å; L48-G107 CarbonylContact C-O 3.59Å; L48-G107 WeakPolarHBondContact CA-O 3.43Å; L48-G107 VanDerWaalsContact CD2-C 3.46Å; L48-T109 HydrophobicContact CB-CG2 3.88Å; L48-T109 WeakPolarHBondContact O-CG2 3.44Å
49	A	64.8	Low	49	Very low	51 Å²	51	104.9 Å²	104.9	42%	0.421	58%	0.578	S	S	.	*	B	Isolated β-bridge	trans	-89.4	158.2	-178.3	0	0	0	0	0	112.9	Y51 G107 Y108 T109	A49-Y51 PolarHBondContact O-N 2.84Å; A49-G107 PolarHBondContact N-O 3.24Å; A49-Y108 HydrophobicContact CB-CD1 4.08Å; A49-Y108 HydrophobicContact CB-CE1 4.32Å; A49-Y108 CarbonylContact O-C 3.53Å; A49-Y108 WeakPolarHBondContact O-CA 3.28Å; A49-T109 PolarHBondContact O-N 3.34Å; A49-T109 PolarHBondContact O-OG1 3.44Å
50	D	73.4	Confident	51.1	Low	53 Å²	53	95.4 Å²	95.4	28%	0.283	54%	0.542	S	S	.	.			trans	-70	119.9	161.4	171.8	19.5	0	0	0	109.5	N52 R53	D50-N52 PolarHBondContact O-N 2.92Å; D50-N52 WeakPolarHBondContact OD1-CB 3.45Å; D50-N52 PolarHBondContact OD1-N 3.05Å; D50-N52 PolarHBondContact OD1-ND2 2.86Å; D50-R53 HydrophobicContact CB-CG 4.39Å; D50-R53 PolarHBondContact O-N 2.81Å; D50-R53 VanDerWaalsContact O-N 3.15Å; D50-R53 WeakPolarHBondContact OD2-CG 3.31Å; D50-R53 IonicContact OD2-NE 2.75Å
51	Y	73.6	Confident	52.5	Low	7 Å²	7	88.6 Å²	88.6	3%	0.027	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-57.4	-33.2	177.1	-176.7	-78.4	0	0	0	112	A49 R53 S54 F56 W60 R86 Y108 L112	A49-Y51 PolarHBondContact O-N 2.84Å; Y51-R53 PolarHBondContact O-N 3.32Å; Y51-S54 VanDerWaalsContact O-CB 3.3Å; Y51-S54 WeakPolarHBondContact O-CB 3.19Å; Y51-S54 PolarHBondContact O-N 3.41Å; Y51-S54 PolarHBondContact O-OG 2.92Å; Y51-F56 HydrophobicContact CE2-CB 4.43Å; Y51-W60 AromaticContact CE1-CZ2 3.63Å; Y51-W60 HydrophobicContact CE1-CZ2 3.63Å; Y51-W60 PolarHBondContact OH-NE1 3.17Å; Y51-R86 HydrophobicContact CD1-CG 4.36Å; Y51-R86 HydrophobicContact CE1-CB 4.4Å; Y51-R86 HydrophobicContact CE1-CG 3.85Å; Y51-R86 HydrophobicContact CE2-CB 4.07Å; Y51-R86 HydrophobicContact CE2-CG 4.31Å; Y51-R86 WeakPolarHBondContact OH-CA 3.22Å; Y51-R86 PolarHBondContact OH-O 3.01Å; Y51-Y108 HydrophobicContact CD2-CD1 4.16Å; Y51-Y108 AromaticContact CD2-CD2 3.76Å; Y51-Y108 HydrophobicContact CD2-CD2 3.76Å; Y51-Y108 HydrophobicContact CD2-CE1 4.21Å; Y51-Y108 AromaticContact CD2-CE2 3.81Å; Y51-Y108 HydrophobicContact CD2-CE2 3.81Å; Y51-Y108 AromaticContact CD2-CG 3.94Å; Y51-Y108 HydrophobicContact CD2-CG 3.94Å; Y51-Y108 HydrophobicContact CE2-CE2 4.27Å; Y51-Y108 HydrophobicContact CG-CD1 4.48Å; Y51-Y108 HydrophobicContact CG-CG 4.47Å; Y51-L112 HydrophobicContact CD1-CD2 4.39Å; Y51-L112 HydrophobicContact CD2-CD1 3.97Å; Y51-L112 HydrophobicContact CD2-CD2 3.41Å; Y51-L112 VanDerWaalsContact CD2-CD2 3.41Å; Y51-L112 HydrophobicContact CD2-CG 4.36Å; Y51-L112 HydrophobicContact CE2-CD1 4.16Å; Y51-L112 HydrophobicContact CE2-CD2 4.03Å; Y51-L112 HydrophobicContact CG-CD2 3.62Å
52	N	67.3	Low	54.7	Low	73 Å²	73	86.8 Å²	86.8	39%	0.39	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-67.3	-23.2	-177.7	-60.9	-81.6	0	0	0	113.2	D50 R57	D50-N52 PolarHBondContact O-N 2.92Å; D50-N52 WeakPolarHBondContact OD1-CB 3.45Å; D50-N52 PolarHBondContact OD1-N 3.05Å; D50-N52 PolarHBondContact OD1-ND2 2.86Å; N52-R57 PolarHBondContact O-NH1 3.15Å; N52-R57 PolarHBondContact OD1-NH2 3.45Å
53	R	63.8	Low	57	Low	220 Å²	220	86.3 Å²	86.3	83%	0.83	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-92.4	1.9	173.5	-64.8	179	-174.8	-157.9	-1	113.3	D50 Y51	D50-R53 HydrophobicContact CB-CG 4.39Å; D50-R53 PolarHBondContact O-N 2.81Å; D50-R53 VanDerWaalsContact O-N 3.15Å; D50-R53 WeakPolarHBondContact OD2-CG 3.31Å; D50-R53 IonicContact OD2-NE 2.75Å; Y51-R53 PolarHBondContact O-N 3.32Å
54	S	66.6	Low	59	Low	19 Å²	19	86.1 Å²	86.1	13%	0.133	46%	0.46	C	S	.	.	S	Bend	trans	-84.7	147.8	-178.2	77.6	0	0	0	0	113.4	Y51 F56 R57	Y51-S54 VanDerWaalsContact O-CB 3.3Å; Y51-S54 WeakPolarHBondContact O-CB 3.19Å; Y51-S54 PolarHBondContact O-N 3.41Å; Y51-S54 PolarHBondContact O-OG 2.92Å; S54-F56 PolarHBondContact O-N 3.17Å; S54-F56 VanDerWaalsContact O-N 3.12Å; S54-R57 PolarHBondContact O-N 3.47Å
55	N	52.5	Low	60.1	Low	116 Å²	116	88.3 Å²	88.3	62%	0.62	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-64.5	-12.9	175.7	-70.7	-14.6	0	0	0	113.6	R57 Q58	N55-R57 PolarHBondContact O-N 2.84Å; N55-R57 VanDerWaalsContact O-N 3.1Å; N55-Q58 VanDerWaalsContact O-CB 3.26Å; N55-Q58 WeakPolarHBondContact O-CB 3.24Å; N55-Q58 WeakPolarHBondContact O-CG 3.47Å; N55-Q58 PolarHBondContact O-N 2.85Å; N55-Q58 PolarHBondContact OD1-NE2 2.72Å
56	F	55.8	Low	61.6	Low	97 Å²	97	81.3 Å²	81.3	43%	0.425	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-59.5	-22.1	177.3	-90.9	-87.7	0	0	0	113.8	Y51 S54 Q58 C59 Y108	Y51-F56 HydrophobicContact CE2-CB 4.43Å; S54-F56 PolarHBondContact O-N 3.17Å; S54-F56 VanDerWaalsContact O-N 3.12Å; F56-Q58 PolarHBondContact O-N 2.74Å; F56-C59 WeakPolarHBondContact O-CB 3.35Å; F56-C59 PolarHBondContact O-N 3.32Å; F56-C59 VanDerWaalsContact O-N 3.15Å; F56-Y108 WeakPolarHBondContact CD2-OH 3.45Å
57	R	59.2	Low	63.4	Low	114 Å²	114	84.4 Å²	84.4	43%	0.43	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-63	-24	170.1	-92.6	178.8	160.4	170.5	-6	113.9	N52 S54 N55 C59 W60	N52-R57 PolarHBondContact O-NH1 3.15Å; N52-R57 PolarHBondContact OD1-NH2 3.45Å; S54-R57 PolarHBondContact O-N 3.47Å; N55-R57 PolarHBondContact O-N 2.84Å; N55-R57 VanDerWaalsContact O-N 3.1Å; R57-C59 VanDerWaalsContact C-N 3.28Å; R57-W60 HydrophobicContact CG-CD2 4.07Å; R57-W60 HydrophobicContact CG-CE3 4.22Å; R57-W60 HydrophobicContact CG-CH2 4.31Å; R57-W60 HydrophobicContact CG-CZ2 4.15Å; R57-W60 HydrophobicContact CG-CZ3 4.33Å; R57-W60 WeakPolarHBondContact O-CB 3.38Å; R57-W60 PolarHBondContact O-N 3.46Å
58	Q	55.9	Low	64.7	Low	134 Å²	134	80.6 Å²	80.6	63%	0.626	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-72.2	-26.2	175.2	-56.2	174.7	14.9	0	0	111.4	N55 F56 W60	N55-Q58 VanDerWaalsContact O-CB 3.26Å; N55-Q58 WeakPolarHBondContact O-CB 3.24Å; N55-Q58 WeakPolarHBondContact O-CG 3.47Å; N55-Q58 PolarHBondContact O-N 2.85Å; N55-Q58 PolarHBondContact OD1-NE2 2.72Å; F56-Q58 PolarHBondContact O-N 2.74Å; Q58-W60 VanDerWaalsContact C-N 3.29Å
59	C	48.8	Very low	66.2	Low	93 Å²	93	78.9 Å²	78.9	63%	0.628	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-83.2	0.8	174.4	-52.5	0	0	0	0	113.4	F56 R57	F56-C59 WeakPolarHBondContact O-CB 3.35Å; F56-C59 PolarHBondContact O-N 3.32Å; F56-C59 VanDerWaalsContact O-N 3.15Å; R57-C59 VanDerWaalsContact C-N 3.28Å
60	W	70.6	Confident	66.5	Low	43 Å²	43	82 Å²	82	16%	0.163	40%	0.395	C	S	.	.	S	Bend	trans	-75.5	140.5	176.9	-74	14.9	0	0	0	110.6	Y51 R57 Q58 P62 H84 R86	Y51-W60 AromaticContact CE1-CZ2 3.63Å; Y51-W60 HydrophobicContact CE1-CZ2 3.63Å; Y51-W60 PolarHBondContact OH-NE1 3.17Å; R57-W60 HydrophobicContact CG-CD2 4.07Å; R57-W60 HydrophobicContact CG-CE3 4.22Å; R57-W60 HydrophobicContact CG-CH2 4.31Å; R57-W60 HydrophobicContact CG-CZ2 4.15Å; R57-W60 HydrophobicContact CG-CZ3 4.33Å; R57-W60 WeakPolarHBondContact O-CB 3.38Å; R57-W60 PolarHBondContact O-N 3.46Å; Q58-W60 VanDerWaalsContact C-N 3.29Å; W60-P62 WeakPolarHBondContact O-CD 3.19Å; W60-H84 HydrophobicContact CD2-CB 3.75Å; W60-H84 AromaticContact CD2-CD2 3.92Å; W60-H84 AromaticContact CD2-CG 3.78Å; W60-H84 HydrophobicContact CE3-CB 3.67Å; W60-H84 AromaticContact CE3-CD2 3.68Å; W60-H84 AromaticContact CE3-CG 3.35Å; W60-H84 AromaticContact CE3-ND1 3.66Å; W60-H84 HydrophobicContact CG-CB 4.34Å; W60-H84 AromaticContact CG-CD2 4Å; W60-H84 HydrophobicContact CH2-CB 4.12Å; W60-H84 HydrophobicContact CZ2-CB 4.18Å; W60-H84 HydrophobicContact CZ3-CB 3.88Å; W60-H84 AromaticContact CZ3-CG 3.79Å; W60-H84 AromaticContact CZ3-ND1 3.79Å; W60-R86 HydrophobicContact CZ2-CG 4.15Å
61	M	61.1	Low	66.6	Low	55 Å²	55	83.3 Å²	83.3	27%	0.271	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-60.8	127.7	169.8	173.3	177.9	-81.2	0	0	109.1	R65 H84 G89 I91	M61-R65 HydrophobicContact CG-CB 3.96Å; M61-R65 HydrophobicContact SD-CB 4.26Å; M61-H84 PolarHBondContact O-CD2 2.89Å; M61-H84 PolarHBondContact O-NE2 3.2Å; M61-G89 PolarHBondContact N-O 3.41Å; M61-I91 HydrophobicContact CB-CD1 4.11Å; M61-I91 HydrophobicContact CB-CG1 4.09Å; M61-I91 HydrophobicContact CG-CD1 3.77Å; M61-I91 HydrophobicContact CG-CG1 4.19Å; M61-I91 WeakPolarHBondContact O-CD1 3.24Å; M61-I91 HydrophobicContact SD-CD1 4.02Å; M61-I91 HydrophobicContact SD-CG1 4.22Å
62	P	69	Low	67	Low	62 Å²	62	85.1 Å²	85.1	40%	0.403	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-58.8	138.7	175.2	-26.4	35.2	0	0	0	111.7	W60 S64 R65 G66	W60-P62 WeakPolarHBondContact O-CD 3.19Å; P62-S64 PolarHBondContact O-N 2.83Å; P62-R65 PolarHBondContact O-N 3.34Å; P62-G66 PolarHBondContact O-N 3.41Å
63	D	73.9	Confident	67.8	Low	78 Å²	78	87.3 Å²	87.3	42%	0.417	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-25.8	-179.4	-90.1	-50.7	0	0	0	113.2	R65 K82 H84	D63-R65 VanDerWaalsContact C-N 3.32Å; D63-R65 PolarHBondContact O-N 3.42Å; D63-K82 HydrophobicContact CB-CD 4.24Å; D63-K82 PolarHBondContact O-NZ 3.38Å; D63-K82 WeakPolarHBondContact OD1-CB 3.32Å; D63-K82 WeakPolarHBondContact OD1-CD 3.47Å; D63-H84 IonicContact OD1-CE1 3.98Å; D63-H84 IonicContact OD2-CE1 3.39Å
64	S	70.4	Confident	68.3	Low	95 Å²	95	81.4 Å²	81.4	66%	0.664	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.2	173.4	49.4	0	0	0	0	113.7	P62	P62-S64 PolarHBondContact O-N 2.83Å
65	R	54.3	Low	69.3	Low	140 Å²	140	88.2 Å²	88.2	53%	0.528	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-35	179	-71.8	-174.5	158	139.9	4.2	112.9	M61 P62 D63 K67 E787	M61-R65 HydrophobicContact CG-CB 3.96Å; M61-R65 HydrophobicContact SD-CB 4.26Å; P62-R65 PolarHBondContact O-N 3.34Å; D63-R65 VanDerWaalsContact C-N 3.32Å; D63-R65 PolarHBondContact O-N 3.42Å; R65-K67 PolarHBondContact O-N 3.26Å; R65-E787 WeakPolarHBondContact CD-OE2 3.23Å; R65-E787 IonicContact CZ-OE2 3.11Å; R65-E787 IonicContact NE-OE2 2.83Å; R65-E787 PolarHBondContact NE-OE2 3.44Å; R65-E787 IonicContact NH2-OE2 3.14Å
66	G	63.1	Low	70.9	Confident	3 Å²	3	84 Å²	84	3%	0.031	40%	0.401	C	S	.	.			trans	-69.7	83.2	177.9	0	0	0	0	0	112.8	P62 F76 K82	P62-G66 PolarHBondContact O-N 3.41Å; G66-F76 VanDerWaalsContact O-CD2 3.28Å; G66-F76 WeakPolarHBondContact O-CD2 3.41Å; G66-K82 WeakPolarHBondContact O-CE 3.43Å; G66-K82 PolarHBondContact O-NZ 3.3Å
67	K	81.4	Confident	72.3	Confident	152 Å²	152	83.1 Å²	83.1	66%	0.661	40%	0.404	S	S	*	.			trans	-85.2	-25.6	173.2	-67.2	-179.9	-177.9	172.3	0	113.1	R65 K75 F76	R65-K67 PolarHBondContact O-N 3.26Å; K67-K75 WeakPolarHBondContact O-CA 3.36Å; K67-F76 PolarHBondContact O-N 2.96Å
68	V	81.7	Confident	73.3	Confident	51 Å²	51	83.1 Å²	83.1	31%	0.309	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-132.8	153.4	-178.9	-69.7	0	0	0	0	111.4	Y70 R73 E74 K75 F76	V68-Y70 PolarHBondContact O-N 3.3Å; V68-R73 VanDerWaalsContact CB-O 3.3Å; V68-R73 WeakPolarHBondContact CB-O 3.46Å; V68-R73 VanDerWaalsContact CG1-O 3.23Å; V68-R73 WeakPolarHBondContact CG1-O 3.5Å; V68-E74 WeakPolarHBondContact CA-O 3.45Å; V68-K75 HydrophobicContact CG1-CB 4.45Å; V68-K75 HydrophobicContact CG1-CG 3.74Å; V68-F76 WeakPolarHBondContact O-CE2 3.39Å
69	C	81.9	Confident	74.5	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.426	C	S	.	.			trans	-61.4	126.6	170.6	178.8	0	0	0	0	110.6	E71 C72 R73 E74 F76 C93	C69-E71 VanDerWaalsContact C-N 3.25Å; C69-E71 PolarHBondContact O-N 3.02Å; C69-C72 VanDerWaalsContact CB-SG 3.6Å; C69-R73 WeakPolarHBondContact O-CA 3.23Å; C69-R73 PolarHBondContact O-N 3.5Å; C69-E74 PolarHBondContact N-O 3.38Å; C69-F76 HydrophobicContact CB-CE1 4.47Å; C69-F76 HydrophobicContact CB-CZ 4.16Å; C69-C93 HydrophobicContact CB-CB 4.23Å; C69-C93 PolarHBondContact SG-N 3.08Å
70	Y	72.6	Confident	76.3	Confident	117 Å²	117	84.9 Å²	84.9	46%	0.459	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-35.4	-178.3	-170.6	-82.7	0	0	0	113.4	V68 Q90 I91 F92	V68-Y70 PolarHBondContact O-N 3.3Å; Y70-Q90 HydrophobicContact CD1-CB 4.49Å; Y70-Q90 HydrophobicContact CD2-CB 3.81Å; Y70-Q90 HydrophobicContact CD2-CG 3.77Å; Y70-Q90 HydrophobicContact CE2-CB 4.28Å; Y70-Q90 HydrophobicContact CE2-CG 3.71Å; Y70-Q90 HydrophobicContact CG-CB 3.94Å; Y70-Q90 HydrophobicContact CG-CG 4.24Å; Y70-I91 WeakPolarHBondContact CB-O 3.32Å; Y70-I91 PolarHBondContact N-O 3.35Å; Y70-F92 AromaticContact CD1-CE1 3.96Å; Y70-F92 HydrophobicContact CD1-CE1 3.96Å; Y70-F92 HydrophobicContact CD1-CZ 4.03Å; Y70-F92 HydrophobicContact CG-CE1 4.26Å; Y70-F92 HydrophobicContact CG-CZ 4.25Å
71	E	75.4	Confident	77	Confident	80 Å²	80	91.5 Å²	91.5	37%	0.374	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-49.8	-176.4	-160.3	175	121.3	0	0	113.3	C69 F92 C96 N116	C69-E71 VanDerWaalsContact C-N 3.25Å; C69-E71 PolarHBondContact O-N 3.02Å; E71-F92 HydrophobicContact CB-CD1 3.79Å; E71-F92 HydrophobicContact CB-CE1 3.87Å; E71-C96 HydrophobicContact CB-CB 3.88Å; E71-C96 HydrophobicContact CG-CB 4.45Å; E71-N116 PolarHBondContact OE1-ND2 3.47Å
72	C	81.9	Confident	78.4	Confident	45 Å²	45	92.3 Å²	92.3	30%	0.304	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	4.8	-175.7	80.1	0	0	0	0	115	C69 E74	C69-C72 VanDerWaalsContact CB-SG 3.6Å; C72-E74 PolarHBondContact O-N 3.15Å
73	R	83.3	Confident	79.4	Confident	120 Å²	120	91.5 Å²	91.5	45%	0.453	43%	0.427	S	S	.	.			trans	56.8	-8.1	176.3	-57.6	-62	180	161.2	-2.7	118.2	V68 C69 S155	V68-R73 VanDerWaalsContact CB-O 3.3Å; V68-R73 WeakPolarHBondContact CB-O 3.46Å; V68-R73 VanDerWaalsContact CG1-O 3.23Å; V68-R73 WeakPolarHBondContact CG1-O 3.5Å; C69-R73 WeakPolarHBondContact O-CA 3.23Å; C69-R73 PolarHBondContact O-N 3.5Å; R73-S155 PolarHBondContact NH2-O 2.78Å
74	E	75.3	Confident	80.1	Confident	96 Å²	96	88.5 Å²	88.5	45%	0.449	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-60.2	137.2	174.2	-66.1	-175.1	-93.6	0	0	112.6	V68 C69 C72 R80	V68-E74 WeakPolarHBondContact CA-O 3.45Å; C69-E74 PolarHBondContact N-O 3.38Å; C72-E74 PolarHBondContact O-N 3.15Å; E74-R80 IonicContact OE1-CZ 3.53Å; E74-R80 IonicContact OE1-NH1 3.58Å; E74-R80 PolarHBondContact OE1-NH1 3.44Å; E74-R80 IonicContact OE1-NH2 2.8Å; E74-R80 PolarHBondContact OE1-NH2 2.73Å; E74-R80 IonicContact OE2-CZ 2.71Å; E74-R80 IonicContact OE2-NE 3.52Å; E74-R80 IonicContact OE2-NH1 2.81Å; E74-R80 PolarHBondContact OE2-NH1 2.88Å; E74-R80 IonicContact OE2-NH2 3.41Å; E74-R80 PolarHBondContact OE2-NH2 3.01Å
75	K	86.6	Confident	80.8	Confident	162 Å²	162	84 Å²	84	70%	0.704	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-60.6	141.1	176.7	-75.7	175	179.4	166.4	0	112.1	K67 V68 R80	K67-K75 WeakPolarHBondContact O-CA 3.36Å; V68-K75 HydrophobicContact CG1-CB 4.45Å; V68-K75 HydrophobicContact CG1-CG 3.74Å; K75-R80 WeakPolarHBondContact O-CD 3.31Å
76	F	85.8	Confident	82.2	Confident	28 Å²	28	80 Å²	80	12%	0.123	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-72.3	145.4	169.4	-66.8	-68.3	0	0	0	110.9	G66 K67 V68 C69 R80 R81 K82 I91 F92 C93	G66-F76 VanDerWaalsContact O-CD2 3.28Å; G66-F76 WeakPolarHBondContact O-CD2 3.41Å; K67-F76 PolarHBondContact O-N 2.96Å; V68-F76 WeakPolarHBondContact O-CE2 3.39Å; C69-F76 HydrophobicContact CB-CE1 4.47Å; C69-F76 HydrophobicContact CB-CZ 4.16Å; F76-R80 WeakPolarHBondContact CA-O 3.18Å; F76-R80 HydrophobicContact CD1-CG 4.17Å; F76-R80 WeakPolarHBondContact CD1-O 2.95Å; F76-R81 WeakPolarHBondContact CD1-O 3.48Å; F76-R81 WeakPolarHBondContact CE1-O 3.45Å; F76-K82 HydrophobicContact CB-CG 4.12Å; F76-K82 HydrophobicContact CD1-CG 3.75Å; F76-K82 HydrophobicContact CD2-CD 4.23Å; F76-K82 HydrophobicContact CD2-CG 3.71Å; F76-K82 HydrophobicContact CE1-CB 4.46Å; F76-K82 HydrophobicContact CE1-CG 4.04Å; F76-K82 HydrophobicContact CE2-CG 3.97Å; F76-K82 HydrophobicContact CG-CD 4.4Å; F76-K82 HydrophobicContact CG-CG 3.59Å; F76-K82 HydrophobicContact CZ-CG 4.16Å; F76-I91 HydrophobicContact CE1-CG2 4.44Å; F76-I91 HydrophobicContact CE2-CB 4.41Å; F76-I91 HydrophobicContact CE2-CG2 3.66Å; F76-I91 HydrophobicContact CZ-CB 4.45Å; F76-I91 HydrophobicContact CZ-CG2 3.55Å; F76-F92 WeakPolarHBondContact CE1-O 3.09Å; F76-C93 HydrophobicContact CE1-CB 4.27Å
77	T	85.9	Confident	82.8	Confident	78 Å²	78	82 Å²	82	48%	0.479	37%	0.374	S	S	.	.			trans	-138.7	178.1	-178.1	69.4	0	0	0	0	110	F79 R80	T77-F79 PolarHBondContact O-N 3.34Å; T77-F79 PolarHBondContact OG1-N 3.36Å; T77-R80 PolarHBondContact N-O 3.2Å; T77-R80 CarbonylContact O-C 3.36Å; T77-R80 PolarHBondContact O-N 2.88Å; T77-R80 WeakPolarHBondContact OG1-CB 3.4Å; T77-R80 PolarHBondContact OG1-N 2.99Å
78	T	79.7	Confident	82.5	Confident	113 Å²	113	77.1 Å²	77.1	69%	0.693	36%	0.358	S	S	*	.	S	Bend	trans	-54.7	-34.5	173.1	47	0	0	0	0	112.9
79	F	81.8	Confident	81.9	Confident	192 Å²	192	74.9 Å²	74.9	84%	0.842	35%	0.345	S	S	*	.	S	Bend	trans	-91	-38.5	177.3	-57.3	-71	0	0	0	112.8	T77 R81	T77-F79 PolarHBondContact O-N 3.34Å; T77-F79 PolarHBondContact OG1-N 3.36Å; F79-R81 PolarHBondContact O-N 3.15Å
80	R	86.5	Confident	81.9	Confident	73 Å²	73	77.3 Å²	77.3	28%	0.275	36%	0.356	S	S	.	.	S	Bend	trans	-89	87.6	175.1	-173.4	175.2	-70	-123.9	5.6	110.1	E74 K75 F76 T77 C93	E74-R80 IonicContact OE1-CZ 3.53Å; E74-R80 IonicContact OE1-NH1 3.58Å; E74-R80 PolarHBondContact OE1-NH1 3.44Å; E74-R80 IonicContact OE1-NH2 2.8Å; E74-R80 PolarHBondContact OE1-NH2 2.73Å; E74-R80 IonicContact OE2-CZ 2.71Å; E74-R80 IonicContact OE2-NE 3.52Å; E74-R80 IonicContact OE2-NH1 2.81Å; E74-R80 PolarHBondContact OE2-NH1 2.88Å; E74-R80 IonicContact OE2-NH2 3.41Å; E74-R80 PolarHBondContact OE2-NH2 3.01Å; K75-R80 WeakPolarHBondContact O-CD 3.31Å; F76-R80 WeakPolarHBondContact CA-O 3.18Å; F76-R80 HydrophobicContact CD1-CG 4.17Å; F76-R80 WeakPolarHBondContact CD1-O 2.95Å; T77-R80 PolarHBondContact N-O 3.2Å; T77-R80 CarbonylContact O-C 3.36Å; T77-R80 PolarHBondContact O-N 2.88Å; T77-R80 WeakPolarHBondContact OG1-CB 3.4Å; T77-R80 PolarHBondContact OG1-N 2.99Å; R80-C93 HydrophobicContact CG-CB 4.03Å
81	R	85.8	Confident	82.4	Confident	181 Å²	181	71.8 Å²	71.8	68%	0.683	34%	0.335	S	S	*	.			trans	-76.3	161.1	-179.2	-64.5	-174.6	176.4	-170.2	-2.5	113.5	F76 F79	F76-R81 WeakPolarHBondContact CD1-O 3.48Å; F76-R81 WeakPolarHBondContact CE1-O 3.45Å; F79-R81 PolarHBondContact O-N 3.15Å
82	K	89.5	Confident	83.2	Confident	73 Å²	73	68.1 Å²	68.1	32%	0.317	32%	0.318	S	S	.	.			trans	-88.5	138.6	-177.2	-65.4	178.7	-170.1	-174.9	0	111.7	D63 G66 F76 I91	D63-K82 HydrophobicContact CB-CD 4.24Å; D63-K82 PolarHBondContact O-NZ 3.38Å; D63-K82 WeakPolarHBondContact OD1-CB 3.32Å; D63-K82 WeakPolarHBondContact OD1-CD 3.47Å; G66-K82 WeakPolarHBondContact O-CE 3.43Å; G66-K82 PolarHBondContact O-NZ 3.3Å; F76-K82 HydrophobicContact CB-CG 4.12Å; F76-K82 HydrophobicContact CD1-CG 3.75Å; F76-K82 HydrophobicContact CD2-CD 4.23Å; F76-K82 HydrophobicContact CD2-CG 3.71Å; F76-K82 HydrophobicContact CE1-CB 4.46Å; F76-K82 HydrophobicContact CE1-CG 4.04Å; F76-K82 HydrophobicContact CE2-CG 3.97Å; F76-K82 HydrophobicContact CG-CD 4.4Å; F76-K82 HydrophobicContact CG-CG 3.59Å; F76-K82 HydrophobicContact CZ-CG 4.16Å; K82-I91 HydrophobicContact CB-CG2 3.6Å; K82-I91 HydrophobicContact CD-CG2 4.4Å; K82-I91 HydrophobicContact CG-CG2 3.93Å
83	H	91.5	Very high	83.8	Confident	44 Å²	44	66.1 Å²	66.1	20%	0.204	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	123.4	174.8	-51.9	-53.7	0	0	0	112.3	F92 S94	H83-F92 PolarHBondContact N-O 3.45Å; H83-F92 PolarHBondContact O-N 2.89Å; H83-S94 VanDerWaalsContact CD2-CA 3.48Å; H83-S94 WeakPolarHBondContact CD2-CA 3.04Å; H83-S94 PolarHBondContact CD2-N 3.41Å
84	H	87.8	Confident	84.2	Confident	16 Å²	16	64.1 Å²	64.1	7%	0.074	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	136.1	174.6	-54.9	74.9	0	0	0	112.7	W60 M61 D63 R86 Q90	W60-H84 HydrophobicContact CD2-CB 3.75Å; W60-H84 AromaticContact CD2-CD2 3.92Å; W60-H84 AromaticContact CD2-CG 3.78Å; W60-H84 HydrophobicContact CE3-CB 3.67Å; W60-H84 AromaticContact CE3-CD2 3.68Å; W60-H84 AromaticContact CE3-CG 3.35Å; W60-H84 AromaticContact CE3-ND1 3.66Å; W60-H84 HydrophobicContact CG-CB 4.34Å; W60-H84 AromaticContact CG-CD2 4Å; W60-H84 HydrophobicContact CH2-CB 4.12Å; W60-H84 HydrophobicContact CZ2-CB 4.18Å; W60-H84 HydrophobicContact CZ3-CB 3.88Å; W60-H84 AromaticContact CZ3-CG 3.79Å; W60-H84 AromaticContact CZ3-ND1 3.79Å; M61-H84 PolarHBondContact O-CD2 2.89Å; M61-H84 PolarHBondContact O-NE2 3.2Å; D63-H84 IonicContact OD1-CE1 3.98Å; D63-H84 IonicContact OD2-CE1 3.39Å; H84-R86 WeakPolarHBondContact O-CD 3.16Å; H84-R86 PolarHBondContact O-NH1 3.27Å; H84-Q90 CarbonylContact C-O 3.42Å; H84-Q90 WeakPolarHBondContact CA-O 3.31Å
85	C	85.4	Confident	84.9	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	32%	0.324	C	S	.	.			trans	-72.2	124.3	162.9	174.3	0	0	0	0	109.5	I87 C88 G89 Q90 F92 C115	C85-I87 PolarHBondContact O-N 3.48Å; C85-I87 VanDerWaalsContact O-N 3.14Å; C85-C88 VanDerWaalsContact CB-SG 3.52Å; C85-C88 PolarHBondContact SG-SG 3.05Å; C85-G89 WeakPolarHBondContact O-CA 3.38Å; C85-G89 PolarHBondContact O-N 2.77Å; C85-Q90 PolarHBondContact N-O 3.47Å; C85-F92 HydrophobicContact CB-CD2 3.98Å; C85-F92 HydrophobicContact CB-CE2 3.48Å; C85-F92 VanDerWaalsContact CB-CE2 3.48Å; C85-F92 HydrophobicContact CB-CZ 4.41Å; C85-C115 HydrophobicContact CB-CB 4.4Å; C85-C115 PolarHBondContact SG-N 3.2Å; C85-C115 VanDerWaalsContact SG-N 3.45Å
86	R	83.8	Confident	85	Confident	57 Å²	57	62.1 Å²	62.1	22%	0.215	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-9.8	-177.4	-81.6	50.7	170.5	175.3	0.8	114.1	Y51 W60 H84 L112 R113	Y51-R86 HydrophobicContact CD1-CG 4.36Å; Y51-R86 HydrophobicContact CE1-CB 4.4Å; Y51-R86 HydrophobicContact CE1-CG 3.85Å; Y51-R86 HydrophobicContact CE2-CB 4.07Å; Y51-R86 HydrophobicContact CE2-CG 4.31Å; Y51-R86 WeakPolarHBondContact OH-CA 3.22Å; Y51-R86 PolarHBondContact OH-O 3.01Å; W60-R86 HydrophobicContact CZ2-CG 4.15Å; H84-R86 WeakPolarHBondContact O-CD 3.16Å; H84-R86 PolarHBondContact O-NH1 3.27Å; R86-L112 HydrophobicContact CB-CB 3.88Å; R86-L112 HydrophobicContact CB-CD2 4.25Å; R86-L112 HydrophobicContact CB-CG 4.44Å; R86-L112 HydrophobicContact CG-CB 4.34Å; R86-L112 HydrophobicContact CG-CD2 4.15Å; R86-R113 WeakPolarHBondContact CB-O 2.86Å; R86-R113 WeakPolarHBondContact CD-O 3.34Å; R86-R113 PolarHBondContact N-O 2.93Å
87	I	75.6	Confident	85.3	Confident	44 Å²	44	60.9 Å²	60.9	23%	0.226	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-52.6	174.8	-67.1	179.8	0	0	0	111.7	C85 V101 F106 V114 C118 V122	C85-I87 PolarHBondContact O-N 3.48Å; C85-I87 VanDerWaalsContact O-N 3.14Å; I87-V101 HydrophobicContact CD1-CG2 4.13Å; I87-F106 HydrophobicContact CD1-CE1 4.15Å; I87-F106 HydrophobicContact CD1-CE2 3.77Å; I87-F106 HydrophobicContact CD1-CZ 3.41Å; I87-F106 VanDerWaalsContact CD1-CZ 3.41Å; I87-F106 HydrophobicContact CG1-CE2 4.42Å; I87-F106 HydrophobicContact CG1-CZ 4.19Å; I87-V114 HydrophobicContact CB-CG1 4.22Å; I87-V114 HydrophobicContact CD1-CG1 3.65Å; I87-V114 HydrophobicContact CG1-CG1 3.69Å; I87-C118 HydrophobicContact CB-CB 4.3Å; I87-C118 HydrophobicContact CD1-CB 4.3Å; I87-C118 HydrophobicContact CG2-CB 4.45Å; I87-V122 HydrophobicContact CD1-CG2 3.96Å
88	C	74.2	Confident	85.4	Confident	50 Å²	50	60.5 Å²	60.5	34%	0.338	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	0.7	-172.7	69.2	0	0	0	0	115.5	C85 Q90	C85-C88 VanDerWaalsContact CB-SG 3.52Å; C85-C88 PolarHBondContact SG-SG 3.05Å; C88-Q90 PolarHBondContact O-N 3.05Å
89	G	69.4	Low	86	Confident	4 Å²	4	57.8 Å²	57.8	4%	0.041	27%	0.271	C	S	.	.			trans	69.8	-12	176	0	0	0	0	0	116.3	M61 C85	M61-G89 PolarHBondContact N-O 3.41Å; C85-G89 WeakPolarHBondContact O-CA 3.38Å; C85-G89 PolarHBondContact O-N 2.77Å
90	Q	81.8	Confident	86.4	Confident	50 Å²	50	53.5 Å²	53.5	23%	0.234	25%	0.254	C	S	.	.			trans	-70.6	157.3	-179.4	-59.1	-56.6	-34.4	0	0	112.7	Y70 H84 C85 C88 F92	Y70-Q90 HydrophobicContact CD1-CB 4.49Å; Y70-Q90 HydrophobicContact CD2-CB 3.81Å; Y70-Q90 HydrophobicContact CD2-CG 3.77Å; Y70-Q90 HydrophobicContact CE2-CB 4.28Å; Y70-Q90 HydrophobicContact CE2-CG 3.71Å; Y70-Q90 HydrophobicContact CG-CB 3.94Å; Y70-Q90 HydrophobicContact CG-CG 4.24Å; H84-Q90 CarbonylContact C-O 3.42Å; H84-Q90 WeakPolarHBondContact CA-O 3.31Å; C85-Q90 PolarHBondContact N-O 3.47Å; C88-Q90 PolarHBondContact O-N 3.05Å; Q90-F92 HydrophobicContact CB-CE2 3.61Å; Q90-F92 HydrophobicContact CB-CZ 3.84Å; Q90-F92 WeakPolarHBondContact O-CD2 3.44Å; Q90-F92 WeakPolarHBondContact O-CE2 3.31Å
91	I	84.4	Confident	86.3	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.1	-174.5	-54.8	170.7	0	0	0	111.6	M61 Y70 F76 K82	M61-I91 HydrophobicContact CB-CD1 4.11Å; M61-I91 HydrophobicContact CB-CG1 4.09Å; M61-I91 HydrophobicContact CG-CD1 3.77Å; M61-I91 HydrophobicContact CG-CG1 4.19Å; M61-I91 WeakPolarHBondContact O-CD1 3.24Å; M61-I91 HydrophobicContact SD-CD1 4.02Å; M61-I91 HydrophobicContact SD-CG1 4.22Å; Y70-I91 WeakPolarHBondContact CB-O 3.32Å; Y70-I91 PolarHBondContact N-O 3.35Å; F76-I91 HydrophobicContact CE1-CG2 4.44Å; F76-I91 HydrophobicContact CE2-CB 4.41Å; F76-I91 HydrophobicContact CE2-CG2 3.66Å; F76-I91 HydrophobicContact CZ-CB 4.45Å; F76-I91 HydrophobicContact CZ-CG2 3.55Å; K82-I91 HydrophobicContact CB-CG2 3.6Å; K82-I91 HydrophobicContact CD-CG2 4.4Å; K82-I91 HydrophobicContact CG-CG2 3.93Å
92	F	91.7	Very high	86.2	Confident	4 Å²	4	43 Å²	43	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	162.7	-175.9	-57.5	-96.8	0	0	0	111.6	Y70 E71 F76 H83 C85 Q90 C96 C97 C115	Y70-F92 AromaticContact CD1-CE1 3.96Å; Y70-F92 HydrophobicContact CD1-CE1 3.96Å; Y70-F92 HydrophobicContact CD1-CZ 4.03Å; Y70-F92 HydrophobicContact CG-CE1 4.26Å; Y70-F92 HydrophobicContact CG-CZ 4.25Å; E71-F92 HydrophobicContact CB-CD1 3.79Å; E71-F92 HydrophobicContact CB-CE1 3.87Å; F76-F92 WeakPolarHBondContact CE1-O 3.09Å; H83-F92 PolarHBondContact N-O 3.45Å; H83-F92 PolarHBondContact O-N 2.89Å; C85-F92 HydrophobicContact CB-CD2 3.98Å; C85-F92 HydrophobicContact CB-CE2 3.48Å; C85-F92 VanDerWaalsContact CB-CE2 3.48Å; C85-F92 HydrophobicContact CB-CZ 4.41Å; Q90-F92 HydrophobicContact CB-CE2 3.61Å; Q90-F92 HydrophobicContact CB-CZ 3.84Å; Q90-F92 WeakPolarHBondContact O-CD2 3.44Å; Q90-F92 WeakPolarHBondContact O-CE2 3.31Å; F92-C96 HydrophobicContact CB-CB 4.26Å; F92-C96 HydrophobicContact CD1-CB 4.09Å; F92-C97 HydrophobicContact CB-CB 3.49Å; F92-C97 VanDerWaalsContact CB-CB 3.49Å; F92-C97 HydrophobicContact CD2-CB 4.14Å; F92-C97 HydrophobicContact CG-CB 3.93Å; F92-C115 HydrophobicContact CD1-CB 3.86Å; F92-C115 HydrophobicContact CD2-CB 4.13Å; F92-C115 HydrophobicContact CE1-CB 3.43Å; F92-C115 VanDerWaalsContact CE1-CB 3.43Å; F92-C115 HydrophobicContact CE2-CB 3.75Å; F92-C115 HydrophobicContact CG-CB 4.21Å; F92-C115 HydrophobicContact CZ-CB 3.4Å; F92-C115 VanDerWaalsContact CZ-CB 3.4Å
93	C	93.8	Very high	85.3	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.02	20%	0.203	C	C	.	.			trans	-76.9	165.7	164	73.9	0	0	0	0	110.9	C69 F76 R80 R95 C96 C97	C69-C93 HydrophobicContact CB-CB 4.23Å; C69-C93 PolarHBondContact SG-N 3.08Å; F76-C93 HydrophobicContact CE1-CB 4.27Å; R80-C93 HydrophobicContact CG-CB 4.03Å; C93-R95 PolarHBondContact O-N 3.43Å; C93-C96 PolarHBondContact O-N 3.4Å; C93-C97 PolarHBondContact O-N 2.87Å; C93-C97 VanDerWaalsContact O-N 3.12Å
94	S	91.5	Very high	84.5	Confident	78 Å²	78	45.4 Å²	45.4	55%	0.545	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.3	-177.6	54.7	0	0	0	0	113.2	H83 C97 S98	H83-S94 VanDerWaalsContact CD2-CA 3.48Å; H83-S94 WeakPolarHBondContact CD2-CA 3.04Å; H83-S94 PolarHBondContact CD2-N 3.41Å; S94-C97 CarbonylContact O-C 3.58Å; S94-S98 WeakPolarHBondContact O-CA 3.43Å; S94-S98 WeakPolarHBondContact O-CB 3.33Å; S94-S98 PolarHBondContact O-N 2.96Å
95	R	90	Very high	83.4	Confident	202 Å²	202	48 Å²	48	76%	0.762	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-47.2	179.8	-136.2	176.6	-169.3	173.3	3.9	112.3	C93 S98	C93-R95 PolarHBondContact O-N 3.43Å; R95-S98 PolarHBondContact O-OG 2.99Å
96	C	88.6	Confident	82.5	Confident	13 Å²	13	51.2 Å²	51.2	9%	0.088	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-18.4	-176.9	-63.7	0	0	0	0	114.2	E71 F92 C93 C115 N116	E71-C96 HydrophobicContact CB-CB 3.88Å; E71-C96 HydrophobicContact CG-CB 4.45Å; F92-C96 HydrophobicContact CB-CB 4.26Å; F92-C96 HydrophobicContact CD1-CB 4.09Å; C93-C96 PolarHBondContact O-N 3.4Å; C96-C115 VanDerWaalsContact O-CA 3.27Å; C96-C115 WeakPolarHBondContact O-CA 3.33Å; C96-N116 PolarHBondContact O-N 3.32Å
97	C	91.9	Very high	81.7	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.014	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	53.5	174.8	-172.1	0	0	0	0	110.1	F92 C93 S94 R113 V114	F92-C97 HydrophobicContact CB-CB 3.49Å; F92-C97 VanDerWaalsContact CB-CB 3.49Å; F92-C97 HydrophobicContact CD2-CB 4.14Å; F92-C97 HydrophobicContact CG-CB 3.93Å; C93-C97 PolarHBondContact O-N 2.87Å; C93-C97 VanDerWaalsContact O-N 3.12Å; S94-C97 CarbonylContact O-C 3.58Å; C97-R113 VanDerWaalsContact O-CD 3.25Å; C97-R113 WeakPolarHBondContact O-CD 3.32Å; C97-R113 WeakPolarHBondContact O-CG 3.45Å; C97-V114 WeakPolarHBondContact CA-O 3.26Å; C97-V114 PolarHBondContact SG-O 3.48Å
98	S	89	Confident	81.8	Confident	71 Å²	71	48.7 Å²	48.7	50%	0.497	25%	0.246	S	C	.	.			trans	-94.8	-12.7	179.7	46.5	0	0	0	0	113.9	S94 R95	S94-S98 WeakPolarHBondContact O-CA 3.43Å; S94-S98 WeakPolarHBondContact O-CB 3.33Å; S94-S98 PolarHBondContact O-N 2.96Å; R95-S98 PolarHBondContact O-OG 2.99Å
99	L	91.4	Very high	81.9	Confident	56 Å²	56	49.8 Å²	49.8	29%	0.293	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	148.9	-172.3	-57.4	178.4	0	0	0	110.7	R113 V114 N116 H119	L99-R113 WeakPolarHBondContact O-CA 3.23Å; L99-V114 WeakPolarHBondContact O-CG2 3.49Å; L99-V114 PolarHBondContact O-N 3.47Å; L99-N116 WeakPolarHBondContact CD1-OD1 3.27Å; L99-H119 HydrophobicContact CB-CB 4.03Å; L99-H119 HydrophobicContact CD1-CB 3.81Å
100	E	91.9	Very high	82.3	Confident	102 Å²	102	52.4 Å²	52.4	48%	0.477	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.9	179.2	-49	-159.1	138.5	0	0	110	L112 R113	E100-L112 CarbonylContact C-O 3.53Å; E100-L112 WeakPolarHBondContact CA-O 3.35Å; E100-R113 HydrophobicContact CG-CB 4.23Å; E100-R113 HydrophobicContact CG-CG 4.29Å; E100-R113 IonicContact OE1-NE 3.79Å; E100-R113 PolarHBondContact OE1-NE 2.61Å; E100-R113 IonicContact OE1-NH2 2.95Å
101	V	83.1	Confident	82.5	Confident	8 Å²	8	54.3 Å²	54.3	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.9	176.8	-66.9	0	0	0	0	109.1	I87 G103 F106 L112 V114 H119 V122	I87-V101 HydrophobicContact CD1-CG2 4.13Å; V101-G103 PolarHBondContact O-N 2.89Å; V101-F106 HydrophobicContact CG2-CE2 4.09Å; V101-L112 HydrophobicContact CG2-CB 4.42Å; V101-L112 PolarHBondContact N-O 2.88Å; V101-L112 WeakPolarHBondContact O-CB 3.17Å; V101-L112 PolarHBondContact O-N 3.03Å; V101-V114 HydrophobicContact CB-CG2 4.43Å; V101-V114 HydrophobicContact CG1-CG2 3.87Å; V101-V114 HydrophobicContact CG2-CG1 3.75Å; V101-V114 HydrophobicContact CG2-CG2 3.91Å; V101-H119 HydrophobicContact CG1-CB 4.49Å; V101-V122 HydrophobicContact CB-CG1 4.17Å; V101-V122 HydrophobicContact CG1-CB 4.14Å; V101-V122 HydrophobicContact CG1-CG1 3.94Å
102	S	84.4	Confident	82.6	Confident	25 Å²	25	54.4 Å²	54.4	18%	0.175	28%	0.279	C	S	.	.			trans	-65.5	127.6	-168.2	-171.9	0	0	0	0	113.3	R104 L105 D111	S102-R104 PolarHBondContact O-N 2.81Å; S102-R104 VanDerWaalsContact O-N 3.12Å; S102-L105 VanDerWaalsContact O-CB 3.32Å; S102-L105 WeakPolarHBondContact O-CB 3.39Å; S102-L105 WeakPolarHBondContact O-CG 3.48Å; S102-L105 PolarHBondContact O-N 2.87Å; S102-L105 VanDerWaalsContact O-N 3.08Å; S102-D111 VanDerWaalsContact CA-CG 3.47Å; S102-D111 WeakPolarHBondContact CA-OD1 3.15Å; S102-D111 WeakPolarHBondContact CB-OD1 3.29Å; S102-D111 PolarHBondContact OG-OD1 3.12Å
103	G	71.2	Confident	82.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-62.4	-21.9	-173.5	0	0	0	0	0	113.5	V101 L105 F106 G107 Y108 T110	V101-G103 PolarHBondContact O-N 2.89Å; G103-L105 PolarHBondContact O-N 2.89Å; G103-L105 VanDerWaalsContact O-N 3.13Å; G103-F106 CarbonylContact O-C 3.56Å; G103-F106 WeakPolarHBondContact O-CA 3.48Å; G103-F106 PolarHBondContact O-N 3.19Å; G103-G107 PolarHBondContact O-N 2.57Å; G103-G107 VanDerWaalsContact O-N 3.14Å; G103-Y108 CarbonylContact C-O 3.53Å; G103-Y108 PolarHBondContact O-N 3.42Å; G103-T110 VanDerWaalsContact CA-O 3.28Å; G103-T110 WeakPolarHBondContact CA-O 3.27Å; G103-T110 PolarHBondContact N-O 3.34Å
104	R	73.2	Confident	82.3	Confident	167 Å²	167	57.8 Å²	57.8	63%	0.63	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-56.2	-29.7	174.6	-53.2	-163.3	-175.7	-169	1	112.5	L48 S102 F106 G107 Y108	L48-R104 HydrophobicContact CD1-CB 4.41Å; L48-R104 HydrophobicContact CD1-CG 3.84Å; S102-R104 PolarHBondContact O-N 2.81Å; S102-R104 VanDerWaalsContact O-N 3.12Å; R104-F106 PolarHBondContact O-N 3.08Å; R104-G107 PolarHBondContact O-N 3.27Å; R104-Y108 PolarHBondContact N-O 2.93Å
105	L	65.2	Low	82.1	Confident	71 Å²	71	54.2 Å²	54.2	37%	0.372	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-59.1	-26.9	172.2	-70.5	175.2	0	0	0	114.1	S102 G103 V122	S102-L105 VanDerWaalsContact O-CB 3.32Å; S102-L105 WeakPolarHBondContact O-CB 3.39Å; S102-L105 WeakPolarHBondContact O-CG 3.48Å; S102-L105 PolarHBondContact O-N 2.87Å; S102-L105 VanDerWaalsContact O-N 3.08Å; G103-L105 PolarHBondContact O-N 2.89Å; G103-L105 VanDerWaalsContact O-N 3.13Å; L105-V122 HydrophobicContact CD1-CG1 3.51Å
106	F	66.4	Low	81.8	Confident	67 Å²	67	46.9 Å²	46.9	29%	0.294	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-117.3	6.5	-172.9	-59.7	-79.7	0	0	0	112.2	I87 V101 G103 R104 Y108 L112 V122 L143	I87-F106 HydrophobicContact CD1-CE1 4.15Å; I87-F106 HydrophobicContact CD1-CE2 3.77Å; I87-F106 HydrophobicContact CD1-CZ 3.41Å; I87-F106 VanDerWaalsContact CD1-CZ 3.41Å; I87-F106 HydrophobicContact CG1-CE2 4.42Å; I87-F106 HydrophobicContact CG1-CZ 4.19Å; V101-F106 HydrophobicContact CG2-CE2 4.09Å; G103-F106 CarbonylContact O-C 3.56Å; G103-F106 WeakPolarHBondContact O-CA 3.48Å; G103-F106 PolarHBondContact O-N 3.19Å; R104-F106 PolarHBondContact O-N 3.08Å; F106-Y108 HydrophobicContact CB-CD2 3.72Å; F106-Y108 HydrophobicContact CB-CE2 3.85Å; F106-Y108 WeakPolarHBondContact O-CD2 3.29Å; F106-Y108 WeakPolarHBondContact O-CE2 3.47Å; F106-L112 HydrophobicContact CB-CD1 4.37Å; F106-L112 HydrophobicContact CD2-CD1 3.96Å; F106-L112 HydrophobicContact CG-CD1 4.43Å; F106-V122 HydrophobicContact CE2-CG2 4.34Å; F106-V122 HydrophobicContact CZ-CG2 3.81Å; F106-L143 HydrophobicContact CD1-CD2 4.47Å
107	G	67.9	Low	81	Confident	20 Å²	20	51.8 Å²	51.8	21%	0.206	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	22.5	-179	0	0	0	0	0	115.3	L48 A49 G103 R104	L48-G107 CarbonylContact C-O 3.59Å; L48-G107 WeakPolarHBondContact CA-O 3.43Å; L48-G107 VanDerWaalsContact CD2-C 3.46Å; A49-G107 PolarHBondContact N-O 3.24Å; G103-G107 PolarHBondContact O-N 2.57Å; G103-G107 VanDerWaalsContact O-N 3.14Å; R104-G107 PolarHBondContact O-N 3.27Å
108	Y	77.4	Confident	80.1	Confident	29 Å²	29	51.9 Å²	51.9	11%	0.114	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-118.5	152.9	-178.8	-55.7	-73.3	0	0	0	114.2	A49 Y51 F56 G103 R104 F106 L112	A49-Y108 HydrophobicContact CB-CD1 4.08Å; A49-Y108 HydrophobicContact CB-CE1 4.32Å; A49-Y108 CarbonylContact O-C 3.53Å; A49-Y108 WeakPolarHBondContact O-CA 3.28Å; Y51-Y108 HydrophobicContact CD2-CD1 4.16Å; Y51-Y108 AromaticContact CD2-CD2 3.76Å; Y51-Y108 HydrophobicContact CD2-CD2 3.76Å; Y51-Y108 HydrophobicContact CD2-CE1 4.21Å; Y51-Y108 AromaticContact CD2-CE2 3.81Å; Y51-Y108 HydrophobicContact CD2-CE2 3.81Å; Y51-Y108 AromaticContact CD2-CG 3.94Å; Y51-Y108 HydrophobicContact CD2-CG 3.94Å; Y51-Y108 HydrophobicContact CE2-CE2 4.27Å; Y51-Y108 HydrophobicContact CG-CD1 4.48Å; Y51-Y108 HydrophobicContact CG-CG 4.47Å; F56-Y108 WeakPolarHBondContact CD2-OH 3.45Å; G103-Y108 CarbonylContact C-O 3.53Å; G103-Y108 PolarHBondContact O-N 3.42Å; R104-Y108 PolarHBondContact N-O 2.93Å; F106-Y108 HydrophobicContact CB-CD2 3.72Å; F106-Y108 HydrophobicContact CB-CE2 3.85Å; F106-Y108 WeakPolarHBondContact O-CD2 3.29Å; F106-Y108 WeakPolarHBondContact O-CE2 3.47Å; Y108-L112 HydrophobicContact CD2-CD1 4.01Å
109	T	75.7	Confident	80	Confident	72 Å²	72	50 Å²	50	44%	0.442	25%	0.246	S	C	.	.	S	Bend	trans	-72.2	-40.3	-177.6	52.6	0	0	0	0	113.8	L48 A49	L48-T109 HydrophobicContact CB-CG2 3.88Å; L48-T109 WeakPolarHBondContact O-CG2 3.44Å; A49-T109 PolarHBondContact O-N 3.34Å; A49-T109 PolarHBondContact O-OG1 3.44Å
110	T	78.5	Confident	79	Confident	60 Å²	60	51.2 Å²	51.2	37%	0.368	25%	0.253	S	S	.	.	S	Bend	trans	-95.4	145.6	-174.9	58.6	0	0	0	0	112.8	G103	G103-T110 VanDerWaalsContact CA-O 3.28Å; G103-T110 WeakPolarHBondContact CA-O 3.27Å; G103-T110 PolarHBondContact N-O 3.34Å
111	D	86.5	Confident	77.7	Confident	89 Å²	89	49.5 Å²	49.5	48%	0.476	25%	0.246	S	C	.	.			trans	-62.1	142.9	169.7	-79.3	18.5	0	0	0	111.9	S102	S102-D111 VanDerWaalsContact CA-CG 3.47Å; S102-D111 WeakPolarHBondContact CA-OD1 3.15Å; S102-D111 WeakPolarHBondContact CB-OD1 3.29Å; S102-D111 PolarHBondContact OG-OD1 3.12Å
112	L	85.3	Confident	76.8	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	116.5	-166	-61.8	-176.4	0	0	0	111.4	Y51 R86 E100 V101 F106 Y108	Y51-L112 HydrophobicContact CD1-CD2 4.39Å; Y51-L112 HydrophobicContact CD2-CD1 3.97Å; Y51-L112 HydrophobicContact CD2-CD2 3.41Å; Y51-L112 VanDerWaalsContact CD2-CD2 3.41Å; Y51-L112 HydrophobicContact CD2-CG 4.36Å; Y51-L112 HydrophobicContact CE2-CD1 4.16Å; Y51-L112 HydrophobicContact CE2-CD2 4.03Å; Y51-L112 HydrophobicContact CG-CD2 3.62Å; R86-L112 HydrophobicContact CB-CB 3.88Å; R86-L112 HydrophobicContact CB-CD2 4.25Å; R86-L112 HydrophobicContact CB-CG 4.44Å; R86-L112 HydrophobicContact CG-CB 4.34Å; R86-L112 HydrophobicContact CG-CD2 4.15Å; E100-L112 CarbonylContact C-O 3.53Å; E100-L112 WeakPolarHBondContact CA-O 3.35Å; V101-L112 HydrophobicContact CG2-CB 4.42Å; V101-L112 PolarHBondContact N-O 2.88Å; V101-L112 WeakPolarHBondContact O-CB 3.17Å; V101-L112 PolarHBondContact O-N 3.03Å; F106-L112 HydrophobicContact CB-CD1 4.37Å; F106-L112 HydrophobicContact CD2-CD1 3.96Å; F106-L112 HydrophobicContact CG-CD1 4.43Å; Y108-L112 HydrophobicContact CD2-CD1 4.01Å
113	R	92.2	Very high	75.8	Confident	78 Å²	78	56.3 Å²	56.3	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	130.1	174.1	-164.3	-173.8	-62.3	175.6	2	112.4	R86 C97 L99 E100	R86-R113 WeakPolarHBondContact CB-O 2.86Å; R86-R113 WeakPolarHBondContact CD-O 3.34Å; R86-R113 PolarHBondContact N-O 2.93Å; C97-R113 VanDerWaalsContact O-CD 3.25Å; C97-R113 WeakPolarHBondContact O-CD 3.32Å; C97-R113 WeakPolarHBondContact O-CG 3.45Å; L99-R113 WeakPolarHBondContact O-CA 3.23Å; E100-R113 HydrophobicContact CG-CB 4.23Å; E100-R113 HydrophobicContact CG-CG 4.29Å; E100-R113 IonicContact OE1-NE 3.79Å; E100-R113 PolarHBondContact OE1-NE 2.61Å; E100-R113 IonicContact OE1-NH2 2.95Å
114	V	87.2	Confident	74.8	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	158.4	-172.7	-72.5	0	0	0	0	112.1	I87 C97 L99 V101 C118 H119	I87-V114 HydrophobicContact CB-CG1 4.22Å; I87-V114 HydrophobicContact CD1-CG1 3.65Å; I87-V114 HydrophobicContact CG1-CG1 3.69Å; C97-V114 WeakPolarHBondContact CA-O 3.26Å; C97-V114 PolarHBondContact SG-O 3.48Å; L99-V114 WeakPolarHBondContact O-CG2 3.49Å; L99-V114 PolarHBondContact O-N 3.47Å; V101-V114 HydrophobicContact CB-CG2 4.43Å; V101-V114 HydrophobicContact CG1-CG2 3.87Å; V101-V114 HydrophobicContact CG2-CG1 3.75Å; V101-V114 HydrophobicContact CG2-CG2 3.91Å; V114-C118 HydrophobicContact CB-CB 4.03Å; V114-C118 HydrophobicContact CG1-CB 4.31Å; V114-H119 HydrophobicContact CG2-CB 3.82Å
115	C	88	Confident	73.6	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.02	29%	0.288	C	S	.	.			trans	-73.9	164.8	170.3	64.8	0	0	0	0	112.2	C85 F92 C96 F117 C118 H119	C85-C115 HydrophobicContact CB-CB 4.4Å; C85-C115 PolarHBondContact SG-N 3.2Å; C85-C115 VanDerWaalsContact SG-N 3.45Å; F92-C115 HydrophobicContact CD1-CB 3.86Å; F92-C115 HydrophobicContact CD2-CB 4.13Å; F92-C115 HydrophobicContact CE1-CB 3.43Å; F92-C115 VanDerWaalsContact CE1-CB 3.43Å; F92-C115 HydrophobicContact CE2-CB 3.75Å; F92-C115 HydrophobicContact CG-CB 4.21Å; F92-C115 HydrophobicContact CZ-CB 3.4Å; F92-C115 VanDerWaalsContact CZ-CB 3.4Å; C96-C115 VanDerWaalsContact O-CA 3.27Å; C96-C115 WeakPolarHBondContact O-CA 3.33Å; C115-F117 VanDerWaalsContact C-N 3.26Å; C115-F117 PolarHBondContact O-N 3.49Å; C115-C118 PolarHBondContact O-N 3.31Å; C115-H119 PolarHBondContact O-N 2.87Å
116	N	82.8	Confident	72.3	Confident	48 Å²	48	60.1 Å²	60.1	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-53.9	-41.3	-179.4	-68.8	-38.8	0	0	0	112.8	E71 C96 L99 N120	E71-N116 PolarHBondContact OE1-ND2 3.47Å; C96-N116 PolarHBondContact O-N 3.32Å; L99-N116 WeakPolarHBondContact CD1-OD1 3.27Å; N116-N120 WeakPolarHBondContact O-CB 3.35Å; N116-N120 VanDerWaalsContact O-CG 3.32Å; N116-N120 PolarHBondContact O-N 2.9Å; N116-N120 PolarHBondContact O-ND2 3.29Å
117	F	72.7	Confident	70.6	Confident	115 Å²	115	63.5 Å²	63.5	50%	0.504	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-54.4	176.7	-179	-93.8	0	0	0	112.2	C115 H119 N120 M121	C115-F117 VanDerWaalsContact C-N 3.26Å; C115-F117 PolarHBondContact O-N 3.49Å; F117-H119 VanDerWaalsContact C-N 3.34Å; F117-H119 PolarHBondContact O-N 3.24Å; F117-N120 PolarHBondContact O-N 3.25Å; F117-M121 PolarHBondContact O-N 2.96Å
118	C	73.4	Confident	68.9	Low	5 Å²	5	68.2 Å²	68.2	3%	0.034	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-38.2	-179.4	-70.9	0	0	0	0	112.3	I87 V114 C115 M121 V122	I87-C118 HydrophobicContact CB-CB 4.3Å; I87-C118 HydrophobicContact CD1-CB 4.3Å; I87-C118 HydrophobicContact CG2-CB 4.45Å; V114-C118 HydrophobicContact CB-CB 4.03Å; V114-C118 HydrophobicContact CG1-CB 4.31Å; C115-C118 PolarHBondContact O-N 3.31Å; C118-M121 PolarHBondContact O-N 3.47Å; C118-V122 WeakPolarHBondContact O-CG2 3.17Å; C118-V122 PolarHBondContact O-N 3.39Å
119	H	86	Confident	66.6	Low	32 Å²	32	71.9 Å²	71.9	15%	0.148	36%	0.364	C	S	.	.	H	α-helix	trans	-60.7	-47	172.6	171.7	-89.6	0	0	0	111.8	L99 V101 V114 C115 F117 M121 V122 R123	L99-H119 HydrophobicContact CB-CB 4.03Å; L99-H119 HydrophobicContact CD1-CB 3.81Å; V101-H119 HydrophobicContact CG1-CB 4.49Å; V114-H119 HydrophobicContact CG2-CB 3.82Å; C115-H119 PolarHBondContact O-N 2.87Å; F117-H119 VanDerWaalsContact C-N 3.34Å; F117-H119 PolarHBondContact O-N 3.24Å; H119-M121 PolarHBondContact O-N 3.45Å; H119-V122 PolarHBondContact O-N 2.94Å; H119-R123 VanDerWaalsContact O-CB 3.28Å; H119-R123 WeakPolarHBondContact O-CB 3.42Å; H119-R123 PolarHBondContact O-N 2.81Å
120	N	71	Confident	64.2	Low	81 Å²	81	79.4 Å²	79.4	43%	0.433	38%	0.384	S	S	.	.	H	α-helix	trans	-65.7	-36.9	179	-75.3	-18.5	0	0	0	112.4	N116 F117 R123 N124	N116-N120 WeakPolarHBondContact O-CB 3.35Å; N116-N120 VanDerWaalsContact O-CG 3.32Å; N116-N120 PolarHBondContact O-N 2.9Å; N116-N120 PolarHBondContact O-ND2 3.29Å; F117-N120 PolarHBondContact O-N 3.25Å; N120-R123 PolarHBondContact O-N 3.24Å; N120-N124 WeakPolarHBondContact O-CB 3.29Å; N120-N124 PolarHBondContact O-N 3.17Å; N120-N124 PolarHBondContact O-ND2 2.78Å
121	M	64.1	Low	61.7	Low	66 Å²	66	82.3 Å²	82.3	33%	0.325	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-50	172.7	-171.2	-178.9	77.1	0	0	111.4	F117 C118 H119 R123 N124 N125	F117-M121 PolarHBondContact O-N 2.96Å; C118-M121 PolarHBondContact O-N 3.47Å; H119-M121 PolarHBondContact O-N 3.45Å; M121-R123 PolarHBondContact O-N 2.81Å; M121-N124 PolarHBondContact O-N 2.66Å; M121-N125 PolarHBondContact O-N 2.83Å; M121-N125 VanDerWaalsContact O-N 3.09Å
122	V	63.5	Low	58.8	Low	15 Å²	15	81.7 Å²	81.7	9%	0.091	42%	0.417	C	S	.	.	H	α-helix	trans	-64	-40.7	176.8	171.2	0	0	0	0	112	I87 V101 L105 F106 C118 H119 N125 R126	I87-V122 HydrophobicContact CD1-CG2 3.96Å; V101-V122 HydrophobicContact CB-CG1 4.17Å; V101-V122 HydrophobicContact CG1-CB 4.14Å; V101-V122 HydrophobicContact CG1-CG1 3.94Å; L105-V122 HydrophobicContact CD1-CG1 3.51Å; F106-V122 HydrophobicContact CE2-CG2 4.34Å; F106-V122 HydrophobicContact CZ-CG2 3.81Å; C118-V122 WeakPolarHBondContact O-CG2 3.17Å; C118-V122 PolarHBondContact O-N 3.39Å; H119-V122 PolarHBondContact O-N 2.94Å; V122-N125 PolarHBondContact O-N 3.25Å; V122-R126 PolarHBondContact O-N 3.24Å
123	R	64.1	Low	56	Low	160 Å²	160	88.9 Å²	88.9	60%	0.604	46%	0.455	S	S	*	.	H	α-helix	trans	-66.4	-40.1	179.4	-176.9	171.7	177.7	145.5	-1.7	112.4	H119 N120 M121 R126	H119-R123 VanDerWaalsContact O-CB 3.28Å; H119-R123 WeakPolarHBondContact O-CB 3.42Å; H119-R123 PolarHBondContact O-N 2.81Å; N120-R123 PolarHBondContact O-N 3.24Å; M121-R123 PolarHBondContact O-N 2.81Å; R123-R126 PolarHBondContact O-N 3.39Å
124	N	50.2	Low	52.9	Low	98 Å²	98	90.7 Å²	90.7	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-69.6	-41.6	177.6	-69.6	-17.6	0	0	0	111.3	N120 M121 R126 L127	N120-N124 WeakPolarHBondContact O-CB 3.29Å; N120-N124 PolarHBondContact O-N 3.17Å; N120-N124 PolarHBondContact O-ND2 2.78Å; M121-N124 PolarHBondContact O-N 2.66Å; N124-R126 PolarHBondContact O-N 2.84Å; N124-L127 PolarHBondContact O-N 3.34Å; N124-L127 VanDerWaalsContact O-N 3.14Å
125	N	47.4	Very low	50	Low	98 Å²	98	97.8 Å²	97.8	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-70.1	-15.8	175.3	-72.9	-9.7	0	0	0	113.9	M121 V122 L127 T128	M121-N125 PolarHBondContact O-N 2.83Å; M121-N125 VanDerWaalsContact O-N 3.09Å; V122-N125 PolarHBondContact O-N 3.25Å; N125-L127 VanDerWaalsContact C-N 3.33Å; N125-T128 PolarHBondContact O-OG1 2.91Å; N125-T128 VanDerWaalsContact O-OG1 3.07Å
126	R	39	Very low	47.1	Very low	122 Å²	122	103.7 Å²	103.7	46%	0.46	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-10.7	170.1	-89.1	-178.6	160.7	-175.6	-4.1	114.5	V122 R123 N124 T129	V122-R126 PolarHBondContact O-N 3.24Å; R123-R126 PolarHBondContact O-N 3.39Å; N124-R126 PolarHBondContact O-N 2.84Å; R126-T129 PolarHBondContact O-OG1 2.89Å
127	L	30	Very low	44.7	Very low	138 Å²	138	104.8 Å²	104.8	72%	0.723	58%	0.578	S	S	*	*	S	Bend	trans	-84.1	-17.5	178.8	-74.3	167.3	0	0	0	113.7	N124 N125	N124-L127 PolarHBondContact O-N 3.34Å; N124-L127 VanDerWaalsContact O-N 3.14Å; N125-L127 VanDerWaalsContact C-N 3.33Å
128	T	31.4	Very low	42.5	Very low	119 Å²	119	108.5 Å²	108.5	73%	0.73	59%	0.594	S	S	*	*	S	Bend	trans	-86.9	-8.9	177.9	51.7	0	0	0	0	114	N125	N125-T128 PolarHBondContact O-OG1 2.91Å; N125-T128 VanDerWaalsContact O-OG1 3.07Å
129	T	29.1	Very low	40.3	Very low	107 Å²	107	111.1 Å²	111.1	66%	0.656	61%	0.613	S	S	*	*	S	Bend	trans	-111.6	9.8	-167.7	38.5	0	0	0	0	114.5	R126	R126-T129 PolarHBondContact O-OG1 2.89Å
130	R	25.4	Very low	37.4	Very low	230 Å²	230	116.9 Å²	116.9	87%	0.868	64%	0.638	S	S	*	*			trans	-109.3	35.8	-168	-133.8	178.7	-176.8	-159.1	-2.7	116.9
131	T	25.9	Very low	35.4	Very low	120 Å²	120	121.9 Å²	121.9	74%	0.736	66%	0.655	S	S	*	*	S	Bend	trans	-145.4	100.5	160.8	52.6	0	0	0	0	110.8
132	G	25.8	Very low	33.6	Very low	77 Å²	77	124 Å²	124	79%	0.794	67%	0.668	S	S	*	*			trans	170.1	132.5	177.1	0	0	0	0	0	113.1
133	N	26.5	Very low	31.8	Very low	154 Å²	154	129.4 Å²	129.4	82%	0.824	70%	0.696	S	S	*	*			trans	-73.4	136.1	-174.6	-159.9	29	0	0	0	111.8	N135	N133-N135 PolarHBondContact O-N 3.17Å; N133-N135 VanDerWaalsContact O-N 3.07Å
134	P	28	Very low	29.9	Very low	116 Å²	116	131 Å²	131	75%	0.753	71%	0.708	S	S	*	*	S	Bend	trans	-81.6	87.9	-178.4	32.4	-34.7	0	0	0	111.8
135	N	25.6	Very low	28.7	Very low	149 Å²	149	136 Å²	136	80%	0.797	72%	0.719	S	S	*	*			trans	-157.1	80.3	164.7	-121.2	-15.6	0	0	0	113.5	N133	N133-N135 PolarHBondContact O-N 3.17Å; N133-N135 VanDerWaalsContact O-N 3.07Å
136	S	27.9	Very low	27.5	Very low	127 Å²	127	135.7 Å²	135.7	89%	0.888	73%	0.725	S	S	*	*			trans	177.1	130.7	152.8	34.3	0	0	0	0	109.8
137	G	31.3	Very low	26.8	Very low	71 Å²	71	136.7 Å²	136.7	73%	0.732	74%	0.744	S	S	*	*			trans	-101.3	141.6	-178.5	0	0	0	0	0	113.4
138	K	27.1	Very low	26.6	Very low	193 Å²	193	132.9 Å²	132.9	84%	0.839	73%	0.728	S	S	*	*			trans	-168.6	129.5	153.3	-108.9	153.9	-171.8	176.7	0	113.8
139	S	27.5	Very low	26.3	Very low	61 Å²	61	132.2 Å²	132.2	43%	0.427	72%	0.719	S	S	.	*			trans	55.6	96.5	147.2	-161.2	0	0	0	0	119.6	K141 K672	S139-K141 PolarHBondContact O-N 2.9Å; S139-K672 PolarHBondContact OG-NZ 3.27Å
140	K	25.6	Very low	26.1	Very low	153 Å²	153	134.4 Å²	134.4	67%	0.665	72%	0.724	S	S	*	*	S	Bend	trans	-59	115.3	158.6	-61.3	174.7	179.5	177	0	109.8	N47	N47-K140 PolarHBondContact O-NZ 3.1Å
141	K	27.9	Very low	26.1	Very low	185 Å²	185	126.3 Å²	126.3	80%	0.804	71%	0.712	S	S	*	*			trans	-167.2	-24.7	160.1	-115.7	166.4	-175.3	179.7	0	118.3	S139 L143	S139-K141 PolarHBondContact O-N 2.9Å; K141-L143 VanDerWaalsContact C-N 3.33Å; K141-L143 PolarHBondContact O-N 3.49Å
142	D	26.5	Very low	26.5	Very low	112 Å²	112	122.9 Å²	122.9	60%	0.599	69%	0.691	S	S	*	*			trans	-83.5	37.6	-167.8	-61.7	-54.8	0	0	0	116.8
143	L	26.4	Very low	27	Very low	127 Å²	127	121.5 Å²	121.5	67%	0.665	67%	0.668	S	S	*	*			trans	-91	2.7	-171.5	-141.9	78.7	0	0	0	116	F106 K141	F106-L143 HydrophobicContact CD1-CD2 4.47Å; K141-L143 VanDerWaalsContact C-N 3.33Å; K141-L143 PolarHBondContact O-N 3.49Å
144	F	24.1	Very low	27.6	Very low	195 Å²	195	114.6 Å²	114.6	86%	0.855	63%	0.631	S	S	*	*			trans	-121.3	39.8	-168.2	-83	-81.9	0	0	0	114.9
145	R	23.4	Very low	28	Very low	203 Å²	203	112 Å²	112	77%	0.766	62%	0.615	S	S	*	*			trans	-141.9	62.1	171.2	-148.6	168.5	-171.2	165.7	4.2	115.3
146	S	24	Very low	28.2	Very low	91 Å²	91	107 Å²	107	64%	0.636	60%	0.599	S	S	*	*			trans	-140.9	106.1	157.8	60.5	0	0	0	0	109.5	P148	S146-P148 VanDerWaalsContact O-CD 3.3Å; S146-P148 WeakPolarHBondContact O-CD 3.45Å
147	V	24.1	Very low	28.5	Very low	142 Å²	142	102.6 Å²	102.6	86%	0.861	56%	0.564	S	S	*	*			trans	-65.2	119.9	169.9	179.7	0	0	0	0	107.6
148	P	24.3	Very low	28.2	Very low	59 Å²	59	103.6 Å²	103.6	38%	0.383	57%	0.565	S	S	.	*			trans	-69.3	146.5	173.4	-15.1	30.9	0	0	0	110	S146 M150	S146-P148 VanDerWaalsContact O-CD 3.3Å; S146-P148 WeakPolarHBondContact O-CD 3.45Å; P148-M150 PolarHBondContact O-N 2.82Å
149	D	26.3	Very low	28.1	Very low	104 Å²	104	99.1 Å²	99.1	56%	0.556	56%	0.559	S	S	*	*			trans	-60.1	102.7	160.8	-113.1	-38.5	0	0	0	106.9	R732	D149-R732 IonicContact OD1-CZ 3.21Å; D149-R732 IonicContact OD1-NH2 2.71Å; D149-R732 PolarHBondContact OD1-NH2 2.91Å; D149-R732 IonicContact OD2-CZ 3.45Å; D149-R732 IonicContact OD2-NH2 2.58Å; D149-R732 PolarHBondContact OD2-NH2 3.14Å
150	M	24.9	Very low	27.9	Very low	153 Å²	153	104.4 Å²	104.4	75%	0.754	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-68.8	137.3	-177.7	-72.8	-73.7	-91.1	0	0	109.3	P148	P148-M150 PolarHBondContact O-N 2.82Å
151	G	25	Very low	27.8	Very low	60 Å²	60	102.5 Å²	102.5	62%	0.619	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.5	155.5	174.2	0	0	0	0	0	111.3
152	T	33.7	Very low	27.5	Very low	48 Å²	48	101.4 Å²	101.4	29%	0.294	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-49.6	129.9	-163.6	68.7	0	0	0	0	112.2	F154 S155 P764	T152-F154 PolarHBondContact O-N 3.1Å; T152-S155 VanDerWaalsContact O-CB 3.23Å; T152-S155 WeakPolarHBondContact O-CB 3.39Å; T152-S155 PolarHBondContact O-N 2.83Å; T152-S155 PolarHBondContact O-OG 2.84Å; T152-P764 WeakPolarHBondContact CG2-O 3.26Å
153	P	36.9	Very low	27.3	Very low	49 Å²	49	100.7 Å²	100.7	32%	0.318	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65	-14.1	-175	24.4	-32.9	0	0	0	112.7	F757	P153-F757 HydrophobicContact CG-CD2 3.64Å; P153-F757 HydrophobicContact CG-CE2 3.82Å
154	F	39.1	Very low	27.1	Very low	9 Å²	9	99.7 Å²	99.7	4%	0.039	60%	0.604	C	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-7.1	174.9	-62.6	-56.6	0	0	0	114.7	T152 G156 F157 F757 L767 Y772 Y776 F858	T152-F154 PolarHBondContact O-N 3.1Å; F154-G156 PolarHBondContact O-N 2.87Å; F154-F157 WeakPolarHBondContact O-CD2 3.45Å; F154-F157 PolarHBondContact O-N 2.88Å; F154-F757 AromaticContact CE2-CE2 3.64Å; F154-F757 HydrophobicContact CE2-CE2 3.64Å; F154-F757 HydrophobicContact CE2-CZ 4.11Å; F154-F757 AromaticContact CZ-CE2 3.68Å; F154-F757 HydrophobicContact CZ-CE2 3.68Å; F154-F757 HydrophobicContact CZ-CZ 4.17Å; F154-L767 HydrophobicContact CB-CD1 4.39Å; F154-L767 HydrophobicContact CD2-CD1 3.49Å; F154-L767 VanDerWaalsContact CD2-CD1 3.49Å; F154-L767 HydrophobicContact CD2-CG 4.18Å; F154-L767 HydrophobicContact CE2-CD1 3.87Å; F154-L767 HydrophobicContact CE2-CG 4.49Å; F154-L767 HydrophobicContact CG-CD1 3.97Å; F154-Y772 HydrophobicContact CE1-CD2 4.04Å; F154-Y772 AromaticContact CE1-CE2 3.84Å; F154-Y772 HydrophobicContact CE1-CE2 3.84Å; F154-Y772 HydrophobicContact CZ-CD2 4.01Å; F154-Y772 HydrophobicContact CZ-CE2 4.08Å; F154-Y776 HydrophobicContact CB-CE1 3.57Å; F154-Y776 AromaticContact CD1-CD1 3.94Å; F154-Y776 HydrophobicContact CD1-CD1 3.94Å; F154-Y776 AromaticContact CD1-CE1 3.72Å; F154-Y776 HydrophobicContact CD1-CE1 3.72Å; F154-Y776 AromaticContact CG-CE1 3.92Å; F154-Y776 HydrophobicContact CG-CE1 3.92Å; F154-F858 HydrophobicContact CZ-CD1 4.43Å; F154-F858 HydrophobicContact CZ-CE1 4.08Å
155	S	36.7	Very low	27	Very low	60 Å²	60	100.8 Å²	100.8	42%	0.42	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-0.8	-174	59.5	0	0	0	0	116	R73 T152	R73-S155 PolarHBondContact NH2-O 2.78Å; T152-S155 VanDerWaalsContact O-CB 3.23Å; T152-S155 WeakPolarHBondContact O-CB 3.39Å; T152-S155 PolarHBondContact O-N 2.83Å; T152-S155 PolarHBondContact O-OG 2.84Å
156	G	29.9	Very low	27	Very low	45 Å²	45	96.8 Å²	96.8	46%	0.464	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.7	-6.7	174	0	0	0	0	0	116.3	F154	F154-G156 PolarHBondContact O-N 2.87Å
157	F	34.3	Very low	27	Very low	34 Å²	34	96.9 Å²	96.9	15%	0.149	61%	0.614	C	S	.	*			trans	-110.1	-14.9	-167.2	-65.9	-93.1	0	0	0	115.9	F154 S159 I752 Y776 P785 M793	F154-F157 WeakPolarHBondContact O-CD2 3.45Å; F154-F157 PolarHBondContact O-N 2.88Å; F157-S159 PolarHBondContact O-N 2.97Å; F157-I752 HydrophobicContact CZ-CD1 4.3Å; F157-Y776 HydrophobicContact CB-CD1 3.87Å; F157-Y776 HydrophobicContact CB-CE1 3.56Å; F157-Y776 HydrophobicContact CD1-CD1 4.41Å; F157-Y776 HydrophobicContact CD2-CD1 4.07Å; F157-Y776 AromaticContact CD2-CE1 3.91Å; F157-Y776 HydrophobicContact CD2-CE1 3.91Å; F157-Y776 AromaticContact CG-CD1 3.88Å; F157-Y776 HydrophobicContact CG-CD1 3.88Å; F157-Y776 AromaticContact CG-CE1 3.89Å; F157-Y776 HydrophobicContact CG-CE1 3.89Å; F157-P785 HydrophobicContact CD1-CG 4.22Å; F157-P785 HydrophobicContact CE1-CG 3.61Å; F157-P785 HydrophobicContact CE2-CG 4.22Å; F157-P785 HydrophobicContact CZ-CG 3.61Å; F157-M793 HydrophobicContact CE1-CG 4.5Å; F157-M793 HydrophobicContact CE1-SD 4.3Å
158	A	25	Very low	26.8	Very low	92 Å²	92	99.5 Å²	99.5	76%	0.76	62%	0.617	S	S	*	*			trans	-71.9	110.4	-176.1	0	0	0	0	0	112.1
159	S	24.8	Very low	26.8	Very low	100 Å²	100	100.8 Å²	100.8	70%	0.699	63%	0.632	S	S	*	*			trans	-87.5	159.9	171.7	50.8	0	0	0	0	111.9	F157 S161	F157-S159 PolarHBondContact O-N 2.97Å; S159-S161 PolarHBondContact O-N 2.91Å
160	D	22.3	Very low	26.8	Very low	171 Å²	171	104.8 Å²	104.8	91%	0.914	65%	0.653	S	S	*	*			trans	-65	128.8	-168.2	-63	-69.6	0	0	0	114
161	S	23.7	Very low	26.6	Very low	114 Å²	114	104.8 Å²	104.8	80%	0.797	66%	0.655	S	S	*	*			trans	-126.4	142.3	158.6	57.5	0	0	0	0	110.3	S159 A163	S159-S161 PolarHBondContact O-N 2.91Å; S161-A163 PolarHBondContact O-N 3.07Å
162	N	22.3	Very low	26.7	Very low	161 Å²	161	110.7 Å²	110.7	86%	0.861	66%	0.663	S	S	*	*			trans	-72.9	121.7	-155.3	-73.1	-59.4	0	0	0	115.1
163	A	23	Very low	26.3	Very low	97 Å²	97	119.1 Å²	119.1	80%	0.802	69%	0.69	S	S	*	*			trans	-141.3	42.9	164.4	0	0	0	0	0	112.3	S161 Y165	S161-A163 PolarHBondContact O-N 3.07Å; A163-Y165 PolarHBondContact O-N 2.75Å; A163-Y165 VanDerWaalsContact O-N 3.13Å
164	S	20.4	Very low	25.8	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	70%	0.701	S	S	*	*			trans	-77.9	91.3	180	46.1	0	0	0	0	112.8
165	Y	23.6	Very low	25.1	Very low	219 Å²	219	128.8 Å²	128.8	86%	0.859	74%	0.738	S	S	*	*			trans	-105.9	143.2	159.5	-90.1	-84.7	0	0	0	111.3	A163	A163-Y165 PolarHBondContact O-N 2.75Å; A163-Y165 VanDerWaalsContact O-N 3.13Å
166	S	23.1	Very low	24.5	Very low	118 Å²	118	132.1 Å²	132.1	83%	0.825	76%	0.756	S	S	*	*			trans	-74.6	140	-161.5	49	0	0	0	0	114.2
167	A	22.8	Very low	24.3	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	76%	0.764	S	S	*	*			trans	-132.7	30.8	171.2	0	0	0	0	0	111.9
168	E	21.4	Very low	23.8	Very low	197 Å²	197	141.3 Å²	141.3	92%	0.921	79%	0.794	S	S	*	*			trans	-104.3	50.7	179.3	-161.5	158.7	-134.7	0	0	111.5
169	A	23.7	Very low	23.8	Very low	86 Å²	86	146.8 Å²	146.8	71%	0.711	80%	0.795	S	S	*	*			trans	-146.6	89.4	175	0	0	0	0	0	110.4
170	L	25.6	Very low	23.7	Very low	187 Å²	187	149.1 Å²	149.1	98%	0.979	80%	0.795	S	S	*	*			trans	158.3	91.1	148.8	-88.2	166.1	0	0	0	110.1
171	L	22.2	Very low	23.9	Very low	154 Å²	154	150 Å²	150	81%	0.806	79%	0.793	S	S	*	*			trans	-127.1	139.7	168	-142.4	168.3	0	0	0	107.2
172	K	25.2	Very low	24	Very low	183 Å²	183	149.9 Å²	149.9	80%	0.796	79%	0.793	S	S	*	*			trans	78.1	102	176.1	-47.7	174.3	-177	175.2	0	116.6
173	R	27.3	Very low	24	Very low	225 Å²	225	146.6 Å²	146.6	85%	0.849	79%	0.788	S	S	*	*				168.3	144.5	118.9	-93.4	-171.5	164.5	107.1	-1.2	110.1
174	D	25.3	Very low	24.6	Very low	104 Å²	104	147.1 Å²	147.1	56%	0.556	78%	0.783	S	S	*	*			cis	-133.2	174.9	8.2	-81.9	-57	0	0	0	112.9
175	I	23.7	Very low	24.8	Very low	157 Å²	157	149.7 Å²	149.7	81%	0.805	79%	0.788	S	S	*	*			trans	-138.4	161.9	169.8	-43.4	176.8	0	0	0	106.8
176	V	24.9	Very low	24.8	Very low	131 Å²	131	142.5 Å²	142.5	79%	0.794	77%	0.773	S	S	*	*			trans	77.8	132.6	168.1	-176.2	0	0	0	0	114.3
177	S	24.9	Very low	24.9	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	78%	0.775	S	S	*	*			cis	-168.9	163.4	-13	55.7	0	0	0	0	112
178	K	25.7	Very low	25	Very low	179 Å²	179	143.9 Å²	143.9	78%	0.778	77%	0.769	S	S	*	*				176.6	120.6	124.7	-96.6	169.7	-177.5	-178.7	0	109.7
179	R	24.2	Very low	25.3	Very low	206 Å²	206	140 Å²	140	78%	0.777	76%	0.764	S	S	*	*				72.4	116.3	101.3	-72.6	-152.7	155.2	145.7	4.2	113.9
180	E	21.8	Very low	25.5	Very low	150 Å²	150	140.5 Å²	140.5	70%	0.701	76%	0.762	S	S	*	*			cis	105.9	149.2	49.8	-88.5	175.6	151.3	0	0	110.1
181	H	27.2	Very low	25.5	Very low	189 Å²	189	139 Å²	139	88%	0.875	75%	0.754	S	S	*	*			trans	102	137	-169.5	-60.2	-62	0	0	0	114.1
182	S	26.1	Very low	25.9	Very low	112 Å²	112	137.9 Å²	137.9	78%	0.783	75%	0.749	S	S	*	*			cis	-170.8	155	-24	40.7	0	0	0	0	109.6
183	A	22	Very low	26.1	Very low	91 Å²	91	136.3 Å²	136.3	75%	0.752	75%	0.749	S	S	*	*			trans	-117.6	-159.4	171.3	0	0	0	0	0	109.3
184	P	36	Very low	26.1	Very low	108 Å²	108	133 Å²	133	70%	0.701	75%	0.749	S	S	*	*			cis	-134.7	-156.4	-18.1	21.7	5.6	0	0	0	113.7
185	L	23.8	Very low	26.2	Very low	161 Å²	161	131.2 Å²	131.2	84%	0.843	76%	0.755	S	S	*	*			trans	80.5	153.9	165	-71.7	101.1	0	0	0	120.3
186	A	24.9	Very low	26.4	Very low	67 Å²	67	131.2 Å²	131.2	55%	0.554	76%	0.756	S	S	*	*			cis	-177	163.3	-26.8	0	0	0	0	0	113
187	N	24.2	Very low	26.4	Very low	161 Å²	161	129.6 Å²	129.6	86%	0.861	75%	0.751	S	S	*	*			trans	68.9	156.1	149	-70.2	4.5	0	0	0	120
188	A	25.4	Very low	26.5	Very low	80 Å²	80	130.9 Å²	130.9	66%	0.661	76%	0.758	S	S	*	*			cis	-163.2	175.9	-2.5	0	0	0	0	0	113.1
189	S	26.7	Very low	26.3	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	76%	0.757	S	S	*	*			trans	69.4	146.4	155.3	45.5	0	0	0	0	120.5
190	S	28.2	Very low	26.3	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	76%	0.756	S	S	*	*			cis	-173.7	141.2	-10.4	47.3	0	0	0	0	113.4
191	L	25.5	Very low	26.4	Very low	155 Å²	155	128.3 Å²	128.3	81%	0.812	77%	0.765	S	S	*	*			trans	56.1	164.9	140.9	-55.1	171.2	0	0	0	119.9
192	D	30.4	Very low	26.3	Very low	132 Å²	132	128.2 Å²	128.2	71%	0.706	77%	0.765	S	S	*	*			cis	-135.1	166.5	8.9	-60.6	-83.1	0	0	0	112.2
193	D	29.4	Very low	26.1	Very low	149 Å²	149	128.5 Å²	128.5	80%	0.797	77%	0.767	S	S	*	*			trans	43.4	147.3	141.9	-71.9	10.6	0	0	0	123.4
194	D	27.7	Very low	26.3	Very low	157 Å²	157	128.8 Å²	128.8	84%	0.84	77%	0.77	S	S	*	*			cis	-166.2	166.1	-13.6	-168.8	4.1	0	0	0	107.5
195	G	28.3	Very low	25.9	Very low	66 Å²	66	128.5 Å²	128.5	68%	0.68	78%	0.776	S	S	*	*			trans	154.5	47.8	171.3	0	0	0	0	0	122.7
196	D	27.6	Very low	26	Very low	156 Å²	156	129.1 Å²	129.1	83%	0.834	78%	0.78	S	S	*	*			trans	68.1	174.3	152.7	-136.8	-24.5	0	0	0	120.8
197	S	24.3	Very low	26	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	78%	0.778	S	S	*	*			trans	-110.1	-179.4	-160.8	64.8	0	0	0	0	111.2
198	C	26.6	Very low	26.1	Very low	120 Å²	120	128.5 Å²	128.5	81%	0.811	77%	0.774	S	S	*	*			cis	-156.1	-179	27.7	-157.7	0	0	0	0	114
199	L	22.9	Very low	26.5	Very low	142 Å²	142	132.6 Å²	132.6	74%	0.743	78%	0.777	S	S	*	*			trans	-77.9	155.2	-174.8	-68	160.6	0	0	0	113.9
200	I	23	Very low	26.7	Very low	147 Å²	147	135 Å²	135	75%	0.754	78%	0.775	S	S	*	*			trans	29.6	114.3	136.8	-51.3	166.8	0	0	0	117.3
201	E	24.3	Very low	26.9	Very low	193 Å²	193	136.5 Å²	136.5	90%	0.902	78%	0.776	S	S	*	*				-157.3	167.1	126.2	-123.2	170.1	-151.4	0	0	112.6
202	E	24.4	Very low	27.7	Very low	187 Å²	187	133 Å²	133	87%	0.874	75%	0.754	S	S	*	*			trans	-91.7	133.4	-176.2	-56.8	173.4	117.6	0	0	111.3
203	S	23.2	Very low	28.2	Very low	117 Å²	117	130 Å²	130	82%	0.818	74%	0.74	S	S	*	*			trans	-168.8	142.5	151.8	51.7	0	0	0	0	115.1
204	A	25.7	Very low	28.6	Very low	98 Å²	98	129.7 Å²	129.7	81%	0.81	74%	0.739	S	S	*	*			trans	33.4	108.3	146	0	0	0	0	0	120.1
205	A	27.4	Very low	29.5	Very low	102 Å²	102	125.8 Å²	125.8	84%	0.843	72%	0.718	S	S	*	*			trans	-142.7	25.6	155.3	0	0	0	0	0	113.1	G207	A205-G207 PolarHBondContact O-N 3.19Å
206	D	25.4	Very low	30.5	Very low	173 Å²	173	127.5 Å²	127.5	93%	0.925	72%	0.717	S	S	*	*			trans	-67.4	112.7	165.4	-72.3	-58.5	0	0	0	108.4
207	G	24.7	Very low	31.7	Very low	49 Å²	49	121.2 Å²	121.2	51%	0.505	68%	0.683	S	S	.	*			trans	-151.7	110.5	-167	0	0	0	0	0	114	A205	A205-G207 PolarHBondContact O-N 3.19Å
208	H	27.7	Very low	33.2	Very low	167 Å²	167	117.5 Å²	117.5	77%	0.773	66%	0.656	S	S	*	*	S	Bend	trans	61.2	69	165.8	-60	-76.3	0	0	0	116.8
209	F	33.4	Very low	35	Very low	166 Å²	166	119.6 Å²	119.6	73%	0.728	65%	0.654	S	S	*	*	S	Bend	trans	-143.1	3.5	148.8	-127.5	-83.6	0	0	0	115
210	E	30.6	Very low	37.5	Very low	165 Å²	165	114.6 Å²	114.6	77%	0.771	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-80.4	-23.8	-178.3	-63.8	-175.1	125.2	0	0	113.3	F212 V213	E210-F212 PolarHBondContact O-N 3.36Å; E210-V213 PolarHBondContact O-N 2.93Å
211	N	32.6	Very low	39.5	Very low	129 Å²	129	107.6 Å²	107.6	69%	0.69	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-66.8	6.2	-173.3	-62.2	33.3	0	0	0	116
212	F	41.9	Very low	41.3	Very low	82 Å²	82	104.6 Å²	104.6	36%	0.36	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-94.9	1.6	178.5	-92.2	-79.9	0	0	0	114.5	E210	E210-F212 PolarHBondContact O-N 3.36Å
213	V	40.3	Very low	43	Very low	67 Å²	67	101 Å²	101	41%	0.406	55%	0.553	S	S	.	*	S	Bend	trans	-115.2	-35.3	-175.3	-174.4	0	0	0	0	113.1	E210 D215	E210-V213 PolarHBondContact O-N 2.93Å; V213-D215 PolarHBondContact O-N 3.18Å
214	D	37.8	Very low	44.5	Very low	144 Å²	144	96.5 Å²	96.5	77%	0.77	52%	0.519	S	S	*	.			trans	-95.2	40	-172	-67.1	-31.2	0	0	0	114.4
215	D	47	Very low	45.4	Very low	75 Å²	75	97.4 Å²	97.4	40%	0.401	51%	0.507	S	S	.	.			trans	-58.5	145	162.1	-93	-37.7	0	0	0	110.1	V213 E217 K1201	V213-D215 PolarHBondContact O-N 3.18Å; D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 3.16Å; D215-K1201 IonicContact OD2-NZ 3.61Å; D215-K1201 PolarHBondContact OD2-NZ 3.24Å
216	P	49.5	Very low	46.1	Very low	101 Å²	101	96.4 Å²	96.4	66%	0.656	50%	0.498	S	S	*	.			trans	-72	82.7	174.5	30.7	-34.2	0	0	0	111.2
217	E	53.3	Low	46.8	Very low	25 Å²	25	91.6 Å²	91.6	12%	0.117	48%	0.483	C	S	.	.			trans	-46.2	137.6	166.8	-69.7	-171.4	162	0	0	110.1	D215 E219 L221 R222 R1300 K1313	D215-E217 VanDerWaalsContact C-N 3.28Å; D215-E217 PolarHBondContact O-N 3.16Å; E217-E219 PolarHBondContact O-N 2.91Å; E217-L221 HydrophobicContact CB-CD2 4.39Å; E217-R222 HydrophobicContact CB-CG 4.13Å; E217-R222 WeakPolarHBondContact O-CD 3.33Å; E217-R222 PolarHBondContact O-NE 3.01Å; E217-R1300 IonicContact OE1-CZ 2.63Å; E217-R1300 IonicContact OE1-NH1 2.66Å; E217-R1300 PolarHBondContact OE1-NH1 3.4Å; E217-K1313 WeakPolarHBondContact OE1-CE 3.36Å; E217-K1313 IonicContact OE1-NZ 3.67Å; E217-K1313 PolarHBondContact OE1-NZ 3.35Å; E217-K1313 IonicContact OE2-NZ 2.74Å; E217-K1313 PolarHBondContact OE2-NZ 3Å
218	P	56	Low	47.1	Very low	19 Å²	19	95.5 Å²	95.5	12%	0.123	49%	0.492	C	S	.	.			trans	-56.9	140.6	-173.7	23.3	-34.3	0	0	0	111.1	W220 L221 R222 Y1199	P218-W220 VanDerWaalsContact C-N 3.26Å; P218-W220 PolarHBondContact O-N 2.85Å; P218-W220 VanDerWaalsContact O-N 3.09Å; P218-L221 HydrophobicContact CG-CB 4.12Å; P218-L221 WeakPolarHBondContact O-CA 3.4Å; P218-L221 VanDerWaalsContact O-CB 3.3Å; P218-L221 WeakPolarHBondContact O-CB 3.05Å; P218-L221 PolarHBondContact O-N 3.37Å; P218-R222 PolarHBondContact O-N 3.04Å; P218-Y1199 HydrophobicContact CG-CD2 3.8Å; P218-Y1199 HydrophobicContact CG-CE2 3.92Å
219	E	64.9	Low	47.1	Very low	164 Å²	164	95.1 Å²	95.1	77%	0.766	50%	0.495	S	S	*	.	H	α-helix	trans	-53.6	-41	-163.6	-167.6	166.4	-153.6	0	0	113.2	E217 L221 R222 E223	E217-E219 PolarHBondContact O-N 2.91Å; E219-L221 VanDerWaalsContact C-N 3.25Å; E219-L221 PolarHBondContact O-N 2.88Å; E219-R222 WeakPolarHBondContact O-CB 3.45Å; E219-R222 PolarHBondContact O-N 3.35Å; E219-E223 PolarHBondContact O-N 3.28Å
220	W	75.3	Confident	46.7	Very low	36 Å²	36	94.5 Å²	94.5	14%	0.136	50%	0.499	C	S	.	.	H	α-helix	trans	-63.1	-24	177.5	67.8	-99.5	0	0	0	115	P218 I224 Q1197 K1304	P218-W220 VanDerWaalsContact C-N 3.26Å; P218-W220 PolarHBondContact O-N 2.85Å; P218-W220 VanDerWaalsContact O-N 3.09Å; W220-I224 HydrophobicContact CE3-CD1 4.25Å; W220-I224 HydrophobicContact CZ3-CD1 4.19Å; W220-Q1197 HydrophobicContact CH2-CB 4.11Å; W220-Q1197 HydrophobicContact CZ2-CB 3.88Å; W220-K1304 HydrophobicContact CB-CD 4.33Å; W220-K1304 HydrophobicContact CE3-CB 3.61Å; W220-K1304 HydrophobicContact CE3-CD 3.8Å; W220-K1304 HydrophobicContact CE3-CG 4.39Å; W220-K1304 HydrophobicContact CZ3-CB 3.51Å
221	L	63.9	Low	46.5	Very low	0 Å²	0	92.9 Å²	92.9	0%	0	50%	0.5	C	S	.	.	H	α-helix	trans	-84.8	-29.2	178.8	-163.2	83	0	0	0	111.3	E217 P218 E219 I224 Y1199 K1313	E217-L221 HydrophobicContact CB-CD2 4.39Å; P218-L221 HydrophobicContact CG-CB 4.12Å; P218-L221 WeakPolarHBondContact O-CA 3.4Å; P218-L221 VanDerWaalsContact O-CB 3.3Å; P218-L221 WeakPolarHBondContact O-CB 3.05Å; P218-L221 PolarHBondContact O-N 3.37Å; E219-L221 VanDerWaalsContact C-N 3.25Å; E219-L221 PolarHBondContact O-N 2.88Å; L221-I224 HydrophobicContact CD1-CD1 4.02Å; L221-I224 PolarHBondContact O-N 2.82Å; L221-Y1199 HydrophobicContact CD2-CD1 4.21Å; L221-Y1199 HydrophobicContact CD2-CD2 4.12Å; L221-Y1199 HydrophobicContact CD2-CE1 4.26Å; L221-Y1199 HydrophobicContact CD2-CE2 4.15Å; L221-Y1199 HydrophobicContact CD2-CG 4.14Å; L221-K1313 HydrophobicContact CD2-CD 4.33Å; L221-K1313 HydrophobicContact CG-CD 4.29Å
222	R	61.8	Low	46.1	Very low	131 Å²	131	94.2 Å²	94.2	49%	0.494	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-37.9	174.7	-68.1	176.2	158.2	-162.5	-11.3	111.6	E217 P218 E219 I224 Q225	E217-R222 HydrophobicContact CB-CG 4.13Å; E217-R222 WeakPolarHBondContact O-CD 3.33Å; E217-R222 PolarHBondContact O-NE 3.01Å; P218-R222 PolarHBondContact O-N 3.04Å; E219-R222 WeakPolarHBondContact O-CB 3.45Å; E219-R222 PolarHBondContact O-N 3.35Å; R222-I224 PolarHBondContact O-N 2.9Å; R222-Q225 PolarHBondContact O-N 2.84Å
223	E	60.8	Low	45.2	Very low	111 Å²	111	99.6 Å²	99.6	52%	0.519	53%	0.531	S	S	.	.	H	α-helix	trans	-54.8	-36.8	174.5	-65.5	-179.5	150.9	0	0	112.9	E219 Q225 A226 A227 K1304	E219-E223 PolarHBondContact O-N 3.28Å; E223-Q225 VanDerWaalsContact C-N 3.28Å; E223-Q225 PolarHBondContact O-N 2.92Å; E223-A226 WeakPolarHBondContact O-CB 3.36Å; E223-A226 PolarHBondContact O-N 2.57Å; E223-A226 VanDerWaalsContact O-N 3.08Å; E223-A227 PolarHBondContact O-N 2.91Å; E223-K1304 IonicContact OE2-NZ 3.08Å; E223-K1304 PolarHBondContact OE2-NZ 3.18Å
224	I	55.4	Low	44.5	Very low	22 Å²	22	103.4 Å²	103.4	11%	0.113	55%	0.548	C	S	.	.	H	α-helix	trans	-62.2	-38.2	-178	-56	171.5	0	0	0	110.6	W220 L221 R222 A226 A227 K1304 A1311	W220-I224 HydrophobicContact CE3-CD1 4.25Å; W220-I224 HydrophobicContact CZ3-CD1 4.19Å; L221-I224 HydrophobicContact CD1-CD1 4.02Å; L221-I224 PolarHBondContact O-N 2.82Å; R222-I224 PolarHBondContact O-N 2.9Å; I224-A226 VanDerWaalsContact C-N 3.27Å; I224-A226 PolarHBondContact O-N 3.06Å; I224-A227 PolarHBondContact O-N 3.34Å; I224-K1304 HydrophobicContact CD1-CB 4.5Å; I224-A1311 HydrophobicContact CD1-CB 4.02Å; I224-A1311 HydrophobicContact CG1-CB 4.04Å; I224-A1311 HydrophobicContact CG2-CB 3.97Å
225	Q	44.7	Very low	43.8	Very low	118 Å²	118	103.4 Å²	103.4	55%	0.551	55%	0.548	S	S	*	.	H	α-helix	trans	-72.8	-18.2	178.4	-65.7	-170.8	-55.5	0	0	113.6	R222 E223 K1313	R222-Q225 PolarHBondContact O-N 2.84Å; E223-Q225 VanDerWaalsContact C-N 3.28Å; E223-Q225 PolarHBondContact O-N 2.92Å; Q225-K1313 HydrophobicContact CG-CD 4.35Å; Q225-K1313 VanDerWaalsContact NE2-NZ 3.18Å
226	A	42	Very low	42.7	Very low	80 Å²	80	106.7 Å²	106.7	66%	0.661	56%	0.561	S	S	*	*	H	α-helix	trans	-80.8	-18.6	173.7	0	0	0	0	0	113	E223 I224	E223-A226 WeakPolarHBondContact O-CB 3.36Å; E223-A226 PolarHBondContact O-N 2.57Å; E223-A226 VanDerWaalsContact O-N 3.08Å; I224-A226 VanDerWaalsContact C-N 3.27Å; I224-A226 PolarHBondContact O-N 3.06Å
227	A	40.1	Very low	41.5	Very low	73 Å²	73	112 Å²	112	60%	0.603	57%	0.57	S	S	*	*	H	α-helix	trans	-81.9	-28.3	-179.6	0	0	0	0	0	113.8	E223 I224 L229	E223-A227 PolarHBondContact O-N 2.91Å; I224-A227 PolarHBondContact O-N 3.34Å; A227-L229 VanDerWaalsContact C-N 3.25Å; A227-L229 PolarHBondContact O-N 3.27Å; A227-L229 VanDerWaalsContact O-N 3.12Å
228	D	31	Very low	40	Very low	131 Å²	131	115.5 Å²	115.5	70%	0.701	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	10.1	-167.9	-102.1	-13.6	0	0	0	115.7
229	L	27.7	Very low	38.6	Very low	158 Å²	158	122.3 Å²	122.3	83%	0.827	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	13	-179.5	-78.3	175.2	0	0	0	114.9	A227	A227-L229 VanDerWaalsContact C-N 3.25Å; A227-L229 PolarHBondContact O-N 3.27Å; A227-L229 VanDerWaalsContact O-N 3.12Å
230	N	24.9	Very low	36.7	Very low	153 Å²	153	122 Å²	122	82%	0.818	63%	0.633	S	S	*	*			trans	-147	49.4	-171.7	-130.9	-13.2	0	0	0	115.9
231	V	26.6	Very low	34.4	Very low	131 Å²	131	125.9 Å²	125.9	79%	0.794	67%	0.666	S	S	*	*			trans	-130.7	69.5	170.6	-165.6	0	0	0	0	111.5
232	D	23.2	Very low	32.6	Very low	158 Å²	158	131.6 Å²	131.6	85%	0.845	71%	0.706	S	S	*	*			trans	-133.8	37.1	170.4	-151.7	9.4	0	0	0	112.1
233	F	23.2	Very low	31	Very low	195 Å²	195	130.6 Å²	130.6	86%	0.855	72%	0.719	S	S	*	*			trans	-144.9	105.3	173.6	-96.8	-82.5	0	0	0	111.5
234	L	26	Very low	29.5	Very low	146 Å²	146	131.7 Å²	131.7	76%	0.764	73%	0.733	S	S	*	*				178.8	88.2	118.4	-97.4	168.3	0	0	0	110.5	Y237	L234-Y237 HydrophobicContact CD2-CD2 4.41Å
235	N	22.1	Very low	28.3	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	77%	0.766	S	S	*	*			trans	-90.9	131.6	160.6	-147	-6.8	0	0	0	107.9
236	H	23.6	Very low	27.5	Very low	144 Å²	144	137.6 Å²	137.6	67%	0.667	78%	0.775	S	S	*	*			trans	58.1	110.3	-179.5	-62.7	-78.8	0	0	0	118.9
237	Y	24.4	Very low	27	Very low	214 Å²	214	141.1 Å²	141.1	84%	0.839	78%	0.778	S	S	*	*				-126	113.7	126.5	-103	-82.3	0	0	0	109.5	L234	L234-Y237 HydrophobicContact CD2-CD2 4.41Å
238	S	23.5	Very low	26.4	Very low	98 Å²	98	143.8 Å²	143.8	69%	0.685	79%	0.787	S	S	*	*			trans	-101.3	114.1	169.8	-61.1	0	0	0	0	108.6
239	I	25.7	Very low	26.2	Very low	162 Å²	162	141.5 Å²	141.5	83%	0.831	79%	0.786	S	S	*	*			trans	-89.8	107.4	168.1	-62.4	179.3	0	0	0	107.8
240	L	24.5	Very low	26.2	Very low	157 Å²	157	145 Å²	145	82%	0.822	79%	0.788	S	S	*	*			trans	-85	127.6	164.2	-83.6	164.8	0	0	0	109.2
241	S	26.9	Very low	26.2	Very low	117 Å²	117	142.6 Å²	142.6	82%	0.818	78%	0.783	S	S	*	*			trans	-74.5	153.7	156.8	48.5	0	0	0	0	109.9
242	S	25.6	Very low	26.2	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	78%	0.779	S	S	*	*			trans	-111.1	122.2	-156.8	48.5	0	0	0	0	115.7
243	S	29.6	Very low	26.3	Very low	111 Å²	111	143 Å²	143	78%	0.776	77%	0.774	S	S	*	*			trans	-169.3	139	150.1	50.5	0	0	0	0	109.4
244	T	29.1	Very low	26.5	Very low	133 Å²	133	139.9 Å²	139.9	82%	0.816	76%	0.762	S	S	*	*			cis	-148.7	149.8	-20.1	25.5	0	0	0	0	106.7
245	P	29.7	Very low	26.5	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	76%	0.76	S	S	*	*			trans	-94	152.9	-168.2	36	-34.8	0	0	0	114.3
246	D	29	Very low	26.8	Very low	141 Å²	141	139 Å²	139	75%	0.754	76%	0.757	S	S	*	*			trans	-155.5	130.7	141.2	-122.9	-18.8	0	0	0	116.4
247	Q	30	Very low	27	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.724	77%	0.765	S	S	*	*			trans	46.8	117.2	148.4	-73.4	169.9	75.1	0	0	126.6
248	V	28.2	Very low	27.2	Very low	128 Å²	128	132.9 Å²	132.9	78%	0.776	76%	0.762	S	S	*	*				77.9	96.4	118.9	-178	0	0	0	0	121.9
249	A	27.1	Very low	27.4	Very low	83 Å²	83	135.8 Å²	135.8	69%	0.686	78%	0.775	S	S	*	*				64.1	126.1	120.2	0	0	0	0	0	125.4
250	R	26.3	Very low	27.5	Very low	233 Å²	233	131.8 Å²	131.8	88%	0.879	77%	0.774	S	S	*	*			trans	74.9	104.1	131.1	-75.4	-177.4	179.9	173.8	1	122.4
251	S	25.8	Very low	27.5	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	78%	0.775	S	S	*	*				76.5	116.4	121	66.5	0	0	0	0	123.2
252	S	25.7	Very low	27.6	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	77%	0.772	S	S	*	*				87.8	112.6	122.8	64.8	0	0	0	0	123
253	R	26	Very low	27.6	Very low	197 Å²	197	130.4 Å²	130.4	74%	0.743	78%	0.776	S	S	*	*			trans	83.3	127	133.4	-67.1	177.9	94.2	129.7	18.7	120.9
254	E	27.5	Very low	27.2	Very low	131 Å²	131	134.3 Å²	134.3	61%	0.612	78%	0.779	S	S	*	*			trans	61.6	133.9	130	-62.8	158.1	-175.9	0	0	118.8
255	D	26.9	Very low	27	Very low	133 Å²	133	135 Å²	135	71%	0.711	78%	0.778	S	S	*	*			cis	-164.9	161.2	-6.4	-125.2	-17.7	0	0	0	113.9
256	L	26.9	Very low	26.6	Very low	138 Å²	138	135.1 Å²	135.1	72%	0.723	78%	0.776	S	S	*	*			trans	70.7	145.6	149.1	-69.1	168.9	0	0	0	125.9
257	D	27.8	Very low	26.5	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	78%	0.778	S	S	*	*			trans	68.5	125.5	153	-64.3	-22.3	0	0	0	123.7
258	G	28.5	Very low	26.1	Very low	74 Å²	74	135.3 Å²	135.3	76%	0.763	78%	0.781	S	S	*	*			trans	-169.7	-1.4	-178.4	0	0	0	0	0	120.3
259	V	27.9	Very low	26	Very low	159 Å²	159	137.8 Å²	137.8	96%	0.964	78%	0.784	S	S	*	*			trans	63.2	120.8	167.3	-176.4	0	0	0	0	119.6
260	G	28.1	Very low	25.8	Very low	78 Å²	78	139.7 Å²	139.7	80%	0.804	79%	0.786	S	S	*	*			trans	141	131.4	156.8	0	0	0	0	0	114.2
261	G	25.8	Very low	25.9	Very low	82 Å²	82	133.7 Å²	133.7	85%	0.845	78%	0.78	S	S	*	*			cis	174.1	97.2	-6.1	0	0	0	0	0	113.6
262	G	27.4	Very low	25.9	Very low	75 Å²	75	137 Å²	137	77%	0.773	79%	0.785	S	S	*	*			trans	85.1	166.7	178.1	0	0	0	0	0	114.7
263	K	26.7	Very low	26	Very low	209 Å²	209	139.2 Å²	139.2	91%	0.909	79%	0.789	S	S	*	*			cis	-163.5	166.1	-16.1	-135.1	-179.8	-177.6	-176.2	0	108.1
264	F	21.6	Very low	26	Very low	193 Å²	193	138.1 Å²	138.1	85%	0.846	79%	0.792	S	S	*	*			trans	-58.5	145.3	164.9	-88.8	-120.5	0	0	0	110.5
265	D	24.3	Very low	26	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	80%	0.802	S	S	*	*				-154.8	155.7	124.9	-125	-30.8	0	0	0	113.2
266	V	22	Very low	26	Very low	125 Å²	125	135.9 Å²	135.9	76%	0.758	80%	0.804	S	S	*	*			trans	-110.6	117.9	173.1	171.9	0	0	0	0	107.9
267	Q	25.6	Very low	26	Very low	173 Å²	173	135.2 Å²	135.2	81%	0.808	81%	0.805	S	S	*	*			trans	-113.9	117.9	176	-72.8	-163.6	-15.1	0	0	112.8
268	V	21.3	Very low	25.8	Very low	127 Å²	127	134.2 Å²	134.2	77%	0.77	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-75	126.6	161.9	175.4	0	0	0	0	108	V270	V268-V270 HydrophobicContact CG1-CG2 4.38Å
269	Q	27.6	Very low	25.7	Very low	181 Å²	181	138.5 Å²	138.5	85%	0.846	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-86.8	121.5	166.2	-76.6	-169	-52.2	0	0	110.4
270	V	22.2	Very low	25.6	Very low	122 Å²	122	134.5 Å²	134.5	74%	0.739	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-100.3	133	165.5	176.1	0	0	0	0	107.8	V268	V268-V270 HydrophobicContact CG1-CG2 4.38Å
271	S	28.6	Very low	25.5	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	80%	0.799	S	S	*	*			trans	-136.2	134	173.6	-61	0	0	0	0	109.6
272	Q	24.7	Very low	25.5	Very low	170 Å²	170	140.4 Å²	140.4	79%	0.794	80%	0.8	S	S	*	*			trans	-132	162.5	173.4	-76.1	-169.8	-18.4	0	0	109.9
273	N	29.8	Very low	25.4	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	80%	0.798	S	S	*	*			trans	73.2	134.8	-173.2	-56.5	-35.1	0	0	0	113.9
274	Q	25.4	Very low	25.4	Very low	174 Å²	174	135.8 Å²	135.8	81%	0.813	80%	0.795	S	S	*	*			cis	-144.7	169.2	-2.8	-115.6	170.6	9.5	0	0	110.1
275	P	28.1	Very low	25.7	Very low	127 Å²	127	133.5 Å²	133.5	83%	0.825	79%	0.792	S	S	*	*			trans	-91.7	150.4	-152.7	35	-37.9	0	0	0	116.3
276	A	26	Very low	25.7	Very low	90 Å²	90	131.5 Å²	131.5	74%	0.744	80%	0.796	S	S	*	*			trans	-143.2	127.8	157.7	0	0	0	0	0	111.1
277	T	25.9	Very low	25.9	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	79%	0.793	S	S	*	*			trans	22.1	107.4	154.1	53.7	0	0	0	0	120.1
278	T	24.9	Very low	26	Very low	135 Å²	135	127.7 Å²	127.7	83%	0.828	79%	0.791	S	S	*	*			trans	42.5	100.6	132.3	57.4	0	0	0	0	119.3
279	D	26.4	Very low	26.4	Very low	164 Å²	164	126.5 Å²	126.5	88%	0.877	78%	0.78	S	S	*	*			trans	-149.2	141.3	130.7	-145.6	-14	0	0	0	112
280	G	24.8	Very low	26.6	Very low	74 Å²	74	122.2 Å²	122.2	76%	0.763	77%	0.768	S	S	*	*			trans	-104.5	87	-163	0	0	0	0	0	114.6
281	R	26.5	Very low	26.9	Very low	200 Å²	200	123.9 Å²	123.9	76%	0.755	77%	0.772	S	S	*	*			trans	-128.7	101.4	169	-69.6	-169.4	179.4	-150	-0.5	112	S283	R281-S283 PolarHBondContact O-N 2.98Å
282	G	25.6	Very low	27.1	Very low	85 Å²	85	124.1 Å²	124.1	88%	0.876	77%	0.768	S	S	*	*			trans	-78.9	98.7	178.8	0	0	0	0	0	112.9	G284	G282-G284 PolarHBondContact O-N 3.31Å
283	S	26.3	Very low	27.1	Very low	105 Å²	105	127.1 Å²	127.1	73%	0.734	77%	0.772	S	S	*	*			trans	-70.2	110.1	160.5	50	0	0	0	0	109.4	R281 D285	R281-S283 PolarHBondContact O-N 2.98Å; S283-D285 PolarHBondContact O-N 3.34Å; S283-D285 VanDerWaalsContact O-N 3.14Å
284	G	26.4	Very low	26.9	Very low	82 Å²	82	125.5 Å²	125.5	85%	0.845	77%	0.773	S	S	*	*			trans	-77.2	95.6	-179	0	0	0	0	0	112.4	G282	G282-G284 PolarHBondContact O-N 3.31Å
285	D	26.7	Very low	27.1	Very low	144 Å²	144	122.6 Å²	122.6	77%	0.77	77%	0.769	S	S	*	*			trans	-59.4	138.9	178.8	-92.2	-43.9	0	0	0	113.6	S283 S287	S283-D285 PolarHBondContact O-N 3.34Å; S283-D285 VanDerWaalsContact O-N 3.14Å; D285-S287 PolarHBondContact O-N 3.29Å
286	A	25.6	Very low	27	Very low	105 Å²	105	127.9 Å²	127.9	87%	0.868	77%	0.772	S	S	*	*			trans	-81.5	61.5	176.1	0	0	0	0	0	111.6
287	S	25.7	Very low	27	Very low	100 Å²	100	127 Å²	127	70%	0.699	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60	137.5	177.1	-68.6	0	0	0	0	112.2	D285	D285-S287 PolarHBondContact O-N 3.29Å
288	P	28.1	Very low	27.1	Very low	119 Å²	119	128.6 Å²	128.6	77%	0.773	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-68.9	160.5	-179.8	29	-35.4	0	0	0	112.9
289	L	30.1	Very low	27.5	Very low	102 Å²	102	128.5 Å²	128.5	53%	0.534	77%	0.765	S	S	.	*	P	Polyproline II helix	trans	-58.4	132.2	-176	-64.8	168.5	0	0	0	112.6	L291 L898	L289-L291 PolarHBondContact O-N 2.84Å; L289-L898 HydrophobicContact CD1-CD2 4.26Å
290	P	31.6	Very low	27.7	Very low	91 Å²	91	128.3 Å²	128.3	59%	0.591	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.6	116	175.7	30.3	-32.9	0	0	0	111.5	V292	P290-V292 PolarHBondContact O-N 2.93Å
291	L	27.8	Very low	27.9	Very low	157 Å²	157	129.6 Å²	129.6	82%	0.822	77%	0.767	S	S	*	*			trans	-71.2	92.6	165.1	-85.7	160.7	0	0	0	109.8	L289 R293	L289-L291 PolarHBondContact O-N 2.84Å; L291-R293 PolarHBondContact O-N 3.19Å
292	V	32	Very low	28.3	Very low	113 Å²	113	124.9 Å²	124.9	69%	0.685	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-74.1	120.2	-179.7	-179.7	0	0	0	0	110.6	P290	P290-V292 PolarHBondContact O-N 2.93Å
293	R	25.4	Very low	28.8	Very low	232 Å²	232	125.7 Å²	125.7	88%	0.875	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-81.2	135.5	166.3	-71.4	178.9	170.7	176.1	-3.4	109.7	L291 P295	L291-R293 PolarHBondContact O-N 3.19Å; R293-P295 WeakPolarHBondContact O-CD 2.98Å
294	S	26.4	Very low	29.4	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-63.9	130.9	175.4	-170.3	0	0	0	0	111.8
295	P	29.3	Very low	30.4	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	74%	0.742	S	S	*	*			trans	-67.4	174.4	159.2	-15.9	31.8	0	0	0	111.5	R293	R293-P295 WeakPolarHBondContact O-CD 2.98Å
296	R	25.8	Very low	31.5	Very low	239 Å²	239	130.4 Å²	130.4	90%	0.902	74%	0.743	S	S	*	*			trans	-96.2	138.4	169.7	-70.7	176.3	172.2	166.7	-3.9	109.7
297	A	26.8	Very low	32.9	Very low	72 Å²	72	129.8 Å²	129.8	60%	0.595	73%	0.729	S	S	*	*			trans	-68.3	145.1	-179	0	0	0	0	0	113.2
298	H	27.1	Very low	34.8	Very low	157 Å²	157	125.7 Å²	125.7	73%	0.727	70%	0.7	S	S	*	*			trans	-130.2	115.6	164	-87.3	-78.9	0	0	0	108.4	L300	H298-L300 PolarHBondContact O-N 3.09Å
299	P	33.6	Very low	36.6	Very low	132 Å²	132	122 Å²	122	86%	0.857	68%	0.675	S	S	*	*			trans	-78.2	94.3	-171	30.5	-35.1	0	0	0	112.4
300	L	31	Very low	38.1	Very low	161 Å²	161	120.7 Å²	120.7	84%	0.843	68%	0.678	S	S	*	*			trans	-93.1	120	155.1	-75.2	171	0	0	0	108.1	H298 P302	H298-L300 PolarHBondContact O-N 3.09Å; L300-P302 WeakPolarHBondContact O-CD 3.42Å
301	A	28.7	Very low	40.2	Very low	101 Å²	101	120.4 Å²	120.4	84%	0.835	67%	0.672	S	S	*	*			trans	-70.6	114.7	-170	0	0	0	0	0	112.4
302	P	34.7	Very low	42.8	Very low	101 Å²	101	113 Å²	113	66%	0.656	63%	0.633	S	S	*	*			trans	-74.4	145.3	172.4	-10.6	28.9	0	0	0	110	L300	L300-P302 WeakPolarHBondContact O-CD 3.42Å
303	S	34.9	Very low	45.5	Very low	101 Å²	101	108.6 Å²	108.6	71%	0.706	61%	0.605	S	S	*	*			trans	-63.8	140.6	167	-60.7	0	0	0	0	109.6	L305	S303-L305 PolarHBondContact O-N 3.05Å
304	P	40.5	Very low	48.4	Very low	123 Å²	123	103.8 Å²	103.8	80%	0.799	59%	0.593	S	S	*	*			trans	-69.8	94.2	-176.1	27.9	-34.7	0	0	0	111.2	R306	P304-R306 PolarHBondContact O-N 2.77Å
305	L	46.7	Very low	51.1	Low	101 Å²	101	99.8 Å²	99.8	53%	0.529	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-59.6	123.3	170	-68.9	160	0	0	0	108.7	S303 T879	S303-L305 PolarHBondContact O-N 3.05Å; L305-T879 HydrophobicContact CD1-CG2 3.26Å
306	R	50.2	Low	53.9	Low	207 Å²	207	94.5 Å²	94.5	78%	0.781	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-66.4	131.5	-176.1	-71.1	-173.2	178.1	-172	1	110.6	P304 I308	P304-R306 PolarHBondContact O-N 2.77Å; R306-I308 PolarHBondContact O-N 2.9Å
307	P	55.2	Low	57	Low	91 Å²	91	84.4 Å²	84.4	59%	0.591	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-60.1	125.8	170.6	-23.2	33.9	0	0	0	111.1	V309	P307-V309 HydrophobicContact CB-CG2 4.09Å; P307-V309 PolarHBondContact O-N 3.37Å; P307-V309 VanDerWaalsContact O-N 3.08Å
308	I	64.7	Low	59.9	Low	14 Å²	14	84.6 Å²	84.6	7%	0.072	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24	179	-91.6	-176.9	0	0	0	113.8	R306 A310 T312 V580 S581 F612 L871	R306-I308 PolarHBondContact O-N 2.9Å; I308-A310 PolarHBondContact O-N 3.27Å; I308-T312 WeakPolarHBondContact CG2-OG1 3.29Å; I308-T312 VanDerWaalsContact O-CB 3.3Å; I308-T312 WeakPolarHBondContact O-CB 3.46Å; I308-T312 PolarHBondContact O-N 2.8Å; I308-T312 VanDerWaalsContact O-N 3.09Å; I308-T312 PolarHBondContact O-OG1 2.95Å; I308-V580 VanDerWaalsContact CD1-C 3.44Å; I308-S581 VanDerWaalsContact CD1-N 3.34Å; I308-F612 HydrophobicContact CD1-CE1 3.66Å; I308-F612 HydrophobicContact CD1-CZ 3.49Å; I308-F612 VanDerWaalsContact CD1-CZ 3.49Å; I308-F612 HydrophobicContact CG1-CE1 4.03Å; I308-F612 HydrophobicContact CG1-CZ 4.26Å; I308-L871 HydrophobicContact CD1-CD2 3.37Å
309	V	65.5	Low	62.7	Low	43 Å²	43	79.6 Å²	79.6	26%	0.261	46%	0.456	S	S	.	.	H	α-helix	trans	-53.9	-50	-166.8	-164.4	0	0	0	0	113.2	P307 M313 V571 D575	P307-V309 HydrophobicContact CB-CG2 4.09Å; P307-V309 PolarHBondContact O-N 3.37Å; P307-V309 VanDerWaalsContact O-N 3.08Å; V309-M313 PolarHBondContact O-N 2.84Å; V309-V571 HydrophobicContact CB-CG1 4.42Å; V309-V571 HydrophobicContact CG1-CG1 3.43Å; V309-V571 VanDerWaalsContact CG1-CG1 3.43Å; V309-D575 HydrophobicContact CG1-CB 4.47Å; V309-D575 HydrophobicContact CG2-CB 3.69Å; V309-D575 WeakPolarHBondContact CG2-OD1 3.24Å
310	A	63.3	Low	65.3	Low	73 Å²	73	73.3 Å²	73.3	60%	0.603	42%	0.415	S	S	*	.	H	α-helix	trans	-70.8	-50.7	-172.5	0	0	0	0	0	112.3	I308 T312 M313 H314	I308-A310 PolarHBondContact O-N 3.27Å; A310-T312 VanDerWaalsContact C-N 3.29Å; A310-T312 PolarHBondContact O-N 2.96Å; A310-M313 PolarHBondContact O-N 2.85Å; A310-H314 PolarHBondContact O-N 2.81Å
311	D	75	Confident	68.1	Low	85 Å²	85	66 Å²	66	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-66.3	-33.4	-178.5	-64.8	-27.4	0	0	0	111.3	H314 I315	D311-H314 PolarHBondContact O-N 3.41Å; D311-I315 WeakPolarHBondContact O-CB 3.38Å; D311-I315 WeakPolarHBondContact O-CD1 3.48Å; D311-I315 VanDerWaalsContact O-CG1 3.29Å; D311-I315 WeakPolarHBondContact O-CG1 3.36Å; D311-I315 PolarHBondContact O-N 2.88Å
312	T	81.7	Confident	70.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-46.3	179.7	-61.5	0	0	0	0	112.7	I308 A310 H314 I315 F316 V571 L574 L616	I308-T312 WeakPolarHBondContact CG2-OG1 3.29Å; I308-T312 VanDerWaalsContact O-CB 3.3Å; I308-T312 WeakPolarHBondContact O-CB 3.46Å; I308-T312 PolarHBondContact O-N 2.8Å; I308-T312 VanDerWaalsContact O-N 3.09Å; I308-T312 PolarHBondContact O-OG1 2.95Å; A310-T312 VanDerWaalsContact C-N 3.29Å; A310-T312 PolarHBondContact O-N 2.96Å; T312-H314 VanDerWaalsContact C-N 3.32Å; T312-H314 PolarHBondContact O-N 3.11Å; T312-I315 PolarHBondContact O-N 2.8Å; T312-F316 HydrophobicContact CG2-CD1 4.37Å; T312-F316 HydrophobicContact CG2-CD2 4.01Å; T312-F316 HydrophobicContact CG2-CE1 4.08Å; T312-F316 HydrophobicContact CG2-CE2 3.71Å; T312-F316 HydrophobicContact CG2-CG 4.36Å; T312-F316 HydrophobicContact CG2-CZ 3.76Å; T312-F316 WeakPolarHBondContact O-CG 3.28Å; T312-F316 PolarHBondContact O-N 2.68Å; T312-V571 HydrophobicContact CG2-CG2 3.78Å; T312-L574 HydrophobicContact CG2-CD1 4.35Å; T312-L616 HydrophobicContact CG2-CD2 3.39Å
313	M	88.2	Confident	73.2	Confident	21 Å²	21	63.1 Å²	63.1	10%	0.103	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-38.5	-179.9	-166.6	63.8	-163.7	0	0	111.5	V309 A310 I315 F316 L317 F351 I564 A567 R568 V571	V309-M313 PolarHBondContact O-N 2.84Å; A310-M313 PolarHBondContact O-N 2.85Å; M313-I315 PolarHBondContact O-N 2.71Å; M313-F316 PolarHBondContact O-N 3.27Å; M313-L317 HydrophobicContact CE-CD1 4.43Å; M313-L317 HydrophobicContact CE-CD2 4.16Å; M313-L317 HydrophobicContact CE-CG 4.13Å; M313-L317 HydrophobicContact CG-CD1 4.33Å; M313-L317 WeakPolarHBondContact O-CG 3.21Å; M313-L317 PolarHBondContact O-N 2.8Å; M313-F351 HydrophobicContact CE-CE2 3.96Å; M313-F351 HydrophobicContact CE-CZ 3.8Å; M313-F351 HydrophobicContact CG-CZ 4.24Å; M313-I564 HydrophobicContact CE-CG2 3.82Å; M313-A567 HydrophobicContact CE-CB 4.01Å; M313-A567 HydrophobicContact SD-CB 4.16Å; M313-R568 HydrophobicContact CE-CB 4.38Å; M313-V571 HydrophobicContact CB-CG2 4.13Å; M313-V571 HydrophobicContact SD-CG2 3.99Å
314	H	86.6	Confident	75.8	Confident	131 Å²	131	58.3 Å²	58.3	61%	0.606	30%	0.3	S	S	*	.	H	α-helix	trans	-59.9	-45.5	173.8	179.9	-86.5	0	0	0	111.6	A310 D311 T312 L317 E318	A310-H314 PolarHBondContact O-N 2.81Å; D311-H314 PolarHBondContact O-N 3.41Å; T312-H314 VanDerWaalsContact C-N 3.32Å; T312-H314 PolarHBondContact O-N 3.11Å; H314-L317 PolarHBondContact O-N 3.09Å; H314-E318 WeakPolarHBondContact O-CB 3.37Å; H314-E318 PolarHBondContact O-N 2.91Å
315	I	84	Confident	78.1	Confident	30 Å²	30	55.3 Å²	55.3	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-38.4	178.4	-73.3	165.6	0	0	0	112.1	D311 T312 M313 E318 K319 P613 I617	D311-I315 WeakPolarHBondContact O-CB 3.38Å; D311-I315 WeakPolarHBondContact O-CD1 3.48Å; D311-I315 VanDerWaalsContact O-CG1 3.29Å; D311-I315 WeakPolarHBondContact O-CG1 3.36Å; D311-I315 PolarHBondContact O-N 2.88Å; T312-I315 PolarHBondContact O-N 2.8Å; M313-I315 PolarHBondContact O-N 2.71Å; I315-E318 PolarHBondContact O-N 3.27Å; I315-K319 VanDerWaalsContact O-CG 3.3Å; I315-K319 WeakPolarHBondContact O-CG 3.28Å; I315-K319 PolarHBondContact O-N 3.14Å; I315-P613 HydrophobicContact CD1-CB 4.06Å; I315-P613 HydrophobicContact CD1-CG 3.52Å; I315-I617 HydrophobicContact CG2-CD1 3.3Å; I315-I617 HydrophobicContact CG2-CG1 3.77Å
316	F	88.4	Confident	79.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.1	-45.1	173.2	-74.9	-8.6	0	0	0	111.7	T312 M313 K319 L320 A567 E570 V571 L616 I617 I623	T312-F316 HydrophobicContact CG2-CD1 4.37Å; T312-F316 HydrophobicContact CG2-CD2 4.01Å; T312-F316 HydrophobicContact CG2-CE1 4.08Å; T312-F316 HydrophobicContact CG2-CE2 3.71Å; T312-F316 HydrophobicContact CG2-CG 4.36Å; T312-F316 HydrophobicContact CG2-CZ 3.76Å; T312-F316 WeakPolarHBondContact O-CG 3.28Å; T312-F316 PolarHBondContact O-N 2.68Å; M313-F316 PolarHBondContact O-N 3.27Å; F316-K319 PolarHBondContact O-N 2.75Å; F316-L320 WeakPolarHBondContact O-CB 3.41Å; F316-L320 VanDerWaalsContact O-CG 3.27Å; F316-L320 WeakPolarHBondContact O-CG 3.22Å; F316-L320 PolarHBondContact O-N 3.03Å; F316-A567 HydrophobicContact CB-CB 4.21Å; F316-A567 HydrophobicContact CD2-CB 3.78Å; F316-A567 HydrophobicContact CG-CB 4.39Å; F316-E570 HydrophobicContact CE2-CB 4.36Å; F316-V571 HydrophobicContact CD2-CG2 3.98Å; F316-V571 HydrophobicContact CE2-CG2 4.02Å; F316-L616 HydrophobicContact CE1-CD2 3.94Å; F316-L616 HydrophobicContact CZ-CD2 3.76Å; F316-I617 HydrophobicContact CE1-CG1 4.45Å; F316-I623 HydrophobicContact CB-CD1 3.67Å; F316-I623 HydrophobicContact CD1-CD1 3.64Å; F316-I623 HydrophobicContact CD2-CD1 4.03Å; F316-I623 HydrophobicContact CE1-CD1 4.21Å; F316-I623 HydrophobicContact CG-CD1 3.52Å
317	L	90.8	Very high	81.4	Confident	28 Å²	28	43.8 Å²	43.8	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-62.8	-41.9	174.5	-69.6	168.4	0	0	0	112.1	M313 H314 K319 L320 G321 M343 E347 I564	M313-L317 HydrophobicContact CE-CD1 4.43Å; M313-L317 HydrophobicContact CE-CD2 4.16Å; M313-L317 HydrophobicContact CE-CG 4.13Å; M313-L317 HydrophobicContact CG-CD1 4.33Å; M313-L317 WeakPolarHBondContact O-CG 3.21Å; M313-L317 PolarHBondContact O-N 2.8Å; H314-L317 PolarHBondContact O-N 3.09Å; L317-K319 PolarHBondContact O-N 3.48Å; L317-L320 PolarHBondContact O-N 3.09Å; L317-G321 PolarHBondContact O-N 2.9Å; L317-M343 HydrophobicContact CB-CE 4.13Å; L317-M343 HydrophobicContact CD2-CE 3.75Å; L317-M343 WeakPolarHBondContact O-CE 3.04Å; L317-E347 HydrophobicContact CD2-CG 4.29Å; L317-I564 HydrophobicContact CD2-CD1 3.92Å; L317-I564 HydrophobicContact CD2-CG1 3.98Å; L317-I564 HydrophobicContact CD2-CG2 3.92Å
318	E	87.4	Confident	82.9	Confident	75 Å²	75	39.5 Å²	39.5	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-60.7	-42.6	177.5	-163.4	-126.7	122.4	0	0	111.9	H314 I315 G321 R322	H314-E318 WeakPolarHBondContact O-CB 3.37Å; H314-E318 PolarHBondContact O-N 2.91Å; I315-E318 PolarHBondContact O-N 3.27Å; E318-G321 PolarHBondContact O-N 2.74Å; E318-R322 PolarHBondContact O-N 3.36Å; E318-R322 VanDerWaalsContact O-N 3.11Å; E318-R322 IonicContact OE1-CZ 3.54Å; E318-R322 IonicContact OE1-NE 3.86Å; E318-R322 PolarHBondContact OE1-NE 3.2Å; E318-R322 IonicContact OE1-NH2 3.95Å; E318-R322 PolarHBondContact OE1-NH2 2.8Å
319	K	85	Confident	83.7	Confident	52 Å²	52	45.7 Å²	45.7	23%	0.226	23%	0.226	C	C	.	.	H	α-helix	trans	-69.7	-41.5	175.8	-69.4	-68.5	-174.7	-177.9	0	112.8	I315 F316 L317 G321 R322 Q323 I617 I623	I315-K319 VanDerWaalsContact O-CG 3.3Å; I315-K319 WeakPolarHBondContact O-CG 3.28Å; I315-K319 PolarHBondContact O-N 3.14Å; F316-K319 PolarHBondContact O-N 2.75Å; L317-K319 PolarHBondContact O-N 3.48Å; K319-G321 PolarHBondContact O-N 3.26Å; K319-R322 PolarHBondContact O-N 2.71Å; K319-R322 VanDerWaalsContact O-N 3.17Å; K319-Q323 WeakPolarHBondContact O-CB 3.39Å; K319-Q323 PolarHBondContact O-N 3.06Å; K319-I617 HydrophobicContact CD-CD1 4.27Å; K319-I617 HydrophobicContact CD-CG2 4.3Å; K319-I617 HydrophobicContact CG-CD1 3.94Å; K319-I617 HydrophobicContact CG-CG2 3.94Å; K319-I623 HydrophobicContact CB-CG2 3.39Å; K319-I623 HydrophobicContact CG-CG2 4.22Å
320	L	88.6	Confident	84.1	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-32.2	174.4	-72.3	170.7	0	0	0	111.6	F316 L317 Q323 L324 L560 I564 I623	F316-L320 WeakPolarHBondContact O-CB 3.41Å; F316-L320 VanDerWaalsContact O-CG 3.27Å; F316-L320 WeakPolarHBondContact O-CG 3.22Å; F316-L320 PolarHBondContact O-N 3.03Å; L317-L320 PolarHBondContact O-N 3.09Å; L320-Q323 PolarHBondContact O-N 2.93Å; L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 PolarHBondContact O-N 3.47Å; L320-L560 HydrophobicContact CB-CD2 4.06Å; L320-L560 HydrophobicContact CD2-CD2 4.11Å; L320-I564 HydrophobicContact CD1-CG1 3.68Å; L320-I623 HydrophobicContact CD1-CD1 4.22Å; L320-I623 HydrophobicContact CD2-CG1 4.1Å; L320-I623 HydrophobicContact CG-CD1 4.29Å; L320-I623 HydrophobicContact CG-CG1 4.24Å; L320-I623 HydrophobicContact CG-CG2 4.48Å
321	G	90.7	Very high	84.7	Confident	8 Å²	8	42.5 Å²	42.5	8%	0.082	20%	0.196	C	C	.	.	H	α-helix	trans	-58.5	-56.2	166.2	0	0	0	0	0	112.4	L317 E318 K319 Q323 L324 E325	L317-G321 PolarHBondContact O-N 2.9Å; E318-G321 PolarHBondContact O-N 2.74Å; K319-G321 PolarHBondContact O-N 3.26Å; G321-Q323 PolarHBondContact O-N 3.17Å; G321-L324 WeakPolarHBondContact O-CB 3.31Å; G321-L324 PolarHBondContact O-N 3.41Å; G321-L324 VanDerWaalsContact O-N 3.07Å; G321-E325 VanDerWaalsContact O-CG 3.31Å; G321-E325 WeakPolarHBondContact O-CG 3.41Å; G321-E325 PolarHBondContact O-N 2.8Å
322	R	85.9	Confident	84.8	Confident	138 Å²	138	42.3 Å²	42.3	52%	0.521	20%	0.195	S	C	.	.	H	α-helix	trans	-58.5	-32.1	176.6	-62.4	-179.8	-169.1	-134.3	6.7	113.1	E318 K319 Y326	E318-R322 PolarHBondContact O-N 3.36Å; E318-R322 VanDerWaalsContact O-N 3.11Å; E318-R322 IonicContact OE1-CZ 3.54Å; E318-R322 IonicContact OE1-NE 3.86Å; E318-R322 PolarHBondContact OE1-NE 3.2Å; E318-R322 IonicContact OE1-NH2 3.95Å; E318-R322 PolarHBondContact OE1-NH2 2.8Å; K319-R322 PolarHBondContact O-N 2.71Å; K319-R322 VanDerWaalsContact O-N 3.17Å; R322-Y326 PolarHBondContact O-N 2.97Å
323	Q	84.4	Confident	84.9	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-73	-36.2	176.4	177.8	171.5	-13.2	0	0	112.4	K319 L320 G321 L327 H559 F622 F626 P727	K319-Q323 WeakPolarHBondContact O-CB 3.39Å; K319-Q323 PolarHBondContact O-N 3.06Å; L320-Q323 PolarHBondContact O-N 2.93Å; G321-Q323 PolarHBondContact O-N 3.17Å; Q323-L327 HydrophobicContact CG-CD1 4.49Å; Q323-L327 WeakPolarHBondContact O-CB 3.25Å; Q323-L327 WeakPolarHBondContact O-CG 3.15Å; Q323-L327 PolarHBondContact O-N 3.32Å; Q323-H559 PolarHBondContact NE2-NE2 2.87Å; Q323-F622 PolarHBondContact NE2-O 2.72Å; Q323-F622 PolarHBondContact OE1-O 2.95Å; Q323-F626 HydrophobicContact CB-CD2 4.21Å; Q323-F626 HydrophobicContact CB-CE2 3.86Å; Q323-F626 VanDerWaalsContact CD-CE2 3.44Å; Q323-F626 HydrophobicContact CG-CD2 4.29Å; Q323-F626 HydrophobicContact CG-CE2 3.51Å; Q323-F626 HydrophobicContact CG-CZ 3.92Å; Q323-P727 HydrophobicContact CG-CG 4.32Å
324	L	89.6	Confident	84.8	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.2	-46.2	168.4	168.8	58.2	0	0	0	111.1	L320 G321 Y326 L327 L328 R339 I342 M343 I556 L560	L320-L324 WeakPolarHBondContact O-CB 3.48Å; L320-L324 PolarHBondContact O-N 3.47Å; G321-L324 WeakPolarHBondContact O-CB 3.31Å; G321-L324 PolarHBondContact O-N 3.41Å; G321-L324 VanDerWaalsContact O-N 3.07Å; L324-Y326 VanDerWaalsContact C-N 3.34Å; L324-Y326 PolarHBondContact O-N 2.82Å; L324-L327 PolarHBondContact O-N 3.44Å; L324-L327 VanDerWaalsContact O-N 3.17Å; L324-L328 HydrophobicContact CD1-CD1 3.79Å; L324-L328 HydrophobicContact CD1-CD2 4.39Å; L324-L328 HydrophobicContact CD1-CG 3.85Å; L324-L328 HydrophobicContact CG-CD1 4.11Å; L324-L328 WeakPolarHBondContact O-CG 2.95Å; L324-L328 PolarHBondContact O-N 3.12Å; L324-R339 HydrophobicContact CD2-CG 4.08Å; L324-R339 WeakPolarHBondContact CD2-O 3.47Å; L324-I342 HydrophobicContact CD1-CB 4.23Å; L324-I342 HydrophobicContact CD1-CD1 3.94Å; L324-I342 HydrophobicContact CD1-CG2 3.83Å; L324-I342 HydrophobicContact CD2-CB 4.19Å; L324-I342 HydrophobicContact CD2-CG2 4.04Å; L324-M343 HydrophobicContact CD2-CB 4.05Å; L324-M343 HydrophobicContact CD2-SD 4.49Å; L324-I556 HydrophobicContact CD1-CG2 3.5Å; L324-L560 HydrophobicContact CB-CD1 3.92Å; L324-L560 HydrophobicContact CD1-CD1 3.83Å; L324-L560 HydrophobicContact CD2-CD1 4.05Å; L324-L560 HydrophobicContact CG-CD1 4.15Å
325	E	88.8	Confident	84.9	Confident	59 Å²	59	42.8 Å²	42.8	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-60.5	-42.8	178	-63.8	170.7	-178.8	0	0	111.6	G321 H329 F335 R339	G321-E325 VanDerWaalsContact O-CG 3.31Å; G321-E325 WeakPolarHBondContact O-CG 3.41Å; G321-E325 PolarHBondContact O-N 2.8Å; E325-H329 WeakPolarHBondContact O-CB 3.08Å; E325-H329 PolarHBondContact O-N 2.65Å; E325-H329 VanDerWaalsContact O-N 3.11Å; E325-F335 HydrophobicContact CB-CE2 3.94Å; E325-F335 HydrophobicContact CG-CD2 4.36Å; E325-F335 HydrophobicContact CG-CE2 3.49Å; E325-F335 VanDerWaalsContact CG-CE2 3.49Å; E325-F335 HydrophobicContact CG-CZ 3.97Å; E325-R339 IonicContact OE1-CZ 3.02Å; E325-R339 VanDerWaalsContact OE1-CZ 3.25Å; E325-R339 IonicContact OE1-NE 3.7Å; E325-R339 PolarHBondContact OE1-NE 3.28Å; E325-R339 IonicContact OE1-NH2 3.91Å; E325-R339 PolarHBondContact OE1-NH2 3.18Å
326	Y	82.5	Confident	85.2	Confident	66 Å²	66	46.4 Å²	46.4	26%	0.259	22%	0.222	S	C	.	.	H	α-helix	trans	-62.4	-45.1	171.9	175.8	-110.6	0	0	0	112.7	R322 L324 H329 I330 F626 P727	R322-Y326 PolarHBondContact O-N 2.97Å; L324-Y326 VanDerWaalsContact C-N 3.34Å; L324-Y326 PolarHBondContact O-N 2.82Å; Y326-H329 PolarHBondContact O-N 3.49Å; Y326-I330 HydrophobicContact CD1-CD1 4.39Å; Y326-I330 HydrophobicContact CD2-CG2 4Å; Y326-I330 HydrophobicContact CE1-CD1 3.81Å; Y326-I330 HydrophobicContact CE1-CG2 4.35Å; Y326-I330 HydrophobicContact CE2-CG2 3.49Å; Y326-I330 VanDerWaalsContact CE2-CG2 3.49Å; Y326-I330 PolarHBondContact O-N 2.79Å; Y326-F626 AromaticContact CD1-CD1 3.98Å; Y326-F626 HydrophobicContact CD1-CD1 3.98Å; Y326-F626 HydrophobicContact CD1-CE1 4.36Å; Y326-F626 HydrophobicContact CD1-CG 4.45Å; Y326-F626 AromaticContact CE1-CD1 3.97Å; Y326-F626 HydrophobicContact CE1-CD1 3.97Å; Y326-F626 HydrophobicContact CE1-CE1 4.31Å; Y326-P727 HydrophobicContact CD1-CG 4.42Å
327	L	82.5	Confident	85.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-44.9	179.1	-82.9	168.6	0	0	0	112.8	Q323 L324 H329 I330 E331 I556 P727 F728	Q323-L327 HydrophobicContact CG-CD1 4.49Å; Q323-L327 WeakPolarHBondContact O-CB 3.25Å; Q323-L327 WeakPolarHBondContact O-CG 3.15Å; Q323-L327 PolarHBondContact O-N 3.32Å; L324-L327 PolarHBondContact O-N 3.44Å; L324-L327 VanDerWaalsContact O-N 3.17Å; L327-H329 VanDerWaalsContact C-N 3.3Å; L327-H329 PolarHBondContact O-N 3.04Å; L327-I330 HydrophobicContact CD2-CD1 4.43Å; L327-E331 WeakPolarHBondContact O-CB 3.17Å; L327-E331 PolarHBondContact O-N 3.25Å; L327-E331 VanDerWaalsContact O-N 3.1Å; L327-I556 HydrophobicContact CB-CD1 3.93Å; L327-I556 HydrophobicContact CB-CG1 4.24Å; L327-I556 HydrophobicContact CD1-CG1 4.41Å; L327-I556 HydrophobicContact CD1-CG2 4.22Å; L327-P727 HydrophobicContact CD1-CB 4.08Å; L327-P727 HydrophobicContact CD1-CG 4.2Å; L327-P727 HydrophobicContact CD2-CB 4.06Å; L327-P727 HydrophobicContact CD2-CG 3.76Å; L327-P727 HydrophobicContact CG-CB 4.31Å; L327-P727 HydrophobicContact CG-CG 3.93Å; L327-F728 HydrophobicContact CD1-CZ 4.48Å; L327-F728 HydrophobicContact CD2-CE2 3.91Å; L327-F728 HydrophobicContact CD2-CZ 3.84Å
328	L	87.4	Confident	85.5	Confident	1 Å²	1	48 Å²	48	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-39.8	175.5	-67.8	172.2	0	0	0	111	L324 E331 D332 V333 W338 R339 I342 I556	L324-L328 HydrophobicContact CD1-CD1 3.79Å; L324-L328 HydrophobicContact CD1-CD2 4.39Å; L324-L328 HydrophobicContact CD1-CG 3.85Å; L324-L328 HydrophobicContact CG-CD1 4.11Å; L324-L328 WeakPolarHBondContact O-CG 2.95Å; L324-L328 PolarHBondContact O-N 3.12Å; L328-E331 CarbonylContact O-C 3.52Å; L328-D332 PolarHBondContact O-N 3.36Å; L328-D332 VanDerWaalsContact O-N 3.1Å; L328-V333 HydrophobicContact CD2-CB 3.8Å; L328-V333 HydrophobicContact CD2-CG1 3.72Å; L328-V333 PolarHBondContact O-N 3.23Å; L328-W338 HydrophobicContact CD2-CB 4.44Å; L328-R339 HydrophobicContact CD1-CB 4.09Å; L328-I342 HydrophobicContact CD2-CD1 4.06Å; L328-I556 HydrophobicContact CD2-CD1 3.99Å
329	H	82.3	Confident	85.9	Confident	144 Å²	144	47.9 Å²	47.9	67%	0.667	23%	0.231	S	C	*	.	H	α-helix	trans	-67.5	-45.6	178.7	-176.7	55.9	0	0	0	113.7	E325 Y326 L327 D332	E325-H329 WeakPolarHBondContact O-CB 3.08Å; E325-H329 PolarHBondContact O-N 2.65Å; E325-H329 VanDerWaalsContact O-N 3.11Å; Y326-H329 PolarHBondContact O-N 3.49Å; L327-H329 VanDerWaalsContact C-N 3.3Å; L327-H329 PolarHBondContact O-N 3.04Å; H329-D332 PolarHBondContact O-N 2.91Å
330	I	72.8	Confident	86.3	Confident	35 Å²	35	49.4 Å²	49.4	18%	0.179	24%	0.241	C	C	.	.	H	α-helix	trans	-74.3	-25.8	-179.3	66.8	172.9	0	0	0	113.3	Y326 L327	Y326-I330 HydrophobicContact CD1-CD1 4.39Å; Y326-I330 HydrophobicContact CD2-CG2 4Å; Y326-I330 HydrophobicContact CE1-CD1 3.81Å; Y326-I330 HydrophobicContact CE1-CG2 4.35Å; Y326-I330 HydrophobicContact CE2-CG2 3.49Å; Y326-I330 VanDerWaalsContact CE2-CG2 3.49Å; Y326-I330 PolarHBondContact O-N 2.79Å; L327-I330 HydrophobicContact CD2-CD1 4.43Å
331	E	75.8	Confident	86.7	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.065	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	14.4	172.9	-60.7	-97.8	-146	0	0	111.7	L327 L328 V333 W548 V552 K555	L327-E331 WeakPolarHBondContact O-CB 3.17Å; L327-E331 PolarHBondContact O-N 3.25Å; L327-E331 VanDerWaalsContact O-N 3.1Å; L328-E331 CarbonylContact O-C 3.52Å; E331-V333 HydrophobicContact CB-CG2 4.42Å; E331-V333 WeakPolarHBondContact O-CG2 3.5Å; E331-V333 PolarHBondContact O-N 2.91Å; E331-W548 WeakPolarHBondContact O-CH2 3.15Å; E331-W548 WeakPolarHBondContact O-CZ2 3.42Å; E331-V552 HydrophobicContact CB-CG1 3.63Å; E331-V552 HydrophobicContact CG-CG1 3.95Å; E331-K555 IonicContact OE1-NZ 3.48Å
332	D	77.3	Confident	87	Confident	82 Å²	82	50.5 Å²	50.5	44%	0.439	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	29.8	172.3	-161	36.2	0	0	0	115	L328 H329 W548 S638	L328-D332 PolarHBondContact O-N 3.36Å; L328-D332 VanDerWaalsContact O-N 3.1Å; H329-D332 PolarHBondContact O-N 2.91Å; D332-W548 HydrophobicContact CB-CH2 4.12Å; D332-W548 WeakPolarHBondContact O-CH2 3.41Å; D332-S638 VanDerWaalsContact CB-OG 3.3Å; D332-S638 WeakPolarHBondContact CB-OG 3.49Å; D332-S638 VanDerWaalsContact OD2-CB 3.24Å; D332-S638 WeakPolarHBondContact OD2-CB 3.49Å; D332-S638 PolarHBondContact OD2-OG 3.12Å
333	V	84.4	Confident	87.4	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.048	23%	0.226	C	C	.	.			trans	-92.3	134	177.8	-179.8	0	0	0	0	109.3	L328 E331 F335 W338 W548 Q549 V552 V553	L328-V333 HydrophobicContact CD2-CB 3.8Å; L328-V333 HydrophobicContact CD2-CG1 3.72Å; L328-V333 PolarHBondContact O-N 3.23Å; E331-V333 HydrophobicContact CB-CG2 4.42Å; E331-V333 WeakPolarHBondContact O-CG2 3.5Å; E331-V333 PolarHBondContact O-N 2.91Å; V333-F335 PolarHBondContact O-N 3.42Å; V333-W338 VanDerWaalsContact CG1-CD1 3.46Å; V333-W338 HydrophobicContact CG1-CG 4.13Å; V333-W548 HydrophobicContact CG2-CH2 4.19Å; V333-W548 HydrophobicContact CG2-CZ2 4.49Å; V333-Q549 HydrophobicContact CG1-CG 4.43Å; V333-V552 HydrophobicContact CG2-CB 4.06Å; V333-V552 HydrophobicContact CG2-CG1 3.67Å; V333-V553 HydrophobicContact CG1-CG2 4.25Å
334	P	86.9	Confident	88	Confident	65 Å²	65	51.5 Å²	51.5	42%	0.422	26%	0.255	S	S	.	.			trans	-53.1	129.6	175	-27.7	35.7	0	0	0	112	Q549	P334-Q549 VanDerWaalsContact CD-NE2 3.26Å
335	F	88	Confident	88.3	Confident	90 Å²	90	52 Å²	52	40%	0.395	26%	0.258	S	S	.	.	S	Bend	trans	-58.9	-56.3	-179.4	-174.1	-82.1	0	0	0	110.4	E325 V333 W338 R339	E325-F335 HydrophobicContact CB-CE2 3.94Å; E325-F335 HydrophobicContact CG-CD2 4.36Å; E325-F335 HydrophobicContact CG-CE2 3.49Å; E325-F335 VanDerWaalsContact CG-CE2 3.49Å; E325-F335 HydrophobicContact CG-CZ 3.97Å; V333-F335 PolarHBondContact O-N 3.42Å; F335-W338 PolarHBondContact O-N 2.83Å; F335-W338 VanDerWaalsContact O-N 3.13Å; F335-R339 HydrophobicContact CD1-CB 4.38Å; F335-R339 WeakPolarHBondContact O-CB 3.39Å; F335-R339 PolarHBondContact O-N 2.85Å
336	D	89.7	Confident	88.7	Confident	105 Å²	105	49.2 Å²	49.2	56%	0.561	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	143.9	175.7	-60.6	-54.5	0	0	0	112.3	W338	D336-W338 VanDerWaalsContact C-N 3.28Å
337	P	91.7	Very high	89.4	Confident	61 Å²	61	49.7 Å²	49.7	40%	0.396	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86	10.8	-10.4	38	-38.6	0	0	0	112.7	R339 I341 P381	P337-R339 PolarHBondContact O-N 3.39Å; P337-I341 HydrophobicContact CB-CD1 4.13Å; P337-I341 HydrophobicContact CG-CD1 3.97Å; P337-I341 WeakPolarHBondContact O-CD1 3.43Å; P337-I341 VanDerWaalsContact O-CG1 3.31Å; P337-I341 WeakPolarHBondContact O-CG1 3.32Å; P337-I341 PolarHBondContact O-N 2.95Å; P337-P381 HydrophobicContact CG-CB 3.88Å; P337-P381 HydrophobicContact CG-CG 4.11Å
338	W	94.9	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-37.6	-170.3	-82.7	128.2	0	0	0	113.6	L328 V333 F335 D336 D340 I341 I342 P381 S543 L550 V553	L328-W338 HydrophobicContact CD2-CB 4.44Å; V333-W338 VanDerWaalsContact CG1-CD1 3.46Å; V333-W338 HydrophobicContact CG1-CG 4.13Å; F335-W338 PolarHBondContact O-N 2.83Å; F335-W338 VanDerWaalsContact O-N 3.13Å; D336-W338 VanDerWaalsContact C-N 3.28Å; W338-D340 PolarHBondContact O-N 3.11Å; W338-I341 HydrophobicContact CE3-CD1 4.39Å; W338-I341 HydrophobicContact CE3-CG2 4.32Å; W338-I341 HydrophobicContact CZ3-CG2 4.36Å; W338-I342 HydrophobicContact CB-CD1 4.22Å; W338-I342 VanDerWaalsContact O-CB 3.31Å; W338-I342 WeakPolarHBondContact O-CB 3.33Å; W338-I342 WeakPolarHBondContact O-CD1 3.41Å; W338-I342 WeakPolarHBondContact O-CG1 3.41Å; W338-I342 PolarHBondContact O-N 2.77Å; W338-P381 HydrophobicContact CD2-CB 3.75Å; W338-P381 HydrophobicContact CD2-CG 4.06Å; W338-P381 HydrophobicContact CE3-CB 3.92Å; W338-P381 HydrophobicContact CG-CB 4.46Å; W338-P381 HydrophobicContact CG-CG 4.45Å; W338-P381 HydrophobicContact CH2-CB 3.74Å; W338-P381 HydrophobicContact CH2-CG 4.42Å; W338-P381 HydrophobicContact CZ2-CB 3.58Å; W338-P381 HydrophobicContact CZ2-CG 3.76Å; W338-P381 HydrophobicContact CZ3-CB 3.89Å; W338-S543 VanDerWaalsContact CH2-O 3.29Å; W338-S543 WeakPolarHBondContact CH2-O 3.4Å; W338-L550 HydrophobicContact CH2-CD2 3.84Å; W338-L550 HydrophobicContact CZ2-CD2 4.28Å; W338-V553 HydrophobicContact CD2-CG1 4.32Å; W338-V553 HydrophobicContact CD2-CG2 3.6Å; W338-V553 HydrophobicContact CE3-CB 4.42Å; W338-V553 HydrophobicContact CE3-CG1 3.69Å; W338-V553 HydrophobicContact CE3-CG2 3.87Å; W338-V553 HydrophobicContact CG-CG2 4.03Å; W338-V553 HydrophobicContact CH2-CG1 4.15Å; W338-V553 HydrophobicContact CH2-CG2 4.29Å; W338-V553 HydrophobicContact CZ2-CG2 4.03Å; W338-V553 HydrophobicContact CZ3-CB 4.44Å; W338-V553 HydrophobicContact CZ3-CG1 3.63Å; W338-V553 HydrophobicContact CZ3-CG2 4.23Å
339	R	94.8	Very high	90.6	Very high	73 Å²	73	53.6 Å²	53.6	28%	0.275	27%	0.268	S	S	.	.	H	α-helix	trans	-51.6	-58.1	178.2	176.2	-174.1	-177.8	-85	7.8	111.7	L324 E325 L328 F335 P337 I342 M343	L324-R339 HydrophobicContact CD2-CG 4.08Å; L324-R339 WeakPolarHBondContact CD2-O 3.47Å; E325-R339 IonicContact OE1-CZ 3.02Å; E325-R339 VanDerWaalsContact OE1-CZ 3.25Å; E325-R339 IonicContact OE1-NE 3.7Å; E325-R339 PolarHBondContact OE1-NE 3.28Å; E325-R339 IonicContact OE1-NH2 3.91Å; E325-R339 PolarHBondContact OE1-NH2 3.18Å; L328-R339 HydrophobicContact CD1-CB 4.09Å; F335-R339 HydrophobicContact CD1-CB 4.38Å; F335-R339 WeakPolarHBondContact O-CB 3.39Å; F335-R339 PolarHBondContact O-N 2.85Å; P337-R339 PolarHBondContact O-N 3.39Å; R339-I342 PolarHBondContact O-N 3.15Å; R339-M343 WeakPolarHBondContact O-CB 3.38Å; R339-M343 PolarHBondContact O-N 3.45Å
340	D	94	Very high	91.2	Very high	83 Å²	83	46.8 Å²	46.8	44%	0.444	24%	0.237	S	C	.	.	H	α-helix	trans	-72.1	-37.5	-172.1	-63.3	-8.3	0	0	0	111	W338 I342 M343 Q344	W338-D340 PolarHBondContact O-N 3.11Å; D340-I342 VanDerWaalsContact C-N 3.34Å; D340-I342 PolarHBondContact O-N 2.94Å; D340-M343 PolarHBondContact O-N 2.94Å; D340-Q344 WeakPolarHBondContact O-CB 3.1Å; D340-Q344 PolarHBondContact O-N 3.24Å
341	I	96.1	Very high	92.3	Very high	32 Å²	32	48.9 Å²	48.9	16%	0.164	25%	0.245	C	C	.	.	H	α-helix	trans	-56.3	-48.1	170.2	-66.9	169.8	0	0	0	110.7	P337 W338 L345 P381 A383	P337-I341 HydrophobicContact CB-CD1 4.13Å; P337-I341 HydrophobicContact CG-CD1 3.97Å; P337-I341 WeakPolarHBondContact O-CD1 3.43Å; P337-I341 VanDerWaalsContact O-CG1 3.31Å; P337-I341 WeakPolarHBondContact O-CG1 3.32Å; P337-I341 PolarHBondContact O-N 2.95Å; W338-I341 HydrophobicContact CE3-CD1 4.39Å; W338-I341 HydrophobicContact CE3-CG2 4.32Å; W338-I341 HydrophobicContact CZ3-CG2 4.36Å; I341-L345 HydrophobicContact CG2-CD1 3.82Å; I341-L345 VanDerWaalsContact O-CB 3.31Å; I341-L345 WeakPolarHBondContact O-CB 3.28Å; I341-L345 VanDerWaalsContact O-CD1 3.24Å; I341-L345 WeakPolarHBondContact O-CD1 3.5Å; I341-L345 WeakPolarHBondContact O-CG 3.43Å; I341-L345 PolarHBondContact O-N 3.45Å; I341-P381 HydrophobicContact CD1-CB 4.06Å; I341-A383 HydrophobicContact CG2-CB 3.94Å
342	I	96.8	Very high	93.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-47.1	-178.3	-69.6	162.7	0	0	0	110.8	L324 L328 W338 R339 D340 A346 V553 I556 L557 L560	L324-I342 HydrophobicContact CD1-CB 4.23Å; L324-I342 HydrophobicContact CD1-CD1 3.94Å; L324-I342 HydrophobicContact CD1-CG2 3.83Å; L324-I342 HydrophobicContact CD2-CB 4.19Å; L324-I342 HydrophobicContact CD2-CG2 4.04Å; L328-I342 HydrophobicContact CD2-CD1 4.06Å; W338-I342 HydrophobicContact CB-CD1 4.22Å; W338-I342 VanDerWaalsContact O-CB 3.31Å; W338-I342 WeakPolarHBondContact O-CB 3.33Å; W338-I342 WeakPolarHBondContact O-CD1 3.41Å; W338-I342 WeakPolarHBondContact O-CG1 3.41Å; W338-I342 PolarHBondContact O-N 2.77Å; R339-I342 PolarHBondContact O-N 3.15Å; D340-I342 VanDerWaalsContact C-N 3.34Å; D340-I342 PolarHBondContact O-N 2.94Å; I342-A346 WeakPolarHBondContact O-CB 3.36Å; I342-A346 PolarHBondContact O-N 2.65Å; I342-V553 HydrophobicContact CD1-CB 4.45Å; I342-V553 HydrophobicContact CD1-CG1 3.95Å; I342-V553 HydrophobicContact CD1-CG2 4.27Å; I342-V553 HydrophobicContact CG1-CG1 3.9Å; I342-I556 HydrophobicContact CD1-CG2 4.45Å; I342-I556 HydrophobicContact CG2-CG2 4.21Å; I342-L557 HydrophobicContact CG2-CB 4.31Å; I342-L557 HydrophobicContact CG2-CD1 4.22Å; I342-L557 WeakPolarHBondContact O-CD1 3.43Å; I342-L560 HydrophobicContact CG2-CD1 3.52Å
343	M	95.3	Very high	94	Very high	27 Å²	27	46.4 Å²	46.4	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-48.2	-175.4	-166.1	66.2	-173.3	0	0	111.3	L317 L324 R339 D340 L345 A346 E347 I564	L317-M343 HydrophobicContact CB-CE 4.13Å; L317-M343 HydrophobicContact CD2-CE 3.75Å; L317-M343 WeakPolarHBondContact O-CE 3.04Å; L324-M343 HydrophobicContact CD2-CB 4.05Å; L324-M343 HydrophobicContact CD2-SD 4.49Å; R339-M343 WeakPolarHBondContact O-CB 3.38Å; R339-M343 PolarHBondContact O-N 3.45Å; D340-M343 PolarHBondContact O-N 2.94Å; M343-L345 PolarHBondContact O-N 3.2Å; M343-A346 PolarHBondContact O-N 2.88Å; M343-A346 VanDerWaalsContact O-N 3.16Å; M343-E347 WeakPolarHBondContact O-CB 3.23Å; M343-E347 PolarHBondContact O-N 3.21Å; M343-I564 HydrophobicContact CE-CD1 4.12Å; M343-I564 HydrophobicContact SD-CD1 4.41Å
344	Q	95.8	Very high	94.4	Very high	134 Å²	134	50.7 Å²	50.7	63%	0.626	25%	0.253	S	S	*	.	H	α-helix	trans	-59.3	-45	178.3	-173	-176.2	19.2	0	0	111.7	D340 Q348	D340-Q344 WeakPolarHBondContact O-CB 3.1Å; D340-Q344 PolarHBondContact O-N 3.24Å; Q344-Q348 WeakPolarHBondContact O-CB 3.48Å; Q344-Q348 PolarHBondContact O-N 3.36Å
345	L	97.8	Very high	94.5	Very high	13 Å²	13	47.6 Å²	47.6	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-39.9	176	-71.3	170	0	0	0	112.2	I341 M343 V349 A383 L385 I540 L542 L557	I341-L345 HydrophobicContact CG2-CD1 3.82Å; I341-L345 VanDerWaalsContact O-CB 3.31Å; I341-L345 WeakPolarHBondContact O-CB 3.28Å; I341-L345 VanDerWaalsContact O-CD1 3.24Å; I341-L345 WeakPolarHBondContact O-CD1 3.5Å; I341-L345 WeakPolarHBondContact O-CG 3.43Å; I341-L345 PolarHBondContact O-N 3.45Å; M343-L345 PolarHBondContact O-N 3.2Å; L345-V349 VanDerWaalsContact O-CB 3.22Å; L345-V349 WeakPolarHBondContact O-CB 3.36Å; L345-V349 VanDerWaalsContact O-CG2 3.24Å; L345-V349 WeakPolarHBondContact O-CG2 3.28Å; L345-V349 PolarHBondContact O-N 3.09Å; L345-A383 HydrophobicContact CD1-CB 3.57Å; L345-A383 HydrophobicContact CD2-CB 4.46Å; L345-A383 HydrophobicContact CG-CB 4.49Å; L345-L385 HydrophobicContact CD2-CB 4.04Å; L345-L385 HydrophobicContact CD2-CD2 4.46Å; L345-I540 HydrophobicContact CD1-CG2 3.92Å; L345-I540 HydrophobicContact CD2-CG2 4.36Å; L345-L542 HydrophobicContact CD1-CD2 4.17Å; L345-L557 HydrophobicContact CB-CD1 3.83Å; L345-L557 HydrophobicContact CD1-CD2 4.22Å
346	A	97.2	Very high	94.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-47.1	-178.5	0	0	0	0	0	111.2	I342 M343 A350 L557 L560 I561 I564	I342-A346 WeakPolarHBondContact O-CB 3.36Å; I342-A346 PolarHBondContact O-N 2.65Å; M343-A346 PolarHBondContact O-N 2.88Å; M343-A346 VanDerWaalsContact O-N 3.16Å; A346-A350 WeakPolarHBondContact O-CB 3.35Å; A346-A350 PolarHBondContact O-N 3.14Å; A346-L557 HydrophobicContact CB-CD1 4.01Å; A346-L560 HydrophobicContact CB-CB 3.72Å; A346-I561 HydrophobicContact CB-CG1 4.07Å; A346-I564 HydrophobicContact CB-CD1 3.77Å
347	E	96.3	Very high	94.1	Very high	75 Å²	75	40.6 Å²	40.6	35%	0.35	20%	0.199	S	C	.	.	H	α-helix	trans	-66.1	-53.8	177.9	-169.4	179.9	155.3	0	0	111.4	L317 M343 V349 A350 F351 I564	L317-E347 HydrophobicContact CD2-CG 4.29Å; M343-E347 WeakPolarHBondContact O-CB 3.23Å; M343-E347 PolarHBondContact O-N 3.21Å; E347-V349 VanDerWaalsContact C-N 3.26Å; E347-V349 PolarHBondContact O-N 3.36Å; E347-A350 PolarHBondContact O-N 3.37Å; E347-A350 VanDerWaalsContact O-N 3.16Å; E347-F351 HydrophobicContact CG-CD2 3.79Å; E347-F351 HydrophobicContact CG-CE2 3.91Å; E347-F351 WeakPolarHBondContact O-CD2 3.47Å; E347-F351 PolarHBondContact O-N 3.47Å; E347-I564 HydrophobicContact CB-CD1 4.22Å
348	Q	96.6	Very high	93.7	Very high	83 Å²	83	42.2 Å²	42.2	39%	0.388	20%	0.2	S	C	.	.	H	α-helix	trans	-56.8	-41.1	-178.7	-173.5	176.3	28.4	0	0	111.9	Q344 T352 L385 Y387	Q344-Q348 WeakPolarHBondContact O-CB 3.48Å; Q344-Q348 PolarHBondContact O-N 3.36Å; Q348-T352 WeakPolarHBondContact O-CB 3.43Å; Q348-T352 VanDerWaalsContact O-CG2 3.28Å; Q348-T352 WeakPolarHBondContact O-CG2 3.21Å; Q348-T352 PolarHBondContact O-N 2.94Å; Q348-T352 PolarHBondContact O-OG1 3.24Å; Q348-L385 HydrophobicContact CG-CD2 4.16Å; Q348-L385 VanDerWaalsContact OE1-CD2 3.25Å; Q348-Y387 PolarHBondContact NE2-OH 3.5Å
349	V	97.7	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-75	-40.2	178.7	172.5	0	0	0	0	112.1	L345 E347 F351 V353 V370 L385 I540 I561	L345-V349 VanDerWaalsContact O-CB 3.22Å; L345-V349 WeakPolarHBondContact O-CB 3.36Å; L345-V349 VanDerWaalsContact O-CG2 3.24Å; L345-V349 WeakPolarHBondContact O-CG2 3.28Å; L345-V349 PolarHBondContact O-N 3.09Å; E347-V349 VanDerWaalsContact C-N 3.26Å; E347-V349 PolarHBondContact O-N 3.36Å; V349-F351 VanDerWaalsContact C-N 3.3Å; V349-F351 PolarHBondContact O-N 2.71Å; V349-V353 HydrophobicContact CG1-CG2 3.92Å; V349-V353 WeakPolarHBondContact O-CB 3.47Å; V349-V353 WeakPolarHBondContact O-CG2 3.44Å; V349-V353 PolarHBondContact O-N 3.05Å; V349-V370 HydrophobicContact CG1-CB 4.44Å; V349-V370 HydrophobicContact CG1-CG1 4.2Å; V349-V370 HydrophobicContact CG1-CG2 3.35Å; V349-L385 HydrophobicContact CG2-CD1 3.76Å; V349-L385 HydrophobicContact CG2-CD2 4.18Å; V349-I540 HydrophobicContact CG2-CD1 4.13Å; V349-I561 HydrophobicContact CB-CD1 4.38Å; V349-I561 HydrophobicContact CB-CG1 4.46Å; V349-I561 HydrophobicContact CG1-CD1 4.14Å; V349-I561 HydrophobicContact CG1-CG1 4.42Å; V349-I561 HydrophobicContact CG1-CG2 4.15Å
350	A	95.6	Very high	91.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-34.1	176.9	0	0	0	0	0	112.9	A346 E347 I564 R568	A346-A350 WeakPolarHBondContact O-CB 3.35Å; A346-A350 PolarHBondContact O-N 3.14Å; E347-A350 PolarHBondContact O-N 3.37Å; E347-A350 VanDerWaalsContact O-N 3.16Å; A350-I564 HydrophobicContact CB-CB 3.74Å; A350-I564 HydrophobicContact CB-CG2 3.57Å; A350-R568 PolarHBondContact O-NH1 3.18Å; A350-R568 PolarHBondContact O-NH2 2.75Å
351	F	95.1	Very high	90.9	Very high	80 Å²	80	47.2 Å²	47.2	35%	0.351	25%	0.252	S	S	.	.	H	α-helix	trans	-80.6	-39.7	176.3	-83.6	-83.7	0	0	0	113.7	M313 E347 V349 I564 R568	M313-F351 HydrophobicContact CE-CE2 3.96Å; M313-F351 HydrophobicContact CE-CZ 3.8Å; M313-F351 HydrophobicContact CG-CZ 4.24Å; E347-F351 HydrophobicContact CG-CD2 3.79Å; E347-F351 HydrophobicContact CG-CE2 3.91Å; E347-F351 WeakPolarHBondContact O-CD2 3.47Å; E347-F351 PolarHBondContact O-N 3.47Å; V349-F351 VanDerWaalsContact C-N 3.3Å; V349-F351 PolarHBondContact O-N 2.71Å; F351-I564 HydrophobicContact CD2-CG2 4.46Å; F351-I564 HydrophobicContact CE2-CG2 4.14Å; F351-R568 HydrophobicContact CE1-CG 4.29Å; F351-R568 PolarHBondContact O-NH1 2.88Å
352	T	95.2	Very high	90.2	Very high	43 Å²	43	47.7 Å²	47.7	26%	0.264	26%	0.255	S	S	.	.	H	α-helix	trans	-82.8	-32.6	-175.6	55.1	0	0	0	0	115	Q348 Q535	Q348-T352 WeakPolarHBondContact O-CB 3.43Å; Q348-T352 VanDerWaalsContact O-CG2 3.28Å; Q348-T352 WeakPolarHBondContact O-CG2 3.21Å; Q348-T352 PolarHBondContact O-N 2.94Å; Q348-T352 PolarHBondContact O-OG1 3.24Å; T352-Q535 WeakPolarHBondContact O-CA 3.49Å
353	V	94.9	Very high	89.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.273	C	S	.	.			trans	-83.3	137	180	179.2	0	0	0	0	110.1	V349 I366 Y369 R568	V349-V353 HydrophobicContact CG1-CG2 3.92Å; V349-V353 WeakPolarHBondContact O-CB 3.47Å; V349-V353 WeakPolarHBondContact O-CG2 3.44Å; V349-V353 PolarHBondContact O-N 3.05Å; V353-I366 HydrophobicContact CB-CD1 4.07Å; V353-I366 HydrophobicContact CB-CG1 4.27Å; V353-I366 HydrophobicContact CG1-CD1 4.31Å; V353-I366 HydrophobicContact CG1-CG1 4Å; V353-Y369 VanDerWaalsContact CG1-CB 3.46Å; V353-Y369 HydrophobicContact CG1-CD1 4.32Å; V353-Y369 HydrophobicContact CG1-CG 4.07Å; V353-R568 PolarHBondContact O-NH2 3.25Å
354	Q	91.3	Very high	89.3	Confident	99 Å²	99	50.2 Å²	50.2	46%	0.463	27%	0.269	S	S	.	.			trans	-135.4	109.4	-179.2	-59.3	-178.6	-4.5	0	0	109	E356 Q535	Q354-E356 PolarHBondContact O-N 3.38Å; Q354-Q535 HydrophobicContact CB-CB 4.12Å; Q354-Q535 HydrophobicContact CG-CB 4.36Å; Q354-Q535 PolarHBondContact N-O 3.45Å
355	P	90.1	Very high	89	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.			trans	-56.8	135.8	172.4	-28.7	38.9	0	0	0	112.2	T357 I366 Y369 Y565 Q855	P355-T357 WeakPolarHBondContact CB-OG1 3.33Å; P355-T357 PolarHBondContact O-N 3.1Å; P355-I366 HydrophobicContact CG-CB 4.44Å; P355-Y369 HydrophobicContact CB-CD2 4.23Å; P355-Y369 HydrophobicContact CB-CE2 3.67Å; P355-Y369 HydrophobicContact CG-CD2 4.12Å; P355-Y369 HydrophobicContact CG-CE2 4.08Å; P355-Y565 HydrophobicContact CG-CE2 4.18Å; P355-Y565 WeakPolarHBondContact CG-OH 3.11Å; P355-Q855 PolarHBondContact O-NE2 3.22Å
356	E	84.8	Confident	88.7	Confident	32 Å²	32	44.2 Å²	44.2	15%	0.15	24%	0.243	C	C	.	.			trans	-92.6	35.5	178.1	-71.7	-174.6	168.2	0	0	110.7	Q354 K358 T359 N360 Y369 R492 L536	Q354-E356 PolarHBondContact O-N 3.38Å; E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 3.07Å; E356-T359 PolarHBondContact O-N 3.01Å; E356-T359 VanDerWaalsContact O-N 3.15Å; E356-T359 PolarHBondContact O-OG1 3.16Å; E356-N360 HydrophobicContact CB-CB 4.47Å; E356-N360 VanDerWaalsContact CB-ND2 3.26Å; E356-N360 WeakPolarHBondContact CB-ND2 3.17Å; E356-N360 PolarHBondContact O-N 3.49Å; E356-N360 PolarHBondContact OE2-ND2 2.92Å; E356-Y369 PolarHBondContact N-OH 3.13Å; E356-R492 IonicContact OE1-CZ 3.89Å; E356-R492 IonicContact OE1-NH2 2.78Å; E356-R492 PolarHBondContact OE1-NH2 3.3Å; E356-R492 IonicContact OE2-NH2 3.99Å; E356-L536 VanDerWaalsContact OE1-CD2 3.28Å; E356-L536 WeakPolarHBondContact OE1-CD2 3.5Å
357	T	84.6	Confident	88.5	Confident	15 Å²	15	46.3 Å²	46.3	9%	0.092	25%	0.254	C	S	.	.	H	α-helix	trans	-48	-46.8	-171.9	-35.8	0	0	0	0	113.2	P355 G361 D362 M364 P768 W854	P355-T357 WeakPolarHBondContact CB-OG1 3.33Å; P355-T357 PolarHBondContact O-N 3.1Å; T357-G361 WeakPolarHBondContact O-CA 3.14Å; T357-G361 PolarHBondContact O-N 3.43Å; T357-G361 VanDerWaalsContact O-N 3.17Å; T357-D362 WeakPolarHBondContact CG2-O 3.3Å; T357-M364 HydrophobicContact CG2-CB 3.99Å; T357-P768 HydrophobicContact CG2-CG 3.83Å; T357-W854 HydrophobicContact CG2-CZ3 4.39Å
358	K	82.4	Confident	88.1	Confident	96 Å²	96	45.1 Å²	45.1	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-75.5	-33.7	-175.6	-168.4	168.9	-164.4	168.9	0	113.7	E356 E774 W854	E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 3.07Å; K358-E774 WeakPolarHBondContact CE-OE2 3.43Å; K358-E774 VanDerWaalsContact NZ-CD 3.32Å; K358-E774 IonicContact NZ-OE1 2.64Å; K358-E774 PolarHBondContact NZ-OE1 3.09Å; K358-E774 IonicContact NZ-OE2 3.71Å; K358-E774 PolarHBondContact NZ-OE2 2.92Å; K358-E774 VanDerWaalsContact NZ-OE2 3.17Å; K358-W854 HydrophobicContact CB-CE3 4.09Å; K358-W854 HydrophobicContact CB-CH2 3.59Å; K358-W854 HydrophobicContact CB-CZ2 4.07Å; K358-W854 HydrophobicContact CB-CZ3 3.62Å; K358-W854 HydrophobicContact CD-CD2 3.9Å; K358-W854 HydrophobicContact CD-CE3 4.32Å; K358-W854 HydrophobicContact CD-CG 4.48Å; K358-W854 HydrophobicContact CD-CH2 4.06Å; K358-W854 HydrophobicContact CD-CZ2 3.61Å; K358-W854 HydrophobicContact CD-CZ3 4.4Å; K358-W854 HydrophobicContact CG-CD2 4.5Å; K358-W854 HydrophobicContact CG-CH2 3.64Å; K358-W854 HydrophobicContact CG-CZ2 3.62Å; K358-W854 HydrophobicContact CG-CZ3 4.13Å
359	T	77	Confident	88	Confident	105 Å²	105	41.2 Å²	41.2	64%	0.644	24%	0.236	S	C	*	.	H	α-helix	trans	-90.2	-29.3	-173.4	52.7	0	0	0	0	112.8	E356	E356-T359 PolarHBondContact O-N 3.01Å; E356-T359 VanDerWaalsContact O-N 3.15Å; E356-T359 PolarHBondContact O-OG1 3.16Å
360	N	73.9	Confident	87.9	Confident	86 Å²	86	41.5 Å²	41.5	46%	0.46	24%	0.237	S	C	.	.	H	α-helix	trans	-113.4	-13	-172	-56.7	-2.7	0	0	0	113.5	E356 D362	E356-N360 HydrophobicContact CB-CB 4.47Å; E356-N360 VanDerWaalsContact CB-ND2 3.26Å; E356-N360 WeakPolarHBondContact CB-ND2 3.17Å; E356-N360 PolarHBondContact O-N 3.49Å; E356-N360 PolarHBondContact OE2-ND2 2.92Å; N360-D362 HydrophobicContact CB-CB 4.23Å; N360-D362 WeakPolarHBondContact CB-OD2 3.36Å; N360-D362 PolarHBondContact ND2-OD2 2.82Å; N360-D362 PolarHBondContact O-N 3.13Å
361	G	74.6	Confident	87.9	Confident	70 Å²	70	43.5 Å²	43.5	72%	0.722	25%	0.246	S	C	*	.			trans	67.1	22.6	-164.5	0	0	0	0	0	113.1	T357	T357-G361 WeakPolarHBondContact O-CA 3.14Å; T357-G361 PolarHBondContact O-N 3.43Å; T357-G361 VanDerWaalsContact O-N 3.17Å
362	D	81.7	Confident	87.9	Confident	42 Å²	42	39.8 Å²	39.8	23%	0.225	23%	0.23	C	C	.	.			trans	-65.3	155.1	179.8	-96	-48.6	0	0	0	112.1	T357 N360 M364 Y369	T357-D362 WeakPolarHBondContact CG2-O 3.3Å; N360-D362 HydrophobicContact CB-CB 4.23Å; N360-D362 WeakPolarHBondContact CB-OD2 3.36Å; N360-D362 PolarHBondContact ND2-OD2 2.82Å; N360-D362 PolarHBondContact O-N 3.13Å; D362-M364 PolarHBondContact O-N 2.89Å; D362-Y369 HydrophobicContact CB-CE2 4.41Å; D362-Y369 WeakPolarHBondContact CB-OH 3.21Å; D362-Y369 PolarHBondContact OD2-OH 2.86Å
363	D	83.1	Confident	87.8	Confident	68 Å²	68	39.3 Å²	39.3	36%	0.364	22%	0.224	S	C	.	.			trans	-60.3	127.1	175.9	177.1	-84	0	0	0	111.8	S365 S368	D363-S365 PolarHBondContact O-N 2.82Å; D363-S365 VanDerWaalsContact O-N 3.07Å; D363-S365 WeakPolarHBondContact OD1-CA 3.28Å; D363-S365 WeakPolarHBondContact OD1-CB 3.38Å; D363-S365 PolarHBondContact OD1-N 3.11Å; D363-S368 VanDerWaalsContact CG-OG 3.23Å; D363-S368 VanDerWaalsContact OD1-CB 3.31Å; D363-S368 WeakPolarHBondContact OD1-CB 3.32Å; D363-S368 PolarHBondContact OD1-OG 3.02Å
364	M	89.8	Confident	87.7	Confident	13 Å²	13	42.4 Å²	42.4	6%	0.064	24%	0.243	C	C	.	.	S	Bend	trans	-66.4	-10.3	-174.8	74.8	-173	-72	0	0	114.5	T357 D362 I366 Y762 D766 P768	T357-M364 HydrophobicContact CG2-CB 3.99Å; D362-M364 PolarHBondContact O-N 2.89Å; M364-I366 PolarHBondContact O-N 2.97Å; M364-Y762 HydrophobicContact CE-CD1 3.67Å; M364-Y762 HydrophobicContact CE-CE1 4.13Å; M364-Y762 HydrophobicContact CE-CG 4.34Å; M364-D766 HydrophobicContact SD-CB 3.97Å; M364-P768 HydrophobicContact CB-CG 4.19Å; M364-P768 HydrophobicContact CE-CG 4.18Å; M364-P768 HydrophobicContact SD-CG 4.26Å
365	S	89	Confident	87.6	Confident	19 Å²	19	38.6 Å²	38.6	13%	0.133	23%	0.226	C	C	.	.			trans	-80.1	117.4	179.2	-146.3	0	0	0	0	110.1	D363 L367 S368 Y762	D363-S365 PolarHBondContact O-N 2.82Å; D363-S365 VanDerWaalsContact O-N 3.07Å; D363-S365 WeakPolarHBondContact OD1-CA 3.28Å; D363-S365 WeakPolarHBondContact OD1-CB 3.38Å; D363-S365 PolarHBondContact OD1-N 3.11Å; S365-L367 PolarHBondContact O-N 2.89Å; S365-S368 VanDerWaalsContact O-CB 3.27Å; S365-S368 WeakPolarHBondContact O-CB 3.3Å; S365-S368 PolarHBondContact O-N 2.91Å; S365-Y762 WeakPolarHBondContact CB-O 3.3Å; S365-Y762 PolarHBondContact OG-O 3.23Å
366	I	92.6	Very high	87.7	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-50.6	-26.7	167.7	-174.3	166.3	0	0	0	112.3	V353 P355 M364 S368 Y369 V370 I561 Y565	V353-I366 HydrophobicContact CB-CD1 4.07Å; V353-I366 HydrophobicContact CB-CG1 4.27Å; V353-I366 HydrophobicContact CG1-CD1 4.31Å; V353-I366 HydrophobicContact CG1-CG1 4Å; P355-I366 HydrophobicContact CG-CB 4.44Å; M364-I366 PolarHBondContact O-N 2.97Å; I366-S368 PolarHBondContact O-N 3.38Å; I366-Y369 WeakPolarHBondContact O-CA 3.22Å; I366-Y369 WeakPolarHBondContact O-CB 3.23Å; I366-Y369 PolarHBondContact O-N 3.35Å; I366-V370 HydrophobicContact CG1-CG2 4.29Å; I366-V370 WeakPolarHBondContact O-CG2 3.33Å; I366-V370 PolarHBondContact O-N 3.19Å; I366-I561 HydrophobicContact CD1-CG2 4.02Å; I366-I561 HydrophobicContact CG1-CG2 4.12Å; I366-I561 HydrophobicContact CG2-CG2 4Å; I366-Y565 HydrophobicContact CB-CD1 4.16Å; I366-Y565 HydrophobicContact CB-CD2 4.08Å; I366-Y565 HydrophobicContact CB-CE1 4.46Å; I366-Y565 HydrophobicContact CB-CE2 4.39Å; I366-Y565 HydrophobicContact CB-CG 3.96Å; I366-Y565 HydrophobicContact CD1-CD2 3.63Å; I366-Y565 HydrophobicContact CD1-CE2 4.37Å; I366-Y565 HydrophobicContact CD1-CG 3.98Å; I366-Y565 HydrophobicContact CG1-CD2 4.4Å; I366-Y565 HydrophobicContact CG2-CD1 3.88Å; I366-Y565 HydrophobicContact CG2-CD2 4.38Å; I366-Y565 HydrophobicContact CG2-CG 3.77Å
367	L	91.7	Very high	87.9	Confident	45 Å²	45	42.5 Å²	42.5	24%	0.236	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-69	-14.1	177.3	-58.1	-170.8	0	0	0	114.8	S365 Y369 K558 I561 A562	S365-L367 PolarHBondContact O-N 2.89Å; L367-Y369 VanDerWaalsContact C-N 3.34Å; L367-K558 HydrophobicContact CD1-CB 4.25Å; L367-K558 HydrophobicContact CD2-CB 4.29Å; L367-K558 HydrophobicContact CD2-CG 4.23Å; L367-K558 VanDerWaalsContact CD2-O 3.32Å; L367-K558 WeakPolarHBondContact CD2-O 3.29Å; L367-K558 PolarHBondContact O-NZ 2.99Å; L367-I561 HydrophobicContact CD2-CB 4.04Å; L367-I561 HydrophobicContact CD2-CG2 3.8Å; L367-A562 HydrophobicContact CD1-CB 4.13Å; L367-A562 HydrophobicContact CD2-CB 4.45Å; L367-A562 HydrophobicContact CG-CB 4.24Å
368	S	89.7	Confident	87.9	Confident	50 Å²	50	43.7 Å²	43.7	35%	0.35	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-80.9	-16.6	168.9	-61.3	0	0	0	0	112.3	D363 S365 I366 R489	D363-S368 VanDerWaalsContact CG-OG 3.23Å; D363-S368 VanDerWaalsContact OD1-CB 3.31Å; D363-S368 WeakPolarHBondContact OD1-CB 3.32Å; D363-S368 PolarHBondContact OD1-OG 3.02Å; S365-S368 VanDerWaalsContact O-CB 3.27Å; S365-S368 WeakPolarHBondContact O-CB 3.3Å; S365-S368 PolarHBondContact O-N 2.91Å; I366-S368 PolarHBondContact O-N 3.38Å; S368-R489 PolarHBondContact O-NH1 3.01Å; S368-R489 PolarHBondContact O-NH2 3.29Å
369	Y	93.5	Very high	88.1	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-20.2	172.2	-71	-105	0	0	0	113.6	V353 P355 E356 D362 I366 L367 R489 G537 C538	V353-Y369 VanDerWaalsContact CG1-CB 3.46Å; V353-Y369 HydrophobicContact CG1-CD1 4.32Å; V353-Y369 HydrophobicContact CG1-CG 4.07Å; P355-Y369 HydrophobicContact CB-CD2 4.23Å; P355-Y369 HydrophobicContact CB-CE2 3.67Å; P355-Y369 HydrophobicContact CG-CD2 4.12Å; P355-Y369 HydrophobicContact CG-CE2 4.08Å; E356-Y369 PolarHBondContact N-OH 3.13Å; D362-Y369 HydrophobicContact CB-CE2 4.41Å; D362-Y369 WeakPolarHBondContact CB-OH 3.21Å; D362-Y369 PolarHBondContact OD2-OH 2.86Å; I366-Y369 WeakPolarHBondContact O-CA 3.22Å; I366-Y369 WeakPolarHBondContact O-CB 3.23Å; I366-Y369 PolarHBondContact O-N 3.35Å; L367-Y369 VanDerWaalsContact C-N 3.34Å; Y369-R489 VanDerWaalsContact CE1-CD 3.5Å; Y369-G537 VanDerWaalsContact O-CA 3.29Å; Y369-G537 WeakPolarHBondContact O-CA 3.41Å; Y369-C538 PolarHBondContact O-N 3.11Å
370	V	95.2	Very high	88.7	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.03	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	115.3	-172.6	-176.9	0	0	0	0	113.6	V349 I366 V372 I540 K558 I561	V349-V370 HydrophobicContact CG1-CB 4.44Å; V349-V370 HydrophobicContact CG1-CG1 4.2Å; V349-V370 HydrophobicContact CG1-CG2 3.35Å; I366-V370 HydrophobicContact CG1-CG2 4.29Å; I366-V370 WeakPolarHBondContact O-CG2 3.33Å; I366-V370 PolarHBondContact O-N 3.19Å; V370-V372 HydrophobicContact CG1-CG2 4.1Å; V370-I540 HydrophobicContact CG1-CD1 4.01Å; V370-I540 HydrophobicContact CG1-CG1 4.25Å; V370-K558 PolarHBondContact O-NZ 3.38Å; V370-I561 HydrophobicContact CG1-CD1 4.09Å; V370-I561 HydrophobicContact CG2-CG2 4.37Å
371	H	95.4	Very high	89.7	Confident	44 Å²	44	44.6 Å²	44.6	20%	0.204	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	100.1	173.7	-169.6	54.7	0	0	0	112.6	C538 T539 I540	H371-C538 PolarHBondContact N-O 3.15Å; H371-T539 HydrophobicContact CB-CG2 4.3Å; H371-T539 CarbonylContact O-C 3.56Å; H371-T539 VanDerWaalsContact O-CA 3.31Å; H371-T539 WeakPolarHBondContact O-CA 3.18Å; H371-T539 WeakPolarHBondContact O-CG2 3.14Å; H371-I540 PolarHBondContact O-N 3.34Å
372	V	95.8	Very high	90.6	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	117	171.6	-168.9	0	0	0	0	110.3	V370 I540 L542 K554 L557 K558	V370-V372 HydrophobicContact CG1-CG2 4.1Å; V372-I540 HydrophobicContact CG1-CB 4.48Å; V372-I540 HydrophobicContact CG2-CD1 4.27Å; V372-L542 HydrophobicContact CG1-CD1 3.51Å; V372-L542 HydrophobicContact CG1-CG 4.05Å; V372-K554 HydrophobicContact CB-CD 4.2Å; V372-K554 HydrophobicContact CB-CG 4.04Å; V372-K554 HydrophobicContact CG1-CB 4.06Å; V372-K554 HydrophobicContact CG1-CD 3.95Å; V372-K554 HydrophobicContact CG1-CG 3.71Å; V372-K554 WeakPolarHBondContact O-CE 3.29Å; V372-K554 PolarHBondContact O-NZ 3.16Å; V372-L557 HydrophobicContact CG1-CD2 4.33Å; V372-K558 HydrophobicContact CG2-CG 4Å
373	K	93.2	Very high	91.3	Very high	32 Å²	32	42.6 Å²	42.6	14%	0.139	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.7	-173	-177	178.5	-179.9	64.8	0	110.3	I375 T392 T539 I540 L541 L542	K373-I375 HydrophobicContact CD-CD1 4.36Å; K373-I375 HydrophobicContact CG-CD1 4.45Å; K373-I375 HydrophobicContact CG-CG1 4.32Å; K373-T392 WeakPolarHBondContact CE-OG1 3.22Å; K373-T392 PolarHBondContact NZ-OG1 3.22Å; K373-T539 HydrophobicContact CB-CG2 4.4Å; K373-I540 PolarHBondContact N-O 3.47Å; K373-L541 HydrophobicContact CB-CD2 3.97Å; K373-L541 HydrophobicContact CD-CD2 3.75Å; K373-L541 HydrophobicContact CG-CD2 4.15Å; K373-L541 CarbonylContact O-C 3.52Å; K373-L541 WeakPolarHBondContact O-CA 3.42Å; K373-L542 PolarHBondContact O-N 3.14Å
374	T	93	Very high	91.8	Very high	65 Å²	65	41.1 Å²	41.1	40%	0.399	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	131.8	-177.2	45.9	0	0	0	0	111.1	L542 L550 K554	T374-L542 CarbonylContact C-O 3.41Å; T374-L542 WeakPolarHBondContact CA-O 3.03Å; T374-L542 HydrophobicContact CG2-CB 4.28Å; T374-L550 HydrophobicContact CG2-CB 3.9Å; T374-L550 HydrophobicContact CG2-CD2 4.33Å; T374-L550 WeakPolarHBondContact CG2-O 3.36Å; T374-K554 HydrophobicContact CG2-CB 4.41Å; T374-K554 HydrophobicContact CG2-CD 4.02Å
375	I	89.8	Confident	92.2	Very high	19 Å²	19	42.3 Å²	42.3	10%	0.097	23%	0.228	C	C	.	.			trans	-143.1	104.4	-176.1	-54.2	-174.1	0	0	0	107.9	K373 R377 V516 L518 L526 L541 L542 S543	K373-I375 HydrophobicContact CD-CD1 4.36Å; K373-I375 HydrophobicContact CG-CD1 4.45Å; K373-I375 HydrophobicContact CG-CG1 4.32Å; I375-R377 VanDerWaalsContact C-N 3.3Å; I375-R377 HydrophobicContact CG2-CB 4.39Å; I375-R377 PolarHBondContact O-N 3.22Å; I375-V516 HydrophobicContact CG2-CG1 3.96Å; I375-L518 HydrophobicContact CG2-CD2 3.56Å; I375-L526 HydrophobicContact CD1-CD1 3.65Å; I375-L526 HydrophobicContact CD1-CD2 4.01Å; I375-L526 HydrophobicContact CD1-CG 4.48Å; I375-L541 HydrophobicContact CD1-CD1 4.48Å; I375-L541 HydrophobicContact CD1-CD2 3.99Å; I375-L542 PolarHBondContact N-O 3.07Å; I375-S543 VanDerWaalsContact O-CA 3.28Å; I375-S543 WeakPolarHBondContact O-CA 3.49Å; I375-S543 WeakPolarHBondContact O-CB 3.39Å; I375-S543 PolarHBondContact O-OG 2.93Å; I375-S543 VanDerWaalsContact O-OG 3.09Å
376	R	90.7	Very high	92.5	Very high	32 Å²	32	41.7 Å²	41.7	12%	0.121	22%	0.224	C	C	.	.			trans	-74.4	79.6	176.1	-74.6	179.4	74.3	-158.2	19.4	110.7	L518 L519 P545 L550 D645	R376-L518 CarbonylContact O-C 3.51Å; R376-L518 WeakPolarHBondContact O-CA 2.95Å; R376-L518 WeakPolarHBondContact O-CB 3.11Å; R376-L519 HydrophobicContact CB-CB 4.5Å; R376-L519 HydrophobicContact CB-CD1 4.18Å; R376-L519 HydrophobicContact CB-CG 4.34Å; R376-L519 PolarHBondContact O-N 3.13Å; R376-P545 VanDerWaalsContact CZ-O 3.3Å; R376-P545 PolarHBondContact NE-O 3.14Å; R376-P545 PolarHBondContact NH2-O 3.03Å; R376-L550 HydrophobicContact CG-CD1 3.45Å; R376-L550 VanDerWaalsContact CG-CD1 3.45Å; R376-D645 IonicContact CZ-OD1 2.68Å; R376-D645 IonicContact CZ-OD2 3.06Å; R376-D645 VanDerWaalsContact NH1-CG 3.31Å; R376-D645 IonicContact NH1-OD1 3.74Å; R376-D645 PolarHBondContact NH1-OD1 3.2Å; R376-D645 IonicContact NH1-OD2 3.04Å; R376-D645 PolarHBondContact NH1-OD2 2.91Å; R376-D645 IonicContact NH2-OD1 2.88Å; R376-D645 PolarHBondContact NH2-OD1 3.3Å
377	R	89.1	Confident	92.8	Very high	83 Å²	83	44.1 Å²	44.1	31%	0.313	23%	0.233	S	C	.	.			trans	-97.4	-21.5	176	64.6	174.3	-179.3	-163.5	-2.9	113.7	I375 D384 V516 S543	I375-R377 VanDerWaalsContact C-N 3.3Å; I375-R377 HydrophobicContact CG2-CB 4.39Å; I375-R377 PolarHBondContact O-N 3.22Å; R377-D384 IonicContact NH1-OD2 2.67Å; R377-D384 IonicContact NH2-OD2 2.71Å; R377-V516 HydrophobicContact CB-CG1 3.77Å; R377-S543 WeakPolarHBondContact CG-OG 3.48Å; R377-S543 PolarHBondContact N-OG 2.81Å; R377-S543 VanDerWaalsContact N-OG 3.09Å
378	C	85.5	Confident	92.9	Very high	40 Å²	40	42 Å²	42	27%	0.27	22%	0.222	S	C	.	.			trans	-147	152.7	-179.8	62	0	0	0	0	111.3	Q380 S382 S543 G544	C378-Q380 PolarHBondContact SG-O 3.35Å; C378-S382 PolarHBondContact SG-OG 2.05Å; C378-S543 PolarHBondContact N-OG 3.35Å; C378-S543 PolarHBondContact O-OG 3.11Å; C378-S543 PolarHBondContact SG-OG 3.04Å; C378-G544 CarbonylContact O-C 3.49Å; C378-G544 PolarHBondContact O-N 3.42Å
379	L	85.9	Confident	93.3	Very high	117 Å²	117	39.6 Å²	39.6	61%	0.613	21%	0.205	S	C	*	.	S	Bend	trans	-73.3	-40.2	179.9	-73.9	167.4	0	0	0	112.7	L519 P545	L379-L519 HydrophobicContact CD2-CD1 3.77Å; L379-L519 HydrophobicContact CG-CD1 4.12Å; L379-L519 HydrophobicContact CG-CD2 4.14Å; L379-P545 WeakPolarHBondContact O-CA 3.5Å; L379-P545 WeakPolarHBondContact O-CB 3.3Å; L379-P545 WeakPolarHBondContact O-CD 3.44Å; L379-P545 VanDerWaalsContact O-N 3.17Å
380	Q	90.6	Very high	93.4	Very high	160 Å²	160	39.6 Å²	39.6	75%	0.748	21%	0.205	S	C	*	.	S	Bend	trans	-67.1	138.9	173	-73.8	-179	-23.3	0	0	110.4	C378 S382	C378-Q380 PolarHBondContact SG-O 3.35Å; Q380-S382 PolarHBondContact O-N 2.99Å
381	P	93.3	Very high	93.3	Very high	28 Å²	28	39.9 Å²	39.9	18%	0.182	21%	0.207	C	C	.	.			trans	-53.5	133	168.5	-29.7	39.1	0	0	0	112.1	P337 W338 I341 S543	P337-P381 HydrophobicContact CG-CB 3.88Å; P337-P381 HydrophobicContact CG-CG 4.11Å; W338-P381 HydrophobicContact CD2-CB 3.75Å; W338-P381 HydrophobicContact CD2-CG 4.06Å; W338-P381 HydrophobicContact CE3-CB 3.92Å; W338-P381 HydrophobicContact CG-CB 4.46Å; W338-P381 HydrophobicContact CG-CG 4.45Å; W338-P381 HydrophobicContact CH2-CB 3.74Å; W338-P381 HydrophobicContact CH2-CG 4.42Å; W338-P381 HydrophobicContact CZ2-CB 3.58Å; W338-P381 HydrophobicContact CZ2-CG 3.76Å; W338-P381 HydrophobicContact CZ3-CB 3.89Å; I341-P381 HydrophobicContact CD1-CB 4.06Å; P381-S543 WeakPolarHBondContact CA-O 3.23Å
382	S	94.5	Very high	93.1	Very high	33 Å²	33	41.3 Å²	41.3	23%	0.231	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	159.8	172.6	60.3	0	0	0	0	111.4	C378 Q380 S543	C378-S382 PolarHBondContact SG-OG 2.05Å; Q380-S382 PolarHBondContact O-N 2.99Å; S382-S543 PolarHBondContact N-O 3.38Å; S382-S543 PolarHBondContact O-N 3.35Å
383	A	95.5	Very high	92.8	Very high	38 Å²	38	43.5 Å²	43.5	31%	0.314	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	159.5	175.7	0	0	0	0	0	112.3	I341 L345 L541 L542	I341-A383 HydrophobicContact CG2-CB 3.94Å; L345-A383 HydrophobicContact CD1-CB 3.57Å; L345-A383 HydrophobicContact CD2-CB 4.46Å; L345-A383 HydrophobicContact CG-CB 4.49Å; A383-L541 CarbonylContact C-O 3.55Å; A383-L541 WeakPolarHBondContact CA-O 3.28Å; A383-L542 HydrophobicContact CB-CD2 3.93Å
384	D	94.6	Very high	92.5	Very high	37 Å²	37	43 Å²	43	20%	0.198	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	111.2	176.6	166.6	5.1	0	0	0	106.6	R377 R528 L541	R377-D384 IonicContact NH1-OD2 2.67Å; R377-D384 IonicContact NH2-OD2 2.71Å; D384-R528 IonicContact OD1-NH2 3.2Å; D384-R528 PolarHBondContact OD1-NH2 2.88Å; D384-R528 IonicContact OD2-CZ 3.64Å; D384-R528 IonicContact OD2-NH1 2.78Å; D384-R528 PolarHBondContact OD2-NH1 3.31Å; D384-R528 IonicContact OD2-NH2 2.85Å; D384-R528 PolarHBondContact OD2-NH2 3.1Å; D384-R528 VanDerWaalsContact OD2-NH2 3.11Å; D384-L541 HydrophobicContact CB-CB 4.12Å; D384-L541 HydrophobicContact CB-CD1 4.48Å; D384-L541 PolarHBondContact N-O 3.37Å; D384-L541 PolarHBondContact O-N 3.02Å
385	L	97.1	Very high	92.5	Very high	38 Å²	38	41 Å²	41	20%	0.199	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.1	-176.4	172.6	64	0	0	0	109.5	L345 Q348 V349 Y387 C538 I540	L345-L385 HydrophobicContact CD2-CB 4.04Å; L345-L385 HydrophobicContact CD2-CD2 4.46Å; Q348-L385 HydrophobicContact CG-CD2 4.16Å; Q348-L385 VanDerWaalsContact OE1-CD2 3.25Å; V349-L385 HydrophobicContact CG2-CD1 3.76Å; V349-L385 HydrophobicContact CG2-CD2 4.18Å; L385-Y387 HydrophobicContact CD2-CE1 4.32Å; L385-Y387 HydrophobicContact CD2-CE2 4.5Å; L385-C538 HydrophobicContact CD1-CB 3.94Å; L385-I540 HydrophobicContact CD1-CG1 3.95Å
386	V	96.5	Very high	92.4	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.036	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	115.5	-178.3	-176.8	0	0	0	0	109.6	G388 V390 E530 C538 T539	V386-G388 PolarHBondContact O-N 2.98Å; V386-V390 HydrophobicContact CB-CG2 4.05Å; V386-V390 HydrophobicContact CG1-CG2 4.03Å; V386-V390 HydrophobicContact CG2-CG2 3.89Å; V386-E530 HydrophobicContact CG1-CB 4.11Å; V386-E530 HydrophobicContact CG1-CG 3.72Å; V386-C538 CarbonylContact O-C 3.56Å; V386-C538 VanDerWaalsContact O-CA 3.28Å; V386-C538 WeakPolarHBondContact O-CA 3.2Å; V386-C538 WeakPolarHBondContact O-CB 3.48Å; V386-T539 PolarHBondContact N-O 2.92Å; V386-T539 PolarHBondContact O-N 3.02Å
387	Y	97.5	Very high	92.3	Very high	52 Å²	52	43.1 Å²	43.1	20%	0.204	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	113.7	167.2	-60.5	-67.2	0	0	0	108.8	Q348 L385 D531 C532 P534 C538	Q348-Y387 PolarHBondContact NE2-OH 3.5Å; L385-Y387 HydrophobicContact CD2-CE1 4.32Å; L385-Y387 HydrophobicContact CD2-CE2 4.5Å; Y387-D531 PolarHBondContact O-N 3.31Å; Y387-C532 WeakPolarHBondContact CB-O 3.47Å; Y387-C532 PolarHBondContact O-N 2.95Å; Y387-P534 HydrophobicContact CD1-CB 3.54Å; Y387-P534 HydrophobicContact CD1-CG 3.95Å; Y387-P534 HydrophobicContact CD2-CG 4.25Å; Y387-P534 HydrophobicContact CE1-CB 3.76Å; Y387-P534 HydrophobicContact CE1-CG 4.29Å; Y387-P534 HydrophobicContact CG-CB 4.05Å; Y387-P534 HydrophobicContact CG-CG 3.93Å; Y387-C538 HydrophobicContact CD1-CB 4.11Å
388	G	95.9	Very high	92	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	116.6	-156.8	-161.9	0	0	0	0	0	114.3	V386 F529 G537 C538 T539	V386-G388 PolarHBondContact O-N 2.98Å; G388-F529 CarbonylContact C-O 3.3Å; G388-F529 WeakPolarHBondContact CA-O 3.3Å; G388-G537 PolarHBondContact N-O 2.79Å; G388-G537 VanDerWaalsContact N-O 3.12Å; G388-C538 CarbonylContact O-C 3.6Å; G388-C538 WeakPolarHBondContact O-CA 3.35Å; G388-T539 PolarHBondContact O-N 3.2Å; G388-T539 PolarHBondContact O-OG1 3.1Å; G388-T539 VanDerWaalsContact O-OG1 3.05Å
389	T	96.2	Very high	92.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.3	-169.8	-68.9	0	0	0	0	113.2	R486 I487 F529 T539	T389-R486 HydrophobicContact CG2-CB 4.22Å; T389-R486 WeakPolarHBondContact OG1-CB 3.32Å; T389-R486 PolarHBondContact OG1-O 3.26Å; T389-I487 HydrophobicContact CG2-CD1 4.5Å; T389-I487 HydrophobicContact CG2-CG1 3.6Å; T389-F529 PolarHBondContact N-O 2.92Å; T389-F529 PolarHBondContact O-N 2.93Å; T389-T539 WeakPolarHBondContact CA-OG1 3.34Å
390	V	95.9	Very high	92.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.8	165.4	-172.5	0	0	0	0	110.9	V386 L526 C527 R528 T539 L541	V386-V390 HydrophobicContact CB-CG2 4.05Å; V386-V390 HydrophobicContact CG1-CG2 4.03Å; V386-V390 HydrophobicContact CG2-CG2 3.89Å; V390-L526 HydrophobicContact CG1-CB 4.06Å; V390-L526 HydrophobicContact CG1-CD1 4.25Å; V390-C527 WeakPolarHBondContact CA-O 3.4Å; V390-R528 HydrophobicContact CB-CG 4.41Å; V390-R528 HydrophobicContact CG1-CG 3.8Å; V390-R528 HydrophobicContact CG2-CB 4.18Å; V390-R528 HydrophobicContact CG2-CG 3.87Å; V390-T539 HydrophobicContact CB-CG2 3.72Å; V390-T539 HydrophobicContact CG2-CG2 4.03Å; V390-T539 PolarHBondContact N-OG1 3.36Å; V390-T539 VanDerWaalsContact N-OG1 3.1Å; V390-L541 HydrophobicContact CB-CD2 4.06Å; V390-L541 HydrophobicContact CG1-CD1 4.45Å; V390-L541 HydrophobicContact CG1-CD2 4.09Å; V390-L541 HydrophobicContact CG2-CD1 4.46Å; V390-L541 HydrophobicContact CG2-CD2 4.38Å
391	C	93.8	Very high	92.4	Very high	11 Å²	11	44.3 Å²	44.3	7%	0.074	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	157	176.5	69	0	0	0	0	111.6	K393 A483 L526 C527	C391-K393 PolarHBondContact O-N 2.97Å; C391-A483 HydrophobicContact CB-CB 4.2Å; C391-L526 CarbonylContact O-C 3.58Å; C391-L526 VanDerWaalsContact O-CA 3.28Å; C391-L526 WeakPolarHBondContact O-CA 3.38Å; C391-C527 PolarHBondContact N-O 3.4Å; C391-C527 PolarHBondContact O-N 3.45Å
392	T	91.4	Very high	92.4	Very high	74 Å²	74	46.4 Å²	46.4	45%	0.454	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	100.2	175.9	-63.8	0	0	0	0	108.4	K373 K524 M525	K373-T392 WeakPolarHBondContact CE-OG1 3.22Å; K373-T392 PolarHBondContact NZ-OG1 3.22Å; T392-K524 HydrophobicContact CG2-CB 4.44Å; T392-M525 CarbonylContact C-O 3.59Å; T392-M525 WeakPolarHBondContact CA-O 3.42Å; T392-M525 WeakPolarHBondContact CG2-O 3.41Å
393	K	90.2	Very high	92.5	Very high	48 Å²	48	51.8 Å²	51.8	21%	0.209	26%	0.257	C	S	.	.			trans	-162.9	156.7	-177	-161.2	68.7	-168.7	-173.9	0	109.1	C391 L476 H477 N478 V479 M525 L526 C527	C391-K393 PolarHBondContact O-N 2.97Å; K393-L476 HydrophobicContact CG-CD2 4.23Å; K393-H477 WeakPolarHBondContact CE-O 3.28Å; K393-H477 PolarHBondContact NZ-O 2.91Å; K393-N478 PolarHBondContact NZ-O 3.36Å; K393-V479 HydrophobicContact CD-CG2 4.4Å; K393-V479 HydrophobicContact CG-CG2 4.31Å; K393-M525 PolarHBondContact N-O 3.46Å; K393-M525 CarbonylContact O-C 3.56Å; K393-M525 WeakPolarHBondContact O-CB 3.43Å; K393-L526 CarbonylContact O-C 3.57Å; K393-C527 VanDerWaalsContact C-SG 3.58Å; K393-C527 HydrophobicContact CB-CB 4.5Å; K393-C527 PolarHBondContact O-N 3.12Å; K393-C527 PolarHBondContact O-SG 3.44Å
394	G	86.5	Confident	92.5	Very high	23 Å²	23	51 Å²	51	24%	0.237	25%	0.247	C	C	.	.			trans	-123.4	164.5	167.4	0	0	0	0	0	110.8	L476	G394-L476 WeakPolarHBondContact O-CD2 3.37Å
395	V	91.6	Very high	92.6	Very high	21 Å²	21	58.8 Å²	58.8	13%	0.127	27%	0.273	C	S	.	.			trans	-63	151.2	172	-66.2	0	0	0	0	111.6	R397 M400 Q402 T474 L476 F511 T513	V395-R397 WeakPolarHBondContact CG2-O 3.23Å; V395-R397 PolarHBondContact O-N 2.99Å; V395-M400 HydrophobicContact CB-CB 4.28Å; V395-M400 HydrophobicContact CG2-CB 4.4Å; V395-Q402 HydrophobicContact CG2-CG 3.85Å; V395-T474 HydrophobicContact CB-CG2 4.44Å; V395-T474 HydrophobicContact CG1-CG2 3.58Å; V395-L476 HydrophobicContact CG1-CD2 4.3Å; V395-F511 HydrophobicContact CG1-CE1 4.41Å; V395-F511 HydrophobicContact CG1-CZ 4.23Å; V395-T513 HydrophobicContact CG1-CG2 4.22Å
396	L	89.2	Confident	92.6	Very high	28 Å²	28	62.6 Å²	62.6	15%	0.147	29%	0.293	C	S	.	.	S	Bend	trans	-57.5	-39.4	-174.8	173.5	66.4	0	0	0	114.2	M400 Q465 V475	L396-M400 HydrophobicContact CB-CE 4.27Å; L396-M400 HydrophobicContact CB-SD 3.84Å; L396-M400 HydrophobicContact CD2-CE 4.03Å; L396-M400 HydrophobicContact CG-CE 4.46Å; L396-Q465 HydrophobicContact CD1-CG 4.05Å; L396-Q465 HydrophobicContact CD2-CB 3.77Å; L396-Q465 HydrophobicContact CD2-CG 3.79Å; L396-Q465 HydrophobicContact CG-CG 4.45Å; L396-V475 HydrophobicContact CB-CB 3.96Å; L396-V475 HydrophobicContact CB-CG1 4.41Å; L396-V475 WeakPolarHBondContact CB-O 3.29Å; L396-V475 HydrophobicContact CD2-CB 3.71Å; L396-V475 HydrophobicContact CD2-CG1 3.87Å; L396-V475 HydrophobicContact CD2-CG2 4.22Å; L396-V475 PolarHBondContact N-O 3.5Å
397	R	88	Confident	92.6	Very high	68 Å²	68	62.3 Å²	62.3	26%	0.257	29%	0.292	S	S	.	.	S	Bend	trans	-135	142.8	170.7	-66.3	-172.6	179.7	-173.9	1.6	109.5	V395 H399 M400 E466	V395-R397 WeakPolarHBondContact CG2-O 3.23Å; V395-R397 PolarHBondContact O-N 2.99Å; R397-H399 WeakPolarHBondContact CD-NE2 2.98Å; R397-H399 PolarHBondContact O-N 3.39Å; R397-H399 VanDerWaalsContact O-N 3.12Å; R397-M400 HydrophobicContact CB-CG 4.48Å; R397-M400 WeakPolarHBondContact O-CB 3.21Å; R397-M400 WeakPolarHBondContact O-CG 3.33Å; R397-M400 PolarHBondContact O-N 2.93Å; R397-E466 IonicContact CZ-OE1 3.72Å; R397-E466 IonicContact NH1-OE1 3.14Å; R397-E466 PolarHBondContact NH1-OE1 3.2Å; R397-E466 IonicContact NH2-OE1 2.74Å; R397-E466 PolarHBondContact NH2-OE1 2.97Å
398	Q	83.1	Confident	92.5	Very high	174 Å²	174	62.3 Å²	62.3	81%	0.813	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.4	-171.2	-73.3	-178.6	-21	0	0	115	M400 Q402	Q398-M400 VanDerWaalsContact C-N 3.33Å; Q398-Q402 PolarHBondContact O-NE2 2.65Å
399	H	86.6	Confident	92.5	Very high	137 Å²	137	62.3 Å²	62.3	63%	0.634	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.3	178.7	68.7	-106.6	0	0	0	114	R397 S469	R397-H399 WeakPolarHBondContact CD-NE2 2.98Å; R397-H399 PolarHBondContact O-N 3.39Å; R397-H399 VanDerWaalsContact O-N 3.12Å; H399-S469 PolarHBondContact NE2-OG 2.95Å
400	M	92.2	Very high	92.5	Very high	10 Å²	10	62.4 Å²	62.4	5%	0.049	29%	0.293	C	S	.	.	S	Bend	trans	-64.8	158.3	173.1	-68.8	-178.3	161	0	0	110.4	V395 L396 R397 Q398 Q402 L473 T474 V475	V395-M400 HydrophobicContact CB-CB 4.28Å; V395-M400 HydrophobicContact CG2-CB 4.4Å; L396-M400 HydrophobicContact CB-CE 4.27Å; L396-M400 HydrophobicContact CB-SD 3.84Å; L396-M400 HydrophobicContact CD2-CE 4.03Å; L396-M400 HydrophobicContact CG-CE 4.46Å; R397-M400 HydrophobicContact CB-CG 4.48Å; R397-M400 WeakPolarHBondContact O-CB 3.21Å; R397-M400 WeakPolarHBondContact O-CG 3.33Å; R397-M400 PolarHBondContact O-N 2.93Å; Q398-M400 VanDerWaalsContact C-N 3.33Å; M400-Q402 WeakPolarHBondContact O-CG 3.35Å; M400-Q402 PolarHBondContact O-N 3.24Å; M400-L473 VanDerWaalsContact CE-O 3.23Å; M400-L473 WeakPolarHBondContact CE-O 3.32Å; M400-T474 HydrophobicContact CB-CG2 4.37Å; M400-V475 HydrophobicContact CE-CB 4.25Å; M400-V475 HydrophobicContact CE-CG2 4.02Å; M400-V475 HydrophobicContact SD-CB 4.3Å; M400-V475 PolarHBondContact SD-N 2.69Å; M400-V475 VanDerWaalsContact SD-N 3.44Å
401	L	91.5	Very high	92.4	Very high	104 Å²	104	62.4 Å²	62.4	55%	0.545	29%	0.293	S	S	.	.			trans	-67.5	99.2	-173.5	-66.2	175.8	0	0	0	111.9	R403 I404 T474	L401-R403 PolarHBondContact O-N 2.95Å; L401-I404 HydrophobicContact CB-CD1 3.9Å; L401-I404 HydrophobicContact CB-CG1 3.78Å; L401-T474 PolarHBondContact N-OG1 2.93Å
402	Q	92.4	Very high	92.4	Very high	73 Å²	73	62.2 Å²	62.2	34%	0.341	29%	0.291	S	S	.	.	S	Bend	trans	-74.7	-1.2	-180	-72.9	-161.6	58.3	0	0	114.5	V395 Q398 M400 R512 T513	V395-Q402 HydrophobicContact CG2-CG 3.85Å; Q398-Q402 PolarHBondContact O-NE2 2.65Å; M400-Q402 WeakPolarHBondContact O-CG 3.35Å; M400-Q402 PolarHBondContact O-N 3.24Å; Q402-R512 CarbonylContact O-C 3.55Å; Q402-R512 VanDerWaalsContact O-CA 3.29Å; Q402-R512 WeakPolarHBondContact O-CA 3.48Å; Q402-T513 WeakPolarHBondContact CB-OG1 3.31Å; Q402-T513 VanDerWaalsContact CG-OG1 3.27Å; Q402-T513 WeakPolarHBondContact CG-OG1 3.3Å; Q402-T513 PolarHBondContact O-N 3.42Å; Q402-T513 PolarHBondContact O-OG1 3.1Å; Q402-T513 PolarHBondContact OE1-OG1 3.3Å
403	R	96.2	Very high	92.2	Very high	146 Å²	146	60.5 Å²	60.5	55%	0.551	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.7	117.3	176.8	-173.8	177.2	179.8	81.3	-1.8	110	L401 L510 F511 R512	L401-R403 PolarHBondContact O-N 2.95Å; R403-L510 HydrophobicContact CG-CD1 4.13Å; R403-F511 CarbonylContact C-O 3.59Å; R403-F511 WeakPolarHBondContact CA-O 3.33Å; R403-R512 HydrophobicContact CG-CB 4.46Å
404	I	96.6	Very high	92	Very high	20 Å²	20	58.9 Å²	58.9	10%	0.103	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.3	-177.7	-48.8	174.9	0	0	0	109	L401 P407 D452 I453 F511	L401-I404 HydrophobicContact CB-CD1 3.9Å; L401-I404 HydrophobicContact CB-CG1 3.78Å; I404-P407 HydrophobicContact CB-CB 4.26Å; I404-P407 HydrophobicContact CG2-CB 3.83Å; I404-P407 HydrophobicContact CG2-CG 4.48Å; I404-D452 HydrophobicContact CD1-CB 4.43Å; I404-D452 HydrophobicContact CG2-CB 4.43Å; I404-I453 HydrophobicContact CD1-CD1 4.24Å; I404-I453 HydrophobicContact CD1-CG1 3.82Å; I404-F511 HydrophobicContact CD1-CD1 4.31Å; I404-F511 HydrophobicContact CG1-CD1 4.25Å; I404-F511 PolarHBondContact N-O 3.05Å; I404-F511 PolarHBondContact O-N 3.13Å
405	R	96.8	Very high	92.1	Very high	202 Å²	202	61.2 Å²	61.2	76%	0.762	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	141.3	172	-80.4	178.8	164.5	168	-5.6	110.1	P407 G509 L510	R405-P407 VanDerWaalsContact C-N 3.33Å; R405-G509 WeakPolarHBondContact CA-O 3.46Å; R405-L510 HydrophobicContact CG-CD1 4.18Å
406	L	96.2	Very high	92	Very high	118 Å²	118	60.5 Å²	60.5	62%	0.618	28%	0.281	S	S	*	.	S	Bend	trans	50.8	35.8	179.7	-62.4	167.3	0	0	0	116	C508 G509	L406-C508 WeakPolarHBondContact CA-O 3.42Å; L406-G509 PolarHBondContact N-O 3.32Å
407	P	96.7	Very high	91.9	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.295	C	S	.	.			trans	-60.8	141.5	-174.1	27.4	-37.1	0	0	0	112.9	I404 R405 I409 D452 I453 R507 C508 F511	I404-P407 HydrophobicContact CB-CB 4.26Å; I404-P407 HydrophobicContact CG2-CB 3.83Å; I404-P407 HydrophobicContact CG2-CG 4.48Å; R405-P407 VanDerWaalsContact C-N 3.33Å; P407-I409 HydrophobicContact CB-CG1 4.47Å; P407-D452 HydrophobicContact CB-CB 4.02Å; P407-I453 HydrophobicContact CB-CD1 3.65Å; P407-I453 HydrophobicContact CB-CG1 4.02Å; P407-I453 HydrophobicContact CG-CD1 3.83Å; P407-R507 WeakPolarHBondContact O-CA 3.12Å; P407-C508 WeakPolarHBondContact CD-O 3.41Å; P407-F511 HydrophobicContact CG-CB 3.97Å
408	K	96.1	Very high	91.5	Very high	52 Å²	52	62.7 Å²	62.7	23%	0.226	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	129	159.6	-54.7	160.2	-179.6	174.9	0	108.8	Q450 D452 I453 M505	K408-Q450 WeakPolarHBondContact CD-O 3.47Å; K408-Q450 PolarHBondContact NZ-O 3.39Å; K408-D452 WeakPolarHBondContact CB-OD2 3.35Å; K408-D452 WeakPolarHBondContact CG-OD2 3.17Å; K408-D452 PolarHBondContact N-OD2 2.82Å; K408-D452 PolarHBondContact O-N 3.22Å; K408-I453 PolarHBondContact O-N 2.86Å; K408-I453 VanDerWaalsContact O-N 3.07Å; K408-M505 HydrophobicContact CB-CE 3.9Å; K408-M505 HydrophobicContact CB-SD 4.37Å; K408-M505 HydrophobicContact CD-CE 3.99Å; K408-M505 HydrophobicContact CG-CE 4.24Å
409	I	96	Very high	90.9	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130.5	-175.3	-53.6	166.9	0	0	0	109.3	P407 M411 I453 I455 T491 C493 M505 G506 F529	P407-I409 HydrophobicContact CB-CG1 4.47Å; I409-M411 HydrophobicContact CG2-CE 3.61Å; I409-M411 HydrophobicContact CG2-CG 4.15Å; I409-I453 WeakPolarHBondContact CA-O 3.49Å; I409-I453 HydrophobicContact CG1-CB 4.34Å; I409-I453 HydrophobicContact CG1-CD1 4.4Å; I409-I455 HydrophobicContact CG2-CD1 3.79Å; I409-I455 HydrophobicContact CG2-CG1 4.06Å; I409-T491 HydrophobicContact CD1-CG2 3.79Å; I409-C493 PolarHBondContact O-SG 3.42Å; I409-C493 VanDerWaalsContact O-SG 3.34Å; I409-M505 CarbonylContact O-C 3.57Å; I409-M505 VanDerWaalsContact O-CA 3.31Å; I409-M505 WeakPolarHBondContact O-CA 3.24Å; I409-M505 WeakPolarHBondContact O-CB 3.31Å; I409-G506 PolarHBondContact N-O 2.83Å; I409-G506 PolarHBondContact O-N 3.22Å; I409-F529 HydrophobicContact CD1-CD1 3.88Å; I409-F529 HydrophobicContact CD1-CE1 3.93Å
410	L	95.1	Very high	90.1	Very high	1 Å²	1	63 Å²	63	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.1	170.5	-179.3	63.1	0	0	0	109.5	V446 H449 P451 I453 L454 I455 M505	L410-V446 HydrophobicContact CD2-CG1 4.24Å; L410-H449 HydrophobicContact CD2-CB 4.43Å; L410-P451 HydrophobicContact CB-CB 3.88Å; L410-P451 HydrophobicContact CB-CG 4.35Å; L410-P451 HydrophobicContact CD2-CG 4.39Å; L410-I453 PolarHBondContact N-O 2.96Å; L410-L454 HydrophobicContact CB-CD1 4.32Å; L410-L454 HydrophobicContact CD2-CD1 4.15Å; L410-L454 HydrophobicContact CG-CD1 4.22Å; L410-I455 PolarHBondContact O-N 3.44Å; L410-M505 HydrophobicContact CB-SD 4.31Å; L410-M505 HydrophobicContact CD1-CG 4.5Å
411	M	94.6	Very high	88.8	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122	-178	-56.7	-171.8	-162.9	0	0	111.3	I409 I455 I484 I487 A488 T491 C493 V495 V496	I409-M411 HydrophobicContact CG2-CE 3.61Å; I409-M411 HydrophobicContact CG2-CG 4.15Å; M411-I455 CarbonylContact C-O 3.59Å; M411-I455 WeakPolarHBondContact CA-O 3.4Å; M411-I455 HydrophobicContact CE-CD1 4.1Å; M411-I455 HydrophobicContact CG-CB 4.12Å; M411-I455 HydrophobicContact CG-CD1 4.31Å; M411-I455 HydrophobicContact CG-CG1 4.43Å; M411-I455 HydrophobicContact SD-CD1 4.47Å; M411-I484 HydrophobicContact SD-CG2 4.16Å; M411-I487 HydrophobicContact CE-CB 3.95Å; M411-I487 HydrophobicContact CE-CG2 3.5Å; M411-I487 VanDerWaalsContact CE-CG2 3.5Å; M411-A488 HydrophobicContact CE-CB 4.48Å; M411-A488 HydrophobicContact SD-CB 3.83Å; M411-T491 WeakPolarHBondContact CE-OG1 3.41Å; M411-C493 HydrophobicContact CE-CB 3.48Å; M411-C493 VanDerWaalsContact CE-CB 3.48Å; M411-C493 HydrophobicContact CG-CB 4.34Å; M411-C493 HydrophobicContact SD-CB 4Å; M411-V495 HydrophobicContact CB-CG1 4.22Å; M411-V495 HydrophobicContact CB-CG2 4.27Å; M411-V495 HydrophobicContact SD-CG2 4.37Å; M411-V496 WeakPolarHBondContact O-CG2 3.19Å; M411-V496 PolarHBondContact O-N 2.81Å
412	I	92.3	Very high	87.2	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.036	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.6	178.8	-61.6	178.4	0	0	0	109.7	I416 V446 L454 I455 E457 V496 V499	I412-I416 HydrophobicContact CD1-CD1 4Å; I412-I416 HydrophobicContact CD1-CG1 4.48Å; I412-V446 HydrophobicContact CD1-CG2 3.97Å; I412-L454 HydrophobicContact CD1-CD1 3.9Å; I412-L454 HydrophobicContact CG1-CD1 4.24Å; I412-I455 PolarHBondContact N-O 3.32Å; I412-E457 PolarHBondContact O-N 3.29Å; I412-E457 VanDerWaalsContact O-N 3.1Å; I412-V496 CarbonylContact C-O 3.59Å; I412-V496 WeakPolarHBondContact CA-O 3.43Å; I412-V496 HydrophobicContact CG1-CG2 4.13Å; I412-V499 HydrophobicContact CD1-CG2 3.86Å
413	Q	88.7	Confident	85.7	Confident	39 Å²	39	70.5 Å²	70.5	18%	0.182	34%	0.339	C	S	.	.	S	Bend	trans	-95.4	128.3	175.1	-154.3	-177.7	-49.4	0	0	110.2	E457 R481 V495 V496 H497	Q413-E457 WeakPolarHBondContact CG-OE2 3.15Å; Q413-R481 VanDerWaalsContact NE2-CZ 3.34Å; Q413-V495 HydrophobicContact CB-CG1 4Å; Q413-V496 PolarHBondContact N-O 2.77Å; Q413-H497 VanDerWaalsContact CD-CE1 3.45Å; Q413-H497 PolarHBondContact NE2-CE1 2.83Å; Q413-H497 VanDerWaalsContact NE2-CE1 3.27Å
414	G	85.9	Confident	84.1	Confident	14 Å²	14	70.6 Å²	70.6	14%	0.144	34%	0.343	C	S	.	.	S	Bend	trans	89.3	-173.4	-167.7	0	0	0	0	0	113.9	V456 D458	G414-V456 WeakPolarHBondContact O-CG1 3.28Å; G414-D458 WeakPolarHBondContact CA-OD2 3.48Å
415	P	88.6	Confident	82	Confident	71 Å²	71	79.6 Å²	79.6	46%	0.461	38%	0.382	S	S	.	.			trans	-89.3	161.9	-176.6	34.4	-35.5	0	0	0	113.9	E417 D458 S459	P415-E417 HydrophobicContact CB-CB 4.42Å; P415-E417 HydrophobicContact CB-CG 4.15Å; P415-D458 HydrophobicContact CB-CB 3.94Å; P415-S459 CarbonylContact C-O 3.49Å; P415-S459 VanDerWaalsContact CA-O 3.27Å; P415-S459 WeakPolarHBondContact CA-O 3.47Å; P415-S459 WeakPolarHBondContact CB-O 3.49Å
416	I	89.9	Confident	80.6	Confident	7 Å²	7	72.6 Å²	72.6	4%	0.036	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-105	77.9	165.7	-55.2	179.3	0	0	0	108.3	I412 L439 V442 L454 V456 S459 V460 A461 A464 F468	I412-I416 HydrophobicContact CD1-CD1 4Å; I412-I416 HydrophobicContact CD1-CG1 4.48Å; I416-L439 HydrophobicContact CG2-CD2 4.39Å; I416-V442 HydrophobicContact CG2-CG1 3.9Å; I416-L454 HydrophobicContact CD1-CD2 3.91Å; I416-V456 HydrophobicContact CD1-CG1 4.44Å; I416-V456 HydrophobicContact CD1-CG2 3.64Å; I416-V456 HydrophobicContact CG1-CG1 4.06Å; I416-V456 HydrophobicContact CG1-CG2 4.18Å; I416-S459 PolarHBondContact N-O 3.43Å; I416-V460 HydrophobicContact CB-CB 4.42Å; I416-V460 HydrophobicContact CB-CG1 4.2Å; I416-V460 HydrophobicContact CB-CG2 4.12Å; I416-V460 HydrophobicContact CD1-CG2 4.18Å; I416-V460 HydrophobicContact CG1-CG2 4.28Å; I416-A461 PolarHBondContact O-N 3.12Å; I416-A464 HydrophobicContact CG2-CB 4.15Å; I416-F468 HydrophobicContact CD1-CE2 3.95Å; I416-F468 HydrophobicContact CD1-CZ 4.11Å
417	E	86.1	Confident	79.6	Confident	93 Å²	93	70.5 Å²	70.5	44%	0.435	36%	0.358	S	S	.	.	S	Bend	trans	-139.8	159.8	-177.2	-65.7	-175.1	176.4	0	0	110.3	P415 E419 S459 A461	P415-E417 HydrophobicContact CB-CB 4.42Å; P415-E417 HydrophobicContact CB-CG 4.15Å; E417-E419 PolarHBondContact O-N 2.92Å; E417-S459 WeakPolarHBondContact OE1-CB 3.37Å; E417-S459 PolarHBondContact OE1-OG 3.23Å; E417-A461 HydrophobicContact CG-CB 4.19Å
418	Y	80.4	Confident	78.6	Confident	49 Å²	49	76.4 Å²	76.4	19%	0.192	39%	0.389	C	S	.	.			trans	-83	104.9	177.6	178.4	-113	0	0	0	110.6	R420 I431 Q434 E435 H438	Y418-R420 HydrophobicContact CD1-CG 4Å; Y418-R420 HydrophobicContact CE1-CG 4.26Å; Y418-R420 PolarHBondContact O-N 3.37Å; Y418-I431 HydrophobicContact CE1-CG2 4.49Å; Y418-Q434 PolarHBondContact OH-OE1 2.97Å; Y418-E435 HydrophobicContact CD1-CB 3.78Å; Y418-E435 HydrophobicContact CD1-CG 4.32Å; Y418-E435 HydrophobicContact CG-CB 3.92Å; Y418-E435 HydrophobicContact CG-CG 4.21Å; Y418-H438 HydrophobicContact CD2-CB 3.69Å; Y418-H438 AromaticContact CD2-CD2 3.81Å; Y418-H438 AromaticContact CD2-CG 3.63Å; Y418-H438 HydrophobicContact CE2-CB 4.08Å
419	E	69.8	Low	77.8	Confident	168 Å²	168	79.8 Å²	79.8	79%	0.785	41%	0.409	S	S	*	.			trans	-68.5	106	177.9	-171	172.8	-162.3	0	0	111.1	E417 T421	E417-E419 PolarHBondContact O-N 2.92Å; E419-T421 PolarHBondContact O-N 2.85Å
420	R	69.4	Low	76.9	Confident	150 Å²	150	81.4 Å²	81.4	57%	0.566	42%	0.423	S	S	*	.			trans	-71.7	123.6	-177.3	-63.5	-179.8	-179.2	177	-0	110.7	Y418 K422 E435	Y418-R420 HydrophobicContact CD1-CG 4Å; Y418-R420 HydrophobicContact CE1-CG 4.26Å; Y418-R420 PolarHBondContact O-N 3.37Å; R420-K422 PolarHBondContact O-N 2.9Å; R420-E435 IonicContact CZ-OE2 3.19Å; R420-E435 IonicContact NE-OE2 2.74Å; R420-E435 IonicContact NH2-OE2 3.15Å; R420-E435 PolarHBondContact NH2-OE2 3.5Å
421	T	65.7	Low	76	Confident	96 Å²	96	83 Å²	83	59%	0.589	43%	0.431	S	S	*	.			trans	-62.7	109.1	179.6	-36.8	0	0	0	0	110.8	E419 G423 K424	E419-T421 PolarHBondContact O-N 2.85Å; T421-G423 PolarHBondContact O-N 3.45Å; T421-K424 PolarHBondContact O-N 2.74Å
422	K	56.9	Low	75.2	Confident	190 Å²	190	87.5 Å²	87.5	83%	0.826	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	137.3	178.5	-65.3	175.1	-176.5	168.5	0	110.2	R420	R420-K422 PolarHBondContact O-N 2.9Å
423	G	62.3	Low	74.6	Confident	58 Å²	58	94.3 Å²	94.3	60%	0.598	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-5.7	-179	0	0	0	0	0	116.2	T421	T421-G423 PolarHBondContact O-N 3.45Å
424	K	61.2	Low	74.3	Confident	148 Å²	148	97 Å²	97	64%	0.643	50%	0.5	S	S	*	.			trans	-105	105.7	-176.4	-157.1	175.5	-173.9	-179.4	0	112.9	T421	T421-K424 PolarHBondContact O-N 2.74Å
425	F	54.5	Low	74.2	Confident	209 Å²	209	98.4 Å²	98.4	92%	0.917	50%	0.503	S	S	*	.			trans	-80	117.7	172.2	-68.3	-84.6	0	0	0	110.9
426	C	66.3	Low	74.1	Confident	54 Å²	54	96 Å²	96	37%	0.365	49%	0.488	S	S	.	.			trans	-127.8	163.9	171.9	-66.4	0	0	0	0	108.9	I431	C426-I431 HydrophobicContact CB-CD1 4Å; C426-I431 HydrophobicContact CB-CG1 3.77Å
427	S	75.4	Confident	74	Confident	74 Å²	74	102.8 Å²	102.8	52%	0.517	51%	0.514	S	S	.	.			trans	-63.6	146.2	171.4	55.9	0	0	0	0	111.2	D429 A430 I431	S427-D429 VanDerWaalsContact C-N 3.3Å; S427-D429 PolarHBondContact O-N 2.88Å; S427-A430 PolarHBondContact O-N 3.14Å; S427-A430 VanDerWaalsContact OG-CB 3.28Å; S427-A430 WeakPolarHBondContact OG-CB 3.25Å; S427-I431 WeakPolarHBondContact O-CG1 3.49Å; S427-I431 PolarHBondContact O-N 3.22Å
428	I	75.4	Confident	74	Confident	124 Å²	124	102 Å²	102	64%	0.636	51%	0.51	S	S	*	.	H	α-helix	trans	-57.3	-43.7	-177.9	-78	173.4	0	0	0	111	A430 I431 I432	I428-A430 PolarHBondContact O-N 2.84Å; I428-I431 PolarHBondContact O-N 3.08Å; I428-I431 VanDerWaalsContact O-N 3.17Å; I428-I432 HydrophobicContact CG2-CD1 3.59Å; I428-I432 HydrophobicContact CG2-CG1 4.32Å; I428-I432 WeakPolarHBondContact O-CG1 3.37Å; I428-I432 PolarHBondContact O-N 3.41Å
429	D	79.4	Confident	74.5	Confident	123 Å²	123	99.7 Å²	99.7	66%	0.658	50%	0.501	S	S	*	.	H	α-helix	trans	-64.2	-39	180	-49.6	-71	0	0	0	112.3	S427 I431 I432 M433	S427-D429 VanDerWaalsContact C-N 3.3Å; S427-D429 PolarHBondContact O-N 2.88Å; D429-I431 VanDerWaalsContact C-N 3.34Å; D429-I432 PolarHBondContact O-N 2.84Å; D429-M433 VanDerWaalsContact O-CB 3.28Å; D429-M433 WeakPolarHBondContact O-CB 3.39Å; D429-M433 PolarHBondContact O-N 2.91Å
430	A	76.8	Confident	75.6	Confident	34 Å²	34	98.3 Å²	98.3	28%	0.281	49%	0.489	S	S	.	.	H	α-helix	trans	-66.6	-36.8	175.4	0	0	0	0	0	111.8	S427 I428 Q434	S427-A430 PolarHBondContact O-N 3.14Å; S427-A430 VanDerWaalsContact OG-CB 3.28Å; S427-A430 WeakPolarHBondContact OG-CB 3.25Å; I428-A430 PolarHBondContact O-N 2.84Å; A430-Q434 VanDerWaalsContact O-CB 3.31Å; A430-Q434 WeakPolarHBondContact O-CB 3.36Å; A430-Q434 WeakPolarHBondContact O-CG 3.44Å; A430-Q434 PolarHBondContact O-N 3.13Å
431	I	76.9	Confident	76.5	Confident	35 Å²	35	94.9 Å²	94.9	18%	0.179	48%	0.479	C	S	.	.	H	α-helix	trans	-66.2	-46.7	173.8	-64	168.5	0	0	0	110.2	Y418 C426 S427 I428 D429 M433 Q434 E435	Y418-I431 HydrophobicContact CE1-CG2 4.49Å; C426-I431 HydrophobicContact CB-CD1 4Å; C426-I431 HydrophobicContact CB-CG1 3.77Å; S427-I431 WeakPolarHBondContact O-CG1 3.49Å; S427-I431 PolarHBondContact O-N 3.22Å; I428-I431 PolarHBondContact O-N 3.08Å; I428-I431 VanDerWaalsContact O-N 3.17Å; D429-I431 VanDerWaalsContact C-N 3.34Å; I431-M433 VanDerWaalsContact C-N 3.31Å; I431-M433 PolarHBondContact O-N 3.18Å; I431-Q434 PolarHBondContact O-N 3Å; I431-E435 WeakPolarHBondContact O-CB 3.17Å; I431-E435 PolarHBondContact O-N 2.93Å
432	I	77.2	Confident	77.7	Confident	94 Å²	94	91.5 Å²	91.5	48%	0.482	46%	0.458	S	S	.	.	H	α-helix	trans	-61.3	-40	177.4	-69.3	169.1	0	0	0	111	I428 D429 S436	I428-I432 HydrophobicContact CG2-CD1 3.59Å; I428-I432 HydrophobicContact CG2-CG1 4.32Å; I428-I432 WeakPolarHBondContact O-CG1 3.37Å; I428-I432 PolarHBondContact O-N 3.41Å; D429-I432 PolarHBondContact O-N 2.84Å; I432-S436 VanDerWaalsContact O-CB 3.24Å; I432-S436 WeakPolarHBondContact O-CB 3.42Å; I432-S436 PolarHBondContact O-N 3.04Å
433	M	81	Confident	79.4	Confident	150 Å²	150	82.8 Å²	82.8	74%	0.739	42%	0.421	S	S	*	.	H	α-helix	trans	-71.2	-39	178.8	-156.1	-179	-155.4	0	0	111.9	D429 I431 S436 Y437	D429-M433 VanDerWaalsContact O-CB 3.28Å; D429-M433 WeakPolarHBondContact O-CB 3.39Å; D429-M433 PolarHBondContact O-N 2.91Å; I431-M433 VanDerWaalsContact C-N 3.31Å; I431-M433 PolarHBondContact O-N 3.18Å; M433-S436 PolarHBondContact O-N 3.43Å; M433-Y437 WeakPolarHBondContact O-CB 3.32Å; M433-Y437 PolarHBondContact O-N 3.2Å
434	Q	81.7	Confident	80.8	Confident	96 Å²	96	86.3 Å²	86.3	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-66.2	-43.3	172.8	-75.9	174.1	4.7	0	0	112	Y418 A430 I431 Y437 H438	Y418-Q434 PolarHBondContact OH-OE1 2.97Å; A430-Q434 VanDerWaalsContact O-CB 3.31Å; A430-Q434 WeakPolarHBondContact O-CB 3.36Å; A430-Q434 WeakPolarHBondContact O-CG 3.44Å; A430-Q434 PolarHBondContact O-N 3.13Å; I431-Q434 PolarHBondContact O-N 3Å; Q434-Y437 PolarHBondContact O-N 3.24Å; Q434-H438 VanDerWaalsContact O-CB 3.24Å; Q434-H438 WeakPolarHBondContact O-CB 3.45Å; Q434-H438 PolarHBondContact O-N 3.41Å
435	E	84.2	Confident	82.2	Confident	43 Å²	43	82.8 Å²	82.8	20%	0.201	41%	0.406	C	S	.	.	H	α-helix	trans	-59.2	-48.2	173.1	175.9	163.7	168.1	0	0	110.4	Y418 R420 I431 Y437 H438 L439	Y418-E435 HydrophobicContact CD1-CB 3.78Å; Y418-E435 HydrophobicContact CD1-CG 4.32Å; Y418-E435 HydrophobicContact CG-CB 3.92Å; Y418-E435 HydrophobicContact CG-CG 4.21Å; R420-E435 IonicContact CZ-OE2 3.19Å; R420-E435 IonicContact NE-OE2 2.74Å; R420-E435 IonicContact NH2-OE2 3.15Å; R420-E435 PolarHBondContact NH2-OE2 3.5Å; I431-E435 WeakPolarHBondContact O-CB 3.17Å; I431-E435 PolarHBondContact O-N 2.93Å; E435-Y437 PolarHBondContact O-N 3.4Å; E435-H438 PolarHBondContact O-N 3.22Å; E435-L439 HydrophobicContact CG-CD1 3.8Å; E435-L439 WeakPolarHBondContact O-CB 3.34Å; E435-L439 WeakPolarHBondContact O-CG 3.27Å; E435-L439 PolarHBondContact O-N 3.05Å
436	S	86.7	Confident	84	Confident	21 Å²	21	72.8 Å²	72.8	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-35.4	177.4	-163.6	0	0	0	0	113.5	I432 M433 R440	I432-S436 VanDerWaalsContact O-CB 3.24Å; I432-S436 WeakPolarHBondContact O-CB 3.42Å; I432-S436 PolarHBondContact O-N 3.04Å; M433-S436 PolarHBondContact O-N 3.43Å; S436-R440 WeakPolarHBondContact O-CD 3.38Å; S436-R440 VanDerWaalsContact O-CG 3.23Å; S436-R440 WeakPolarHBondContact O-CG 3.32Å; S436-R440 PolarHBondContact O-N 3.33Å; S436-R440 PolarHBondContact O-NE 2.9Å; S436-R440 VanDerWaalsContact O-NE 3.15Å; S436-R440 PolarHBondContact OG-NE 3.32Å; S436-R440 PolarHBondContact OG-NH2 2.89Å
437	Y	86.5	Confident	85.3	Confident	150 Å²	150	72.8 Å²	72.8	59%	0.588	36%	0.358	S	S	*	.	H	α-helix	trans	-72.8	-46.6	175.3	-177.9	-91.3	0	0	0	111.8	M433 Q434 E435 L439 R440 Q441	M433-Y437 WeakPolarHBondContact O-CB 3.32Å; M433-Y437 PolarHBondContact O-N 3.2Å; Q434-Y437 PolarHBondContact O-N 3.24Å; E435-Y437 PolarHBondContact O-N 3.4Å; Y437-L439 PolarHBondContact O-N 2.84Å; Y437-R440 PolarHBondContact O-N 3.09Å; Y437-Q441 HydrophobicContact CD1-CG 4.15Å; Y437-Q441 HydrophobicContact CE1-CG 3.73Å; Y437-Q441 WeakPolarHBondContact O-CG 3.41Å; Y437-Q441 PolarHBondContact O-N 3.5Å; Y437-Q441 PolarHBondContact OH-NE2 3.38Å
438	H	87.3	Confident	86	Confident	76 Å²	76	72.9 Å²	72.9	35%	0.352	36%	0.363	S	S	.	.	H	α-helix	trans	-60.3	-47.1	178.1	177	91.5	0	0	0	111.4	Y418 Q434 E435 R440 Q441 V442	Y418-H438 HydrophobicContact CD2-CB 3.69Å; Y418-H438 AromaticContact CD2-CD2 3.81Å; Y418-H438 AromaticContact CD2-CG 3.63Å; Y418-H438 HydrophobicContact CE2-CB 4.08Å; Q434-H438 VanDerWaalsContact O-CB 3.24Å; Q434-H438 WeakPolarHBondContact O-CB 3.45Å; Q434-H438 PolarHBondContact O-N 3.41Å; E435-H438 PolarHBondContact O-N 3.22Å; H438-R440 VanDerWaalsContact C-N 3.31Å; H438-R440 PolarHBondContact O-N 3.46Å; H438-Q441 WeakPolarHBondContact O-CB 3.4Å; H438-Q441 PolarHBondContact O-N 3.18Å; H438-Q441 VanDerWaalsContact O-N 3.08Å; H438-V442 WeakPolarHBondContact O-CG2 3.43Å; H438-V442 PolarHBondContact O-N 3.31Å
439	L	90.7	Very high	86.7	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-62.5	-37	178.3	-69	170.2	0	0	0	111.9	I416 E435 Y437 V442 V443 A461 A464	I416-L439 HydrophobicContact CG2-CD2 4.39Å; E435-L439 HydrophobicContact CG-CD1 3.8Å; E435-L439 WeakPolarHBondContact O-CB 3.34Å; E435-L439 WeakPolarHBondContact O-CG 3.27Å; E435-L439 PolarHBondContact O-N 3.05Å; Y437-L439 PolarHBondContact O-N 2.84Å; L439-V442 PolarHBondContact O-N 3.07Å; L439-V443 WeakPolarHBondContact O-CB 3.41Å; L439-V443 WeakPolarHBondContact O-CG2 3.31Å; L439-V443 PolarHBondContact O-N 3.12Å; L439-A461 HydrophobicContact CD1-CB 3.5Å; L439-A461 HydrophobicContact CD2-CB 3.88Å; L439-A461 HydrophobicContact CG-CB 4.36Å; L439-A464 HydrophobicContact CD2-CB 4.3Å
440	R	91.8	Very high	87.3	Confident	139 Å²	139	69.9 Å²	69.9	53%	0.525	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-42.5	171.2	-74.1	171.3	-138.9	-128.1	6.5	112.3	S436 Y437 H438 V443 H444 L467	S436-R440 WeakPolarHBondContact O-CD 3.38Å; S436-R440 VanDerWaalsContact O-CG 3.23Å; S436-R440 WeakPolarHBondContact O-CG 3.32Å; S436-R440 PolarHBondContact O-N 3.33Å; S436-R440 PolarHBondContact O-NE 2.9Å; S436-R440 VanDerWaalsContact O-NE 3.15Å; S436-R440 PolarHBondContact OG-NE 3.32Å; S436-R440 PolarHBondContact OG-NH2 2.89Å; Y437-R440 PolarHBondContact O-N 3.09Å; H438-R440 VanDerWaalsContact C-N 3.31Å; H438-R440 PolarHBondContact O-N 3.46Å; R440-V443 PolarHBondContact O-N 3.47Å; R440-H444 VanDerWaalsContact O-CB 3.31Å; R440-H444 WeakPolarHBondContact O-CB 3.37Å; R440-H444 PolarHBondContact O-N 3.34Å; R440-L467 HydrophobicContact CG-CD1 3.69Å
441	Q	89	Confident	88.2	Confident	78 Å²	78	68.9 Å²	68.9	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-64.9	-42.2	177	-71.2	-66.9	-13.9	0	0	112.2	Y437 H438 H444 K445	Y437-Q441 HydrophobicContact CD1-CG 4.15Å; Y437-Q441 HydrophobicContact CE1-CG 3.73Å; Y437-Q441 WeakPolarHBondContact O-CG 3.41Å; Y437-Q441 PolarHBondContact O-N 3.5Å; Y437-Q441 PolarHBondContact OH-NE2 3.38Å; H438-Q441 WeakPolarHBondContact O-CB 3.4Å; H438-Q441 PolarHBondContact O-N 3.18Å; H438-Q441 VanDerWaalsContact O-N 3.08Å; Q441-H444 PolarHBondContact O-N 2.91Å; Q441-K445 WeakPolarHBondContact O-CG 3.33Å; Q441-K445 PolarHBondContact O-N 3.15Å
442	V	90.3	Very high	89.1	Confident	24 Å²	24	70.2 Å²	70.2	15%	0.145	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-43.6	176	176.4	0	0	0	0	111.2	I416 H438 L439 H444 K445 V446 V499	I416-V442 HydrophobicContact CG2-CG1 3.9Å; H438-V442 WeakPolarHBondContact O-CG2 3.43Å; H438-V442 PolarHBondContact O-N 3.31Å; L439-V442 PolarHBondContact O-N 3.07Å; V442-H444 PolarHBondContact O-N 2.9Å; V442-K445 PolarHBondContact O-N 3.28Å; V442-V446 WeakPolarHBondContact O-CG2 3.29Å; V442-V446 PolarHBondContact O-N 3.21Å; V442-V499 HydrophobicContact CG1-CG2 4.06Å
443	V	92.9	Very high	90	Very high	7 Å²	7	65.7 Å²	65.7	4%	0.042	32%	0.318	C	S	.	.	H	α-helix	trans	-59.7	-45.2	173.7	168.1	0	0	0	0	111.1	L439 R440 K445 V446 L447 A464 L467 F468	L439-V443 WeakPolarHBondContact O-CB 3.41Å; L439-V443 WeakPolarHBondContact O-CG2 3.31Å; L439-V443 PolarHBondContact O-N 3.12Å; R440-V443 PolarHBondContact O-N 3.47Å; V443-K445 PolarHBondContact O-N 3.34Å; V443-V446 PolarHBondContact O-N 3.29Å; V443-L447 HydrophobicContact CG1-CD1 3.6Å; V443-L447 HydrophobicContact CG1-CG 4.19Å; V443-L447 VanDerWaalsContact O-CG 3.31Å; V443-L447 WeakPolarHBondContact O-CG 3.44Å; V443-L447 PolarHBondContact O-N 3.11Å; V443-A464 HydrophobicContact CG2-CB 3.71Å; V443-L467 HydrophobicContact CB-CD1 4.49Å; V443-L467 HydrophobicContact CG1-CB 3.88Å; V443-L467 HydrophobicContact CG2-CB 4.23Å; V443-L467 HydrophobicContact CG2-CD1 4.23Å; V443-F468 HydrophobicContact CB-CD1 4.45Å; V443-F468 HydrophobicContact CB-CE1 3.93Å; V443-F468 HydrophobicContact CB-CZ 4.31Å; V443-F468 HydrophobicContact CG1-CD1 3.82Å; V443-F468 HydrophobicContact CG1-CE1 3.71Å; V443-F468 HydrophobicContact CG2-CD1 4.15Å; V443-F468 HydrophobicContact CG2-CE1 3.69Å; V443-F468 HydrophobicContact CG2-CE2 4.12Å; V443-F468 HydrophobicContact CG2-CZ 3.67Å
444	H	91.7	Very high	90.7	Very high	132 Å²	132	58.6 Å²	58.6	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-40.5	178.6	-170.1	-92.6	0	0	0	112.1	R440 Q441 V442 L447 A448	R440-H444 VanDerWaalsContact O-CB 3.31Å; R440-H444 WeakPolarHBondContact O-CB 3.37Å; R440-H444 PolarHBondContact O-N 3.34Å; Q441-H444 PolarHBondContact O-N 2.91Å; V442-H444 PolarHBondContact O-N 2.9Å; H444-L447 PolarHBondContact O-N 2.8Å; H444-A448 WeakPolarHBondContact O-CB 3.28Å; H444-A448 PolarHBondContact O-N 3.1Å
445	K	90.9	Very high	91.3	Very high	74 Å²	74	54 Å²	54	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-59	-47	171.2	-73.9	174.6	-179.6	174.8	0	111.5	Q441 V442 V443 L447 A448 H449 V499 E500	Q441-K445 WeakPolarHBondContact O-CG 3.33Å; Q441-K445 PolarHBondContact O-N 3.15Å; V442-K445 PolarHBondContact O-N 3.28Å; V443-K445 PolarHBondContact O-N 3.34Å; K445-L447 PolarHBondContact O-N 3.24Å; K445-A448 WeakPolarHBondContact O-CB 3.32Å; K445-A448 PolarHBondContact O-N 3.43Å; K445-H449 PolarHBondContact O-CD2 2.77Å; K445-V499 HydrophobicContact CB-CB 4.11Å; K445-V499 HydrophobicContact CB-CG1 3.87Å; K445-E500 HydrophobicContact CD-CG 4.35Å; K445-E500 IonicContact NZ-OE1 3.77Å; K445-E500 PolarHBondContact NZ-OE1 3.44Å
446	V	92.1	Very high	91.8	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-47.6	177.6	166.6	0	0	0	0	111.6	L410 I412 V442 V443 A448 H449 P451 L454 F468 L473 V499	L410-V446 HydrophobicContact CD2-CG1 4.24Å; I412-V446 HydrophobicContact CD1-CG2 3.97Å; V442-V446 WeakPolarHBondContact O-CG2 3.29Å; V442-V446 PolarHBondContact O-N 3.21Å; V443-V446 PolarHBondContact O-N 3.29Å; V446-A448 VanDerWaalsContact C-N 3.29Å; V446-A448 PolarHBondContact O-N 2.74Å; V446-H449 PolarHBondContact O-N 2.89Å; V446-P451 HydrophobicContact CG1-CG 4.26Å; V446-P451 VanDerWaalsContact O-CD 3.29Å; V446-P451 WeakPolarHBondContact O-CD 3.3Å; V446-L454 HydrophobicContact CG1-CD1 4.04Å; V446-L454 HydrophobicContact CG1-CD2 4.09Å; V446-F468 HydrophobicContact CB-CE1 3.86Å; V446-F468 HydrophobicContact CB-CZ 4.16Å; V446-F468 HydrophobicContact CG1-CE1 3.62Å; V446-F468 HydrophobicContact CG1-CZ 4.04Å; V446-F468 HydrophobicContact CG2-CE1 4.39Å; V446-F468 HydrophobicContact CG2-CZ 4.18Å; V446-L473 HydrophobicContact CG1-CD2 3.94Å; V446-V499 HydrophobicContact CB-CG1 4.35Å; V446-V499 HydrophobicContact CG2-CB 4.45Å; V446-V499 HydrophobicContact CG2-CG1 3.63Å; V446-V499 HydrophobicContact CG2-CG2 3.91Å
447	L	92.9	Very high	92.1	Very high	54 Å²	54	52.4 Å²	52.4	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-67.3	-28.7	-178.7	-67.3	170.4	0	0	0	112.6	V443 H444 K445 H449 Q450 S471 L473	V443-L447 HydrophobicContact CG1-CD1 3.6Å; V443-L447 HydrophobicContact CG1-CG 4.19Å; V443-L447 VanDerWaalsContact O-CG 3.31Å; V443-L447 WeakPolarHBondContact O-CG 3.44Å; V443-L447 PolarHBondContact O-N 3.11Å; H444-L447 PolarHBondContact O-N 2.8Å; K445-L447 PolarHBondContact O-N 3.24Å; L447-H449 PolarHBondContact O-N 3Å; L447-Q450 WeakPolarHBondContact O-CA 3.14Å; L447-Q450 PolarHBondContact O-N 3.12Å; L447-S471 WeakPolarHBondContact CD1-OG 3.45Å; L447-L473 HydrophobicContact CD2-CB 4.38Å; L447-L473 HydrophobicContact CD2-CD2 4.12Å
448	A	91.1	Very high	92.4	Very high	75 Å²	75	48.5 Å²	48.5	62%	0.62	24%	0.241	S	C	*	.	H	α-helix	trans	-62.9	-23.5	175.3	0	0	0	0	0	113.6	H444 K445 V446 Q450	H444-A448 WeakPolarHBondContact O-CB 3.28Å; H444-A448 PolarHBondContact O-N 3.1Å; K445-A448 WeakPolarHBondContact O-CB 3.32Å; K445-A448 PolarHBondContact O-N 3.43Å; V446-A448 VanDerWaalsContact C-N 3.29Å; V446-A448 PolarHBondContact O-N 2.74Å; A448-Q450 PolarHBondContact O-N 3.22Å
449	H	89.4	Confident	92.6	Very high	55 Å²	55	46.6 Å²	46.6	26%	0.255	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-12.6	170.8	-66.8	-89.1	0	0	0	113.4	L410 K445 V446 L447 M505	L410-H449 HydrophobicContact CD2-CB 4.43Å; K445-H449 PolarHBondContact O-CD2 2.77Å; V446-H449 PolarHBondContact O-N 2.89Å; L447-H449 PolarHBondContact O-N 3Å; H449-M505 HydrophobicContact CB-SD 4.12Å; H449-M505 WeakPolarHBondContact O-CE 3.12Å
450	Q	92.9	Very high	92.7	Very high	130 Å²	130	46.8 Å²	46.8	61%	0.607	24%	0.237	S	C	*	.			trans	51.5	50.5	-172	-53	178.8	-2.8	0	0	115	K408 L447 A448	K408-Q450 WeakPolarHBondContact CD-O 3.47Å; K408-Q450 PolarHBondContact NZ-O 3.39Å; L447-Q450 WeakPolarHBondContact O-CA 3.14Å; L447-Q450 PolarHBondContact O-N 3.12Å; A448-Q450 PolarHBondContact O-N 3.22Å
451	P	94.2	Very high	92.6	Very high	13 Å²	13	40.7 Å²	40.7	8%	0.084	22%	0.217	C	C	.	.			trans	-70.1	150.2	171.2	30.9	-33	0	0	0	111.2	L410 V446 L473 M505	L410-P451 HydrophobicContact CB-CB 3.88Å; L410-P451 HydrophobicContact CB-CG 4.35Å; L410-P451 HydrophobicContact CD2-CG 4.39Å; V446-P451 HydrophobicContact CG1-CG 4.26Å; V446-P451 VanDerWaalsContact O-CD 3.29Å; V446-P451 WeakPolarHBondContact O-CD 3.3Å; P451-L473 HydrophobicContact CB-CD1 4.18Å; P451-L473 HydrophobicContact CG-CD1 3.85Å; P451-L473 HydrophobicContact CG-CD2 4.37Å; P451-L473 VanDerWaalsContact O-CD1 3.29Å; P451-L473 WeakPolarHBondContact O-CD1 3.49Å; P451-M505 HydrophobicContact CB-SD 4.11Å
452	D	95.9	Very high	92.7	Very high	62 Å²	62	40.6 Å²	40.6	33%	0.332	22%	0.224	S	C	.	.	S	Bend	trans	-90.4	-30.3	167	-56.5	-70.8	0	0	0	110.6	I404 P407 K408 T474	I404-D452 HydrophobicContact CD1-CB 4.43Å; I404-D452 HydrophobicContact CG2-CB 4.43Å; P407-D452 HydrophobicContact CB-CB 4.02Å; K408-D452 WeakPolarHBondContact CB-OD2 3.35Å; K408-D452 WeakPolarHBondContact CG-OD2 3.17Å; K408-D452 PolarHBondContact N-OD2 2.82Å; K408-D452 PolarHBondContact O-N 3.22Å; D452-T474 PolarHBondContact O-N 3.14Å
453	I	96	Very high	92.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.3	178.3	-55.4	174.1	0	0	0	110.1	I404 P407 K408 I409 L410 I455 T474 L476 F511 F529	I404-I453 HydrophobicContact CD1-CD1 4.24Å; I404-I453 HydrophobicContact CD1-CG1 3.82Å; P407-I453 HydrophobicContact CB-CD1 3.65Å; P407-I453 HydrophobicContact CB-CG1 4.02Å; P407-I453 HydrophobicContact CG-CD1 3.83Å; K408-I453 PolarHBondContact O-N 2.86Å; K408-I453 VanDerWaalsContact O-N 3.07Å; I409-I453 WeakPolarHBondContact CA-O 3.49Å; I409-I453 HydrophobicContact CG1-CB 4.34Å; I409-I453 HydrophobicContact CG1-CD1 4.4Å; L410-I453 PolarHBondContact N-O 2.96Å; I453-I455 HydrophobicContact CG2-CG1 4.04Å; I453-T474 CarbonylContact C-O 3.56Å; I453-T474 VanDerWaalsContact CA-O 3.32Å; I453-T474 WeakPolarHBondContact CA-O 3.39Å; I453-L476 HydrophobicContact CG2-CD1 4.45Å; I453-F511 HydrophobicContact CD1-CB 3.52Å; I453-F511 HydrophobicContact CD1-CD1 3.58Å; I453-F511 HydrophobicContact CD1-CD2 3.8Å; I453-F511 HydrophobicContact CD1-CE1 4.21Å; I453-F511 HydrophobicContact CD1-CE2 4.38Å; I453-F511 HydrophobicContact CD1-CG 3.34Å; I453-F511 HydrophobicContact CG1-CD1 4.44Å; I453-F529 HydrophobicContact CD1-CE1 4.19Å
454	L	95.6	Very high	92.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.9	169.7	178.4	68.8	0	0	0	110.2	L410 I412 I416 V446 V456 F468 L473 T474 V475 L476	L410-L454 HydrophobicContact CB-CD1 4.32Å; L410-L454 HydrophobicContact CD2-CD1 4.15Å; L410-L454 HydrophobicContact CG-CD1 4.22Å; I412-L454 HydrophobicContact CD1-CD1 3.9Å; I412-L454 HydrophobicContact CG1-CD1 4.24Å; I416-L454 HydrophobicContact CD1-CD2 3.91Å; V446-L454 HydrophobicContact CG1-CD1 4.04Å; V446-L454 HydrophobicContact CG1-CD2 4.09Å; L454-V456 HydrophobicContact CD1-CG2 4.5Å; L454-V456 HydrophobicContact CD2-CG2 4.12Å; L454-V456 HydrophobicContact CG-CG2 3.97Å; L454-F468 HydrophobicContact CD2-CD2 4.1Å; L454-F468 HydrophobicContact CD2-CE1 4.14Å; L454-F468 HydrophobicContact CD2-CE2 3.61Å; L454-F468 HydrophobicContact CD2-CZ 3.62Å; L454-L473 HydrophobicContact CB-CD1 4.24Å; L454-L473 HydrophobicContact CB-CD2 3.88Å; L454-L473 HydrophobicContact CB-CG 4.13Å; L454-L473 HydrophobicContact CD2-CD2 4.12Å; L454-T474 PolarHBondContact N-O 3.12Å; L454-V475 HydrophobicContact CB-CG2 4.36Å; L454-V475 HydrophobicContact CD2-CG1 4.31Å; L454-V475 HydrophobicContact CD2-CG2 4.26Å; L454-V475 CarbonylContact O-C 3.54Å; L454-V475 WeakPolarHBondContact O-CA 3.01Å; L454-L476 PolarHBondContact O-N 3.47Å
455	I	95.5	Very high	92.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.9	174.9	-48.2	-172.9	0	0	0	109	I409 L410 M411 I412 I453 L476 V479 I484 I487 F529	I409-I455 HydrophobicContact CG2-CD1 3.79Å; I409-I455 HydrophobicContact CG2-CG1 4.06Å; L410-I455 PolarHBondContact O-N 3.44Å; M411-I455 CarbonylContact C-O 3.59Å; M411-I455 WeakPolarHBondContact CA-O 3.4Å; M411-I455 HydrophobicContact CE-CD1 4.1Å; M411-I455 HydrophobicContact CG-CB 4.12Å; M411-I455 HydrophobicContact CG-CD1 4.31Å; M411-I455 HydrophobicContact CG-CG1 4.43Å; M411-I455 HydrophobicContact SD-CD1 4.47Å; I412-I455 PolarHBondContact N-O 3.32Å; I453-I455 HydrophobicContact CG2-CG1 4.04Å; I455-L476 CarbonylContact C-O 3.55Å; I455-L476 WeakPolarHBondContact CA-O 3.26Å; I455-L476 HydrophobicContact CD1-CD1 4.49Å; I455-L476 HydrophobicContact CG1-CD1 4.38Å; I455-V479 HydrophobicContact CG2-CB 4.01Å; I455-V479 HydrophobicContact CG2-CG1 4.13Å; I455-V479 HydrophobicContact CG2-CG2 3.97Å; I455-I484 HydrophobicContact CG2-CD1 4.2Å; I455-I484 HydrophobicContact CG2-CG1 4.04Å; I455-I487 HydrophobicContact CD1-CD1 4.06Å; I455-I487 HydrophobicContact CD1-CG2 4.12Å; I455-F529 HydrophobicContact CD1-CE1 4.09Å; I455-F529 HydrophobicContact CD1-CE2 4.49Å; I455-F529 HydrophobicContact CD1-CZ 3.67Å
456	V	94.4	Very high	92.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132	-178	-171.3	0	0	0	0	108.8	G414 I416 L454 V460 L476 H477 N478 V479	G414-V456 WeakPolarHBondContact O-CG1 3.28Å; I416-V456 HydrophobicContact CD1-CG1 4.44Å; I416-V456 HydrophobicContact CD1-CG2 3.64Å; I416-V456 HydrophobicContact CG1-CG1 4.06Å; I416-V456 HydrophobicContact CG1-CG2 4.18Å; L454-V456 HydrophobicContact CD1-CG2 4.5Å; L454-V456 HydrophobicContact CD2-CG2 4.12Å; L454-V456 HydrophobicContact CG-CG2 3.97Å; V456-V460 HydrophobicContact CB-CG2 4.08Å; V456-V460 HydrophobicContact CG1-CG2 4.05Å; V456-V460 HydrophobicContact CG2-CG2 3.82Å; V456-L476 PolarHBondContact N-O 3.48Å; V456-H477 CarbonylContact O-C 3.59Å; V456-N478 PolarHBondContact O-N 2.77Å; V456-V479 PolarHBondContact O-N 2.71Å
457	E	94	Very high	92.9	Very high	30 Å²	30	39.5 Å²	39.5	14%	0.14	22%	0.223	C	C	.	.	S	Bend	trans	-61.6	-47.4	180	-172.5	171	-162	0	0	111.7	I412 Q413 N478 V479 R481 I484	I412-E457 PolarHBondContact O-N 3.29Å; I412-E457 VanDerWaalsContact O-N 3.1Å; Q413-E457 WeakPolarHBondContact CG-OE2 3.15Å; E457-N478 CarbonylContact O-C 3.55Å; E457-N478 VanDerWaalsContact O-C 3.3Å; E457-N478 WeakPolarHBondContact O-CA 3Å; E457-V479 PolarHBondContact O-N 2.97Å; E457-R481 WeakPolarHBondContact OE1-CB 2.97Å; E457-R481 VanDerWaalsContact OE1-CD 3.25Å; E457-R481 WeakPolarHBondContact OE1-CD 3.46Å; E457-R481 WeakPolarHBondContact OE1-CG 3.43Å; E457-I484 VanDerWaalsContact CA-CD1 3.49Å; E457-I484 HydrophobicContact CB-CD1 3.71Å; E457-I484 HydrophobicContact CG-CD1 4.22Å
458	D	91.3	Very high	93	Very high	69 Å²	69	37 Å²	37	37%	0.369	21%	0.21	S	C	.	.	S	Bend	trans	-112.4	-154.9	-177	-63.1	-59.8	0	0	0	111.7	G414 P415 N478	G414-D458 WeakPolarHBondContact CA-OD2 3.48Å; P415-D458 HydrophobicContact CB-CB 3.94Å; D458-N478 WeakPolarHBondContact CA-OD1 3.43Å; D458-N478 PolarHBondContact O-N 2.8Å
459	S	91.2	Very high	93	Very high	36 Å²	36	34.3 Å²	34.3	25%	0.252	19%	0.187	S	C	.	.			trans	-74.1	163.6	-174	42.3	0	0	0	0	114	P415 I416 E417 N478	P415-S459 CarbonylContact C-O 3.49Å; P415-S459 VanDerWaalsContact CA-O 3.27Å; P415-S459 WeakPolarHBondContact CA-O 3.47Å; P415-S459 WeakPolarHBondContact CB-O 3.49Å; I416-S459 PolarHBondContact N-O 3.43Å; E417-S459 WeakPolarHBondContact OE1-CB 3.37Å; E417-S459 PolarHBondContact OE1-OG 3.23Å; S459-N478 PolarHBondContact N-OD1 3.44Å
460	V	92.7	Very high	93.1	Very high	4 Å²	4	38.7 Å²	38.7	2%	0.024	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-130.9	124.3	177.3	175.3	0	0	0	0	106.4	I416 V456 A464 Q465 F468 H477	I416-V460 HydrophobicContact CB-CB 4.42Å; I416-V460 HydrophobicContact CB-CG1 4.2Å; I416-V460 HydrophobicContact CB-CG2 4.12Å; I416-V460 HydrophobicContact CD1-CG2 4.18Å; I416-V460 HydrophobicContact CG1-CG2 4.28Å; V456-V460 HydrophobicContact CB-CG2 4.08Å; V456-V460 HydrophobicContact CG1-CG2 4.05Å; V456-V460 HydrophobicContact CG2-CG2 3.82Å; V460-A464 HydrophobicContact CG1-CB 3.81Å; V460-Q465 HydrophobicContact CB-CG 4.17Å; V460-Q465 HydrophobicContact CG1-CG 3.87Å; V460-Q465 WeakPolarHBondContact O-CG 3.34Å; V460-Q465 PolarHBondContact O-NE2 3.16Å; V460-F468 HydrophobicContact CG1-CD2 4.29Å; V460-F468 HydrophobicContact CG1-CE2 4.1Å; V460-H477 HydrophobicContact CB-CB 4.34Å; V460-H477 HydrophobicContact CG2-CB 3.69Å
461	A	91.5	Very high	93	Very high	12 Å²	12	35.4 Å²	35.4	10%	0.099	20%	0.199	C	C	.	.			trans	-60.1	144.7	-178.8	0	0	0	0	0	111.9	I416 E417 L439 T463 A464 Q465	I416-A461 PolarHBondContact O-N 3.12Å; E417-A461 HydrophobicContact CG-CB 4.19Å; L439-A461 HydrophobicContact CD1-CB 3.5Å; L439-A461 HydrophobicContact CD2-CB 3.88Å; L439-A461 HydrophobicContact CG-CB 4.36Å; A461-T463 VanDerWaalsContact C-N 3.28Å; A461-T463 PolarHBondContact O-N 3.27Å; A461-T463 VanDerWaalsContact O-N 3.15Å; A461-A464 WeakPolarHBondContact O-CA 3.12Å; A461-A464 WeakPolarHBondContact O-CB 3.46Å; A461-A464 PolarHBondContact O-N 3.09Å; A461-Q465 WeakPolarHBondContact O-CG 3.23Å; A461-Q465 PolarHBondContact O-N 2.98Å
462	S	90	Very high	92.8	Very high	75 Å²	75	37.2 Å²	37.2	52%	0.524	22%	0.22	S	C	.	.	H	α-helix	trans	-53.6	-41	-172.8	-166.2	0	0	0	0	113.4	A464 Q465 E466	S462-A464 VanDerWaalsContact C-N 3.32Å; S462-A464 PolarHBondContact O-N 3.09Å; S462-Q465 WeakPolarHBondContact O-CB 3.3Å; S462-Q465 PolarHBondContact O-N 3.27Å; S462-E466 PolarHBondContact O-N 3.36Å
463	T	90.1	Very high	92.8	Very high	52 Å²	52	34.5 Å²	34.5	32%	0.319	21%	0.205	S	C	.	.	H	α-helix	trans	-59	-40.5	175.2	-45.5	0	0	0	0	112.5	A461 L467	A461-T463 VanDerWaalsContact C-N 3.28Å; A461-T463 PolarHBondContact O-N 3.27Å; A461-T463 VanDerWaalsContact O-N 3.15Å; T463-L467 HydrophobicContact CG2-CD1 4.21Å; T463-L467 WeakPolarHBondContact O-CD1 3.3Å; T463-L467 VanDerWaalsContact O-CG 3.23Å; T463-L467 WeakPolarHBondContact O-CG 3.17Å; T463-L467 PolarHBondContact O-N 3.05Å; T463-L467 VanDerWaalsContact O-N 3.15Å
464	A	93.5	Very high	92.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-73	-38.7	176.2	0	0	0	0	0	111.9	I416 L439 V443 V460 A461 S462 E466 L467 F468	I416-A464 HydrophobicContact CG2-CB 4.15Å; L439-A464 HydrophobicContact CD2-CB 4.3Å; V443-A464 HydrophobicContact CG2-CB 3.71Å; V460-A464 HydrophobicContact CG1-CB 3.81Å; A461-A464 WeakPolarHBondContact O-CA 3.12Å; A461-A464 WeakPolarHBondContact O-CB 3.46Å; A461-A464 PolarHBondContact O-N 3.09Å; S462-A464 VanDerWaalsContact C-N 3.32Å; S462-A464 PolarHBondContact O-N 3.09Å; A464-E466 VanDerWaalsContact C-N 3.26Å; A464-E466 PolarHBondContact O-N 2.67Å; A464-L467 PolarHBondContact O-N 2.89Å; A464-F468 HydrophobicContact CB-CD2 4.4Å; A464-F468 HydrophobicContact CB-CE2 4.07Å; A464-F468 WeakPolarHBondContact O-CB 3.19Å; A464-F468 WeakPolarHBondContact O-CD2 3.4Å; A464-F468 VanDerWaalsContact O-CG 3.26Å; A464-F468 WeakPolarHBondContact O-CG 3.33Å; A464-F468 PolarHBondContact O-N 3.43Å
465	Q	94.2	Very high	92.8	Very high	42 Å²	42	34.5 Å²	34.5	20%	0.196	21%	0.205	C	C	.	.	H	α-helix	trans	-54.3	-44.4	172.9	-62.3	-176.6	18.6	0	0	111.8	L396 V460 A461 S462 S469	L396-Q465 HydrophobicContact CD1-CG 4.05Å; L396-Q465 HydrophobicContact CD2-CB 3.77Å; L396-Q465 HydrophobicContact CD2-CG 3.79Å; L396-Q465 HydrophobicContact CG-CG 4.45Å; V460-Q465 HydrophobicContact CB-CG 4.17Å; V460-Q465 HydrophobicContact CG1-CG 3.87Å; V460-Q465 WeakPolarHBondContact O-CG 3.34Å; V460-Q465 PolarHBondContact O-NE2 3.16Å; A461-Q465 WeakPolarHBondContact O-CG 3.23Å; A461-Q465 PolarHBondContact O-N 2.98Å; S462-Q465 WeakPolarHBondContact O-CB 3.3Å; S462-Q465 PolarHBondContact O-N 3.27Å; Q465-S469 WeakPolarHBondContact O-CB 3.44Å; Q465-S469 PolarHBondContact O-N 3.49Å
466	E	91.9	Very high	92.8	Very high	82 Å²	82	34.5 Å²	34.5	38%	0.383	21%	0.205	S	C	.	.	H	α-helix	trans	-70.8	-43.4	-177.8	-157.9	123.2	-91.4	0	0	112.1	R397 S462 A464 S469 Q470	R397-E466 IonicContact CZ-OE1 3.72Å; R397-E466 IonicContact NH1-OE1 3.14Å; R397-E466 PolarHBondContact NH1-OE1 3.2Å; R397-E466 IonicContact NH2-OE1 2.74Å; R397-E466 PolarHBondContact NH2-OE1 2.97Å; S462-E466 PolarHBondContact O-N 3.36Å; A464-E466 VanDerWaalsContact C-N 3.26Å; A464-E466 PolarHBondContact O-N 2.67Å; E466-S469 WeakPolarHBondContact O-CB 3.22Å; E466-S469 PolarHBondContact O-N 3.02Å; E466-Q470 VanDerWaalsContact O-CG 3.31Å; E466-Q470 WeakPolarHBondContact O-CG 3.21Å; E466-Q470 PolarHBondContact O-N 2.84Å
467	L	93.7	Very high	92.8	Very high	39 Å²	39	36.4 Å²	36.4	20%	0.204	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-40.4	176.9	-66.9	164.9	0	0	0	112.4	R440 V443 T463 A464 Q470 S471	R440-L467 HydrophobicContact CG-CD1 3.69Å; V443-L467 HydrophobicContact CB-CD1 4.49Å; V443-L467 HydrophobicContact CG1-CB 3.88Å; V443-L467 HydrophobicContact CG2-CB 4.23Å; V443-L467 HydrophobicContact CG2-CD1 4.23Å; T463-L467 HydrophobicContact CG2-CD1 4.21Å; T463-L467 WeakPolarHBondContact O-CD1 3.3Å; T463-L467 VanDerWaalsContact O-CG 3.23Å; T463-L467 WeakPolarHBondContact O-CG 3.17Å; T463-L467 PolarHBondContact O-N 3.05Å; T463-L467 VanDerWaalsContact O-N 3.15Å; A464-L467 PolarHBondContact O-N 2.89Å; L467-Q470 PolarHBondContact O-N 2.95Å; L467-S471 WeakPolarHBondContact O-CB 3.33Å; L467-S471 PolarHBondContact O-N 2.78Å; L467-S471 PolarHBondContact O-OG 3.39Å
468	F	94.7	Very high	92.8	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64	-40.9	172.9	-67.4	-43.1	0	0	0	111.8	I416 V443 V446 L454 V460 A464 S471 G472 L473 V475	I416-F468 HydrophobicContact CD1-CE2 3.95Å; I416-F468 HydrophobicContact CD1-CZ 4.11Å; V443-F468 HydrophobicContact CB-CD1 4.45Å; V443-F468 HydrophobicContact CB-CE1 3.93Å; V443-F468 HydrophobicContact CB-CZ 4.31Å; V443-F468 HydrophobicContact CG1-CD1 3.82Å; V443-F468 HydrophobicContact CG1-CE1 3.71Å; V443-F468 HydrophobicContact CG2-CD1 4.15Å; V443-F468 HydrophobicContact CG2-CE1 3.69Å; V443-F468 HydrophobicContact CG2-CE2 4.12Å; V443-F468 HydrophobicContact CG2-CZ 3.67Å; V446-F468 HydrophobicContact CB-CE1 3.86Å; V446-F468 HydrophobicContact CB-CZ 4.16Å; V446-F468 HydrophobicContact CG1-CE1 3.62Å; V446-F468 HydrophobicContact CG1-CZ 4.04Å; V446-F468 HydrophobicContact CG2-CE1 4.39Å; V446-F468 HydrophobicContact CG2-CZ 4.18Å; L454-F468 HydrophobicContact CD2-CD2 4.1Å; L454-F468 HydrophobicContact CD2-CE1 4.14Å; L454-F468 HydrophobicContact CD2-CE2 3.61Å; L454-F468 HydrophobicContact CD2-CZ 3.62Å; V460-F468 HydrophobicContact CG1-CD2 4.29Å; V460-F468 HydrophobicContact CG1-CE2 4.1Å; A464-F468 HydrophobicContact CB-CD2 4.4Å; A464-F468 HydrophobicContact CB-CE2 4.07Å; A464-F468 WeakPolarHBondContact O-CB 3.19Å; A464-F468 WeakPolarHBondContact O-CD2 3.4Å; A464-F468 VanDerWaalsContact O-CG 3.26Å; A464-F468 WeakPolarHBondContact O-CG 3.33Å; A464-F468 PolarHBondContact O-N 3.43Å; F468-S471 CarbonylContact O-C 3.58Å; F468-S471 PolarHBondContact O-N 2.91Å; F468-G472 PolarHBondContact O-N 3.15Å; F468-L473 HydrophobicContact CB-CB 4.34Å; F468-L473 HydrophobicContact CB-CD2 4.36Å; F468-L473 HydrophobicContact CD1-CD2 3.5Å; F468-L473 HydrophobicContact CE1-CD2 3.92Å; F468-L473 HydrophobicContact CG-CD2 4.05Å; F468-L473 PolarHBondContact O-N 3.27Å; F468-L473 VanDerWaalsContact O-N 3.08Å; F468-V475 HydrophobicContact CB-CG2 3.68Å; F468-V475 HydrophobicContact CD2-CG2 3.96Å; F468-V475 HydrophobicContact CG-CG2 4.01Å
469	S	90.9	Very high	92.9	Very high	20 Å²	20	35.4 Å²	35.4	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-45.1	174.5	168.9	0	0	0	0	112.2	H399 Q465 E466 S471 G472	H399-S469 PolarHBondContact NE2-OG 2.95Å; Q465-S469 WeakPolarHBondContact O-CB 3.44Å; Q465-S469 PolarHBondContact O-N 3.49Å; E466-S469 WeakPolarHBondContact O-CB 3.22Å; E466-S469 PolarHBondContact O-N 3.02Å; S469-S471 VanDerWaalsContact C-N 3.28Å; S469-S471 PolarHBondContact O-N 2.7Å; S469-G472 PolarHBondContact O-N 3.06Å
470	Q	91	Very high	92.9	Very high	146 Å²	146	41.8 Å²	41.8	68%	0.682	23%	0.233	S	C	*	.	H	α-helix	trans	-64.9	-30.3	174.4	-72	168.9	3.4	0	0	112.9	E466 L467 G472	E466-Q470 VanDerWaalsContact O-CG 3.31Å; E466-Q470 WeakPolarHBondContact O-CG 3.21Å; E466-Q470 PolarHBondContact O-N 2.84Å; L467-Q470 PolarHBondContact O-N 2.95Å; Q470-G472 VanDerWaalsContact C-N 3.29Å; Q470-G472 PolarHBondContact O-N 3.22Å
471	S	91	Very high	92.8	Very high	62 Å²	62	47.8 Å²	47.8	43%	0.434	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3	178.9	-51.9	0	0	0	0	113.9	L447 L467 F468 S469 L473	L447-S471 WeakPolarHBondContact CD1-OG 3.45Å; L467-S471 WeakPolarHBondContact O-CB 3.33Å; L467-S471 PolarHBondContact O-N 2.78Å; L467-S471 PolarHBondContact O-OG 3.39Å; F468-S471 CarbonylContact O-C 3.58Å; F468-S471 PolarHBondContact O-N 2.91Å; S469-S471 VanDerWaalsContact C-N 3.28Å; S469-S471 PolarHBondContact O-N 2.7Å; S471-L473 PolarHBondContact O-N 3.02Å
472	G	90.5	Very high	92.8	Very high	50 Å²	50	50.3 Å²	50.3	52%	0.515	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	3.5	-178.5	0	0	0	0	0	115.5	F468 S469 Q470	F468-G472 PolarHBondContact O-N 3.15Å; S469-G472 PolarHBondContact O-N 3.06Å; Q470-G472 VanDerWaalsContact C-N 3.29Å; Q470-G472 PolarHBondContact O-N 3.22Å
473	L	95.4	Very high	92.9	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.026	25%	0.25	C	S	.	.			trans	-71.8	128.6	-176.9	178.3	59.5	0	0	0	110.9	M400 V446 L447 P451 L454 F468 S471 V475	M400-L473 VanDerWaalsContact CE-O 3.23Å; M400-L473 WeakPolarHBondContact CE-O 3.32Å; V446-L473 HydrophobicContact CG1-CD2 3.94Å; L447-L473 HydrophobicContact CD2-CB 4.38Å; L447-L473 HydrophobicContact CD2-CD2 4.12Å; P451-L473 HydrophobicContact CB-CD1 4.18Å; P451-L473 HydrophobicContact CG-CD1 3.85Å; P451-L473 HydrophobicContact CG-CD2 4.37Å; P451-L473 VanDerWaalsContact O-CD1 3.29Å; P451-L473 WeakPolarHBondContact O-CD1 3.49Å; L454-L473 HydrophobicContact CB-CD1 4.24Å; L454-L473 HydrophobicContact CB-CD2 3.88Å; L454-L473 HydrophobicContact CB-CG 4.13Å; L454-L473 HydrophobicContact CD2-CD2 4.12Å; F468-L473 HydrophobicContact CB-CB 4.34Å; F468-L473 HydrophobicContact CB-CD2 4.36Å; F468-L473 HydrophobicContact CD1-CD2 3.5Å; F468-L473 HydrophobicContact CE1-CD2 3.92Å; F468-L473 HydrophobicContact CG-CD2 4.05Å; F468-L473 PolarHBondContact O-N 3.27Å; F468-L473 VanDerWaalsContact O-N 3.08Å; S471-L473 PolarHBondContact O-N 3.02Å; L473-V475 HydrophobicContact CD2-CG2 4.47Å; L473-V475 HydrophobicContact CG-CG2 4.2Å; L473-V475 PolarHBondContact O-N 2.74Å
474	T	96.2	Very high	93.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114.3	177.9	-62.5	0	0	0	0	110.5	V395 M400 L401 D452 I453 L454 F511	V395-T474 HydrophobicContact CB-CG2 4.44Å; V395-T474 HydrophobicContact CG1-CG2 3.58Å; M400-T474 HydrophobicContact CB-CG2 4.37Å; L401-T474 PolarHBondContact N-OG1 2.93Å; D452-T474 PolarHBondContact O-N 3.14Å; I453-T474 CarbonylContact C-O 3.56Å; I453-T474 VanDerWaalsContact CA-O 3.32Å; I453-T474 WeakPolarHBondContact CA-O 3.39Å; L454-T474 PolarHBondContact N-O 3.12Å; T474-F511 HydrophobicContact CG2-CE1 4.04Å; T474-F511 HydrophobicContact CG2-CZ 4.48Å
475	V	96.2	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.5	-173.8	-175.5	0	0	0	0	112.2	L396 M400 L454 F468 L473	L396-V475 HydrophobicContact CB-CB 3.96Å; L396-V475 HydrophobicContact CB-CG1 4.41Å; L396-V475 WeakPolarHBondContact CB-O 3.29Å; L396-V475 HydrophobicContact CD2-CB 3.71Å; L396-V475 HydrophobicContact CD2-CG1 3.87Å; L396-V475 HydrophobicContact CD2-CG2 4.22Å; L396-V475 PolarHBondContact N-O 3.5Å; M400-V475 HydrophobicContact CE-CB 4.25Å; M400-V475 HydrophobicContact CE-CG2 4.02Å; M400-V475 HydrophobicContact SD-CB 4.3Å; M400-V475 PolarHBondContact SD-N 2.69Å; M400-V475 VanDerWaalsContact SD-N 3.44Å; L454-V475 HydrophobicContact CB-CG2 4.36Å; L454-V475 HydrophobicContact CD2-CG1 4.31Å; L454-V475 HydrophobicContact CD2-CG2 4.26Å; L454-V475 CarbonylContact O-C 3.54Å; L454-V475 WeakPolarHBondContact O-CA 3.01Å; F468-V475 HydrophobicContact CB-CG2 3.68Å; F468-V475 HydrophobicContact CD2-CG2 3.96Å; F468-V475 HydrophobicContact CG-CG2 4.01Å; L473-V475 HydrophobicContact CD2-CG2 4.47Å; L473-V475 HydrophobicContact CG-CG2 4.2Å; L473-V475 PolarHBondContact O-N 2.74Å
476	L	95.1	Very high	93	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	100.3	168.7	-62.6	174.4	0	0	0	109.2	K393 G394 V395 I453 L454 I455 V456 V479 F511 F529	K393-L476 HydrophobicContact CG-CD2 4.23Å; G394-L476 WeakPolarHBondContact O-CD2 3.37Å; V395-L476 HydrophobicContact CG1-CD2 4.3Å; I453-L476 HydrophobicContact CG2-CD1 4.45Å; L454-L476 PolarHBondContact O-N 3.47Å; I455-L476 CarbonylContact C-O 3.55Å; I455-L476 WeakPolarHBondContact CA-O 3.26Å; I455-L476 HydrophobicContact CD1-CD1 4.49Å; I455-L476 HydrophobicContact CG1-CD1 4.38Å; V456-L476 PolarHBondContact N-O 3.48Å; L476-V479 HydrophobicContact CB-CG2 3.85Å; L476-V479 WeakPolarHBondContact O-CG2 3.31Å; L476-F511 HydrophobicContact CD1-CE2 4.09Å; L476-F511 HydrophobicContact CD1-CZ 4.33Å; L476-F529 HydrophobicContact CD1-CE2 4.23Å; L476-F529 HydrophobicContact CD1-CZ 3.75Å
477	H	93.9	Very high	93.2	Very high	40 Å²	40	46.3 Å²	46.3	19%	0.185	24%	0.242	C	C	.	.			trans	-99.7	164.4	177.5	76.4	117.5	0	0	0	112	K393 V456 V460 V479	K393-H477 WeakPolarHBondContact CE-O 3.28Å; K393-H477 PolarHBondContact NZ-O 2.91Å; V456-H477 CarbonylContact O-C 3.59Å; V460-H477 HydrophobicContact CB-CB 4.34Å; V460-H477 HydrophobicContact CG2-CB 3.69Å; H477-V479 PolarHBondContact O-N 2.93Å
478	N	93.7	Very high	93.2	Very high	74 Å²	74	45 Å²	45	40%	0.396	24%	0.236	S	C	.	.	S	Bend	trans	53.5	49.6	-178.6	-73.4	-41	0	0	0	111.6	K393 V456 E457 D458 S459	K393-N478 PolarHBondContact NZ-O 3.36Å; V456-N478 PolarHBondContact O-N 2.77Å; E457-N478 CarbonylContact O-C 3.55Å; E457-N478 VanDerWaalsContact O-C 3.3Å; E457-N478 WeakPolarHBondContact O-CA 3Å; D458-N478 WeakPolarHBondContact CA-OD1 3.43Å; D458-N478 PolarHBondContact O-N 2.8Å; S459-N478 PolarHBondContact N-OD1 3.44Å
479	V	93.1	Very high	93.1	Very high	4 Å²	4	47 Å²	47	2%	0.024	24%	0.243	C	C	.	.			trans	-102.2	111	-178.9	-175.7	0	0	0	0	109.7	K393 I455 V456 E457 L476 H477 R481 A483 I484	K393-V479 HydrophobicContact CD-CG2 4.4Å; K393-V479 HydrophobicContact CG-CG2 4.31Å; I455-V479 HydrophobicContact CG2-CB 4.01Å; I455-V479 HydrophobicContact CG2-CG1 4.13Å; I455-V479 HydrophobicContact CG2-CG2 3.97Å; V456-V479 PolarHBondContact O-N 2.71Å; E457-V479 PolarHBondContact O-N 2.97Å; L476-V479 HydrophobicContact CB-CG2 3.85Å; L476-V479 WeakPolarHBondContact O-CG2 3.31Å; H477-V479 PolarHBondContact O-N 2.93Å; V479-R481 PolarHBondContact O-N 2.61Å; V479-A483 HydrophobicContact CG1-CB 4.14Å; V479-I484 HydrophobicContact CB-CD1 4.24Å; V479-I484 HydrophobicContact CB-CG1 4.13Å; V479-I484 HydrophobicContact CG1-CG1 3.85Å; V479-I484 VanDerWaalsContact O-CD1 3.29Å; V479-I484 WeakPolarHBondContact O-CD1 3.43Å
480	K	91.8	Very high	93.3	Very high	170 Å²	170	46.1 Å²	46.1	74%	0.739	24%	0.237	S	C	*	.			trans	-47.4	132.7	-175.8	-59.9	-168.4	177.2	-165.2	0	112.4	S482 A483 I484	K480-S482 VanDerWaalsContact C-N 3.26Å; K480-S482 PolarHBondContact O-N 2.91Å; K480-A483 WeakPolarHBondContact O-CA 3.27Å; K480-A483 VanDerWaalsContact O-CB 3.32Å; K480-A483 WeakPolarHBondContact O-CB 3.4Å; K480-A483 PolarHBondContact O-N 3.2Å; K480-I484 PolarHBondContact O-N 2.87Å
481	R	91.1	Very high	93.4	Very high	129 Å²	129	39.5 Å²	39.5	49%	0.487	21%	0.207	S	C	.	.	H	α-helix	trans	-40.1	-48.1	178.6	-152.9	167.7	176.3	151.6	-7.8	115.2	Q413 E457 V479 A483 I484 Q485	Q413-R481 VanDerWaalsContact NE2-CZ 3.34Å; E457-R481 WeakPolarHBondContact OE1-CB 2.97Å; E457-R481 VanDerWaalsContact OE1-CD 3.25Å; E457-R481 WeakPolarHBondContact OE1-CD 3.46Å; E457-R481 WeakPolarHBondContact OE1-CG 3.43Å; V479-R481 PolarHBondContact O-N 2.61Å; R481-A483 PolarHBondContact O-N 3.06Å; R481-I484 WeakPolarHBondContact O-CB 3.49Å; R481-I484 PolarHBondContact O-N 3.23Å; R481-I484 VanDerWaalsContact O-N 3.09Å; R481-Q485 WeakPolarHBondContact O-CG 3.34Å; R481-Q485 PolarHBondContact O-N 3.23Å
482	S	90.3	Very high	93.5	Very high	65 Å²	65	43 Å²	43	46%	0.455	21%	0.211	S	C	.	.	H	α-helix	trans	-70.9	-16.2	-178.5	69	0	0	0	0	114.2	K480 R486	K480-S482 VanDerWaalsContact C-N 3.26Å; K480-S482 PolarHBondContact O-N 2.91Å; S482-R486 PolarHBondContact O-NH1 2.65Å; S482-R486 PolarHBondContact O-NH2 3.31Å
483	A	92.7	Very high	93.7	Very high	8 Å²	8	41 Å²	41	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-80.2	-46.4	164.9	0	0	0	0	0	110.6	C391 V479 K480 R481 Q485 R486 I487	C391-A483 HydrophobicContact CB-CB 4.2Å; V479-A483 HydrophobicContact CG1-CB 4.14Å; K480-A483 WeakPolarHBondContact O-CA 3.27Å; K480-A483 VanDerWaalsContact O-CB 3.32Å; K480-A483 WeakPolarHBondContact O-CB 3.4Å; K480-A483 PolarHBondContact O-N 3.2Å; R481-A483 PolarHBondContact O-N 3.06Å; A483-Q485 VanDerWaalsContact C-N 3.34Å; A483-Q485 PolarHBondContact O-N 2.95Å; A483-R486 PolarHBondContact O-N 3.25Å; A483-R486 VanDerWaalsContact O-N 3.09Å; A483-I487 WeakPolarHBondContact O-CG1 3.45Å; A483-I487 PolarHBondContact O-N 3.08Å
484	I	94.3	Very high	93.5	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-53.4	-50.5	175.2	-67.8	-177.3	0	0	0	110.8	M411 I455 E457 V479 K480 R481 R486 I487 A488 V495	M411-I484 HydrophobicContact SD-CG2 4.16Å; I455-I484 HydrophobicContact CG2-CD1 4.2Å; I455-I484 HydrophobicContact CG2-CG1 4.04Å; E457-I484 VanDerWaalsContact CA-CD1 3.49Å; E457-I484 HydrophobicContact CB-CD1 3.71Å; E457-I484 HydrophobicContact CG-CD1 4.22Å; V479-I484 HydrophobicContact CB-CD1 4.24Å; V479-I484 HydrophobicContact CB-CG1 4.13Å; V479-I484 HydrophobicContact CG1-CG1 3.85Å; V479-I484 VanDerWaalsContact O-CD1 3.29Å; V479-I484 WeakPolarHBondContact O-CD1 3.43Å; K480-I484 PolarHBondContact O-N 2.87Å; R481-I484 WeakPolarHBondContact O-CB 3.49Å; R481-I484 PolarHBondContact O-N 3.23Å; R481-I484 VanDerWaalsContact O-N 3.09Å; I484-R486 VanDerWaalsContact C-N 3.26Å; I484-R486 PolarHBondContact O-N 2.93Å; I484-I487 PolarHBondContact O-N 3.24Å; I484-I487 VanDerWaalsContact O-N 3.15Å; I484-A488 WeakPolarHBondContact O-CB 3.34Å; I484-A488 PolarHBondContact O-N 3.42Å; I484-V495 HydrophobicContact CG2-CG1 4.01Å; I484-V495 HydrophobicContact CG2-CG2 3.91Å
485	Q	92.2	Very high	93.2	Very high	114 Å²	114	46 Å²	46	53%	0.533	22%	0.218	S	C	.	.	H	α-helix	trans	-55.4	-37.3	178.1	-71	170.4	-56.3	0	0	113.4	R481 A483 R489	R481-Q485 WeakPolarHBondContact O-CG 3.34Å; R481-Q485 PolarHBondContact O-N 3.23Å; A483-Q485 VanDerWaalsContact C-N 3.34Å; A483-Q485 PolarHBondContact O-N 2.95Å; Q485-R489 PolarHBondContact O-N 3.42Å
486	R	93	Very high	92.9	Very high	40 Å²	40	46.7 Å²	46.7	15%	0.151	22%	0.221	C	C	.	.	H	α-helix	trans	-76	-41.7	176.4	-72	-165.6	-58.2	-72.3	-11.8	112.7	T389 S482 A483 I484 A488 C490	T389-R486 HydrophobicContact CG2-CB 4.22Å; T389-R486 WeakPolarHBondContact OG1-CB 3.32Å; T389-R486 PolarHBondContact OG1-O 3.26Å; S482-R486 PolarHBondContact O-NH1 2.65Å; S482-R486 PolarHBondContact O-NH2 3.31Å; A483-R486 PolarHBondContact O-N 3.25Å; A483-R486 VanDerWaalsContact O-N 3.09Å; I484-R486 VanDerWaalsContact C-N 3.26Å; I484-R486 PolarHBondContact O-N 2.93Å; R486-A488 VanDerWaalsContact C-N 3.35Å; R486-C490 VanDerWaalsContact O-CB 3.32Å; R486-C490 WeakPolarHBondContact O-CB 3.22Å; R486-C490 PolarHBondContact O-N 3.19Å; R486-C490 PolarHBondContact O-SG 3.26Å
487	I	95.8	Very high	92.3	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-64.3	-45.1	176.5	-52.4	160.4	0	0	0	108.8	T389 M411 I455 A483 I484 R489 C490 T491 F529	T389-I487 HydrophobicContact CG2-CD1 4.5Å; T389-I487 HydrophobicContact CG2-CG1 3.6Å; M411-I487 HydrophobicContact CE-CB 3.95Å; M411-I487 HydrophobicContact CE-CG2 3.5Å; M411-I487 VanDerWaalsContact CE-CG2 3.5Å; I455-I487 HydrophobicContact CD1-CD1 4.06Å; I455-I487 HydrophobicContact CD1-CG2 4.12Å; A483-I487 WeakPolarHBondContact O-CG1 3.45Å; A483-I487 PolarHBondContact O-N 3.08Å; I484-I487 PolarHBondContact O-N 3.24Å; I484-I487 VanDerWaalsContact O-N 3.15Å; I487-R489 PolarHBondContact O-N 2.87Å; I487-C490 PolarHBondContact O-N 3.46Å; I487-T491 HydrophobicContact CG2-CG2 3.93Å; I487-T491 VanDerWaalsContact O-CB 3.3Å; I487-T491 WeakPolarHBondContact O-CB 3.49Å; I487-T491 VanDerWaalsContact O-CG2 3.29Å; I487-T491 WeakPolarHBondContact O-CG2 3.47Å; I487-T491 PolarHBondContact O-N 3.26Å; I487-T491 PolarHBondContact O-OG1 3.06Å; I487-F529 HydrophobicContact CD1-CD2 4.05Å; I487-F529 HydrophobicContact CD1-CE2 3.64Å; I487-F529 HydrophobicContact CD1-CZ 4.21Å; I487-F529 HydrophobicContact CG1-CD2 4.03Å; I487-F529 HydrophobicContact CG1-CE2 4.13Å; I487-F529 HydrophobicContact CG2-CD1 3.9Å; I487-F529 HydrophobicContact CG2-CD2 4.04Å; I487-F529 HydrophobicContact CG2-CE1 4.05Å; I487-F529 HydrophobicContact CG2-CE2 4.2Å; I487-F529 HydrophobicContact CG2-CG 3.89Å; I487-F529 HydrophobicContact CG2-CZ 4.2Å
488	A	94.4	Very high	91.5	Very high	10 Å²	10	53.3 Å²	53.3	8%	0.083	26%	0.256	C	S	.	.	H	α-helix	trans	-52.6	-54.6	176.7	0	0	0	0	0	111.6	M411 I484 R486 T491 R492 C493 V495	M411-A488 HydrophobicContact CE-CB 4.48Å; M411-A488 HydrophobicContact SD-CB 3.83Å; I484-A488 WeakPolarHBondContact O-CB 3.34Å; I484-A488 PolarHBondContact O-N 3.42Å; R486-A488 VanDerWaalsContact C-N 3.35Å; A488-T491 PolarHBondContact O-N 3.49Å; A488-R492 CarbonylContact O-C 3.51Å; A488-R492 VanDerWaalsContact O-CA 3.3Å; A488-R492 WeakPolarHBondContact O-CA 3.24Å; A488-R492 PolarHBondContact O-N 3.29Å; A488-C493 PolarHBondContact O-N 2.75Å; A488-V495 HydrophobicContact CB-CG2 3.61Å
489	R	92.6	Very high	90.5	Very high	42 Å²	42	50.6 Å²	50.6	16%	0.158	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-52.6	177	-172.3	177.8	63.4	-147.7	-15.1	112.6	S368 Y369 Q485 I487 T491 R492 L536	S368-R489 PolarHBondContact O-NH1 3.01Å; S368-R489 PolarHBondContact O-NH2 3.29Å; Y369-R489 VanDerWaalsContact CE1-CD 3.5Å; Q485-R489 PolarHBondContact O-N 3.42Å; I487-R489 PolarHBondContact O-N 2.87Å; R489-T491 PolarHBondContact O-N 3.39Å; R489-R492 PolarHBondContact O-N 2.94Å; R489-L536 PolarHBondContact NE-O 3.05Å; R489-L536 VanDerWaalsContact NE-O 3.15Å
490	C	94.2	Very high	89.4	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.014	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-29.2	-178.3	-68.8	0	0	0	0	113.5	R486 I487 C532	R486-C490 VanDerWaalsContact O-CB 3.32Å; R486-C490 WeakPolarHBondContact O-CB 3.22Å; R486-C490 PolarHBondContact O-N 3.19Å; R486-C490 PolarHBondContact O-SG 3.26Å; I487-C490 PolarHBondContact O-N 3.46Å; C490-C532 HydrophobicContact CB-CB 4.19Å; C490-C532 WeakPolarHBondContact O-CB 3.46Å
491	T	95	Very high	88.1	Confident	8 Å²	8	54.9 Å²	54.9	5%	0.049	26%	0.263	C	S	.	.	H	α-helix	trans	-102.6	-0.5	-177.8	64.7	0	0	0	0	113.9	I409 M411 I487 A488 R489 C493 G506 R507 C508	I409-T491 HydrophobicContact CD1-CG2 3.79Å; M411-T491 WeakPolarHBondContact CE-OG1 3.41Å; I487-T491 HydrophobicContact CG2-CG2 3.93Å; I487-T491 VanDerWaalsContact O-CB 3.3Å; I487-T491 WeakPolarHBondContact O-CB 3.49Å; I487-T491 VanDerWaalsContact O-CG2 3.29Å; I487-T491 WeakPolarHBondContact O-CG2 3.47Å; I487-T491 PolarHBondContact O-N 3.26Å; I487-T491 PolarHBondContact O-OG1 3.06Å; A488-T491 PolarHBondContact O-N 3.49Å; R489-T491 PolarHBondContact O-N 3.39Å; T491-C493 VanDerWaalsContact C-N 3.25Å; T491-C493 PolarHBondContact O-N 2.88Å; T491-G506 CarbonylContact O-C 3.56Å; T491-G506 WeakPolarHBondContact O-CA 3.31Å; T491-R507 VanDerWaalsContact CA-O 3.23Å; T491-R507 WeakPolarHBondContact CA-O 3.48Å; T491-R507 VanDerWaalsContact CB-O 3.22Å; T491-R507 WeakPolarHBondContact CB-O 3.47Å; T491-R507 PolarHBondContact O-N 3.5Å; T491-C508 HydrophobicContact CG2-CB 4.06Å
492	R	93	Very high	87.1	Confident	135 Å²	135	58.8 Å²	58.8	51%	0.509	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	47.3	-169	-65.4	-175.5	164.4	-179.3	-6	112.5	E356 A488 R489 R504 L536	E356-R492 IonicContact OE1-CZ 3.89Å; E356-R492 IonicContact OE1-NH2 2.78Å; E356-R492 PolarHBondContact OE1-NH2 3.3Å; E356-R492 IonicContact OE2-NH2 3.99Å; A488-R492 CarbonylContact O-C 3.51Å; A488-R492 VanDerWaalsContact O-CA 3.3Å; A488-R492 WeakPolarHBondContact O-CA 3.24Å; A488-R492 PolarHBondContact O-N 3.29Å; R489-R492 PolarHBondContact O-N 2.94Å; R492-R504 WeakPolarHBondContact O-CD 3.26Å; R492-L536 HydrophobicContact CG-CD1 3.75Å
493	C	93.5	Very high	86.6	Confident	9 Å²	9	57 Å²	57	6%	0.061	27%	0.271	C	S	.	.			trans	-90.8	134.7	170.4	-159.8	0	0	0	0	110.4	I409 M411 A488 T491 R504 G506	I409-C493 PolarHBondContact O-SG 3.42Å; I409-C493 VanDerWaalsContact O-SG 3.34Å; M411-C493 HydrophobicContact CE-CB 3.48Å; M411-C493 VanDerWaalsContact CE-CB 3.48Å; M411-C493 HydrophobicContact CG-CB 4.34Å; M411-C493 HydrophobicContact SD-CB 4Å; A488-C493 PolarHBondContact O-N 2.75Å; T491-C493 VanDerWaalsContact C-N 3.25Å; T491-C493 PolarHBondContact O-N 2.88Å; C493-R504 WeakPolarHBondContact CA-O 3.15Å; C493-G506 PolarHBondContact SG-N 3Å
494	D	91.5	Very high	86.4	Confident	62 Å²	62	64.5 Å²	64.5	33%	0.332	30%	0.298	S	S	.	.			trans	-74.8	148.6	161.7	-51.7	-22.8	0	0	0	108.7	R504	D494-R504 HydrophobicContact CB-CB 4.4Å; D494-R504 VanDerWaalsContact CG-CB 3.42Å; D494-R504 PolarHBondContact N-O 3.32Å; D494-R504 WeakPolarHBondContact OD1-CB 3.34Å; D494-R504 IonicContact OD1-NE 3.95Å; D494-R504 PolarHBondContact OD1-NE 3.33Å; D494-R504 WeakPolarHBondContact OD2-CB 3.43Å; D494-R504 PolarHBondContact OD2-N 3.41Å
495	V	90.2	Very high	86.2	Confident	48 Å²	48	66.6 Å²	66.6	29%	0.291	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.9	176.4	-171.6	0	0	0	0	108.6	M411 Q413 I484 A488	M411-V495 HydrophobicContact CB-CG1 4.22Å; M411-V495 HydrophobicContact CB-CG2 4.27Å; M411-V495 HydrophobicContact SD-CG2 4.37Å; Q413-V495 HydrophobicContact CB-CG1 4Å; I484-V495 HydrophobicContact CG2-CG1 4.01Å; I484-V495 HydrophobicContact CG2-CG2 3.91Å; A488-V495 HydrophobicContact CB-CG2 3.61Å
496	V	90.2	Very high	86.3	Confident	13 Å²	13	61.2 Å²	61.2	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	140.2	-173.7	-65.6	0	0	0	0	113.4	M411 I412 Q413	M411-V496 WeakPolarHBondContact O-CG2 3.19Å; M411-V496 PolarHBondContact O-N 2.81Å; I412-V496 CarbonylContact C-O 3.59Å; I412-V496 WeakPolarHBondContact CA-O 3.43Å; I412-V496 HydrophobicContact CG1-CG2 4.13Å; Q413-V496 PolarHBondContact N-O 2.77Å
497	H	82.8	Confident	86.5	Confident	140 Å²	140	66.4 Å²	66.4	65%	0.648	30%	0.303	S	S	*	.	S	Bend	trans	-78.8	-16.7	171	-79.5	-71.1	0	0	0	114	Q413	Q413-H497 VanDerWaalsContact CD-CE1 3.45Å; Q413-H497 PolarHBondContact NE2-CE1 2.83Å; Q413-H497 VanDerWaalsContact NE2-CE1 3.27Å
498	S	76.7	Confident	86.5	Confident	40 Å²	40	66.6 Å²	66.6	28%	0.28	31%	0.305	S	S	.	.	S	Bend	trans	-154.3	150.3	177.8	175.4	0	0	0	0	110	E500	S498-E500 PolarHBondContact O-N 3.22Å; S498-E500 VanDerWaalsContact O-N 3.14Å; S498-E500 PolarHBondContact OG-N 2.87Å
499	V	73.4	Confident	86.6	Confident	17 Å²	17	67 Å²	67	10%	0.103	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	5.3	-179.9	-149.8	0	0	0	0	113	I412 V442 K445 V446	I412-V499 HydrophobicContact CD1-CG2 3.86Å; V442-V499 HydrophobicContact CG1-CG2 4.06Å; K445-V499 HydrophobicContact CB-CB 4.11Å; K445-V499 HydrophobicContact CB-CG1 3.87Å; V446-V499 HydrophobicContact CB-CG1 4.35Å; V446-V499 HydrophobicContact CG2-CB 4.45Å; V446-V499 HydrophobicContact CG2-CG1 3.63Å; V446-V499 HydrophobicContact CG2-CG2 3.91Å
500	E	68.4	Low	86.8	Confident	135 Å²	135	65.7 Å²	65.7	63%	0.631	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-12.6	-177.4	-60.1	-173.6	142.2	0	0	113	K445 S498	K445-E500 HydrophobicContact CD-CG 4.35Å; K445-E500 IonicContact NZ-OE1 3.77Å; K445-E500 PolarHBondContact NZ-OE1 3.44Å; S498-E500 PolarHBondContact O-N 3.22Å; S498-E500 VanDerWaalsContact O-N 3.14Å; S498-E500 PolarHBondContact OG-N 2.87Å
501	F	64.3	Low	86.9	Confident	129 Å²	129	65.6 Å²	65.6	57%	0.566	31%	0.305	S	S	*	.	S	Bend	trans	-94.5	130.8	179.5	-61.7	-78.3	0	0	0	111.5	S503	F501-S503 PolarHBondContact O-N 3.23Å
502	K	69.9	Low	87	Confident	212 Å²	212	68.6 Å²	68.6	92%	0.922	32%	0.315	S	S	*	.			trans	-64	124.7	168.3	-76.6	-175.9	176.5	178.6	0	109.5
503	S	80	Confident	87.1	Confident	28 Å²	28	63 Å²	63	20%	0.196	30%	0.296	C	S	.	.			trans	-137.3	157.4	-175.4	58.5	0	0	0	0	112.1	F501 M505	F501-S503 PolarHBondContact O-N 3.23Å; S503-M505 PolarHBondContact O-N 3.38Å
504	R	88.4	Confident	87.1	Confident	164 Å²	164	64.5 Å²	64.5	62%	0.619	30%	0.302	S	S	*	.			trans	-77.1	106.2	175.8	-163.1	-169.1	-38.8	-113.6	-1.5	109.6	R492 C493 D494 G506	R492-R504 WeakPolarHBondContact O-CD 3.26Å; C493-R504 WeakPolarHBondContact CA-O 3.15Å; D494-R504 HydrophobicContact CB-CB 4.4Å; D494-R504 VanDerWaalsContact CG-CB 3.42Å; D494-R504 PolarHBondContact N-O 3.32Å; D494-R504 WeakPolarHBondContact OD1-CB 3.34Å; D494-R504 IonicContact OD1-NE 3.95Å; D494-R504 PolarHBondContact OD1-NE 3.33Å; D494-R504 WeakPolarHBondContact OD2-CB 3.43Å; D494-R504 PolarHBondContact OD2-N 3.41Å; R504-G506 PolarHBondContact O-N 3.4Å
505	M	91.8	Very high	87.1	Confident	50 Å²	50	67.6 Å²	67.6	25%	0.246	32%	0.315	C	S	.	.			trans	-66.3	131.8	170.5	-71	-154.6	-63.6	0	0	110.7	K408 I409 L410 H449 P451 S503	K408-M505 HydrophobicContact CB-CE 3.9Å; K408-M505 HydrophobicContact CB-SD 4.37Å; K408-M505 HydrophobicContact CD-CE 3.99Å; K408-M505 HydrophobicContact CG-CE 4.24Å; I409-M505 CarbonylContact O-C 3.57Å; I409-M505 VanDerWaalsContact O-CA 3.31Å; I409-M505 WeakPolarHBondContact O-CA 3.24Å; I409-M505 WeakPolarHBondContact O-CB 3.31Å; L410-M505 HydrophobicContact CB-SD 4.31Å; L410-M505 HydrophobicContact CD1-CG 4.5Å; H449-M505 HydrophobicContact CB-SD 4.12Å; H449-M505 WeakPolarHBondContact O-CE 3.12Å; P451-M505 HydrophobicContact CB-SD 4.11Å; S503-M505 PolarHBondContact O-N 3.38Å
506	G	94.6	Very high	87.2	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	164.8	178.8	0	0	0	0	0	113	I409 T491 C493 R504	I409-G506 PolarHBondContact N-O 2.83Å; I409-G506 PolarHBondContact O-N 3.22Å; T491-G506 CarbonylContact O-C 3.56Å; T491-G506 WeakPolarHBondContact O-CA 3.31Å; C493-G506 PolarHBondContact SG-N 3Å; R504-G506 PolarHBondContact O-N 3.4Å
507	R	95.5	Very high	87.3	Confident	148 Å²	148	69 Å²	69	56%	0.558	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	151.8	173	-64.5	-178.4	-178.9	-107.7	11.5	111.9	P407 T491	P407-R507 WeakPolarHBondContact O-CA 3.12Å; T491-R507 VanDerWaalsContact CA-O 3.23Å; T491-R507 WeakPolarHBondContact CA-O 3.48Å; T491-R507 VanDerWaalsContact CB-O 3.22Å; T491-R507 WeakPolarHBondContact CB-O 3.47Å; T491-R507 PolarHBondContact O-N 3.5Å
508	C	96.1	Very high	87.6	Confident	6 Å²	6	63.2 Å²	63.2	4%	0.041	30%	0.297	C	S	.	.			trans	-136.7	164.6	164.3	65.3	0	0	0	0	108.9	L406 P407 T491 L510 E530 C532	L406-C508 WeakPolarHBondContact CA-O 3.42Å; P407-C508 WeakPolarHBondContact CD-O 3.41Å; T491-C508 HydrophobicContact CG2-CB 4.06Å; C508-L510 PolarHBondContact SG-O 3.29Å; C508-L510 VanDerWaalsContact SG-O 3.37Å; C508-E530 WeakPolarHBondContact CB-O 3.37Å; C508-C532 VanDerWaalsContact CB-SG 3.55Å
509	G	96.2	Very high	88.1	Confident	18 Å²	18	64.6 Å²	64.6	19%	0.186	30%	0.301	C	S	.	.	S	Bend	trans	-72.1	-35.5	177.4	0	0	0	0	0	113	R405 L406 E530 D531	R405-G509 WeakPolarHBondContact CA-O 3.46Å; L406-G509 PolarHBondContact N-O 3.32Å; G509-E530 PolarHBondContact N-O 2.83Å; G509-E530 VanDerWaalsContact N-O 3.16Å; G509-D531 PolarHBondContact N-O 3.21Å
510	L	97.5	Very high	88.6	Confident	15 Å²	15	68 Å²	68	8%	0.079	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	131.4	177.7	179.1	63.8	0	0	0	112.1	R403 R405 C508 E530	R403-L510 HydrophobicContact CG-CD1 4.13Å; R405-L510 HydrophobicContact CG-CD1 4.18Å; C508-L510 PolarHBondContact SG-O 3.29Å; C508-L510 VanDerWaalsContact SG-O 3.37Å; L510-E530 HydrophobicContact CB-CB 4.4Å; L510-E530 PolarHBondContact N-O 3.24Å; L510-E530 PolarHBondContact O-N 2.59Å
511	F	97.3	Very high	89.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.7	158.2	169.2	-103	0	0	0	109.4	V395 R403 I404 P407 I453 T474 L476 T513 C527 R528 F529	V395-F511 HydrophobicContact CG1-CE1 4.41Å; V395-F511 HydrophobicContact CG1-CZ 4.23Å; R403-F511 CarbonylContact C-O 3.59Å; R403-F511 WeakPolarHBondContact CA-O 3.33Å; I404-F511 HydrophobicContact CD1-CD1 4.31Å; I404-F511 HydrophobicContact CG1-CD1 4.25Å; I404-F511 PolarHBondContact N-O 3.05Å; I404-F511 PolarHBondContact O-N 3.13Å; P407-F511 HydrophobicContact CG-CB 3.97Å; I453-F511 HydrophobicContact CD1-CB 3.52Å; I453-F511 HydrophobicContact CD1-CD1 3.58Å; I453-F511 HydrophobicContact CD1-CD2 3.8Å; I453-F511 HydrophobicContact CD1-CE1 4.21Å; I453-F511 HydrophobicContact CD1-CE2 4.38Å; I453-F511 HydrophobicContact CD1-CG 3.34Å; I453-F511 HydrophobicContact CG1-CD1 4.44Å; T474-F511 HydrophobicContact CG2-CE1 4.04Å; T474-F511 HydrophobicContact CG2-CZ 4.48Å; L476-F511 HydrophobicContact CD1-CE2 4.09Å; L476-F511 HydrophobicContact CD1-CZ 4.33Å; F511-T513 HydrophobicContact CZ-CG2 4.39Å; F511-C527 HydrophobicContact CE2-CB 4.08Å; F511-R528 WeakPolarHBondContact CA-O 3.45Å; F511-F529 AromaticContact CD2-CD1 3.93Å; F511-F529 HydrophobicContact CD2-CD1 3.93Å; F511-F529 HydrophobicContact CD2-CD2 4.46Å; F511-F529 AromaticContact CD2-CE1 3.59Å; F511-F529 HydrophobicContact CD2-CE1 3.59Å; F511-F529 HydrophobicContact CD2-CE2 4.16Å; F511-F529 HydrophobicContact CD2-CG 4.35Å; F511-F529 AromaticContact CD2-CZ 3.72Å; F511-F529 HydrophobicContact CD2-CZ 3.72Å; F511-F529 HydrophobicContact CE2-CE1 4.08Å; F511-F529 HydrophobicContact CE2-CE2 4.1Å; F511-F529 AromaticContact CE2-CZ 3.73Å; F511-F529 HydrophobicContact CE2-CZ 3.73Å; F511-F529 HydrophobicContact CG-CE1 4.49Å
512	R	96.4	Very high	90.6	Very high	71 Å²	71	60.3 Å²	60.3	27%	0.268	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	151.7	166.1	58.1	169.2	155.4	155.1	0	112.8	Q402 R403 R528 E530	Q402-R512 CarbonylContact O-C 3.55Å; Q402-R512 VanDerWaalsContact O-CA 3.29Å; Q402-R512 WeakPolarHBondContact O-CA 3.48Å; R403-R512 HydrophobicContact CG-CB 4.46Å; R512-R528 HydrophobicContact CG-CB 4.03Å; R512-R528 PolarHBondContact N-O 2.92Å; R512-R528 PolarHBondContact O-N 3.28Å; R512-E530 IonicContact CZ-OE1 2.73Å; R512-E530 IonicContact CZ-OE2 3.5Å; R512-E530 IonicContact NE-OE1 3.31Å; R512-E530 IonicContact NE-OE2 3.49Å; R512-E530 PolarHBondContact NE-OE2 3.41Å; R512-E530 VanDerWaalsContact NH2-CD 3.28Å; R512-E530 IonicContact NH2-OE1 2.71Å; R512-E530 PolarHBondContact NH2-OE1 3.17Å; R512-E530 IonicContact NH2-OE2 3.46Å; R512-E530 PolarHBondContact NH2-OE2 3.17Å
513	T	94.6	Very high	91.6	Very high	17 Å²	17	53.8 Å²	53.8	10%	0.104	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.1	157.7	37	0	0	0	0	111.8	V395 Q402 F511 M525 L526 C527	V395-T513 HydrophobicContact CG1-CG2 4.22Å; Q402-T513 WeakPolarHBondContact CB-OG1 3.31Å; Q402-T513 VanDerWaalsContact CG-OG1 3.27Å; Q402-T513 WeakPolarHBondContact CG-OG1 3.3Å; Q402-T513 PolarHBondContact O-N 3.42Å; Q402-T513 PolarHBondContact O-OG1 3.1Å; Q402-T513 PolarHBondContact OE1-OG1 3.3Å; F511-T513 HydrophobicContact CZ-CG2 4.39Å; T513-M525 HydrophobicContact CG2-CE 4.49Å; T513-L526 CarbonylContact C-O 3.59Å; T513-L526 WeakPolarHBondContact CA-O 3.36Å; T513-C527 VanDerWaalsContact CG2-SG 3.53Å
514	E	92.6	Very high	92.1	Very high	41 Å²	41	56.8 Å²	56.8	19%	0.192	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.8	177.2	-175.6	-174.7	150.1	0	0	108.3	V516 L526 R528	E514-V516 HydrophobicContact CG-CG2 3.84Å; E514-V516 VanDerWaalsContact OE1-CG2 3.28Å; E514-V516 WeakPolarHBondContact OE1-CG2 3.24Å; E514-L526 HydrophobicContact CB-CB 4.42Å; E514-L526 PolarHBondContact N-O 3.39Å; E514-L526 PolarHBondContact O-N 3.4Å; E514-R528 WeakPolarHBondContact OE2-CD 3.38Å; E514-R528 IonicContact OE2-CZ 2.72Å; E514-R528 IonicContact OE2-NE 2.61Å; E514-R528 IonicContact OE2-NH1 3.61Å; E514-R528 PolarHBondContact OE2-NH1 3.35Å
515	Q	92.8	Very high	92.3	Very high	126 Å²	126	51.7 Å²	51.7	59%	0.589	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.9	169.4	-169.8	175.8	18.7	0	0	108.7	T523 M525	Q515-T523 PolarHBondContact NE2-OG1 3.45Å; Q515-M525 HydrophobicContact CB-CE 4.16Å; Q515-M525 HydrophobicContact CB-SD 3.56Å; Q515-M525 VanDerWaalsContact CB-SD 3.56Å; Q515-M525 HydrophobicContact CG-SD 3.71Å
516	V	91.5	Very high	92.4	Very high	9 Å²	9	49.5 Å²	49.5	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118.7	179.2	-174.9	0	0	0	0	109.9	I375 R377 E514 L518 T523 K524 L526	I375-V516 HydrophobicContact CG2-CG1 3.96Å; R377-V516 HydrophobicContact CB-CG1 3.77Å; E514-V516 HydrophobicContact CG-CG2 3.84Å; E514-V516 VanDerWaalsContact OE1-CG2 3.28Å; E514-V516 WeakPolarHBondContact OE1-CG2 3.24Å; V516-L518 HydrophobicContact CG1-CD2 4.32Å; V516-T523 CarbonylContact O-C 3.58Å; V516-T523 WeakPolarHBondContact O-CA 3.37Å; V516-K524 PolarHBondContact N-O 2.86Å; V516-K524 PolarHBondContact O-N 2.85Å; V516-L526 HydrophobicContact CG2-CD1 3.64Å; V516-L526 HydrophobicContact CG2-CG 4.15Å
517	T	92.6	Very high	92.4	Very high	83 Å²	83	49.4 Å²	49.4	51%	0.509	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	138	167.6	-49.4	0	0	0	0	109.6	T523	T517-T523 HydrophobicContact CG2-CG2 4.3Å
518	L	89.8	Confident	92.5	Very high	17 Å²	17	42.7 Å²	42.7	9%	0.089	24%	0.24	C	C	.	.			trans	-100.7	164.1	178.2	-57.8	-170.9	0	0	0	112	I375 R376 V516 D520 G521 S522 K524	I375-L518 HydrophobicContact CG2-CD2 3.56Å; R376-L518 CarbonylContact O-C 3.51Å; R376-L518 WeakPolarHBondContact O-CA 2.95Å; R376-L518 WeakPolarHBondContact O-CB 3.11Å; V516-L518 HydrophobicContact CG1-CD2 4.32Å; L518-D520 WeakPolarHBondContact CB-OD1 3.48Å; L518-D520 PolarHBondContact O-N 2.86Å; L518-G521 PolarHBondContact O-N 2.82Å; L518-S522 WeakPolarHBondContact CB-O 3.48Å; L518-S522 PolarHBondContact N-O 2.88Å; L518-K524 HydrophobicContact CD1-CD 3.89Å
519	L	86.2	Confident	92.5	Very high	70 Å²	70	42.4 Å²	42.4	37%	0.366	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.4	173.7	-64.6	179.6	0	0	0	114.3	R376 L379	R376-L519 HydrophobicContact CB-CB 4.5Å; R376-L519 HydrophobicContact CB-CD1 4.18Å; R376-L519 HydrophobicContact CB-CG 4.34Å; R376-L519 PolarHBondContact O-N 3.13Å; L379-L519 HydrophobicContact CD2-CD1 3.77Å; L379-L519 HydrophobicContact CG-CD1 4.12Å; L379-L519 HydrophobicContact CG-CD2 4.14Å
520	D	83.3	Confident	92.5	Very high	89 Å²	89	42.1 Å²	42.1	48%	0.476	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	10.8	173.1	57.2	36.6	0	0	0	113.2	L518 S522	L518-D520 WeakPolarHBondContact CB-OD1 3.48Å; L518-D520 PolarHBondContact O-N 2.86Å; D520-S522 PolarHBondContact O-N 3.1Å; D520-S522 VanDerWaalsContact O-N 3.17Å; D520-S522 VanDerWaalsContact OD1-CB 3.26Å; D520-S522 WeakPolarHBondContact OD1-CB 3.28Å; D520-S522 PolarHBondContact OD1-N 3.06Å; D520-S522 VanDerWaalsContact OD1-N 3.1Å; D520-S522 PolarHBondContact OD1-OG 2.65Å
521	G	86	Confident	92.5	Very high	57 Å²	57	46.8 Å²	46.8	59%	0.588	26%	0.256	S	S	*	.	S	Bend	trans	76.6	-13.7	-178.5	0	0	0	0	0	114.7	L518	L518-G521 PolarHBondContact O-N 2.82Å
522	S	90	Very high	92.4	Very high	45 Å²	45	47 Å²	47	32%	0.315	26%	0.258	S	S	.	.			trans	-71.4	143.9	177.7	73.8	0	0	0	0	111.6	L518 D520	L518-S522 WeakPolarHBondContact CB-O 3.48Å; L518-S522 PolarHBondContact N-O 2.88Å; D520-S522 PolarHBondContact O-N 3.1Å; D520-S522 VanDerWaalsContact O-N 3.17Å; D520-S522 VanDerWaalsContact OD1-CB 3.26Å; D520-S522 WeakPolarHBondContact OD1-CB 3.28Å; D520-S522 PolarHBondContact OD1-N 3.06Å; D520-S522 VanDerWaalsContact OD1-N 3.1Å; D520-S522 PolarHBondContact OD1-OG 2.65Å
523	T	90.3	Very high	92.3	Very high	75 Å²	75	46.3 Å²	46.3	46%	0.46	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	148.1	174.6	67.4	0	0	0	0	111.3	Q515 V516 T517	Q515-T523 PolarHBondContact NE2-OG1 3.45Å; V516-T523 CarbonylContact O-C 3.58Å; V516-T523 WeakPolarHBondContact O-CA 3.37Å; T517-T523 HydrophobicContact CG2-CG2 4.3Å
524	K	90.7	Very high	92.3	Very high	90 Å²	90	47.7 Å²	47.7	39%	0.391	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	132.1	177	-66.9	-179.5	-175.4	152.1	0	110.8	T392 V516 L518	T392-K524 HydrophobicContact CG2-CB 4.44Å; V516-K524 PolarHBondContact N-O 2.86Å; V516-K524 PolarHBondContact O-N 2.85Å; L518-K524 HydrophobicContact CD1-CD 3.89Å
525	M	91.7	Very high	92.3	Very high	58 Å²	58	49.1 Å²	49.1	29%	0.286	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.5	168.8	-62.4	-52.1	-60.5	0	0	110.5	T392 K393 T513 Q515	T392-M525 CarbonylContact C-O 3.59Å; T392-M525 WeakPolarHBondContact CA-O 3.42Å; T392-M525 WeakPolarHBondContact CG2-O 3.41Å; K393-M525 PolarHBondContact N-O 3.46Å; K393-M525 CarbonylContact O-C 3.56Å; K393-M525 WeakPolarHBondContact O-CB 3.43Å; T513-M525 HydrophobicContact CG2-CE 4.49Å; Q515-M525 HydrophobicContact CB-CE 4.16Å; Q515-M525 HydrophobicContact CB-SD 3.56Å; Q515-M525 VanDerWaalsContact CB-SD 3.56Å; Q515-M525 HydrophobicContact CG-SD 3.71Å
526	L	94.5	Very high	92.3	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.4	168.7	-54.1	179.9	0	0	0	109	I375 V390 C391 K393 T513 E514 V516	I375-L526 HydrophobicContact CD1-CD1 3.65Å; I375-L526 HydrophobicContact CD1-CD2 4.01Å; I375-L526 HydrophobicContact CD1-CG 4.48Å; V390-L526 HydrophobicContact CG1-CB 4.06Å; V390-L526 HydrophobicContact CG1-CD1 4.25Å; C391-L526 CarbonylContact O-C 3.58Å; C391-L526 VanDerWaalsContact O-CA 3.28Å; C391-L526 WeakPolarHBondContact O-CA 3.38Å; K393-L526 CarbonylContact O-C 3.57Å; T513-L526 CarbonylContact C-O 3.59Å; T513-L526 WeakPolarHBondContact CA-O 3.36Å; E514-L526 HydrophobicContact CB-CB 4.42Å; E514-L526 PolarHBondContact N-O 3.39Å; E514-L526 PolarHBondContact O-N 3.4Å; V516-L526 HydrophobicContact CG2-CD1 3.64Å; V516-L526 HydrophobicContact CG2-CG 4.15Å
527	C	94.9	Very high	92.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.5	160.5	-69.8	0	0	0	0	107.7	V390 C391 K393 F511 T513 F529	V390-C527 WeakPolarHBondContact CA-O 3.4Å; C391-C527 PolarHBondContact N-O 3.4Å; C391-C527 PolarHBondContact O-N 3.45Å; K393-C527 VanDerWaalsContact C-SG 3.58Å; K393-C527 HydrophobicContact CB-CB 4.5Å; K393-C527 PolarHBondContact O-N 3.12Å; K393-C527 PolarHBondContact O-SG 3.44Å; F511-C527 HydrophobicContact CE2-CB 4.08Å; T513-C527 VanDerWaalsContact CG2-SG 3.53Å; C527-F529 HydrophobicContact CB-CE2 4.22Å
528	R	96.9	Very high	92.6	Very high	6 Å²	6	38.9 Å²	38.9	2%	0.023	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.1	178.2	-57.4	175.7	63.9	131.6	4.3	108.3	D384 V390 F511 R512 E514 E530	D384-R528 IonicContact OD1-NH2 3.2Å; D384-R528 PolarHBondContact OD1-NH2 2.88Å; D384-R528 IonicContact OD2-CZ 3.64Å; D384-R528 IonicContact OD2-NH1 2.78Å; D384-R528 PolarHBondContact OD2-NH1 3.31Å; D384-R528 IonicContact OD2-NH2 2.85Å; D384-R528 PolarHBondContact OD2-NH2 3.1Å; D384-R528 VanDerWaalsContact OD2-NH2 3.11Å; V390-R528 HydrophobicContact CB-CG 4.41Å; V390-R528 HydrophobicContact CG1-CG 3.8Å; V390-R528 HydrophobicContact CG2-CB 4.18Å; V390-R528 HydrophobicContact CG2-CG 3.87Å; F511-R528 WeakPolarHBondContact CA-O 3.45Å; R512-R528 HydrophobicContact CG-CB 4.03Å; R512-R528 PolarHBondContact N-O 2.92Å; R512-R528 PolarHBondContact O-N 3.28Å; E514-R528 WeakPolarHBondContact OE2-CD 3.38Å; E514-R528 IonicContact OE2-CZ 2.72Å; E514-R528 IonicContact OE2-NE 2.61Å; E514-R528 IonicContact OE2-NH1 3.61Å; E514-R528 PolarHBondContact OE2-NH1 3.35Å; R528-E530 HydrophobicContact CB-CG 3.69Å; R528-E530 IonicContact CZ-OE1 3.36Å; R528-E530 IonicContact NE-OE1 3.95Å; R528-E530 PolarHBondContact NE-OE1 3.01Å; R528-E530 IonicContact NH2-OE1 3.86Å; R528-E530 PolarHBondContact NH2-OE1 3.15Å
529	F	97.2	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	109.1	166.8	-63.5	-95.1	0	0	0	106.4	G388 T389 I409 I453 I455 L476 I487 F511 C527	G388-F529 CarbonylContact C-O 3.3Å; G388-F529 WeakPolarHBondContact CA-O 3.3Å; T389-F529 PolarHBondContact N-O 2.92Å; T389-F529 PolarHBondContact O-N 2.93Å; I409-F529 HydrophobicContact CD1-CD1 3.88Å; I409-F529 HydrophobicContact CD1-CE1 3.93Å; I453-F529 HydrophobicContact CD1-CE1 4.19Å; I455-F529 HydrophobicContact CD1-CE1 4.09Å; I455-F529 HydrophobicContact CD1-CE2 4.49Å; I455-F529 HydrophobicContact CD1-CZ 3.67Å; L476-F529 HydrophobicContact CD1-CE2 4.23Å; L476-F529 HydrophobicContact CD1-CZ 3.75Å; I487-F529 HydrophobicContact CD1-CD2 4.05Å; I487-F529 HydrophobicContact CD1-CE2 3.64Å; I487-F529 HydrophobicContact CD1-CZ 4.21Å; I487-F529 HydrophobicContact CG1-CD2 4.03Å; I487-F529 HydrophobicContact CG1-CE2 4.13Å; I487-F529 HydrophobicContact CG2-CD1 3.9Å; I487-F529 HydrophobicContact CG2-CD2 4.04Å; I487-F529 HydrophobicContact CG2-CE1 4.05Å; I487-F529 HydrophobicContact CG2-CE2 4.2Å; I487-F529 HydrophobicContact CG2-CG 3.89Å; I487-F529 HydrophobicContact CG2-CZ 4.2Å; F511-F529 AromaticContact CD2-CD1 3.93Å; F511-F529 HydrophobicContact CD2-CD1 3.93Å; F511-F529 HydrophobicContact CD2-CD2 4.46Å; F511-F529 AromaticContact CD2-CE1 3.59Å; F511-F529 HydrophobicContact CD2-CE1 3.59Å; F511-F529 HydrophobicContact CD2-CE2 4.16Å; F511-F529 HydrophobicContact CD2-CG 4.35Å; F511-F529 AromaticContact CD2-CZ 3.72Å; F511-F529 HydrophobicContact CD2-CZ 3.72Å; F511-F529 HydrophobicContact CE2-CE1 4.08Å; F511-F529 HydrophobicContact CE2-CE2 4.1Å; F511-F529 AromaticContact CE2-CZ 3.73Å; F511-F529 HydrophobicContact CE2-CZ 3.73Å; F511-F529 HydrophobicContact CG-CE1 4.49Å; C527-F529 HydrophobicContact CB-CE2 4.22Å
530	E	96.4	Very high	93.6	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.056	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	171.3	-165	-46.7	-169.2	116.2	0	0	111	V386 C508 G509 L510 R512 R528 C532	V386-E530 HydrophobicContact CG1-CB 4.11Å; V386-E530 HydrophobicContact CG1-CG 3.72Å; C508-E530 WeakPolarHBondContact CB-O 3.37Å; G509-E530 PolarHBondContact N-O 2.83Å; G509-E530 VanDerWaalsContact N-O 3.16Å; L510-E530 HydrophobicContact CB-CB 4.4Å; L510-E530 PolarHBondContact N-O 3.24Å; L510-E530 PolarHBondContact O-N 2.59Å; R512-E530 IonicContact CZ-OE1 2.73Å; R512-E530 IonicContact CZ-OE2 3.5Å; R512-E530 IonicContact NE-OE1 3.31Å; R512-E530 IonicContact NE-OE2 3.49Å; R512-E530 PolarHBondContact NE-OE2 3.41Å; R512-E530 VanDerWaalsContact NH2-CD 3.28Å; R512-E530 IonicContact NH2-OE1 2.71Å; R512-E530 PolarHBondContact NH2-OE1 3.17Å; R512-E530 IonicContact NH2-OE2 3.46Å; R512-E530 PolarHBondContact NH2-OE2 3.17Å; R528-E530 HydrophobicContact CB-CG 3.69Å; R528-E530 IonicContact CZ-OE1 3.36Å; R528-E530 IonicContact NE-OE1 3.95Å; R528-E530 PolarHBondContact NE-OE1 3.01Å; R528-E530 IonicContact NH2-OE1 3.86Å; R528-E530 PolarHBondContact NH2-OE1 3.15Å; E530-C532 PolarHBondContact O-N 2.95Å
531	D	95.7	Very high	94.2	Very high	113 Å²	113	30.7 Å²	30.7	60%	0.604	18%	0.181	S	C	*	.	S	Bend	trans	54.2	39.6	-177.7	-48.8	-34.2	0	0	0	111.2	Y387 G509	Y387-D531 PolarHBondContact O-N 3.31Å; G509-D531 PolarHBondContact N-O 3.21Å
532	C	95.9	Very high	94.7	Very high	6 Å²	6	28 Å²	28	4%	0.041	15%	0.154	C	C	.	.			trans	-86.2	154.5	170.4	-60.2	0	0	0	0	109.9	Y387 C490 C508 E530 P534	Y387-C532 WeakPolarHBondContact CB-O 3.47Å; Y387-C532 PolarHBondContact O-N 2.95Å; C490-C532 HydrophobicContact CB-CB 4.19Å; C490-C532 WeakPolarHBondContact O-CB 3.46Å; C508-C532 VanDerWaalsContact CB-SG 3.55Å; E530-C532 PolarHBondContact O-N 2.95Å; C532-P534 WeakPolarHBondContact O-CD 3.5Å
533	P	95	Very high	94.9	Very high	55 Å²	55	26 Å²	26	36%	0.357	14%	0.139	S	C	.	.			trans	-55.3	120.5	176	-24.4	33.3	0	0	0	111.8	Q535 L536	P533-Q535 VanDerWaalsContact C-OE1 3.24Å; P533-Q535 VanDerWaalsContact CB-OE1 3.3Å; P533-Q535 PolarHBondContact O-N 3.07Å; P533-Q535 VanDerWaalsContact O-N 3.11Å; P533-L536 HydrophobicContact CB-CD1 3.87Å; P533-L536 HydrophobicContact CB-CG 4.13Å; P533-L536 HydrophobicContact CG-CD1 3.85Å; P533-L536 PolarHBondContact O-N 3.47Å
534	P	94.2	Very high	94.9	Very high	47 Å²	47	22.4 Å²	22.4	31%	0.305	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-52.3	-37.3	-172	-32.5	37.6	0	0	0	115.3	Y387 C532 L536 G537	Y387-P534 HydrophobicContact CD1-CB 3.54Å; Y387-P534 HydrophobicContact CD1-CG 3.95Å; Y387-P534 HydrophobicContact CD2-CG 4.25Å; Y387-P534 HydrophobicContact CE1-CB 3.76Å; Y387-P534 HydrophobicContact CE1-CG 4.29Å; Y387-P534 HydrophobicContact CG-CB 4.05Å; Y387-P534 HydrophobicContact CG-CG 3.93Å; C532-P534 WeakPolarHBondContact O-CD 3.5Å; P534-L536 PolarHBondContact O-N 2.76Å; P534-G537 PolarHBondContact O-N 3.03Å
535	Q	93	Very high	94.7	Very high	70 Å²	70	19.7 Å²	19.7	33%	0.327	11%	0.109	S	C	.	.	G	3₁₀ helix	trans	-59	-30.6	-179	63.1	-86.7	45.7	0	0	113.3	T352 Q354 P533 G537	T352-Q535 WeakPolarHBondContact O-CA 3.49Å; Q354-Q535 HydrophobicContact CB-CB 4.12Å; Q354-Q535 HydrophobicContact CG-CB 4.36Å; Q354-Q535 PolarHBondContact N-O 3.45Å; P533-Q535 VanDerWaalsContact C-OE1 3.24Å; P533-Q535 VanDerWaalsContact CB-OE1 3.3Å; P533-Q535 PolarHBondContact O-N 3.07Å; P533-Q535 VanDerWaalsContact O-N 3.11Å; Q535-G537 PolarHBondContact O-N 3.26Å
536	L	92.5	Very high	94.3	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.01	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-78	-3	-176.6	-56.6	175.8	0	0	0	114	E356 R489 R492 P533 P534	E356-L536 VanDerWaalsContact OE1-CD2 3.28Å; E356-L536 WeakPolarHBondContact OE1-CD2 3.5Å; R489-L536 PolarHBondContact NE-O 3.05Å; R489-L536 VanDerWaalsContact NE-O 3.15Å; R492-L536 HydrophobicContact CG-CD1 3.75Å; P533-L536 HydrophobicContact CB-CD1 3.87Å; P533-L536 HydrophobicContact CB-CG 4.13Å; P533-L536 HydrophobicContact CG-CD1 3.85Å; P533-L536 PolarHBondContact O-N 3.47Å; P534-L536 PolarHBondContact O-N 2.76Å
537	G	94	Very high	93.7	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.			trans	113.1	166.9	174.5	0	0	0	0	0	114.5	Y369 G388 P534 Q535	Y369-G537 VanDerWaalsContact O-CA 3.29Å; Y369-G537 WeakPolarHBondContact O-CA 3.41Å; G388-G537 PolarHBondContact N-O 2.79Å; G388-G537 VanDerWaalsContact N-O 3.12Å; P534-G537 PolarHBondContact O-N 3.03Å; Q535-G537 PolarHBondContact O-N 3.26Å
538	C	97.1	Very high	93	Very high	2 Å²	2	24 Å²	24	1%	0.014	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	165.9	-169.4	69	0	0	0	0	112.8	Y369 H371 L385 V386 Y387 G388	Y369-C538 PolarHBondContact O-N 3.11Å; H371-C538 PolarHBondContact N-O 3.15Å; L385-C538 HydrophobicContact CD1-CB 3.94Å; V386-C538 CarbonylContact O-C 3.56Å; V386-C538 VanDerWaalsContact O-CA 3.28Å; V386-C538 WeakPolarHBondContact O-CA 3.2Å; V386-C538 WeakPolarHBondContact O-CB 3.48Å; Y387-C538 HydrophobicContact CD1-CB 4.11Å; G388-C538 CarbonylContact O-C 3.6Å; G388-C538 WeakPolarHBondContact O-CA 3.35Å
539	T	97.9	Very high	92.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.5	170.5	-58.7	0	0	0	0	110.1	H371 K373 V386 G388 T389 V390 L541	H371-T539 HydrophobicContact CB-CG2 4.3Å; H371-T539 CarbonylContact O-C 3.56Å; H371-T539 VanDerWaalsContact O-CA 3.31Å; H371-T539 WeakPolarHBondContact O-CA 3.18Å; H371-T539 WeakPolarHBondContact O-CG2 3.14Å; K373-T539 HydrophobicContact CB-CG2 4.4Å; V386-T539 PolarHBondContact N-O 2.92Å; V386-T539 PolarHBondContact O-N 3.02Å; G388-T539 PolarHBondContact O-N 3.2Å; G388-T539 PolarHBondContact O-OG1 3.1Å; G388-T539 VanDerWaalsContact O-OG1 3.05Å; T389-T539 WeakPolarHBondContact CA-OG1 3.34Å; V390-T539 HydrophobicContact CB-CG2 3.72Å; V390-T539 HydrophobicContact CG2-CG2 4.03Å; V390-T539 PolarHBondContact N-OG1 3.36Å; V390-T539 VanDerWaalsContact N-OG1 3.1Å; T539-L541 HydrophobicContact CG2-CD2 3.9Å
540	I	97.8	Very high	92.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.4	173.9	-51.1	-178.9	0	0	0	107.7	L345 V349 V370 H371 V372 K373 L385 L542 L557 I561	L345-I540 HydrophobicContact CD1-CG2 3.92Å; L345-I540 HydrophobicContact CD2-CG2 4.36Å; V349-I540 HydrophobicContact CG2-CD1 4.13Å; V370-I540 HydrophobicContact CG1-CD1 4.01Å; V370-I540 HydrophobicContact CG1-CG1 4.25Å; H371-I540 PolarHBondContact O-N 3.34Å; V372-I540 HydrophobicContact CG1-CB 4.48Å; V372-I540 HydrophobicContact CG2-CD1 4.27Å; K373-I540 PolarHBondContact N-O 3.47Å; L385-I540 HydrophobicContact CD1-CG1 3.95Å; I540-L542 HydrophobicContact CG2-CD2 3.78Å; I540-L542 HydrophobicContact CG2-CG 4.1Å; I540-L557 HydrophobicContact CD1-CD2 3.85Å; I540-L557 HydrophobicContact CD1-CG 4.41Å; I540-L557 HydrophobicContact CG2-CD2 4.2Å; I540-I561 HydrophobicContact CD1-CD1 3.98Å
541	L	96.3	Very high	91.7	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.2	170.4	-54.5	-175	0	0	0	109	K373 I375 A383 D384 V390 T539	K373-L541 HydrophobicContact CB-CD2 3.97Å; K373-L541 HydrophobicContact CD-CD2 3.75Å; K373-L541 HydrophobicContact CG-CD2 4.15Å; K373-L541 CarbonylContact O-C 3.52Å; K373-L541 WeakPolarHBondContact O-CA 3.42Å; I375-L541 HydrophobicContact CD1-CD1 4.48Å; I375-L541 HydrophobicContact CD1-CD2 3.99Å; A383-L541 CarbonylContact C-O 3.55Å; A383-L541 WeakPolarHBondContact CA-O 3.28Å; D384-L541 HydrophobicContact CB-CB 4.12Å; D384-L541 HydrophobicContact CB-CD1 4.48Å; D384-L541 PolarHBondContact N-O 3.37Å; D384-L541 PolarHBondContact O-N 3.02Å; V390-L541 HydrophobicContact CB-CD2 4.06Å; V390-L541 HydrophobicContact CG1-CD1 4.45Å; V390-L541 HydrophobicContact CG1-CD2 4.09Å; V390-L541 HydrophobicContact CG2-CD1 4.46Å; V390-L541 HydrophobicContact CG2-CD2 4.38Å; T539-L541 HydrophobicContact CG2-CD2 3.9Å
542	L	95.8	Very high	91.2	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.3	177.6	-63.1	178	0	0	0	111.3	L345 V372 K373 T374 I375 A383 I540 L550 V553 K554 L557	L345-L542 HydrophobicContact CD1-CD2 4.17Å; V372-L542 HydrophobicContact CG1-CD1 3.51Å; V372-L542 HydrophobicContact CG1-CG 4.05Å; K373-L542 PolarHBondContact O-N 3.14Å; T374-L542 CarbonylContact C-O 3.41Å; T374-L542 WeakPolarHBondContact CA-O 3.03Å; T374-L542 HydrophobicContact CG2-CB 4.28Å; I375-L542 PolarHBondContact N-O 3.07Å; A383-L542 HydrophobicContact CB-CD2 3.93Å; I540-L542 HydrophobicContact CG2-CD2 3.78Å; I540-L542 HydrophobicContact CG2-CG 4.1Å; L542-L550 HydrophobicContact CB-CD2 3.85Å; L542-V553 HydrophobicContact CD1-CG1 4Å; L542-K554 HydrophobicContact CD1-CB 4.18Å; L542-L557 HydrophobicContact CD1-CD2 4.15Å; L542-L557 HydrophobicContact CD2-CD2 4.27Å
543	S	94.5	Very high	91	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.014	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155.2	170.9	-173	0	0	0	0	110.9	W338 I375 R377 C378 P381 S382	W338-S543 VanDerWaalsContact CH2-O 3.29Å; W338-S543 WeakPolarHBondContact CH2-O 3.4Å; I375-S543 VanDerWaalsContact O-CA 3.28Å; I375-S543 WeakPolarHBondContact O-CA 3.49Å; I375-S543 WeakPolarHBondContact O-CB 3.39Å; I375-S543 PolarHBondContact O-OG 2.93Å; I375-S543 VanDerWaalsContact O-OG 3.09Å; R377-S543 WeakPolarHBondContact CG-OG 3.48Å; R377-S543 PolarHBondContact N-OG 2.81Å; R377-S543 VanDerWaalsContact N-OG 3.09Å; C378-S543 PolarHBondContact N-OG 3.35Å; C378-S543 PolarHBondContact O-OG 3.11Å; C378-S543 PolarHBondContact SG-OG 3.04Å; P381-S543 WeakPolarHBondContact CA-O 3.23Å; S382-S543 PolarHBondContact N-O 3.38Å; S382-S543 PolarHBondContact O-N 3.35Å
544	G	91.1	Very high	90.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.11	C	C	.	.			trans	169.3	178.2	-174	0	0	0	0	0	112.3	C378	C378-G544 CarbonylContact O-C 3.49Å; C378-G544 PolarHBondContact O-N 3.42Å
545	P	85.4	Confident	90.6	Very high	33 Å²	33	22.8 Å²	22.8	21%	0.214	10%	0.103	C	C	.	.	S	Bend	trans	-69.4	-53.7	-156.3	23.1	-32.1	0	0	0	113.1	R376 L379	R376-P545 VanDerWaalsContact CZ-O 3.3Å; R376-P545 PolarHBondContact NE-O 3.14Å; R376-P545 PolarHBondContact NH2-O 3.03Å; L379-P545 WeakPolarHBondContact O-CA 3.5Å; L379-P545 WeakPolarHBondContact O-CB 3.3Å; L379-P545 WeakPolarHBondContact O-CD 3.44Å; L379-P545 VanDerWaalsContact O-N 3.17Å
546	C	84.1	Confident	90.5	Very high	4 Å²	4	19.4 Å²	19.4	3%	0.027	9%	0.087	C	C	.	.	S	Bend	trans	-126	154.2	-176.4	53.2	0	0	0	0	113.4	W548 Q549 L550 D645 C646	C546-W548 PolarHBondContact O-N 3.1Å; C546-Q549 PolarHBondContact O-N 2.92Å; C546-L550 PolarHBondContact O-N 3.16Å; C546-D645 HydrophobicContact CB-CB 3.36Å; C546-C646 HydrophobicContact CB-CB 4.09Å; C546-C646 WeakPolarHBondContact CB-SG 3.45Å; C546-C646 WeakPolarHBondContact SG-CB 3.27Å; C546-C646 CovalentContact SG-SG 2.05Å; C546-C646 PolarHBondContact SG-SG 3.48Å
547	K	81.9	Confident	90.6	Very high	121 Å²	121	19.4 Å²	19.4	53%	0.526	9%	0.087	S	C	.	.	H	α-helix	trans	-57.5	-34.4	-173.4	-68	-179.9	-166.6	95.8	0	113	Y551 D645	K547-Y551 PolarHBondContact O-N 3.33Å; K547-Y551 VanDerWaalsContact O-N 3.12Å; K547-D645 WeakPolarHBondContact CD-OD2 3.43Å; K547-D645 WeakPolarHBondContact CE-OD2 3.34Å; K547-D645 VanDerWaalsContact CG-OD2 3.23Å; K547-D645 WeakPolarHBondContact CG-OD2 3.34Å; K547-D645 IonicContact NZ-OD1 3.17Å; K547-D645 IonicContact NZ-OD2 2.8Å; K547-D645 PolarHBondContact NZ-OD2 2.94Å
548	W	80.8	Confident	90.5	Very high	27 Å²	27	22 Å²	22	10%	0.102	10%	0.098	C	C	.	.	H	α-helix	trans	-68.8	-47.9	-179.6	164	73.1	0	0	0	113.6	E331 D332 V333 C546 L550 Y551 V552 W639 A640 C643	E331-W548 WeakPolarHBondContact O-CH2 3.15Å; E331-W548 WeakPolarHBondContact O-CZ2 3.42Å; D332-W548 HydrophobicContact CB-CH2 4.12Å; D332-W548 WeakPolarHBondContact O-CH2 3.41Å; V333-W548 HydrophobicContact CG2-CH2 4.19Å; V333-W548 HydrophobicContact CG2-CZ2 4.49Å; C546-W548 PolarHBondContact O-N 3.1Å; W548-L550 VanDerWaalsContact C-N 3.25Å; W548-L550 PolarHBondContact O-N 3.31Å; W548-Y551 WeakPolarHBondContact O-CA 3.4Å; W548-Y551 VanDerWaalsContact O-CB 3.3Å; W548-Y551 WeakPolarHBondContact O-CB 3.33Å; W548-Y551 PolarHBondContact O-N 3.32Å; W548-V552 HydrophobicContact CZ2-CG2 4.37Å; W548-V552 PolarHBondContact O-N 3.11Å; W548-W639 HydrophobicContact CZ2-CB 4.06Å; W548-A640 HydrophobicContact CE3-CB 4.13Å; W548-A640 HydrophobicContact CH2-CB 3.88Å; W548-A640 HydrophobicContact CZ2-CB 4.38Å; W548-A640 HydrophobicContact CZ3-CB 3.76Å; W548-C643 HydrophobicContact CB-CB 3.56Å; W548-C643 WeakPolarHBondContact CB-SG 3.18Å; W548-C643 HydrophobicContact CG-CB 4.24Å
549	Q	87.6	Confident	90.1	Very high	21 Å²	21	22.5 Å²	22.5	10%	0.098	10%	0.101	C	C	.	.	H	α-helix	trans	-56.3	-44.6	174.4	-73.9	-171.8	8.7	0	0	110.6	V333 P334 C546 Y551 V552 V553	V333-Q549 HydrophobicContact CG1-CG 4.43Å; P334-Q549 VanDerWaalsContact CD-NE2 3.26Å; C546-Q549 PolarHBondContact O-N 2.92Å; Q549-Y551 PolarHBondContact O-N 3.41Å; Q549-V552 PolarHBondContact O-N 3.1Å; Q549-V553 VanDerWaalsContact O-CB 3.26Å; Q549-V553 WeakPolarHBondContact O-CB 3.18Å; Q549-V553 WeakPolarHBondContact O-CG2 3.45Å; Q549-V553 PolarHBondContact O-N 2.83Å
550	L	90	Very high	89.9	Confident	4 Å²	4	22.5 Å²	22.5	2%	0.021	10%	0.101	C	C	.	.	H	α-helix	trans	-63.9	-22.6	177	-75.1	172.7	0	0	0	114.3	W338 T374 R376 L542 C546 W548 K554	W338-L550 HydrophobicContact CH2-CD2 3.84Å; W338-L550 HydrophobicContact CZ2-CD2 4.28Å; T374-L550 HydrophobicContact CG2-CB 3.9Å; T374-L550 HydrophobicContact CG2-CD2 4.33Å; T374-L550 WeakPolarHBondContact CG2-O 3.36Å; R376-L550 HydrophobicContact CG-CD1 3.45Å; R376-L550 VanDerWaalsContact CG-CD1 3.45Å; L542-L550 HydrophobicContact CB-CD2 3.85Å; C546-L550 PolarHBondContact O-N 3.16Å; W548-L550 VanDerWaalsContact C-N 3.25Å; W548-L550 PolarHBondContact O-N 3.31Å; L550-K554 WeakPolarHBondContact O-CB 3.28Å; L550-K554 PolarHBondContact O-N 3.24Å
551	Y	85.1	Confident	89.7	Confident	79 Å²	79	22.5 Å²	22.5	31%	0.31	10%	0.101	S	C	.	.	H	α-helix	trans	-76.4	-50.9	171.7	173.5	-90.8	0	0	0	111	K547 W548 Q549 K554 K555 E716	K547-Y551 PolarHBondContact O-N 3.33Å; K547-Y551 VanDerWaalsContact O-N 3.12Å; W548-Y551 WeakPolarHBondContact O-CA 3.4Å; W548-Y551 VanDerWaalsContact O-CB 3.3Å; W548-Y551 WeakPolarHBondContact O-CB 3.33Å; W548-Y551 PolarHBondContact O-N 3.32Å; Q549-Y551 PolarHBondContact O-N 3.41Å; Y551-K554 PolarHBondContact O-N 2.99Å; Y551-K555 PolarHBondContact O-N 3.48Å; Y551-K555 VanDerWaalsContact O-N 3.12Å; Y551-E716 PolarHBondContact OH-OE1 2.92Å; Y551-E716 PolarHBondContact OH-OE2 3.11Å; Y551-E716 VanDerWaalsContact OH-OE2 3.05Å
552	V	84.7	Confident	89.5	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-62.1	-51.5	179.2	174.7	0	0	0	0	111.1	E331 V333 W548 Q549 K554 K555 I556	E331-V552 HydrophobicContact CB-CG1 3.63Å; E331-V552 HydrophobicContact CG-CG1 3.95Å; V333-V552 HydrophobicContact CG2-CB 4.06Å; V333-V552 HydrophobicContact CG2-CG1 3.67Å; W548-V552 HydrophobicContact CZ2-CG2 4.37Å; W548-V552 PolarHBondContact O-N 3.11Å; Q549-V552 PolarHBondContact O-N 3.1Å; V552-K554 VanDerWaalsContact C-N 3.31Å; V552-K554 PolarHBondContact O-N 2.87Å; V552-K555 WeakPolarHBondContact O-CA 3.38Å; V552-K555 WeakPolarHBondContact O-CB 3.5Å; V552-K555 PolarHBondContact O-N 3.22Å; V552-I556 HydrophobicContact CG1-CD1 3.6Å; V552-I556 HydrophobicContact CG1-CG1 4.21Å; V552-I556 WeakPolarHBondContact O-CG1 3.45Å; V552-I556 PolarHBondContact O-N 2.78Å
553	V	92.3	Very high	89.3	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-55	-45.6	177.2	168.7	0	0	0	0	111.2	V333 W338 I342 L542 Q549 K555 I556 L557	V333-V553 HydrophobicContact CG1-CG2 4.25Å; W338-V553 HydrophobicContact CD2-CG1 4.32Å; W338-V553 HydrophobicContact CD2-CG2 3.6Å; W338-V553 HydrophobicContact CE3-CB 4.42Å; W338-V553 HydrophobicContact CE3-CG1 3.69Å; W338-V553 HydrophobicContact CE3-CG2 3.87Å; W338-V553 HydrophobicContact CG-CG2 4.03Å; W338-V553 HydrophobicContact CH2-CG1 4.15Å; W338-V553 HydrophobicContact CH2-CG2 4.29Å; W338-V553 HydrophobicContact CZ2-CG2 4.03Å; W338-V553 HydrophobicContact CZ3-CB 4.44Å; W338-V553 HydrophobicContact CZ3-CG1 3.63Å; W338-V553 HydrophobicContact CZ3-CG2 4.23Å; I342-V553 HydrophobicContact CD1-CB 4.45Å; I342-V553 HydrophobicContact CD1-CG1 3.95Å; I342-V553 HydrophobicContact CD1-CG2 4.27Å; I342-V553 HydrophobicContact CG1-CG1 3.9Å; L542-V553 HydrophobicContact CD1-CG1 4Å; Q549-V553 VanDerWaalsContact O-CB 3.26Å; Q549-V553 WeakPolarHBondContact O-CB 3.18Å; Q549-V553 WeakPolarHBondContact O-CG2 3.45Å; Q549-V553 PolarHBondContact O-N 2.83Å; V553-K555 VanDerWaalsContact C-N 3.26Å; V553-K555 PolarHBondContact O-N 2.95Å; V553-I556 PolarHBondContact O-N 3.23Å; V553-L557 WeakPolarHBondContact O-CB 3.45Å; V553-L557 PolarHBondContact O-N 3.17Å
554	K	92.9	Very high	89.3	Confident	69 Å²	69	23 Å²	23	30%	0.3	11%	0.105	S	C	.	.	H	α-helix	trans	-62.4	-32	177.7	166.2	166.7	169.2	166.6	0	113.1	V372 T374 L542 L550 Y551 V552 K558	V372-K554 HydrophobicContact CB-CD 4.2Å; V372-K554 HydrophobicContact CB-CG 4.04Å; V372-K554 HydrophobicContact CG1-CB 4.06Å; V372-K554 HydrophobicContact CG1-CD 3.95Å; V372-K554 HydrophobicContact CG1-CG 3.71Å; V372-K554 WeakPolarHBondContact O-CE 3.29Å; V372-K554 PolarHBondContact O-NZ 3.16Å; T374-K554 HydrophobicContact CG2-CB 4.41Å; T374-K554 HydrophobicContact CG2-CD 4.02Å; L542-K554 HydrophobicContact CD1-CB 4.18Å; L550-K554 WeakPolarHBondContact O-CB 3.28Å; L550-K554 PolarHBondContact O-N 3.24Å; Y551-K554 PolarHBondContact O-N 2.99Å; V552-K554 VanDerWaalsContact C-N 3.31Å; V552-K554 PolarHBondContact O-N 2.87Å; K554-K558 WeakPolarHBondContact O-CB 3.36Å; K554-K558 PolarHBondContact O-N 3.4Å
555	K	87.1	Confident	89.4	Confident	38 Å²	38	23 Å²	23	17%	0.165	11%	0.105	C	C	.	.	H	α-helix	trans	-76.1	-48.6	177.6	-179.7	-174.2	175.4	-174.5	0	111.1	E331 Y551 V552 V553 K558 H559 E716 F728	E331-K555 IonicContact OE1-NZ 3.48Å; Y551-K555 PolarHBondContact O-N 3.48Å; Y551-K555 VanDerWaalsContact O-N 3.12Å; V552-K555 WeakPolarHBondContact O-CA 3.38Å; V552-K555 WeakPolarHBondContact O-CB 3.5Å; V552-K555 PolarHBondContact O-N 3.22Å; V553-K555 VanDerWaalsContact C-N 3.26Å; V553-K555 PolarHBondContact O-N 2.95Å; K555-K558 PolarHBondContact O-N 2.92Å; K555-H559 PolarHBondContact O-N 3.37Å; K555-E716 WeakPolarHBondContact CE-OE1 3.39Å; K555-E716 IonicContact NZ-OE1 3.95Å; K555-E716 PolarHBondContact NZ-OE1 2.59Å; K555-F728 HydrophobicContact CD-CE2 4.01Å; K555-F728 HydrophobicContact CD-CZ 4.03Å; K555-F728 HydrophobicContact CG-CE1 4Å; K555-F728 HydrophobicContact CG-CE2 4.3Å; K555-F728 HydrophobicContact CG-CZ 3.84Å
556	I	90.7	Very high	89.8	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-59.1	-47.9	174.8	-64.8	172.8	0	0	0	110.9	L324 L327 L328 I342 V552 V553 K558 H559 L560 F728	L324-I556 HydrophobicContact CD1-CG2 3.5Å; L327-I556 HydrophobicContact CB-CD1 3.93Å; L327-I556 HydrophobicContact CB-CG1 4.24Å; L327-I556 HydrophobicContact CD1-CG1 4.41Å; L327-I556 HydrophobicContact CD1-CG2 4.22Å; L328-I556 HydrophobicContact CD2-CD1 3.99Å; I342-I556 HydrophobicContact CD1-CG2 4.45Å; I342-I556 HydrophobicContact CG2-CG2 4.21Å; V552-I556 HydrophobicContact CG1-CD1 3.6Å; V552-I556 HydrophobicContact CG1-CG1 4.21Å; V552-I556 WeakPolarHBondContact O-CG1 3.45Å; V552-I556 PolarHBondContact O-N 2.78Å; V553-I556 PolarHBondContact O-N 3.23Å; I556-K558 VanDerWaalsContact C-N 3.34Å; I556-K558 PolarHBondContact O-N 3.37Å; I556-H559 WeakPolarHBondContact O-CB 3.42Å; I556-H559 PolarHBondContact O-N 2.86Å; I556-H559 VanDerWaalsContact O-N 3.1Å; I556-L560 HydrophobicContact CG2-CD1 3.77Å; I556-L560 PolarHBondContact O-N 2.8Å; I556-F728 HydrophobicContact CG1-CZ 4.03Å
557	L	94.8	Very high	90.1	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-41.6	177.6	177.7	59.3	0	0	0	112.2	I342 L345 A346 V372 I540 L542 V553 L560 I561	I342-L557 HydrophobicContact CG2-CB 4.31Å; I342-L557 HydrophobicContact CG2-CD1 4.22Å; I342-L557 WeakPolarHBondContact O-CD1 3.43Å; L345-L557 HydrophobicContact CB-CD1 3.83Å; L345-L557 HydrophobicContact CD1-CD2 4.22Å; A346-L557 HydrophobicContact CB-CD1 4.01Å; V372-L557 HydrophobicContact CG1-CD2 4.33Å; I540-L557 HydrophobicContact CD1-CD2 3.85Å; I540-L557 HydrophobicContact CD1-CG 4.41Å; I540-L557 HydrophobicContact CG2-CD2 4.2Å; L542-L557 HydrophobicContact CD1-CD2 4.15Å; L542-L557 HydrophobicContact CD2-CD2 4.27Å; V553-L557 WeakPolarHBondContact O-CB 3.45Å; V553-L557 PolarHBondContact O-N 3.17Å; L557-L560 PolarHBondContact O-N 3.46Å; L557-I561 HydrophobicContact CD1-CD1 3.91Å; L557-I561 HydrophobicContact CD1-CG1 4.2Å; L557-I561 HydrophobicContact CG-CD1 3.95Å; L557-I561 WeakPolarHBondContact O-CB 3.39Å; L557-I561 WeakPolarHBondContact O-CD1 3.4Å; L557-I561 VanDerWaalsContact O-CG1 3.23Å; L557-I561 WeakPolarHBondContact O-CG1 3.38Å; L557-I561 PolarHBondContact O-N 2.82Å
558	K	92.3	Very high	90.7	Very high	54 Å²	54	17.3 Å²	17.3	24%	0.235	8%	0.075	C	C	.	.	H	α-helix	trans	-65.8	-36.7	174.2	-87.2	-170.4	161.3	-75.6	0	112.8	L367 V370 V372 K554 K555 I556 A562	L367-K558 HydrophobicContact CD1-CB 4.25Å; L367-K558 HydrophobicContact CD2-CB 4.29Å; L367-K558 HydrophobicContact CD2-CG 4.23Å; L367-K558 VanDerWaalsContact CD2-O 3.32Å; L367-K558 WeakPolarHBondContact CD2-O 3.29Å; L367-K558 PolarHBondContact O-NZ 2.99Å; V370-K558 PolarHBondContact O-NZ 3.38Å; V372-K558 HydrophobicContact CG2-CG 4Å; K554-K558 WeakPolarHBondContact O-CB 3.36Å; K554-K558 PolarHBondContact O-N 3.4Å; K555-K558 PolarHBondContact O-N 2.92Å; I556-K558 VanDerWaalsContact C-N 3.34Å; I556-K558 PolarHBondContact O-N 3.37Å; K558-A562 PolarHBondContact O-N 3.1Å
559	H	89.3	Confident	91.3	Very high	14 Å²	14	16 Å²	16	7%	0.065	7%	0.071	C	C	.	.	H	α-helix	trans	-62.7	-52.4	173.9	-177.1	93	0	0	0	110.7	Q323 K555 I556 I561 A562 S563 P727 F728	Q323-H559 PolarHBondContact NE2-NE2 2.87Å; K555-H559 PolarHBondContact O-N 3.37Å; I556-H559 WeakPolarHBondContact O-CB 3.42Å; I556-H559 PolarHBondContact O-N 2.86Å; I556-H559 VanDerWaalsContact O-N 3.1Å; H559-I561 PolarHBondContact O-N 3.35Å; H559-A562 WeakPolarHBondContact O-CB 3.37Å; H559-A562 PolarHBondContact O-N 2.89Å; H559-A562 VanDerWaalsContact O-N 3.07Å; H559-S563 PolarHBondContact CD2-OG 2.93Å; H559-S563 PolarHBondContact NE2-OG 3.12Å; H559-S563 VanDerWaalsContact NE2-OG 3.16Å; H559-S563 PolarHBondContact O-N 3.5Å; H559-S563 PolarHBondContact O-OG 3.44Å; H559-S563 VanDerWaalsContact O-OG 3.11Å; H559-P727 PolarHBondContact CE1-O 3.36Å; H559-F728 HydrophobicContact CB-CD1 3.98Å; H559-F728 HydrophobicContact CB-CE1 3.71Å; H559-F728 AromaticContact CG-CD1 3.93Å; H559-F728 AromaticContact ND1-CD1 3.58Å
560	L	92.7	Very high	91.6	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.4	-37.3	-177.6	-71.1	163.6	0	0	0	113.4	L320 L324 I342 A346 I556 L557 A562 S563 I564	L320-L560 HydrophobicContact CB-CD2 4.06Å; L320-L560 HydrophobicContact CD2-CD2 4.11Å; L324-L560 HydrophobicContact CB-CD1 3.92Å; L324-L560 HydrophobicContact CD1-CD1 3.83Å; L324-L560 HydrophobicContact CD2-CD1 4.05Å; L324-L560 HydrophobicContact CG-CD1 4.15Å; I342-L560 HydrophobicContact CG2-CD1 3.52Å; A346-L560 HydrophobicContact CB-CB 3.72Å; I556-L560 HydrophobicContact CG2-CD1 3.77Å; I556-L560 PolarHBondContact O-N 2.8Å; L557-L560 PolarHBondContact O-N 3.46Å; L560-A562 VanDerWaalsContact C-N 3.28Å; L560-A562 PolarHBondContact O-N 3.47Å; L560-S563 PolarHBondContact O-N 3.48Å; L560-I564 WeakPolarHBondContact O-CB 3.26Å; L560-I564 VanDerWaalsContact O-CG1 3.3Å; L560-I564 WeakPolarHBondContact O-CG1 3.35Å; L560-I564 PolarHBondContact O-N 3.04Å
561	I	94.8	Very high	91.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.4	-42.2	172.4	-71	165.8	0	0	0	111	A346 V349 I366 L367 V370 I540 L557 H559 Y565	A346-I561 HydrophobicContact CB-CG1 4.07Å; V349-I561 HydrophobicContact CB-CD1 4.38Å; V349-I561 HydrophobicContact CB-CG1 4.46Å; V349-I561 HydrophobicContact CG1-CD1 4.14Å; V349-I561 HydrophobicContact CG1-CG1 4.42Å; V349-I561 HydrophobicContact CG1-CG2 4.15Å; I366-I561 HydrophobicContact CD1-CG2 4.02Å; I366-I561 HydrophobicContact CG1-CG2 4.12Å; I366-I561 HydrophobicContact CG2-CG2 4Å; L367-I561 HydrophobicContact CD2-CB 4.04Å; L367-I561 HydrophobicContact CD2-CG2 3.8Å; V370-I561 HydrophobicContact CG1-CD1 4.09Å; V370-I561 HydrophobicContact CG2-CG2 4.37Å; I540-I561 HydrophobicContact CD1-CD1 3.98Å; L557-I561 HydrophobicContact CD1-CD1 3.91Å; L557-I561 HydrophobicContact CD1-CG1 4.2Å; L557-I561 HydrophobicContact CG-CD1 3.95Å; L557-I561 WeakPolarHBondContact O-CB 3.39Å; L557-I561 WeakPolarHBondContact O-CD1 3.4Å; L557-I561 VanDerWaalsContact O-CG1 3.23Å; L557-I561 WeakPolarHBondContact O-CG1 3.38Å; L557-I561 PolarHBondContact O-N 2.82Å; H559-I561 PolarHBondContact O-N 3.35Å; I561-Y565 WeakPolarHBondContact O-CB 3.49Å; I561-Y565 PolarHBondContact O-N 3Å; I561-Y565 VanDerWaalsContact O-N 3.11Å
562	A	91.8	Very high	91.9	Very high	15 Å²	15	14 Å²	14	12%	0.124	7%	0.065	C	C	.	.	H	α-helix	trans	-70.8	-40.1	176.9	0	0	0	0	0	112.3	L367 K558 H559 L560 Y565 S566	L367-A562 HydrophobicContact CD1-CB 4.13Å; L367-A562 HydrophobicContact CD2-CB 4.45Å; L367-A562 HydrophobicContact CG-CB 4.24Å; K558-A562 PolarHBondContact O-N 3.1Å; H559-A562 WeakPolarHBondContact O-CB 3.37Å; H559-A562 PolarHBondContact O-N 2.89Å; H559-A562 VanDerWaalsContact O-N 3.07Å; L560-A562 VanDerWaalsContact C-N 3.28Å; L560-A562 PolarHBondContact O-N 3.47Å; A562-Y565 PolarHBondContact O-N 3.44Å; A562-S566 PolarHBondContact O-N 3.17Å
563	S	91.2	Very high	92.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-67.7	-43.3	178.7	-55.6	0	0	0	0	113.1	H559 L560 Y565 S566 A567 F622	H559-S563 PolarHBondContact CD2-OG 2.93Å; H559-S563 PolarHBondContact NE2-OG 3.12Å; H559-S563 VanDerWaalsContact NE2-OG 3.16Å; H559-S563 PolarHBondContact O-N 3.5Å; H559-S563 PolarHBondContact O-OG 3.44Å; H559-S563 VanDerWaalsContact O-OG 3.11Å; L560-S563 PolarHBondContact O-N 3.48Å; S563-Y565 VanDerWaalsContact C-N 3.34Å; S563-S566 PolarHBondContact O-N 2.93Å; S563-A567 VanDerWaalsContact O-CB 3.22Å; S563-A567 WeakPolarHBondContact O-CB 3.41Å; S563-A567 PolarHBondContact O-N 3.26Å; S563-F622 WeakPolarHBondContact OG-CD1 3.41Å
564	I	94.2	Very high	92.2	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-68.7	-36.1	176.4	-61.4	172.9	0	0	0	110.4	M313 L317 L320 M343 A346 E347 A350 F351 L560 R568	M313-I564 HydrophobicContact CE-CG2 3.82Å; L317-I564 HydrophobicContact CD2-CD1 3.92Å; L317-I564 HydrophobicContact CD2-CG1 3.98Å; L317-I564 HydrophobicContact CD2-CG2 3.92Å; L320-I564 HydrophobicContact CD1-CG1 3.68Å; M343-I564 HydrophobicContact CE-CD1 4.12Å; M343-I564 HydrophobicContact SD-CD1 4.41Å; A346-I564 HydrophobicContact CB-CD1 3.77Å; E347-I564 HydrophobicContact CB-CD1 4.22Å; A350-I564 HydrophobicContact CB-CB 3.74Å; A350-I564 HydrophobicContact CB-CG2 3.57Å; F351-I564 HydrophobicContact CD2-CG2 4.46Å; F351-I564 HydrophobicContact CE2-CG2 4.14Å; L560-I564 WeakPolarHBondContact O-CB 3.26Å; L560-I564 VanDerWaalsContact O-CG1 3.3Å; L560-I564 WeakPolarHBondContact O-CG1 3.35Å; L560-I564 PolarHBondContact O-N 3.04Å; I564-R568 PolarHBondContact O-N 2.84Å
565	Y	94.4	Very high	92.1	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.008	7%	0.067	C	C	.	.	H	α-helix	trans	-61.9	-49.1	172.4	176.4	-102	0	0	0	111.7	P355 I366 I561 A562 S563 R568 L569 Y762 Q855	P355-Y565 HydrophobicContact CG-CE2 4.18Å; P355-Y565 WeakPolarHBondContact CG-OH 3.11Å; I366-Y565 HydrophobicContact CB-CD1 4.16Å; I366-Y565 HydrophobicContact CB-CD2 4.08Å; I366-Y565 HydrophobicContact CB-CE1 4.46Å; I366-Y565 HydrophobicContact CB-CE2 4.39Å; I366-Y565 HydrophobicContact CB-CG 3.96Å; I366-Y565 HydrophobicContact CD1-CD2 3.63Å; I366-Y565 HydrophobicContact CD1-CE2 4.37Å; I366-Y565 HydrophobicContact CD1-CG 3.98Å; I366-Y565 HydrophobicContact CG1-CD2 4.4Å; I366-Y565 HydrophobicContact CG2-CD1 3.88Å; I366-Y565 HydrophobicContact CG2-CD2 4.38Å; I366-Y565 HydrophobicContact CG2-CG 3.77Å; I561-Y565 WeakPolarHBondContact O-CB 3.49Å; I561-Y565 PolarHBondContact O-N 3Å; I561-Y565 VanDerWaalsContact O-N 3.11Å; A562-Y565 PolarHBondContact O-N 3.44Å; S563-Y565 VanDerWaalsContact C-N 3.34Å; Y565-R568 WeakPolarHBondContact O-CB 3.26Å; Y565-R568 PolarHBondContact O-N 3.11Å; Y565-L569 HydrophobicContact CD1-CD1 4.43Å; Y565-L569 HydrophobicContact CE1-CD1 3.77Å; Y565-L569 WeakPolarHBondContact O-CG 3.38Å; Y565-L569 PolarHBondContact O-N 2.93Å; Y565-Y762 HydrophobicContact CD1-CD1 4.45Å; Y565-Y762 HydrophobicContact CD1-CE1 4.33Å; Y565-Y762 AromaticContact CE1-CD1 3.98Å; Y565-Y762 HydrophobicContact CE1-CD1 3.98Å; Y565-Y762 AromaticContact CE1-CE1 3.87Å; Y565-Y762 HydrophobicContact CE1-CE1 3.87Å; Y565-Q855 PolarHBondContact OH-OE1 3.03Å; Y565-Q855 VanDerWaalsContact OH-OE1 3.14Å
566	S	92.7	Very high	92.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.5	-47.9	175.8	-166.8	0	0	0	0	111.5	A562 S563 R568 L569 E570 Y762	A562-S566 PolarHBondContact O-N 3.17Å; S563-S566 PolarHBondContact O-N 2.93Å; S566-R568 VanDerWaalsContact C-N 3.25Å; S566-R568 PolarHBondContact O-N 3.15Å; S566-L569 CarbonylContact O-C 3.54Å; S566-L569 PolarHBondContact O-N 3.01Å; S566-E570 VanDerWaalsContact C-OE1 3.28Å; S566-E570 WeakPolarHBondContact CB-OE1 3.4Å; S566-E570 WeakPolarHBondContact O-CG 3.28Å; S566-E570 PolarHBondContact O-N 2.9Å; S566-E570 PolarHBondContact OG-OE1 2.83Å; S566-Y762 VanDerWaalsContact OG-CE2 3.25Å; S566-Y762 WeakPolarHBondContact OG-CE2 3.46Å; S566-Y762 PolarHBondContact OG-OH 2.91Å; S566-Y762 VanDerWaalsContact OG-OH 3.12Å
567	A	91.7	Very high	92.3	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-53	-40.4	176.7	0	0	0	0	0	112.8	M313 F316 S563 E570 V571 I623	M313-A567 HydrophobicContact CE-CB 4.01Å; M313-A567 HydrophobicContact SD-CB 4.16Å; F316-A567 HydrophobicContact CB-CB 4.21Å; F316-A567 HydrophobicContact CD2-CB 3.78Å; F316-A567 HydrophobicContact CG-CB 4.39Å; S563-A567 VanDerWaalsContact O-CB 3.22Å; S563-A567 WeakPolarHBondContact O-CB 3.41Å; S563-A567 PolarHBondContact O-N 3.26Å; A567-E570 PolarHBondContact O-N 2.57Å; A567-V571 WeakPolarHBondContact O-CB 3.23Å; A567-V571 VanDerWaalsContact O-CG2 3.29Å; A567-V571 WeakPolarHBondContact O-CG2 3.48Å; A567-V571 PolarHBondContact O-N 3.32Å; A567-I623 HydrophobicContact CB-CD1 4.26Å
568	R	93.1	Very high	92	Very high	37 Å²	37	13.3 Å²	13.3	14%	0.14	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-41.2	174.7	-176.9	179.6	66.7	172.2	-8.4	112.6	M313 A350 F351 V353 I564 Y565 S566 E572	M313-R568 HydrophobicContact CE-CB 4.38Å; A350-R568 PolarHBondContact O-NH1 3.18Å; A350-R568 PolarHBondContact O-NH2 2.75Å; F351-R568 HydrophobicContact CE1-CG 4.29Å; F351-R568 PolarHBondContact O-NH1 2.88Å; V353-R568 PolarHBondContact O-NH2 3.25Å; I564-R568 PolarHBondContact O-N 2.84Å; Y565-R568 WeakPolarHBondContact O-CB 3.26Å; Y565-R568 PolarHBondContact O-N 3.11Å; S566-R568 VanDerWaalsContact C-N 3.25Å; S566-R568 PolarHBondContact O-N 3.15Å; R568-E572 PolarHBondContact O-N 3.17Å
569	L	94.4	Very high	91.7	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-73.8	-33.3	178	-53.8	-170.7	0	0	0	112.1	Y565 S566 E572 M573 Y762 Q852 Q855 L856	Y565-L569 HydrophobicContact CD1-CD1 4.43Å; Y565-L569 HydrophobicContact CE1-CD1 3.77Å; Y565-L569 WeakPolarHBondContact O-CG 3.38Å; Y565-L569 PolarHBondContact O-N 2.93Å; S566-L569 CarbonylContact O-C 3.54Å; S566-L569 PolarHBondContact O-N 3.01Å; L569-E572 PolarHBondContact O-N 2.91Å; L569-M573 PolarHBondContact O-N 3.48Å; L569-Y762 HydrophobicContact CD1-CE1 4.01Å; L569-Q852 HydrophobicContact CD2-CB 3.8Å; L569-Q852 HydrophobicContact CD2-CG 4.34Å; L569-Q855 HydrophobicContact CD1-CB 4.07Å; L569-L856 HydrophobicContact CB-CB 4.4Å; L569-L856 HydrophobicContact CB-CD1 3.67Å
570	E	92.5	Very high	91.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-64.8	-42.2	173.4	-70.4	165.5	-124.9	0	0	111	F316 S566 A567 M573 L574 S620 L856 T860 Y864	F316-E570 HydrophobicContact CE2-CB 4.36Å; S566-E570 VanDerWaalsContact C-OE1 3.28Å; S566-E570 WeakPolarHBondContact CB-OE1 3.4Å; S566-E570 WeakPolarHBondContact O-CG 3.28Å; S566-E570 PolarHBondContact O-N 2.9Å; S566-E570 PolarHBondContact OG-OE1 2.83Å; A567-E570 PolarHBondContact O-N 2.57Å; E570-M573 WeakPolarHBondContact O-CB 3.48Å; E570-M573 PolarHBondContact O-N 3.16Å; E570-L574 WeakPolarHBondContact O-CG 3.16Å; E570-L574 PolarHBondContact O-N 3.49Å; E570-L574 VanDerWaalsContact O-N 3.08Å; E570-S620 WeakPolarHBondContact OE2-CB 3.2Å; E570-S620 PolarHBondContact OE2-OG 3.34Å; E570-L856 HydrophobicContact CG-CD1 4.02Å; E570-T860 HydrophobicContact CG-CG2 3.74Å; E570-Y864 HydrophobicContact CB-CE2 4.36Å; E570-Y864 HydrophobicContact CG-CE2 3.9Å; E570-Y864 WeakPolarHBondContact OE2-CE2 3.14Å; E570-Y864 PolarHBondContact OE2-OH 2.81Å
571	V	91	Very high	90.1	Very high	13 Å²	13	13.3 Å²	13.3	8%	0.079	7%	0.074	C	C	.	.	H	α-helix	trans	-63.5	-39.7	174.1	166.9	0	0	0	0	112.1	V309 T312 M313 F316 A567 L574 D575	V309-V571 HydrophobicContact CB-CG1 4.42Å; V309-V571 HydrophobicContact CG1-CG1 3.43Å; V309-V571 VanDerWaalsContact CG1-CG1 3.43Å; T312-V571 HydrophobicContact CG2-CG2 3.78Å; M313-V571 HydrophobicContact CB-CG2 4.13Å; M313-V571 HydrophobicContact SD-CG2 3.99Å; F316-V571 HydrophobicContact CD2-CG2 3.98Å; F316-V571 HydrophobicContact CE2-CG2 4.02Å; A567-V571 WeakPolarHBondContact O-CB 3.23Å; A567-V571 VanDerWaalsContact O-CG2 3.29Å; A567-V571 WeakPolarHBondContact O-CG2 3.48Å; A567-V571 PolarHBondContact O-N 3.32Å; V571-L574 PolarHBondContact O-N 2.96Å; V571-D575 PolarHBondContact O-N 3.14Å
572	E	92.3	Very high	88.7	Confident	48 Å²	48	14.9 Å²	14.9	22%	0.224	8%	0.083	C	C	.	.	H	α-helix	trans	-64.4	-41.5	174.7	-175.7	101.3	-175.5	0	0	112.5	R568 L569 L574 D575 S576 T850 Q852 F853	R568-E572 PolarHBondContact O-N 3.17Å; L569-E572 PolarHBondContact O-N 2.91Å; E572-L574 VanDerWaalsContact C-N 3.29Å; E572-L574 PolarHBondContact O-N 3.46Å; E572-D575 PolarHBondContact O-N 3.02Å; E572-S576 WeakPolarHBondContact O-CB 3.3Å; E572-S576 PolarHBondContact O-N 3.47Å; E572-S576 PolarHBondContact O-OG 2.84Å; E572-T850 WeakPolarHBondContact CG-OG1 3.33Å; E572-T850 WeakPolarHBondContact OE1-CB 3.42Å; E572-T850 VanDerWaalsContact OE1-CG2 3.26Å; E572-T850 WeakPolarHBondContact OE1-CG2 3.32Å; E572-T850 PolarHBondContact OE1-OG1 3.37Å; E572-Q852 HydrophobicContact CB-CB 4.13Å; E572-Q852 HydrophobicContact CG-CB 3.67Å; E572-Q852 PolarHBondContact OE1-NE2 2.76Å; E572-Q852 PolarHBondContact OE2-NE2 2.68Å; E572-F853 HydrophobicContact CG-CB 4.3Å
573	M	93.3	Very high	87	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.5	-44.3	172.8	168.8	-167.3	74.9	0	0	110.8	L569 E570 D575 S576 L577 F853 L856 F861 Y864	L569-M573 PolarHBondContact O-N 3.48Å; E570-M573 WeakPolarHBondContact O-CB 3.48Å; E570-M573 PolarHBondContact O-N 3.16Å; M573-D575 PolarHBondContact O-N 3.33Å; M573-S576 WeakPolarHBondContact O-CB 3.25Å; M573-S576 PolarHBondContact O-N 2.71Å; M573-L577 HydrophobicContact CG-CD1 3.8Å; M573-L577 HydrophobicContact CG-CG 4.27Å; M573-L577 WeakPolarHBondContact O-CB 3.4Å; M573-L577 VanDerWaalsContact O-CG 3.29Å; M573-L577 WeakPolarHBondContact O-CG 3.5Å; M573-L577 PolarHBondContact O-N 3.25Å; M573-L577 HydrophobicContact SD-CD1 4.5Å; M573-F853 HydrophobicContact CB-CD2 3.74Å; M573-F853 HydrophobicContact CB-CE2 3.73Å; M573-F853 HydrophobicContact CB-CG 4.4Å; M573-F853 HydrophobicContact CB-CZ 4.36Å; M573-F853 HydrophobicContact CG-CD2 4.09Å; M573-F853 HydrophobicContact CG-CE2 3.52Å; M573-F853 HydrophobicContact CG-CZ 3.87Å; M573-F853 HydrophobicContact SD-CE2 4.28Å; M573-L856 HydrophobicContact CB-CD2 4.09Å; M573-L856 HydrophobicContact CG-CD2 4.22Å; M573-L856 HydrophobicContact SD-CD2 3.58Å; M573-L856 VanDerWaalsContact SD-CD2 3.58Å; M573-F861 HydrophobicContact SD-CD2 3.8Å; M573-F861 HydrophobicContact SD-CE2 4.36Å; M573-Y864 HydrophobicContact CE-CD1 3.67Å; M573-Y864 HydrophobicContact CE-CD2 3.81Å; M573-Y864 HydrophobicContact CE-CE1 3.89Å; M573-Y864 HydrophobicContact CE-CE2 4.02Å; M573-Y864 HydrophobicContact CE-CG 3.61Å
574	L	90	Very high	84.9	Confident	2 Å²	2	26.7 Å²	26.7	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-37.6	-179.2	-67.7	176.3	0	0	0	112.8	T312 E570 V571 E572 Q578 A579 L616 Y864 L871 F885	T312-L574 HydrophobicContact CG2-CD1 4.35Å; E570-L574 WeakPolarHBondContact O-CG 3.16Å; E570-L574 PolarHBondContact O-N 3.49Å; E570-L574 VanDerWaalsContact O-N 3.08Å; V571-L574 PolarHBondContact O-N 2.96Å; E572-L574 VanDerWaalsContact C-N 3.29Å; E572-L574 PolarHBondContact O-N 3.46Å; L574-Q578 PolarHBondContact O-N 2.87Å; L574-A579 HydrophobicContact CB-CB 4.14Å; L574-A579 HydrophobicContact CD2-CB 4.06Å; L574-A579 VanDerWaalsContact O-CB 3.23Å; L574-A579 WeakPolarHBondContact O-CB 3.48Å; L574-A579 PolarHBondContact O-N 3.02Å; L574-L616 HydrophobicContact CD1-CD1 4.08Å; L574-L616 HydrophobicContact CD1-CD2 3.98Å; L574-Y864 HydrophobicContact CD2-CE1 4.49Å; L574-L871 HydrophobicContact CD2-CD1 3.46Å; L574-L871 VanDerWaalsContact CD2-CD1 3.46Å; L574-F885 HydrophobicContact CD2-CZ 3.88Å
575	D	90	Very high	82.4	Confident	64 Å²	64	31.4 Å²	31.4	34%	0.342	17%	0.167	S	C	.	.	H	α-helix	trans	-67.9	-43.3	170.7	-171.6	71.1	0	0	0	112.1	V309 V571 E572 M573 L577 Q578 R847	V309-D575 HydrophobicContact CG1-CB 4.47Å; V309-D575 HydrophobicContact CG2-CB 3.69Å; V309-D575 WeakPolarHBondContact CG2-OD1 3.24Å; V571-D575 PolarHBondContact O-N 3.14Å; E572-D575 PolarHBondContact O-N 3.02Å; M573-D575 PolarHBondContact O-N 3.33Å; D575-L577 PolarHBondContact O-N 3.16Å; D575-Q578 PolarHBondContact O-N 2.88Å; D575-R847 PolarHBondContact O-NH1 3.19Å; D575-R847 IonicContact OD1-NH1 3.96Å; D575-R847 IonicContact OD2-CZ 3.74Å; D575-R847 IonicContact OD2-NH1 2.79Å; D575-R847 PolarHBondContact OD2-NH1 2.88Å
576	S	91.1	Very high	79.8	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.028	18%	0.175	C	C	.	.	H	α-helix	trans	-58.4	-37.1	178.5	-60.4	0	0	0	0	112.2	E572 M573 Q578 R847	E572-S576 WeakPolarHBondContact O-CB 3.3Å; E572-S576 PolarHBondContact O-N 3.47Å; E572-S576 PolarHBondContact O-OG 2.84Å; M573-S576 WeakPolarHBondContact O-CB 3.25Å; M573-S576 PolarHBondContact O-N 2.71Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; S576-R847 WeakPolarHBondContact O-CD 3.19Å
577	L	90.7	Very high	77.7	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	7	175.9	-62	-178.3	0	0	0	114.1	M573 D575 A579 L833 S873 L884 F885	M573-L577 HydrophobicContact CG-CD1 3.8Å; M573-L577 HydrophobicContact CG-CG 4.27Å; M573-L577 WeakPolarHBondContact O-CB 3.4Å; M573-L577 VanDerWaalsContact O-CG 3.29Å; M573-L577 WeakPolarHBondContact O-CG 3.5Å; M573-L577 PolarHBondContact O-N 3.25Å; M573-L577 HydrophobicContact SD-CD1 4.5Å; D575-L577 PolarHBondContact O-N 3.16Å; L577-A579 PolarHBondContact O-N 3.46Å; L577-L833 HydrophobicContact CD2-CD1 3.89Å; L577-S873 PolarHBondContact O-OG 3.06Å; L577-L884 HydrophobicContact CB-CD1 4.32Å; L577-L884 HydrophobicContact CB-CD2 4.19Å; L577-F885 HydrophobicContact CD1-CE1 4.23Å
578	Q	89	Confident	75.6	Confident	25 Å²	25	42 Å²	42	12%	0.117	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	38.8	177.8	-69.4	158.2	90.1	0	0	112.9	L574 D575 S576 S845 S873 V874	L574-Q578 PolarHBondContact O-N 2.87Å; D575-Q578 PolarHBondContact O-N 2.88Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; Q578-S845 PolarHBondContact NE2-O 3.45Å; Q578-S845 PolarHBondContact NE2-OG 2.91Å; Q578-S845 PolarHBondContact OE1-OG 3.43Å; Q578-S873 WeakPolarHBondContact O-CA 3.22Å; Q578-S873 PolarHBondContact O-OG 3.38Å; Q578-V874 PolarHBondContact O-N 3.26Å
579	A	85.8	Confident	73.5	Confident	7 Å²	7	48.4 Å²	48.4	6%	0.058	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.9	-172.8	0	0	0	0	0	112.9	L574 L577 L871 S872 L884	L574-A579 HydrophobicContact CB-CB 4.14Å; L574-A579 HydrophobicContact CD2-CB 4.06Å; L574-A579 VanDerWaalsContact O-CB 3.23Å; L574-A579 WeakPolarHBondContact O-CB 3.48Å; L574-A579 PolarHBondContact O-N 3.02Å; L577-A579 PolarHBondContact O-N 3.46Å; A579-L871 HydrophobicContact CB-CD1 4.01Å; A579-L871 HydrophobicContact CB-CD2 4.44Å; A579-S872 WeakPolarHBondContact CA-O 3.39Å; A579-L884 HydrophobicContact CB-CD2 3.61Å
580	V	78.7	Confident	71.7	Confident	16 Å²	16	54.8 Å²	54.8	10%	0.097	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.9	174.9	-73.1	0	0	0	0	111.4	I308 L871 S872 V874	I308-V580 VanDerWaalsContact CD1-C 3.44Å; V580-L871 WeakPolarHBondContact O-CD2 3.45Å; V580-S872 PolarHBondContact N-O 3.02Å; V580-S872 PolarHBondContact O-N 3.41Å; V580-V874 HydrophobicContact CB-CG2 4.49Å; V580-V874 HydrophobicContact CG1-CG2 3.56Å; V580-V874 HydrophobicContact CG2-CG2 4.1Å
581	S	69.7	Low	70.2	Confident	45 Å²	45	56 Å²	56	32%	0.315	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	135.4	177.3	-173.7	0	0	0	0	109.6	I308 F612	I308-S581 VanDerWaalsContact CD1-N 3.34Å; S581-F612 WeakPolarHBondContact OG-CD1 3.1Å; S581-F612 WeakPolarHBondContact OG-CG 3.41Å
582	V	64.2	Low	69.3	Low	32 Å²	32	59.1 Å²	59.1	19%	0.194	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-61.3	143.9	158.1	-178.3	0	0	0	0	108.1	A586	V582-A586 HydrophobicContact CG1-CB 4.38Å
583	K	56.3	Low	68.7	Low	114 Å²	114	57.1 Å²	57.1	50%	0.496	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-64.4	141.2	-175	-67.3	164.5	-172.7	146.9	0	111.3	S585 A586	K583-S585 PolarHBondContact O-N 3.29Å; K583-A586 PolarHBondContact O-N 3.02Å
584	E	48.5	Very low	67.7	Low	149 Å²	149	66.1 Å²	66.1	70%	0.696	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.5	-174	-64.4	-169.5	114.4	0	0	114.7	A586	E584-A586 PolarHBondContact O-N 2.87Å
585	S	41.6	Very low	67.1	Low	99 Å²	99	66.5 Å²	66.5	69%	0.692	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.9	175	52.5	0	0	0	0	114.4	K583 T587	K583-S585 PolarHBondContact O-N 3.29Å; S585-T587 PolarHBondContact O-N 3.41Å; S585-T587 VanDerWaalsContact O-N 3.09Å
586	A	40	Very low	66.6	Low	21 Å²	21	63.6 Å²	63.6	17%	0.174	33%	0.327	C	S	.	.			trans	-74.4	95.1	176.6	0	0	0	0	0	112.1	V582 K583 E584 H590	V582-A586 HydrophobicContact CG1-CB 4.38Å; K583-A586 PolarHBondContact O-N 3.02Å; E584-A586 PolarHBondContact O-N 2.87Å; A586-H590 HydrophobicContact CB-CB 3.96Å
587	T	46.9	Very low	65.8	Low	75 Å²	75	65.9 Å²	65.9	46%	0.46	34%	0.339	S	S	.	.			trans	-59.5	169.7	154.1	54.5	0	0	0	0	110.5	S585 E589 H590	S585-T587 PolarHBondContact O-N 3.41Å; S585-T587 VanDerWaalsContact O-N 3.09Å; T587-E589 PolarHBondContact O-N 2.9Å; T587-E589 PolarHBondContact OG1-OE2 3.09Å; T587-H590 PolarHBondContact O-N 3.27Å; T587-H590 VanDerWaalsContact O-N 3.08Å
588	F	49.3	Very low	64.8	Low	129 Å²	129	67.6 Å²	67.6	57%	0.566	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-50.8	-33.6	-179.9	-109.6	-98.9	0	0	0	113.4	H590 V591 L600	F588-H590 PolarHBondContact O-N 2.99Å; F588-V591 PolarHBondContact O-N 2.9Å; F588-L600 HydrophobicContact CE1-CB 3.66Å; F588-L600 HydrophobicContact CE1-CD1 4.16Å; F588-L600 HydrophobicContact CE1-CG 4.45Å; F588-L600 HydrophobicContact CZ-CB 3.76Å; F588-L600 HydrophobicContact CZ-CD1 4.33Å; F588-L600 HydrophobicContact CZ-CD2 4.41Å; F588-L600 HydrophobicContact CZ-CG 4.4Å
589	E	49.1	Very low	63.7	Low	171 Å²	171	68.2 Å²	68.2	80%	0.799	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-63.7	-20	-177.9	-62.4	159.1	130	0	0	114	T587	T587-E589 PolarHBondContact O-N 2.9Å; T587-E589 PolarHBondContact OG1-OE2 3.09Å
590	H	54.7	Low	62.7	Low	134 Å²	134	69.5 Å²	69.5	62%	0.62	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-95.8	1.7	-176.8	-73.6	-65.5	0	0	0	114.6	A586 T587 F588 S592	A586-H590 HydrophobicContact CB-CB 3.96Å; T587-H590 PolarHBondContact O-N 3.27Å; T587-H590 VanDerWaalsContact O-N 3.08Å; F588-H590 PolarHBondContact O-N 2.99Å; H590-S592 PolarHBondContact O-N 2.87Å; H590-S592 VanDerWaalsContact O-N 3.13Å
591	V	62.6	Low	62	Low	27 Å²	27	75 Å²	75	16%	0.164	38%	0.383	C	S	.	.			trans	-82.6	89.6	178	-175.9	0	0	0	0	110.1	F588 C593 C596 L597 L600	F588-V591 PolarHBondContact O-N 2.9Å; V591-C593 PolarHBondContact O-N 3.37Å; V591-C596 HydrophobicContact CG1-CB 3.48Å; V591-C596 VanDerWaalsContact CG1-CB 3.48Å; V591-L597 HydrophobicContact CB-CD2 3.94Å; V591-L597 HydrophobicContact CB-CG 4.24Å; V591-L597 HydrophobicContact CG1-CD2 4.3Å; V591-L597 HydrophobicContact CG1-CG 4.14Å; V591-L597 WeakPolarHBondContact O-CD1 3.15Å; V591-L597 WeakPolarHBondContact O-CG 3.19Å; V591-L600 HydrophobicContact CG2-CD1 4.38Å
592	S	71.7	Confident	61.4	Low	78 Å²	78	79 Å²	79	55%	0.545	40%	0.396	S	S	.	.			trans	-66.6	-18.1	179.2	58.8	0	0	0	0	114.5	H590 R594 H882	H590-S592 PolarHBondContact O-N 2.87Å; H590-S592 VanDerWaalsContact O-N 3.13Å; S592-R594 PolarHBondContact O-N 3.47Å; S592-H882 PolarHBondContact OG-CD2 2.91Å
593	C	78.7	Confident	60.8	Low	6 Å²	6	79.4 Å²	79.4	4%	0.041	41%	0.407	C	S	.	.			trans	-81.7	110.7	-179.1	-167.9	0	0	0	0	112.1	V591 T595 C596 L597 C883 H886 D887	V591-C593 PolarHBondContact O-N 3.37Å; C593-T595 VanDerWaalsContact C-N 3.3Å; C593-T595 PolarHBondContact O-N 3.04Å; C593-C596 HydrophobicContact CB-CB 3.97Å; C593-C596 WeakPolarHBondContact O-CB 3.11Å; C593-C596 PolarHBondContact O-N 3.37Å; C593-L597 PolarHBondContact O-N 3.16Å; C593-C883 HydrophobicContact CB-CB 4.12Å; C593-H886 WeakPolarHBondContact SG-CB 3.5Å; C593-D887 VanDerWaalsContact CB-OD2 3.24Å; C593-D887 WeakPolarHBondContact CB-OD2 3.47Å; C593-D887 PolarHBondContact SG-OD1 3.04Å; C593-D887 PolarHBondContact SG-OD2 3.15Å; C593-D887 VanDerWaalsContact SG-OD2 3.33Å
594	R	73.9	Confident	59.9	Low	189 Å²	189	79.4 Å²	79.4	71%	0.713	42%	0.421	S	S	*	.	H	α-helix	trans	-55.9	-38.9	-179.9	-171	175.2	180	177.3	0.4	113.7	S592 L597 T598	S592-R594 PolarHBondContact O-N 3.47Å; R594-L597 PolarHBondContact O-N 3.16Å; R594-T598 PolarHBondContact O-N 3.35Å; R594-T598 VanDerWaalsContact O-N 3.11Å; R594-T598 PolarHBondContact O-OG1 3.03Å
595	T	77.4	Confident	59.3	Low	9 Å²	9	77.1 Å²	77.1	6%	0.055	42%	0.421	C	S	.	.	H	α-helix	trans	-65	-41.8	176.6	-63.1	0	0	0	0	111.7	C593 L597 M599 T805 H886	C593-T595 VanDerWaalsContact C-N 3.3Å; C593-T595 PolarHBondContact O-N 3.04Å; T595-L597 VanDerWaalsContact C-N 3.34Å; T595-L597 PolarHBondContact O-N 3.4Å; T595-M599 HydrophobicContact CG2-CG 4.46Å; T595-M599 VanDerWaalsContact O-CB 3.28Å; T595-M599 WeakPolarHBondContact O-CB 3.35Å; T595-M599 VanDerWaalsContact O-CG 3.26Å; T595-M599 WeakPolarHBondContact O-CG 3.39Å; T595-M599 PolarHBondContact O-N 2.65Å; T595-T805 HydrophobicContact CG2-CG2 4.43Å; T595-T805 WeakPolarHBondContact CG2-OG1 3.43Å; T595-H886 WeakPolarHBondContact CG2-NE2 3.31Å
596	C	78.4	Confident	59	Low	3 Å²	3	75.2 Å²	75.2	2%	0.02	42%	0.417	C	S	.	.	H	α-helix	trans	-61.8	-40.5	173.9	-69.3	0	0	0	0	112.1	V591 C593 L600 V869 H886	V591-C596 HydrophobicContact CG1-CB 3.48Å; V591-C596 VanDerWaalsContact CG1-CB 3.48Å; C593-C596 HydrophobicContact CB-CB 3.97Å; C593-C596 WeakPolarHBondContact O-CB 3.11Å; C593-C596 PolarHBondContact O-N 3.37Å; C596-L600 WeakPolarHBondContact O-CB 3.44Å; C596-L600 WeakPolarHBondContact O-CD1 3.21Å; C596-L600 WeakPolarHBondContact O-CG 3.43Å; C596-L600 PolarHBondContact O-N 2.76Å; C596-V869 HydrophobicContact CB-CG1 4.36Å; C596-H886 PolarHBondContact SG-ND1 2.85Å; C596-H886 VanDerWaalsContact SG-ND1 3.43Å
597	L	74.8	Confident	58.7	Low	53 Å²	53	82.6 Å²	82.6	28%	0.277	45%	0.453	S	S	.	.	H	α-helix	trans	-60.3	-55.2	177.3	-75	169.6	0	0	0	111.5	V591 C593 R594 T595 M599 L600 E601	V591-L597 HydrophobicContact CB-CD2 3.94Å; V591-L597 HydrophobicContact CB-CG 4.24Å; V591-L597 HydrophobicContact CG1-CD2 4.3Å; V591-L597 HydrophobicContact CG1-CG 4.14Å; V591-L597 WeakPolarHBondContact O-CD1 3.15Å; V591-L597 WeakPolarHBondContact O-CG 3.19Å; C593-L597 PolarHBondContact O-N 3.16Å; R594-L597 PolarHBondContact O-N 3.16Å; T595-L597 VanDerWaalsContact C-N 3.34Å; T595-L597 PolarHBondContact O-N 3.4Å; L597-M599 VanDerWaalsContact C-N 3.3Å; L597-M599 PolarHBondContact O-N 3.37Å; L597-L600 WeakPolarHBondContact O-CA 3.33Å; L597-L600 WeakPolarHBondContact O-CB 3.23Å; L597-L600 PolarHBondContact O-N 3.03Å; L597-E601 WeakPolarHBondContact O-CG 3.38Å; L597-E601 PolarHBondContact O-N 3.13Å
598	T	69	Low	58.4	Low	38 Å²	38	84.7 Å²	84.7	23%	0.233	46%	0.458	C	S	.	.	H	α-helix	trans	-60.7	-38.7	-180	-54.9	0	0	0	0	112.2	R594 L600 E601 E602	R594-T598 PolarHBondContact O-N 3.35Å; R594-T598 VanDerWaalsContact O-N 3.11Å; R594-T598 PolarHBondContact O-OG1 3.03Å; T598-L600 VanDerWaalsContact C-N 3.29Å; T598-L600 PolarHBondContact O-N 3.44Å; T598-E601 WeakPolarHBondContact CA-OE2 3.16Å; T598-E601 PolarHBondContact O-N 2.78Å; T598-E602 HydrophobicContact CG2-CG 4.46Å; T598-E602 WeakPolarHBondContact O-CB 3.43Å; T598-E602 WeakPolarHBondContact O-CG 3.46Å; T598-E602 PolarHBondContact O-N 2.99Å
599	M	67	Low	58	Low	38 Å²	38	84 Å²	84	19%	0.187	47%	0.469	C	S	.	.	H	α-helix	trans	-61.2	-32.3	172.3	-82.6	-83.4	-64.7	0	0	114	T595 L597 G603 H867 V869	T595-M599 HydrophobicContact CG2-CG 4.46Å; T595-M599 VanDerWaalsContact O-CB 3.28Å; T595-M599 WeakPolarHBondContact O-CB 3.35Å; T595-M599 VanDerWaalsContact O-CG 3.26Å; T595-M599 WeakPolarHBondContact O-CG 3.39Å; T595-M599 PolarHBondContact O-N 2.65Å; L597-M599 VanDerWaalsContact C-N 3.3Å; L597-M599 PolarHBondContact O-N 3.37Å; M599-G603 PolarHBondContact O-N 3.41Å; M599-H867 HydrophobicContact CE-CB 3.84Å; M599-H867 WeakPolarHBondContact CE-O 3.47Å; M599-V869 HydrophobicContact CB-CG1 4.33Å; M599-V869 HydrophobicContact CE-CG1 4.22Å
600	L	64.6	Low	57.8	Low	33 Å²	33	77.7 Å²	77.7	17%	0.173	45%	0.446	C	S	.	.	H	α-helix	trans	-79.4	-34.5	177	-73.3	165.7	0	0	0	111.9	F588 V591 C596 L597 T598 G603	F588-L600 HydrophobicContact CE1-CB 3.66Å; F588-L600 HydrophobicContact CE1-CD1 4.16Å; F588-L600 HydrophobicContact CE1-CG 4.45Å; F588-L600 HydrophobicContact CZ-CB 3.76Å; F588-L600 HydrophobicContact CZ-CD1 4.33Å; F588-L600 HydrophobicContact CZ-CD2 4.41Å; F588-L600 HydrophobicContact CZ-CG 4.4Å; V591-L600 HydrophobicContact CG2-CD1 4.38Å; C596-L600 WeakPolarHBondContact O-CB 3.44Å; C596-L600 WeakPolarHBondContact O-CD1 3.21Å; C596-L600 WeakPolarHBondContact O-CG 3.43Å; C596-L600 PolarHBondContact O-N 2.76Å; L597-L600 WeakPolarHBondContact O-CA 3.33Å; L597-L600 WeakPolarHBondContact O-CB 3.23Å; L597-L600 PolarHBondContact O-N 3.03Å; T598-L600 VanDerWaalsContact C-N 3.29Å; T598-L600 PolarHBondContact O-N 3.44Å; L600-G603 PolarHBondContact O-N 2.9Å
601	E	64.2	Low	57.6	Low	131 Å²	131	72.7 Å²	72.7	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-68.7	-48.9	175.6	-68.1	168.2	155.2	0	0	111.8	L597 T598 G603	L597-E601 WeakPolarHBondContact O-CG 3.38Å; L597-E601 PolarHBondContact O-N 3.13Å; T598-E601 WeakPolarHBondContact CA-OE2 3.16Å; T598-E601 PolarHBondContact O-N 2.78Å; E601-G603 PolarHBondContact O-N 3.22Å
602	E	56.9	Low	56.9	Low	130 Å²	130	73 Å²	73	61%	0.607	43%	0.43	S	S	*	.	H	α-helix	trans	-62.7	-28.5	173	-70.4	179.5	-161.4	0	0	112	T598 S604	T598-E602 HydrophobicContact CG2-CG 4.46Å; T598-E602 WeakPolarHBondContact O-CB 3.43Å; T598-E602 WeakPolarHBondContact O-CG 3.46Å; T598-E602 PolarHBondContact O-N 2.99Å; E602-S604 PolarHBondContact O-N 3.48Å
603	G	52.1	Low	56.2	Low	40 Å²	40	70.6 Å²	70.6	41%	0.412	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	20.5	-173.3	0	0	0	0	0	116.8	M599 L600 E601 C605	M599-G603 PolarHBondContact O-N 3.41Å; L600-G603 PolarHBondContact O-N 2.9Å; E601-G603 PolarHBondContact O-N 3.22Å; G603-C605 PolarHBondContact O-N 3.22Å
604	S	37.3	Very low	55.3	Low	114 Å²	114	76 Å²	76	80%	0.797	43%	0.432	S	S	*	.			trans	-64.9	89.4	-171.2	-169.9	0	0	0	0	114	E602	E602-S604 PolarHBondContact O-N 3.48Å
605	C	35.7	Very low	54.7	Low	101 Å²	101	67.1 Å²	67.1	68%	0.682	40%	0.399	S	S	*	.			trans	-127.9	36.4	178	73.6	0	0	0	0	114.5	G603	G603-C605 PolarHBondContact O-N 3.22Å
606	G	34.9	Very low	54.1	Low	59 Å²	59	66.8 Å²	66.8	61%	0.608	40%	0.397	S	S	*	.			trans	95.3	157.2	162.3	0	0	0	0	0	116.9	E608	G606-E608 PolarHBondContact O-N 3.14Å
607	N	33.8	Very low	53.3	Low	177 Å²	177	66.9 Å²	66.9	95%	0.947	40%	0.397	S	S	*	.			trans	-77.2	46.3	-166.3	-57.2	5.2	0	0	0	114.8
608	E	40.6	Very low	52.9	Low	118 Å²	118	67.4 Å²	67.4	55%	0.551	40%	0.397	S	S	*	.			trans	-81.4	123.3	159.6	-79.9	-160.5	-154	0	0	109	G606 A610 R614	G606-E608 PolarHBondContact O-N 3.14Å; E608-A610 PolarHBondContact O-N 3.09Å; E608-R614 IonicContact OE2-CZ 2.71Å; E608-R614 IonicContact OE2-NH1 3.91Å; E608-R614 PolarHBondContact OE2-NH1 3.41Å
609	S	40.4	Very low	52.8	Low	116 Å²	116	65.7 Å²	65.7	81%	0.811	39%	0.386	S	S	*	.			trans	-61.5	104	177.8	36	0	0	0	0	111.2	G611	S609-G611 PolarHBondContact O-N 3.31Å; S609-G611 VanDerWaalsContact O-N 3.11Å
610	A	45.1	Very low	53.4	Low	37 Å²	37	63.9 Å²	63.9	31%	0.306	38%	0.377	S	S	.	.			trans	-82.8	87	-175.5	0	0	0	0	0	111.5	E608 R870	E608-A610 PolarHBondContact O-N 3.09Å; A610-R870 PolarHBondContact O-NH1 2.95Å
611	G	50.6	Low	53.8	Low	29 Å²	29	62.7 Å²	62.7	30%	0.299	37%	0.372	S	S	.	.			trans	-70.7	147.1	159.6	0	0	0	0	0	111.1	S609 R614	S609-G611 PolarHBondContact O-N 3.31Å; S609-G611 VanDerWaalsContact O-N 3.11Å; G611-R614 VanDerWaalsContact O-CB 3.27Å; G611-R614 WeakPolarHBondContact O-CB 3.32Å; G611-R614 PolarHBondContact O-N 2.88Å
612	F	48.3	Very low	54.3	Low	34 Å²	34	57 Å²	57	15%	0.149	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	142.3	166.4	-173.3	-89.9	0	0	0	109	I308 S581 L616 L871	I308-F612 HydrophobicContact CD1-CE1 3.66Å; I308-F612 HydrophobicContact CD1-CZ 3.49Å; I308-F612 VanDerWaalsContact CD1-CZ 3.49Å; I308-F612 HydrophobicContact CG1-CE1 4.03Å; I308-F612 HydrophobicContact CG1-CZ 4.26Å; S581-F612 WeakPolarHBondContact OG-CD1 3.1Å; S581-F612 WeakPolarHBondContact OG-CG 3.41Å; F612-L616 HydrophobicContact CE2-CB 4.12Å; F612-L616 HydrophobicContact CE2-CD1 4.21Å; F612-L616 HydrophobicContact CZ-CB 4.47Å; F612-L616 HydrophobicContact CZ-CD1 4.33Å; F612-L871 HydrophobicContact CE2-CD2 3.57Å; F612-L871 HydrophobicContact CE2-CG 4.28Å; F612-L871 HydrophobicContact CZ-CD2 3.59Å
613	P	56.3	Low	55.1	Low	28 Å²	28	50.9 Å²	50.9	18%	0.182	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	cis	-90.5	16.8	6.2	-11.7	32.1	0	0	0	116.1	I315 D615 L616	I315-P613 HydrophobicContact CD1-CB 4.06Å; I315-P613 HydrophobicContact CD1-CG 3.52Å; P613-D615 PolarHBondContact O-N 2.86Å; P613-D615 VanDerWaalsContact O-N 3.13Å; P613-L616 HydrophobicContact CB-CB 4.4Å; P613-L616 VanDerWaalsContact O-CB 3.3Å; P613-L616 WeakPolarHBondContact O-CB 3.32Å; P613-L616 PolarHBondContact O-N 3.4Å
614	R	60.2	Low	55.7	Low	120 Å²	120	50.8 Å²	50.8	45%	0.453	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.1	-173.6	-67.7	-177.3	168.4	-150.2	3.9	114.4	E608 G611	E608-R614 IonicContact OE2-CZ 2.71Å; E608-R614 IonicContact OE2-NH1 3.91Å; E608-R614 PolarHBondContact OE2-NH1 3.41Å; G611-R614 VanDerWaalsContact O-CB 3.27Å; G611-R614 WeakPolarHBondContact O-CB 3.32Å; G611-R614 PolarHBondContact O-N 2.88Å
615	D	60.8	Low	56.4	Low	2 Å²	2	48.6 Å²	48.6	1%	0.011	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-30.7	176	-67.4	-45.7	0	0	0	113.1	P613 I617 K618 C619 V869 R870	P613-D615 PolarHBondContact O-N 2.86Å; P613-D615 VanDerWaalsContact O-N 3.13Å; D615-I617 PolarHBondContact O-N 3.03Å; D615-K618 VanDerWaalsContact O-CB 3.26Å; D615-K618 WeakPolarHBondContact O-CB 3.11Å; D615-K618 PolarHBondContact O-N 2.8Å; D615-K618 WeakPolarHBondContact OD1-CE 3.27Å; D615-K618 IonicContact OD1-NZ 3.84Å; D615-K618 PolarHBondContact OD1-NZ 3.23Å; D615-C619 PolarHBondContact O-SG 3.42Å; D615-C619 VanDerWaalsContact O-SG 3.35Å; D615-V869 HydrophobicContact CB-CG2 4.42Å; D615-R870 WeakPolarHBondContact OD2-CD 3.5Å; D615-R870 IonicContact OD2-CZ 3.2Å; D615-R870 IonicContact OD2-NE 3.06Å; D615-R870 IonicContact OD2-NH1 2.69Å; D615-R870 PolarHBondContact OD2-NH1 3.4Å
616	L	65	Low	57.3	Low	2 Å²	2	46.2 Å²	46.2	1%	0.01	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-57.6	-37.4	173.8	-168.4	99	0	0	0	111.2	T312 F316 L574 F612 P613 K618 C619 L871	T312-L616 HydrophobicContact CG2-CD2 3.39Å; F316-L616 HydrophobicContact CE1-CD2 3.94Å; F316-L616 HydrophobicContact CZ-CD2 3.76Å; L574-L616 HydrophobicContact CD1-CD1 4.08Å; L574-L616 HydrophobicContact CD1-CD2 3.98Å; F612-L616 HydrophobicContact CE2-CB 4.12Å; F612-L616 HydrophobicContact CE2-CD1 4.21Å; F612-L616 HydrophobicContact CZ-CB 4.47Å; F612-L616 HydrophobicContact CZ-CD1 4.33Å; P613-L616 HydrophobicContact CB-CB 4.4Å; P613-L616 VanDerWaalsContact O-CB 3.3Å; P613-L616 WeakPolarHBondContact O-CB 3.32Å; P613-L616 PolarHBondContact O-N 3.4Å; L616-K618 PolarHBondContact O-N 3.22Å; L616-C619 WeakPolarHBondContact O-CA 3.47Å; L616-C619 WeakPolarHBondContact O-CB 3.32Å; L616-C619 PolarHBondContact O-N 3.49Å; L616-L871 HydrophobicContact CD1-CD1 3.26Å; L616-L871 HydrophobicContact CD1-CD2 4.02Å; L616-L871 HydrophobicContact CD1-CG 3.64Å
617	I	62	Low	57.9	Low	4 Å²	4	47.8 Å²	47.8	2%	0.021	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-61.2	-32.7	177.4	-54	167	0	0	0	111.2	I315 F316 K319 D615 C619 S620 I623	I315-I617 HydrophobicContact CG2-CD1 3.3Å; I315-I617 HydrophobicContact CG2-CG1 3.77Å; F316-I617 HydrophobicContact CE1-CG1 4.45Å; K319-I617 HydrophobicContact CD-CD1 4.27Å; K319-I617 HydrophobicContact CD-CG2 4.3Å; K319-I617 HydrophobicContact CG-CD1 3.94Å; K319-I617 HydrophobicContact CG-CG2 3.94Å; D615-I617 PolarHBondContact O-N 3.03Å; I617-C619 PolarHBondContact O-N 3.46Å; I617-C619 VanDerWaalsContact O-N 3.15Å; I617-S620 PolarHBondContact O-N 2.84Å; I617-I623 HydrophobicContact CG2-CB 4.49Å; I617-I623 HydrophobicContact CG2-CG2 3.96Å; I617-I623 WeakPolarHBondContact CG2-O 3.43Å
618	K	65.4	Low	58.3	Low	65 Å²	65	42.8 Å²	42.8	28%	0.283	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-66.8	-10.7	174.7	-56.2	173.4	176	166.7	0	112.7	D615 L616 P625 R1470	D615-K618 VanDerWaalsContact O-CB 3.26Å; D615-K618 WeakPolarHBondContact O-CB 3.11Å; D615-K618 PolarHBondContact O-N 2.8Å; D615-K618 WeakPolarHBondContact OD1-CE 3.27Å; D615-K618 IonicContact OD1-NZ 3.84Å; D615-K618 PolarHBondContact OD1-NZ 3.23Å; L616-K618 PolarHBondContact O-N 3.22Å; K618-P625 HydrophobicContact CG-CG 4.44Å; K618-R1470 VanDerWaalsContact O-CZ 3.27Å; K618-R1470 PolarHBondContact O-NH1 3.12Å; K618-R1470 PolarHBondContact O-NH2 3.41Å
619	C	67.6	Low	58.4	Low	1 Å²	1	47 Å²	47	1%	0.007	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-98.9	-23.9	-176.1	-47	0	0	0	0	112.9	D615 L616 I617 Y864 H867	D615-C619 PolarHBondContact O-SG 3.42Å; D615-C619 VanDerWaalsContact O-SG 3.35Å; L616-C619 WeakPolarHBondContact O-CA 3.47Å; L616-C619 WeakPolarHBondContact O-CB 3.32Å; L616-C619 PolarHBondContact O-N 3.49Å; I617-C619 PolarHBondContact O-N 3.46Å; I617-C619 VanDerWaalsContact O-N 3.15Å; C619-Y864 HydrophobicContact CB-CD1 4.33Å; C619-Y864 HydrophobicContact CB-CE1 4.04Å; C619-H867 PolarHBondContact SG-O 2.66Å
620	S	79.8	Confident	58.5	Low	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.261	C	S	.	.			trans	-78.8	123.4	179.7	-178.5	0	0	0	0	111.4	E570 I617 F622 I623	E570-S620 WeakPolarHBondContact OE2-CB 3.2Å; E570-S620 PolarHBondContact OE2-OG 3.34Å; I617-S620 PolarHBondContact O-N 2.84Å; S620-F622 PolarHBondContact O-N 3.33Å; S620-I623 PolarHBondContact O-N 2.97Å; S620-I623 WeakPolarHBondContact OG-CG1 3.31Å
621	P	73.6	Confident	58.3	Low	9 Å²	9	59.7 Å²	59.7	6%	0.058	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.4	-172.8	22.9	-33	0	0	0	113.7	L761 T860	P621-L761 HydrophobicContact CB-CD1 3.6Å; P621-L761 HydrophobicContact CG-CD1 3.73Å; P621-T860 HydrophobicContact CG-CG2 4.21Å
622	F	74.8	Confident	57.8	Low	11 Å²	11	61.9 Å²	61.9	5%	0.048	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-14.6	180	-71.9	-78.7	0	0	0	114.5	Q323 S563 S620 L761 Y762	Q323-F622 PolarHBondContact NE2-O 2.72Å; Q323-F622 PolarHBondContact OE1-O 2.95Å; S563-F622 WeakPolarHBondContact OG-CD1 3.41Å; S620-F622 PolarHBondContact O-N 3.33Å; F622-L761 HydrophobicContact CE2-CB 4.21Å; F622-L761 HydrophobicContact CE2-CD1 3.89Å; F622-L761 HydrophobicContact CZ-CB 3.88Å; F622-L761 HydrophobicContact CZ-CD1 4.03Å; F622-Y762 HydrophobicContact CE2-CD2 4.12Å; F622-Y762 AromaticContact CE2-CE2 3.98Å; F622-Y762 HydrophobicContact CE2-CE2 3.98Å; F622-Y762 HydrophobicContact CZ-CD2 4.22Å
623	I	73.3	Confident	57.5	Low	1 Å²	1	66.5 Å²	66.5	1%	0.005	33%	0.334	C	S	.	.			trans	-121.7	47.1	-163	-40.3	-179.6	0	0	0	111.4	F316 K319 L320 A567 I617 S620	F316-I623 HydrophobicContact CB-CD1 3.67Å; F316-I623 HydrophobicContact CD1-CD1 3.64Å; F316-I623 HydrophobicContact CD2-CD1 4.03Å; F316-I623 HydrophobicContact CE1-CD1 4.21Å; F316-I623 HydrophobicContact CG-CD1 3.52Å; K319-I623 HydrophobicContact CB-CG2 3.39Å; K319-I623 HydrophobicContact CG-CG2 4.22Å; L320-I623 HydrophobicContact CD1-CD1 4.22Å; L320-I623 HydrophobicContact CD2-CG1 4.1Å; L320-I623 HydrophobicContact CG-CD1 4.29Å; L320-I623 HydrophobicContact CG-CG1 4.24Å; L320-I623 HydrophobicContact CG-CG2 4.48Å; A567-I623 HydrophobicContact CB-CD1 4.26Å; I617-I623 HydrophobicContact CG2-CB 4.49Å; I617-I623 HydrophobicContact CG2-CG2 3.96Å; I617-I623 WeakPolarHBondContact CG2-O 3.43Å; S620-I623 PolarHBondContact O-N 2.97Å; S620-I623 WeakPolarHBondContact OG-CG1 3.31Å
624	H	64.2	Low	56.8	Low	38 Å²	38	67.1 Å²	67.1	18%	0.176	34%	0.339	C	S	.	.			trans	-60	145.8	-178.7	-105.4	-89.5	0	0	0	113.4	F626 Y730	H624-F626 HydrophobicContact CB-CZ 4.43Å; H624-F626 WeakPolarHBondContact O-CD2 3.44Å; H624-F626 WeakPolarHBondContact O-CE2 3.49Å; H624-F626 PolarHBondContact O-N 3.27Å; H624-Y730 HydrophobicContact CB-CE2 4.3Å; H624-Y730 AromaticContact CD2-CD1 3.61Å; H624-Y730 AromaticContact CD2-CE1 3.55Å; H624-Y730 AromaticContact CD2-CG 3.93Å; H624-Y730 AromaticContact CD2-CZ 3.78Å; H624-Y730 AromaticContact CE1-CE1 3.76Å; H624-Y730 AromaticContact CE1-CZ 3.9Å; H624-Y730 AromaticContact CG-CZ 3.85Å; H624-Y730 AromaticContact ND1-CZ 3.92Å; H624-Y730 AromaticContact NE2-CD1 3.68Å; H624-Y730 AromaticContact NE2-CE1 3.32Å; H624-Y730 VanDerWaalsContact NE2-CE1 3.32Å; H624-Y730 WeakPolarHBondContact NE2-CE1 3.35Å; H624-Y730 AromaticContact NE2-CZ 3.82Å
625	P	52	Low	55.8	Low	69 Å²	69	64.5 Å²	64.5	45%	0.448	34%	0.339	S	S	.	.			trans	-70.5	100.3	173.4	28.2	-35.3	0	0	0	111.7	K618	K618-P625 HydrophobicContact CG-CG 4.44Å
626	F	54	Low	55	Low	51 Å²	51	68.3 Å²	68.3	22%	0.224	36%	0.362	C	S	.	.			trans	-68.2	144	174.5	-64.2	-78.7	0	0	0	112.1	Q323 Y326 H624 S628 P727	Q323-F626 HydrophobicContact CB-CD2 4.21Å; Q323-F626 HydrophobicContact CB-CE2 3.86Å; Q323-F626 VanDerWaalsContact CD-CE2 3.44Å; Q323-F626 HydrophobicContact CG-CD2 4.29Å; Q323-F626 HydrophobicContact CG-CE2 3.51Å; Q323-F626 HydrophobicContact CG-CZ 3.92Å; Y326-F626 AromaticContact CD1-CD1 3.98Å; Y326-F626 HydrophobicContact CD1-CD1 3.98Å; Y326-F626 HydrophobicContact CD1-CE1 4.36Å; Y326-F626 HydrophobicContact CD1-CG 4.45Å; Y326-F626 AromaticContact CE1-CD1 3.97Å; Y326-F626 HydrophobicContact CE1-CD1 3.97Å; Y326-F626 HydrophobicContact CE1-CE1 4.31Å; H624-F626 HydrophobicContact CB-CZ 4.43Å; H624-F626 WeakPolarHBondContact O-CD2 3.44Å; H624-F626 WeakPolarHBondContact O-CE2 3.49Å; H624-F626 PolarHBondContact O-N 3.27Å; F626-S628 PolarHBondContact O-N 3.04Å; F626-P727 HydrophobicContact CE1-CG 3.69Å; F626-P727 HydrophobicContact CZ-CB 4.39Å; F626-P727 HydrophobicContact CZ-CG 3.69Å
627	P	48.3	Very low	54.1	Low	91 Å²	91	70.6 Å²	70.6	59%	0.591	38%	0.376	S	S	*	.			trans	-66.8	106.6	-178.7	27.3	-34.5	0	0	0	110.8
628	S	42.4	Very low	53.5	Low	72 Å²	72	71.6 Å²	71.6	50%	0.503	38%	0.383	S	S	.	.			trans	-64.5	141.1	176.2	63.1	0	0	0	0	110.8	F626 K630	F626-S628 PolarHBondContact O-N 3.04Å; S628-K630 VanDerWaalsContact C-N 3.26Å; S628-K630 PolarHBondContact O-N 2.96Å
629	K	43	Very low	53	Low	206 Å²	206	70.8 Å²	70.8	90%	0.896	38%	0.379	S	S	*	.	S	Bend	trans	66.2	-21	166.6	-55.2	171.8	-177	172.2	0	118.8	R631	K629-R631 PolarHBondContact O-N 3.07Å
630	K	42.2	Very low	52.3	Low	185 Å²	185	71.7 Å²	71.7	80%	0.804	39%	0.386	S	S	*	.			trans	-78.5	103.2	173.9	-77.6	-170.1	177.3	180	0	111.2	S628	S628-K630 VanDerWaalsContact C-N 3.26Å; S628-K630 PolarHBondContact O-N 2.96Å
631	R	40.5	Very low	50.9	Low	236 Å²	236	76.9 Å²	76.9	89%	0.891	41%	0.41	S	S	*	.			trans	-49.5	125.6	169.1	-76.2	-177.2	175.2	174.3	-0.6	109.6	K629 S633	K629-R631 PolarHBondContact O-N 3.07Å; R631-S633 PolarHBondContact O-N 3.19Å
632	P	41.2	Very low	49.9	Very low	74 Å²	74	79.8 Å²	79.8	48%	0.481	42%	0.422	S	S	.	.			trans	-66.3	122.9	170.6	27.7	-32.6	0	0	0	108.8	S634	P632-S634 PolarHBondContact O-N 3.2Å
633	S	41.2	Very low	49.3	Very low	132 Å²	132	79.8 Å²	79.8	92%	0.923	42%	0.423	S	S	*	.			trans	-70.7	-6	178	54	0	0	0	0	113.4	R631 S635	R631-S633 PolarHBondContact O-N 3.19Å; S633-S635 PolarHBondContact O-N 2.79Å
634	S	42.3	Very low	48.9	Very low	41 Å²	41	86.8 Å²	86.8	29%	0.287	46%	0.461	S	S	.	.			trans	-72.9	116.2	173	54.1	0	0	0	0	111.5	P632 V636	P632-S634 PolarHBondContact O-N 3.2Å; S634-V636 PolarHBondContact O-N 3.38Å
635	S	39.6	Very low	48.9	Very low	64 Å²	64	87.8 Å²	87.8	45%	0.448	47%	0.468	S	S	.	.			trans	-65.6	81	156.1	50.3	0	0	0	0	109.9	S633 V637 L659	S633-S635 PolarHBondContact O-N 2.79Å; S635-V637 PolarHBondContact O-N 2.79Å; S635-L659 WeakPolarHBondContact OG-CD1 3.44Å
636	V	44	Very low	49.3	Very low	83 Å²	83	86.4 Å²	86.4	50%	0.503	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-60.1	119.1	157.9	-177.6	0	0	0	0	105.9	S634 S638	S634-V636 PolarHBondContact O-N 3.38Å; V636-S638 PolarHBondContact O-N 2.75Å
637	V	45.6	Very low	49.2	Very low	49 Å²	49	87.3 Å²	87.3	30%	0.297	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-67.6	121.4	177.5	178.6	0	0	0	0	107.1	S635 W639 F642 T694	S635-V637 PolarHBondContact O-N 2.79Å; V637-W639 PolarHBondContact O-N 3.19Å; V637-F642 HydrophobicContact CG1-CE2 4.4Å; V637-T694 HydrophobicContact CG2-CG2 4.06Å
638	S	49.2	Very low	49.1	Very low	25 Å²	25	86.6 Å²	86.6	18%	0.175	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-61.4	125.3	-179	173.8	0	0	0	0	109.5	D332 V636 A640 E641	D332-S638 VanDerWaalsContact CB-OG 3.3Å; D332-S638 WeakPolarHBondContact CB-OG 3.49Å; D332-S638 VanDerWaalsContact OD2-CB 3.24Å; D332-S638 WeakPolarHBondContact OD2-CB 3.49Å; D332-S638 PolarHBondContact OD2-OG 3.12Å; V636-S638 PolarHBondContact O-N 2.75Å; S638-A640 PolarHBondContact O-N 3.3Å; S638-A640 VanDerWaalsContact OG-CB 3.28Å; S638-A640 WeakPolarHBondContact OG-CB 3.44Å; S638-A640 PolarHBondContact OG-N 2.85Å; S638-E641 WeakPolarHBondContact O-CB 3.49Å; S638-E641 PolarHBondContact O-N 2.85Å
639	W	54.9	Low	49.2	Very low	49 Å²	49	88.5 Å²	88.5	19%	0.186	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-62	-13.7	176.6	-74.1	114.2	0	0	0	112.8	W548 V637 E641 F642 L712 L715 M719	W548-W639 HydrophobicContact CZ2-CB 4.06Å; V637-W639 PolarHBondContact O-N 3.19Å; W639-E641 PolarHBondContact O-N 2.93Å; W639-F642 AromaticContact CE3-CD2 3.61Å; W639-F642 HydrophobicContact CE3-CD2 3.61Å; W639-F642 AromaticContact CE3-CE2 3.99Å; W639-F642 HydrophobicContact CE3-CE2 3.99Å; W639-F642 HydrophobicContact CE3-CG 4.25Å; W639-F642 AromaticContact CZ3-CD2 3.95Å; W639-F642 HydrophobicContact CZ3-CD2 3.95Å; W639-F642 AromaticContact CZ3-CE2 3.98Å; W639-F642 HydrophobicContact CZ3-CE2 3.98Å; W639-F642 HydrophobicContact CZ3-CG 4.46Å; W639-F642 PolarHBondContact O-N 2.77Å; W639-F642 VanDerWaalsContact O-N 3.09Å; W639-L712 HydrophobicContact CE3-CD2 4.47Å; W639-L712 HydrophobicContact CZ3-CD2 4.49Å; W639-L715 HydrophobicContact CH2-CD1 3.92Å; W639-L715 HydrophobicContact CZ3-CD1 4.38Å; W639-M719 HydrophobicContact CZ2-SD 3.78Å
640	A	52.9	Low	49.1	Very low	20 Å²	20	85.9 Å²	85.9	17%	0.165	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-55.7	-31.8	167.9	0	0	0	0	0	112.8	W548 S638 F642 C643	W548-A640 HydrophobicContact CE3-CB 4.13Å; W548-A640 HydrophobicContact CH2-CB 3.88Å; W548-A640 HydrophobicContact CZ2-CB 4.38Å; W548-A640 HydrophobicContact CZ3-CB 3.76Å; S638-A640 PolarHBondContact O-N 3.3Å; S638-A640 VanDerWaalsContact OG-CB 3.28Å; S638-A640 WeakPolarHBondContact OG-CB 3.44Å; S638-A640 PolarHBondContact OG-N 2.85Å; A640-F642 PolarHBondContact O-N 2.66Å; A640-F642 VanDerWaalsContact O-N 3.16Å; A640-C643 PolarHBondContact O-N 3.07Å
641	E	50.5	Low	49	Very low	108 Å²	108	84.6 Å²	84.6	51%	0.505	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-61.5	-20.7	176.4	-69.2	-171.9	-154.2	0	0	113.8	S638 W639	S638-E641 WeakPolarHBondContact O-CB 3.49Å; S638-E641 PolarHBondContact O-N 2.85Å; W639-E641 PolarHBondContact O-N 2.93Å
642	F	53.2	Low	49.1	Very low	71 Å²	71	77.5 Å²	77.5	31%	0.311	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-98.1	-1.7	177.6	-64.9	-88	0	0	0	113.2	V637 W639 A640 F697	V637-F642 HydrophobicContact CG1-CE2 4.4Å; W639-F642 AromaticContact CE3-CD2 3.61Å; W639-F642 HydrophobicContact CE3-CD2 3.61Å; W639-F642 AromaticContact CE3-CE2 3.99Å; W639-F642 HydrophobicContact CE3-CE2 3.99Å; W639-F642 HydrophobicContact CE3-CG 4.25Å; W639-F642 AromaticContact CZ3-CD2 3.95Å; W639-F642 HydrophobicContact CZ3-CD2 3.95Å; W639-F642 AromaticContact CZ3-CE2 3.98Å; W639-F642 HydrophobicContact CZ3-CE2 3.98Å; W639-F642 HydrophobicContact CZ3-CG 4.46Å; W639-F642 PolarHBondContact O-N 2.77Å; W639-F642 VanDerWaalsContact O-N 3.09Å; A640-F642 PolarHBondContact O-N 2.66Å; A640-F642 VanDerWaalsContact O-N 3.16Å; F642-F697 HydrophobicContact CE1-CB 4.43Å
643	C	61.5	Low	49	Very low	11 Å²	11	78.1 Å²	78.1	7%	0.074	45%	0.445	C	S	.	.			trans	-103.8	100.2	-177.3	-169.6	0	0	0	0	111.5	W548 A640 D645 C646 T647	W548-C643 HydrophobicContact CB-CB 3.56Å; W548-C643 WeakPolarHBondContact CB-SG 3.18Å; W548-C643 HydrophobicContact CG-CB 4.24Å; A640-C643 PolarHBondContact O-N 3.07Å; C643-D645 PolarHBondContact O-N 2.97Å; C643-C646 HydrophobicContact CB-CB 4.37Å; C643-C646 VanDerWaalsContact CB-SG 3.55Å; C643-C646 PolarHBondContact O-N 3.36Å; C643-C646 PolarHBondContact SG-SG 2.92Å; C643-T647 PolarHBondContact O-N 3.45Å
644	N	63.8	Low	48.8	Very low	148 Å²	148	82.6 Å²	82.6	79%	0.791	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-19.5	175.1	-58.4	11.1	0	0	0	114	T647	N644-T647 PolarHBondContact O-OG1 3.36Å
645	D	65.4	Low	48.6	Very low	59 Å²	59	88.5 Å²	88.5	32%	0.316	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-12.7	174.6	-67.7	-73.4	0	0	0	114	R376 C546 K547 C643	R376-D645 IonicContact CZ-OD1 2.68Å; R376-D645 IonicContact CZ-OD2 3.06Å; R376-D645 VanDerWaalsContact NH1-CG 3.31Å; R376-D645 IonicContact NH1-OD1 3.74Å; R376-D645 PolarHBondContact NH1-OD1 3.2Å; R376-D645 IonicContact NH1-OD2 3.04Å; R376-D645 PolarHBondContact NH1-OD2 2.91Å; R376-D645 IonicContact NH2-OD1 2.88Å; R376-D645 PolarHBondContact NH2-OD1 3.3Å; C546-D645 HydrophobicContact CB-CB 3.36Å; K547-D645 WeakPolarHBondContact CD-OD2 3.43Å; K547-D645 WeakPolarHBondContact CE-OD2 3.34Å; K547-D645 VanDerWaalsContact CG-OD2 3.23Å; K547-D645 WeakPolarHBondContact CG-OD2 3.34Å; K547-D645 IonicContact NZ-OD1 3.17Å; K547-D645 IonicContact NZ-OD2 2.8Å; K547-D645 PolarHBondContact NZ-OD2 2.94Å; C643-D645 PolarHBondContact O-N 2.97Å
646	C	59.3	Low	48.3	Very low	39 Å²	39	96 Å²	96	26%	0.264	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-0.8	-179.2	-27.4	0	0	0	0	113.8	C546 C643 N648	C546-C646 HydrophobicContact CB-CB 4.09Å; C546-C646 WeakPolarHBondContact CB-SG 3.45Å; C546-C646 WeakPolarHBondContact SG-CB 3.27Å; C546-C646 CovalentContact SG-SG 2.05Å; C546-C646 PolarHBondContact SG-SG 3.48Å; C643-C646 HydrophobicContact CB-CB 4.37Å; C643-C646 VanDerWaalsContact CB-SG 3.55Å; C643-C646 PolarHBondContact O-N 3.36Å; C643-C646 PolarHBondContact SG-SG 2.92Å; C646-N648 PolarHBondContact O-N 2.9Å
647	T	51.5	Low	48	Very low	70 Å²	70	98.4 Å²	98.4	43%	0.429	49%	0.49	S	S	.	.			trans	-73.3	91.2	-176.7	45.4	0	0	0	0	112.7	C643 N644	C643-T647 PolarHBondContact O-N 3.45Å; N644-T647 PolarHBondContact O-OG1 3.36Å
648	N	47.6	Very low	47.8	Very low	77 Å²	77	101.6 Å²	101.6	41%	0.412	52%	0.515	S	S	.	.			trans	-68.4	122.9	163	177.1	-7.8	0	0	0	109.2	C646 E650 F651	C646-N648 PolarHBondContact O-N 2.9Å; N648-E650 PolarHBondContact O-N 3.17Å; N648-E650 PolarHBondContact OD1-N 2.63Å; N648-F651 HydrophobicContact CB-CB 4.37Å; N648-F651 PolarHBondContact O-N 3.36Å; N648-F651 VanDerWaalsContact O-N 3.1Å
649	P	43.8	Very low	47.4	Very low	112 Å²	112	105.1 Å²	105.1	73%	0.727	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.1	-179.2	23.1	-34.3	0	0	0	114.1	F651	P649-F651 PolarHBondContact O-N 2.85Å
650	E	41.2	Very low	47	Very low	151 Å²	151	108 Å²	108	71%	0.706	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-33.8	177.6	-62.9	-169.1	127	0	0	112.6	N648 V652 S653	N648-E650 PolarHBondContact O-N 3.17Å; N648-E650 PolarHBondContact OD1-N 2.63Å; E650-V652 PolarHBondContact O-N 2.75Å; E650-S653 PolarHBondContact O-N 3.49Å; E650-S653 PolarHBondContact O-OG 2.66Å
651	F	39.9	Very low	46.7	Very low	157 Å²	157	109.1 Å²	109.1	69%	0.689	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-74.3	-30.4	-171.3	-146.3	-99.7	0	0	0	112.8	N648 P649 S653 R654	N648-F651 HydrophobicContact CB-CB 4.37Å; N648-F651 PolarHBondContact O-N 3.36Å; N648-F651 VanDerWaalsContact O-N 3.1Å; P649-F651 PolarHBondContact O-N 2.85Å; F651-S653 PolarHBondContact O-N 2.67Å; F651-S653 VanDerWaalsContact O-N 3.09Å; F651-R654 PolarHBondContact O-N 3.23Å
652	V	42.9	Very low	47.2	Very low	88 Å²	88	104.2 Å²	104.2	53%	0.533	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-62.2	-17.9	179	-177.5	0	0	0	0	112.5	E650	E650-V652 PolarHBondContact O-N 2.75Å
653	S	39.6	Very low	47.8	Very low	87 Å²	87	103.3 Å²	103.3	61%	0.608	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-79.9	-26.6	-177.6	70.1	0	0	0	0	114.9	E650 F651	E650-S653 PolarHBondContact O-N 3.49Å; E650-S653 PolarHBondContact O-OG 2.66Å; F651-S653 PolarHBondContact O-N 2.67Å; F651-S653 VanDerWaalsContact O-N 3.09Å
654	R	36.7	Very low	48	Very low	226 Å²	226	105.1 Å²	105.1	85%	0.853	54%	0.544	S	S	*	.	S	Bend	trans	-101.6	2.7	-162.6	-74	-172.5	179	179.5	1.3	117.1	F651	F651-R654 PolarHBondContact O-N 3.23Å
655	K	36.6	Very low	47.6	Very low	164 Å²	164	101.3 Å²	101.3	71%	0.713	52%	0.523	S	S	*	.			trans	-141.8	31.3	-177.3	-118.6	177.4	-174.4	178.9	0	117	L657	K655-L657 PolarHBondContact O-N 3.32Å
656	R	34.5	Very low	47	Very low	221 Å²	221	102.6 Å²	102.6	83%	0.834	53%	0.532	S	S	*	.			trans	-71.8	60.9	166.6	-70.8	-166.8	-177.2	-172.7	4.3	112.7	S658	R656-S658 PolarHBondContact O-N 3.45Å; R656-S658 VanDerWaalsContact O-N 3.1Å
657	L	37	Very low	46.9	Very low	135 Å²	135	106.3 Å²	106.3	71%	0.707	55%	0.546	S	S	*	.			trans	-74.4	95	161.8	-85.5	167.9	0	0	0	108.3	K655 L659	K655-L657 PolarHBondContact O-N 3.32Å; L657-L659 PolarHBondContact O-N 3.04Å
658	S	41.6	Very low	47	Very low	116 Å²	116	108 Å²	108	81%	0.811	56%	0.558	S	S	*	*			trans	-73	71.5	172.3	56.4	0	0	0	0	110.6	R656	R656-S658 PolarHBondContact O-N 3.45Å; R656-S658 VanDerWaalsContact O-N 3.1Å
659	L	41.4	Very low	47.6	Very low	99 Å²	99	108.6 Å²	108.6	52%	0.518	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-54.3	133.5	166	-77	163.2	0	0	0	108.8	S635 L657 L661 L692	S635-L659 WeakPolarHBondContact OG-CD1 3.44Å; L657-L659 PolarHBondContact O-N 3.04Å; L659-L661 PolarHBondContact O-N 3.32Å; L659-L692 HydrophobicContact CB-CD2 4.09Å
660	P	46.2	Very low	48.5	Very low	108 Å²	108	112.1 Å²	112.1	70%	0.701	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-60.7	139.7	177.2	26.2	-33.6	0	0	0	109.4	H662 L692	P660-H662 PolarHBondContact O-N 3.06Å; P660-L692 WeakPolarHBondContact O-CD1 3.36Å
661	L	46.7	Very low	49.8	Very low	44 Å²	44	111.3 Å²	111.3	23%	0.23	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-61.2	138.4	172.3	-71.4	172	0	0	0	108.9	L659 V666 L692	L659-L661 PolarHBondContact O-N 3.32Å; L661-V666 HydrophobicContact CB-CB 4.32Å; L661-V666 HydrophobicContact CB-CG1 3.6Å; L661-V666 HydrophobicContact CB-CG2 3.82Å; L661-V666 HydrophobicContact CD1-CG1 3.55Å; L661-V666 HydrophobicContact CG-CG1 4.19Å; L661-V666 VanDerWaalsContact O-CG2 3.26Å; L661-V666 WeakPolarHBondContact O-CG2 3.29Å; L661-L692 HydrophobicContact CD2-CB 4.15Å; L661-L692 WeakPolarHBondContact CD2-O 3.19Å
662	H	60.7	Low	51	Low	6 Å²	6	109.7 Å²	109.7	3%	0.028	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-54.6	139.7	179.6	-167.5	-94.7	0	0	0	109.9	P660 F664 I665 V666 L681 D684 Y685 Q688 L692	P660-H662 PolarHBondContact O-N 3.06Å; H662-F664 WeakPolarHBondContact ND1-CB 3.33Å; H662-F664 PolarHBondContact ND1-N 2.81Å; H662-F664 PolarHBondContact O-N 3.03Å; H662-I665 PolarHBondContact O-N 3.34Å; H662-V666 WeakPolarHBondContact O-CG2 3.1Å; H662-V666 PolarHBondContact O-N 2.91Å; H662-L681 PolarHBondContact CE1-O 3.07Å; H662-L681 VanDerWaalsContact CE1-O 3.22Å; H662-D684 IonicContact CE1-OD2 3.11Å; H662-D684 IonicContact NE2-OD2 3.32Å; H662-D684 PolarHBondContact NE2-OD2 2.94Å; H662-Y685 HydrophobicContact CB-CD2 3.84Å; H662-Y685 HydrophobicContact CB-CE2 4.38Å; H662-Y685 PolarHBondContact CE1-N 3.25Å; H662-Y685 AromaticContact CG-CD2 3.78Å; H662-Y685 AromaticContact ND1-CD2 3.92Å; H662-Q688 PolarHBondContact CD2-OE1 3.5Å; H662-Q688 PolarHBondContact NE2-NE2 3.15Å; H662-L692 HydrophobicContact CB-CD1 4.09Å
663	P	65.4	Low	51.7	Low	51 Å²	51	108.1 Å²	108.1	33%	0.331	54%	0.544	S	S	.	.	H	α-helix	trans	-54.9	-34.1	-173.3	-27.2	34.8	0	0	0	113.6	I665 V666 Q667 L681	P663-I665 PolarHBondContact O-N 3.36Å; P663-I665 VanDerWaalsContact O-N 3.12Å; P663-V666 PolarHBondContact O-N 2.92Å; P663-Q667 HydrophobicContact CB-CG 4.3Å; P663-Q667 VanDerWaalsContact O-CB 3.29Å; P663-Q667 WeakPolarHBondContact O-CB 3.33Å; P663-Q667 WeakPolarHBondContact O-CG 3.34Å; P663-Q667 PolarHBondContact O-N 2.78Å; P663-L681 HydrophobicContact CB-CD2 3.85Å; P663-L681 HydrophobicContact CG-CD2 4.45Å
664	F	65.8	Low	52.5	Low	49 Å²	49	109.1 Å²	109.1	22%	0.215	54%	0.542	C	S	.	.	H	α-helix	trans	-53.1	-26.2	171.2	-171.3	-107.1	0	0	0	115.7	H662 L669 T678 L681 L682 Y685	H662-F664 WeakPolarHBondContact ND1-CB 3.33Å; H662-F664 PolarHBondContact ND1-N 2.81Å; H662-F664 PolarHBondContact O-N 3.03Å; F664-L669 HydrophobicContact CD2-CD2 4.25Å; F664-L669 HydrophobicContact CE2-CD1 4.16Å; F664-L669 HydrophobicContact CE2-CD2 4.26Å; F664-L669 HydrophobicContact CZ-CD1 4.49Å; F664-T678 HydrophobicContact CE2-CG2 4.12Å; F664-L681 HydrophobicContact CB-CB 4.11Å; F664-L681 HydrophobicContact CD2-CB 3.88Å; F664-L681 HydrophobicContact CG-CB 4.44Å; F664-L682 HydrophobicContact CD2-CB 4.36Å; F664-L682 HydrophobicContact CE1-CD1 3.94Å; F664-L682 HydrophobicContact CE2-CB 3.92Å; F664-L682 HydrophobicContact CE2-CD1 4.41Å; F664-L682 HydrophobicContact CZ-CB 4.19Å; F664-L682 HydrophobicContact CZ-CD1 3.82Å; F664-L682 HydrophobicContact CZ-CG 4.44Å; F664-Y685 HydrophobicContact CD1-CD1 4.19Å; F664-Y685 HydrophobicContact CD1-CG 4.32Å
665	I	55.8	Low	54.2	Low	69 Å²	69	101.1 Å²	101.1	35%	0.354	52%	0.515	S	S	.	.	H	α-helix	trans	-97.7	-34.1	-178.1	-65.4	179.9	0	0	0	112.1	H662 P663 Y685	H662-I665 PolarHBondContact O-N 3.34Å; P663-I665 PolarHBondContact O-N 3.36Å; P663-I665 VanDerWaalsContact O-N 3.12Å; I665-Y685 HydrophobicContact CD1-CD2 4.42Å; I665-Y685 HydrophobicContact CD1-CE2 3.57Å; I665-Y685 HydrophobicContact CG1-CE2 4.31Å
666	V	52.2	Low	55.3	Low	85 Å²	85	95 Å²	95	52%	0.515	49%	0.49	S	S	.	.	H	α-helix	trans	-98.1	-27.5	-176	-95.1	0	0	0	0	114.6	L661 H662 P663	L661-V666 HydrophobicContact CB-CB 4.32Å; L661-V666 HydrophobicContact CB-CG1 3.6Å; L661-V666 HydrophobicContact CB-CG2 3.82Å; L661-V666 HydrophobicContact CD1-CG1 3.55Å; L661-V666 HydrophobicContact CG-CG1 4.19Å; L661-V666 VanDerWaalsContact O-CG2 3.26Å; L661-V666 WeakPolarHBondContact O-CG2 3.29Å; H662-V666 WeakPolarHBondContact O-CG2 3.1Å; H662-V666 PolarHBondContact O-N 2.91Å; P663-V666 PolarHBondContact O-N 2.92Å
667	Q	58.6	Low	56.8	Low	118 Å²	118	86.7 Å²	86.7	55%	0.551	46%	0.462	S	S	*	.	S	Bend	trans	-83	130.2	175.7	-61.8	-173.9	-3.3	0	0	109.3	P663 L669	P663-Q667 HydrophobicContact CB-CG 4.3Å; P663-Q667 VanDerWaalsContact O-CB 3.29Å; P663-Q667 WeakPolarHBondContact O-CB 3.33Å; P663-Q667 WeakPolarHBondContact O-CG 3.34Å; P663-Q667 PolarHBondContact O-N 2.78Å; Q667-L669 PolarHBondContact O-N 3.2Å
668	P	53.4	Low	58.4	Low	104 Å²	104	80.7 Å²	80.7	68%	0.675	43%	0.43	S	S	*	.			trans	-57.4	129.4	168.9	-22.7	33.3	0	0	0	109.8	K670	P668-K670 PolarHBondContact O-N 3.23Å
669	L	59.5	Low	59.4	Low	90 Å²	90	80.1 Å²	80.1	47%	0.471	41%	0.411	S	S	.	.			trans	-69.7	81.3	174.3	-67.2	178.6	0	0	0	110	F664 Q667 R671 T678	F664-L669 HydrophobicContact CD2-CD2 4.25Å; F664-L669 HydrophobicContact CE2-CD1 4.16Å; F664-L669 HydrophobicContact CE2-CD2 4.26Å; F664-L669 HydrophobicContact CZ-CD1 4.49Å; Q667-L669 PolarHBondContact O-N 3.2Å; L669-R671 PolarHBondContact O-N 3.36Å; L669-T678 HydrophobicContact CD1-CG2 4.24Å; L669-T678 HydrophobicContact CD2-CG2 3.91Å
670	K	62	Low	60.5	Low	187 Å²	187	79.9 Å²	79.9	81%	0.813	40%	0.403	S	S	*	.			trans	-65.5	-23.7	177	-65.7	-178.7	-179.5	-178.5	0	112.4	P668	P668-K670 PolarHBondContact O-N 3.23Å
671	R	69	Low	61.3	Low	134 Å²	134	76.6 Å²	76.6	51%	0.506	38%	0.379	S	S	.	.	S	Bend	trans	-105.5	156.5	-179	-61.6	179.6	171	-170	-9.4	109.8	L669 H675 D677	L669-R671 PolarHBondContact O-N 3.36Å; R671-H675 HydrophobicContact CB-CB 3.9Å; R671-H675 PolarHBondContact NH1-CE1 2.87Å; R671-D677 IonicContact CZ-OD2 4Å; R671-D677 IonicContact NH1-OD2 3.36Å; R671-D677 PolarHBondContact NH1-OD2 3.3Å
672	K	65.2	Low	62.1	Low	122 Å²	122	76.8 Å²	76.8	53%	0.53	38%	0.38	S	S	.	.			trans	-69.1	157.3	-176.5	-63.8	-175.2	-175.9	-175.1	0	111.6	S139 N674 H675	S139-K672 PolarHBondContact OG-NZ 3.27Å; K672-N674 WeakPolarHBondContact CB-OD1 3.48Å; K672-N674 PolarHBondContact O-N 2.94Å; K672-N674 VanDerWaalsContact O-N 3.09Å; K672-H675 WeakPolarHBondContact O-CB 3.21Å; K672-H675 PolarHBondContact O-N 3.11Å
673	A	58.3	Low	62	Low	55 Å²	55	79 Å²	79	46%	0.455	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.5	-176.1	0	0	0	0	0	114.5
674	N	55.8	Low	61.8	Low	108 Å²	108	80 Å²	80	58%	0.578	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-5.5	176.2	69.1	-41.1	0	0	0	114.6	K672	K672-N674 WeakPolarHBondContact CB-OD1 3.48Å; K672-N674 PolarHBondContact O-N 2.94Å; K672-N674 VanDerWaalsContact O-N 3.09Å
675	H	71.8	Confident	61.4	Low	59 Å²	59	79.2 Å²	79.2	27%	0.273	40%	0.397	S	S	.	.	S	Bend	trans	-64	144.9	177.7	-162.8	-78.8	0	0	0	110.9	R671 K672 D677 T678 R679	R671-H675 HydrophobicContact CB-CB 3.9Å; R671-H675 PolarHBondContact NH1-CE1 2.87Å; K672-H675 WeakPolarHBondContact O-CB 3.21Å; K672-H675 PolarHBondContact O-N 3.11Å; H675-D677 IonicContact CE1-OD2 2.79Å; H675-D677 PolarHBondContact CE1-OD2 2.59Å; H675-D677 PolarHBondContact ND1-N 3.32Å; H675-D677 IonicContact ND1-OD2 2.9Å; H675-D677 PolarHBondContact ND1-OD2 3.11Å; H675-D677 PolarHBondContact O-N 3.39Å; H675-T678 WeakPolarHBondContact O-CA 3.28Å; H675-T678 PolarHBondContact O-N 3.18Å; H675-R679 PolarHBondContact O-N 3.2Å
676	L	60.3	Low	61.3	Low	36 Å²	36	83.3 Å²	83.3	19%	0.188	41%	0.409	C	S	.	.	H	α-helix	trans	-57.7	-50.3	-175.6	-176.5	74.3	0	0	0	112.1	T678 R679 R680 E1285 E1286	L676-T678 PolarHBondContact O-N 3.28Å; L676-T678 VanDerWaalsContact O-N 3.16Å; L676-R679 CarbonylContact O-C 3.58Å; L676-R679 WeakPolarHBondContact O-CA 3.3Å; L676-R679 WeakPolarHBondContact O-CB 3.44Å; L676-R679 PolarHBondContact O-N 2.97Å; L676-R680 HydrophobicContact CD1-CG 4.43Å; L676-R680 HydrophobicContact CG-CG 4.2Å; L676-R680 WeakPolarHBondContact O-CB 3.34Å; L676-R680 PolarHBondContact O-N 3.47Å; L676-E1285 HydrophobicContact CD2-CB 3.58Å; L676-E1285 HydrophobicContact CD2-CG 3.93Å; L676-E1285 WeakPolarHBondContact CD2-OE2 3.3Å; L676-E1286 HydrophobicContact CD1-CB 3.79Å; L676-E1286 HydrophobicContact CD2-CB 3.63Å; L676-E1286 HydrophobicContact CG-CB 4.32Å
677	D	66.8	Low	61.1	Low	46 Å²	46	83.5 Å²	83.5	25%	0.246	42%	0.419	C	S	.	.	H	α-helix	trans	-54.9	-35.2	175.2	-51.1	-59.2	0	0	0	113.5	R671 H675 R680 L681	R671-D677 IonicContact CZ-OD2 4Å; R671-D677 IonicContact NH1-OD2 3.36Å; R671-D677 PolarHBondContact NH1-OD2 3.3Å; H675-D677 IonicContact CE1-OD2 2.79Å; H675-D677 PolarHBondContact CE1-OD2 2.59Å; H675-D677 PolarHBondContact ND1-N 3.32Å; H675-D677 IonicContact ND1-OD2 2.9Å; H675-D677 PolarHBondContact ND1-OD2 3.11Å; H675-D677 PolarHBondContact O-N 3.39Å; D677-R680 PolarHBondContact O-N 3.3Å; D677-L681 WeakPolarHBondContact O-CB 3.12Å; D677-L681 VanDerWaalsContact O-CG 3.23Å; D677-L681 WeakPolarHBondContact O-CG 3.26Å; D677-L681 PolarHBondContact O-N 2.87Å
678	T	69.6	Low	60.7	Low	8 Å²	8	82.2 Å²	82.2	5%	0.049	41%	0.413	C	S	.	.	H	α-helix	trans	-75	-35.3	179.3	-54.1	0	0	0	0	110.8	F664 L669 H675 L676 L682	F664-T678 HydrophobicContact CE2-CG2 4.12Å; L669-T678 HydrophobicContact CD1-CG2 4.24Å; L669-T678 HydrophobicContact CD2-CG2 3.91Å; H675-T678 WeakPolarHBondContact O-CA 3.28Å; H675-T678 PolarHBondContact O-N 3.18Å; L676-T678 PolarHBondContact O-N 3.28Å; L676-T678 VanDerWaalsContact O-N 3.16Å; T678-L682 WeakPolarHBondContact O-CB 3.46Å; T678-L682 PolarHBondContact O-N 3.12Å
679	R	63.7	Low	60.4	Low	104 Å²	104	78 Å²	78	39%	0.392	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-44.7	166.4	-74.1	178	61.9	169	-4.5	111.7	H675 L676 L682 A683 E1383	H675-R679 PolarHBondContact O-N 3.2Å; L676-R679 CarbonylContact O-C 3.58Å; L676-R679 WeakPolarHBondContact O-CA 3.3Å; L676-R679 WeakPolarHBondContact O-CB 3.44Å; L676-R679 PolarHBondContact O-N 2.97Å; R679-L682 PolarHBondContact O-N 3.45Å; R679-A683 WeakPolarHBondContact O-CB 3.48Å; R679-A683 PolarHBondContact O-N 3.4Å; R679-E1383 IonicContact CZ-OE1 2.58Å; R679-E1383 IonicContact CZ-OE2 2.75Å; R679-E1383 IonicContact NH1-OE1 2.95Å; R679-E1383 PolarHBondContact NH1-OE1 3.44Å; R679-E1383 IonicContact NH1-OE2 2.69Å; R679-E1383 IonicContact NH2-OE1 2.78Å; R679-E1383 PolarHBondContact NH2-OE1 3.23Å; R679-E1383 IonicContact NH2-OE2 3.82Å; R679-E1383 PolarHBondContact NH2-OE2 3.36Å
680	R	62.9	Low	59.8	Low	95 Å²	95	74.2 Å²	74.2	36%	0.358	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-49.9	178.7	-78.8	179.6	161.7	-174.5	-11.1	111.9	L676 D677 L682 A683 D684 E1286	L676-R680 HydrophobicContact CD1-CG 4.43Å; L676-R680 HydrophobicContact CG-CG 4.2Å; L676-R680 WeakPolarHBondContact O-CB 3.34Å; L676-R680 PolarHBondContact O-N 3.47Å; D677-R680 PolarHBondContact O-N 3.3Å; R680-L682 VanDerWaalsContact C-N 3.28Å; R680-L682 PolarHBondContact O-N 2.83Å; R680-A683 CarbonylContact O-C 3.53Å; R680-A683 PolarHBondContact O-N 2.95Å; R680-A683 VanDerWaalsContact O-N 3.13Å; R680-D684 VanDerWaalsContact O-CB 3.3Å; R680-D684 WeakPolarHBondContact O-CB 3.48Å; R680-D684 PolarHBondContact O-N 2.8Å; R680-E1286 IonicContact CZ-OE2 3.9Å; R680-E1286 IonicContact NE-OE2 3.19Å; R680-E1286 PolarHBondContact NE-OE2 3.28Å; R680-E1286 VanDerWaalsContact NH2-CB 3.35Å; R680-E1286 IonicContact NH2-OE2 3.52Å; R680-E1286 PolarHBondContact NH2-OE2 2.88Å
681	L	64.6	Low	59.1	Low	39 Å²	39	71 Å²	71	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-33.6	175.4	-77.2	169.1	0	0	0	112.3	H662 P663 F664 D677 Y685	H662-L681 PolarHBondContact CE1-O 3.07Å; H662-L681 VanDerWaalsContact CE1-O 3.22Å; P663-L681 HydrophobicContact CB-CD2 3.85Å; P663-L681 HydrophobicContact CG-CD2 4.45Å; F664-L681 HydrophobicContact CB-CB 4.11Å; F664-L681 HydrophobicContact CD2-CB 3.88Å; F664-L681 HydrophobicContact CG-CB 4.44Å; D677-L681 WeakPolarHBondContact O-CB 3.12Å; D677-L681 VanDerWaalsContact O-CG 3.23Å; D677-L681 WeakPolarHBondContact O-CG 3.26Å; D677-L681 PolarHBondContact O-N 2.87Å; L681-Y685 WeakPolarHBondContact O-CB 3.43Å; L681-Y685 PolarHBondContact O-N 3.17Å
682	L	62.4	Low	58	Low	48 Å²	48	66 Å²	66	25%	0.251	34%	0.341	S	S	.	.	H	α-helix	trans	-74.3	-35.8	172.4	179.6	58.8	0	0	0	112.3	F664 T678 R679 R680 Y685 R686	F664-L682 HydrophobicContact CD2-CB 4.36Å; F664-L682 HydrophobicContact CE1-CD1 3.94Å; F664-L682 HydrophobicContact CE2-CB 3.92Å; F664-L682 HydrophobicContact CE2-CD1 4.41Å; F664-L682 HydrophobicContact CZ-CB 4.19Å; F664-L682 HydrophobicContact CZ-CD1 3.82Å; F664-L682 HydrophobicContact CZ-CG 4.44Å; T678-L682 WeakPolarHBondContact O-CB 3.46Å; T678-L682 PolarHBondContact O-N 3.12Å; R679-L682 PolarHBondContact O-N 3.45Å; R680-L682 VanDerWaalsContact C-N 3.28Å; R680-L682 PolarHBondContact O-N 2.83Å; L682-Y685 HydrophobicContact CD1-CD1 4.45Å; L682-R686 WeakPolarHBondContact O-CB 3.32Å; L682-R686 WeakPolarHBondContact O-CD 3.27Å; L682-R686 WeakPolarHBondContact O-CG 3.33Å; L682-R686 PolarHBondContact O-N 3Å
683	A	59.3	Low	57.1	Low	51 Å²	51	63.9 Å²	63.9	42%	0.421	34%	0.335	S	S	.	.	H	α-helix	trans	-71.8	-42.6	177.4	0	0	0	0	0	111.9	R679 R680 R686 A687	R679-A683 WeakPolarHBondContact O-CB 3.48Å; R679-A683 PolarHBondContact O-N 3.4Å; R680-A683 CarbonylContact O-C 3.53Å; R680-A683 PolarHBondContact O-N 2.95Å; R680-A683 VanDerWaalsContact O-N 3.13Å; A683-R686 CarbonylContact O-C 3.56Å; A683-R686 WeakPolarHBondContact O-CB 3.37Å; A683-R686 PolarHBondContact O-N 2.81Å; A683-A687 WeakPolarHBondContact O-CB 3.29Å; A683-A687 PolarHBondContact O-N 3.26Å
684	D	60.2	Low	56.3	Low	72 Å²	72	64 Å²	64	39%	0.385	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-45.3	172.3	-173.8	28.1	0	0	0	110.6	H662 R680 R686 A687 Q688	H662-D684 IonicContact CE1-OD2 3.11Å; H662-D684 IonicContact NE2-OD2 3.32Å; H662-D684 PolarHBondContact NE2-OD2 2.94Å; R680-D684 VanDerWaalsContact O-CB 3.3Å; R680-D684 WeakPolarHBondContact O-CB 3.48Å; R680-D684 PolarHBondContact O-N 2.8Å; D684-R686 PolarHBondContact O-N 3.01Å; D684-A687 PolarHBondContact O-N 3.21Å; D684-Q688 WeakPolarHBondContact O-CB 3.48Å; D684-Q688 VanDerWaalsContact O-CG 3.32Å; D684-Q688 WeakPolarHBondContact O-CG 3.41Å; D684-Q688 PolarHBondContact O-N 3.17Å; D684-Q688 PolarHBondContact OD1-NE2 3.15Å; D684-Q688 PolarHBondContact OD2-NE2 2.77Å
685	Y	57.2	Low	55.6	Low	33 Å²	33	67 Å²	67	13%	0.129	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-37.9	172.1	180	-114.2	0	0	0	112.6	H662 F664 I665 L681 L682 G689 G690	H662-Y685 HydrophobicContact CB-CD2 3.84Å; H662-Y685 HydrophobicContact CB-CE2 4.38Å; H662-Y685 PolarHBondContact CE1-N 3.25Å; H662-Y685 AromaticContact CG-CD2 3.78Å; H662-Y685 AromaticContact ND1-CD2 3.92Å; F664-Y685 HydrophobicContact CD1-CD1 4.19Å; F664-Y685 HydrophobicContact CD1-CG 4.32Å; I665-Y685 HydrophobicContact CD1-CD2 4.42Å; I665-Y685 HydrophobicContact CD1-CE2 3.57Å; I665-Y685 HydrophobicContact CG1-CE2 4.31Å; L681-Y685 WeakPolarHBondContact O-CB 3.43Å; L681-Y685 PolarHBondContact O-N 3.17Å; L682-Y685 HydrophobicContact CD1-CD1 4.45Å; Y685-G689 PolarHBondContact O-N 3.44Å; Y685-G690 VanDerWaalsContact CZ-CA 3.48Å; Y685-G690 WeakPolarHBondContact O-CA 3.3Å; Y685-G690 PolarHBondContact O-N 3.28Å; Y685-G690 PolarHBondContact OH-O 3.17Å
686	R	53.8	Low	54.1	Low	156 Å²	156	67.9 Å²	67.9	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-71.6	-46.2	174.5	-75.6	164.7	176.1	177.8	-3	112.3	L682 A683 D684 Q688 G689	L682-R686 WeakPolarHBondContact O-CB 3.32Å; L682-R686 WeakPolarHBondContact O-CD 3.27Å; L682-R686 WeakPolarHBondContact O-CG 3.33Å; L682-R686 PolarHBondContact O-N 3Å; A683-R686 CarbonylContact O-C 3.56Å; A683-R686 WeakPolarHBondContact O-CB 3.37Å; A683-R686 PolarHBondContact O-N 2.81Å; D684-R686 PolarHBondContact O-N 3.01Å; R686-Q688 VanDerWaalsContact C-N 3.35Å; R686-Q688 PolarHBondContact O-N 2.6Å; R686-G689 WeakPolarHBondContact O-CA 3.32Å; R686-G689 PolarHBondContact O-N 2.57Å
687	A	48.8	Very low	53.2	Low	89 Å²	89	68.1 Å²	68.1	74%	0.736	35%	0.35	S	S	*	.	H	α-helix	trans	-64.8	-37.6	179.5	0	0	0	0	0	112.2	A683 D684 G689	A683-A687 WeakPolarHBondContact O-CB 3.29Å; A683-A687 PolarHBondContact O-N 3.26Å; D684-A687 PolarHBondContact O-N 3.21Å; A687-G689 PolarHBondContact O-N 2.97Å
688	Q	51.2	Low	52	Low	90 Å²	90	73.1 Å²	73.1	42%	0.421	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-8.1	170	-65.4	-177.2	30.5	0	0	113	H662 D684 R686 K691	H662-Q688 PolarHBondContact CD2-OE1 3.5Å; H662-Q688 PolarHBondContact NE2-NE2 3.15Å; D684-Q688 WeakPolarHBondContact O-CB 3.48Å; D684-Q688 VanDerWaalsContact O-CG 3.32Å; D684-Q688 WeakPolarHBondContact O-CG 3.41Å; D684-Q688 PolarHBondContact O-N 3.17Å; D684-Q688 PolarHBondContact OD1-NE2 3.15Å; D684-Q688 PolarHBondContact OD2-NE2 2.77Å; R686-Q688 VanDerWaalsContact C-N 3.35Å; R686-Q688 PolarHBondContact O-N 2.6Å; Q688-K691 VanDerWaalsContact O-CD 3.27Å; Q688-K691 WeakPolarHBondContact O-CD 3.35Å; Q688-K691 WeakPolarHBondContact O-CE 3.47Å; Q688-K691 WeakPolarHBondContact O-CG 3.33Å; Q688-K691 PolarHBondContact O-NZ 2.96Å
689	G	45.7	Very low	50.7	Low	15 Å²	15	76.5 Å²	76.5	16%	0.155	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	14.9	171.7	0	0	0	0	0	116.1	Y685 R686 A687 K691 T722	Y685-G689 PolarHBondContact O-N 3.44Å; R686-G689 WeakPolarHBondContact O-CA 3.32Å; R686-G689 PolarHBondContact O-N 2.57Å; A687-G689 PolarHBondContact O-N 2.97Å; G689-K691 VanDerWaalsContact C-N 3.34Å; G689-K691 PolarHBondContact O-N 3.19Å; G689-T722 WeakPolarHBondContact O-CB 3.36Å; G689-T722 PolarHBondContact O-OG1 2.82Å; G689-T722 VanDerWaalsContact O-OG1 3.14Å
690	G	47.4	Very low	49.6	Very low	12 Å²	12	76.1 Å²	76.1	12%	0.124	40%	0.396	C	S	.	.	S	Bend	trans	73.4	14.3	172.7	0	0	0	0	0	116.7	Y685 L692	Y685-G690 VanDerWaalsContact CZ-CA 3.48Å; Y685-G690 WeakPolarHBondContact O-CA 3.3Å; Y685-G690 PolarHBondContact O-N 3.28Å; Y685-G690 PolarHBondContact OH-O 3.17Å; G690-L692 VanDerWaalsContact C-N 3.26Å; G690-L692 PolarHBondContact O-N 3.49Å
691	K	46.8	Very low	48.6	Very low	118 Å²	118	74 Å²	74	51%	0.513	40%	0.396	S	S	.	.			trans	-65.4	11.6	-154.4	-64	175.3	179.9	130	0	119.1	Q688 G689	Q688-K691 VanDerWaalsContact O-CD 3.27Å; Q688-K691 WeakPolarHBondContact O-CD 3.35Å; Q688-K691 WeakPolarHBondContact O-CE 3.47Å; Q688-K691 WeakPolarHBondContact O-CG 3.33Å; Q688-K691 PolarHBondContact O-NZ 2.96Å; G689-K691 VanDerWaalsContact C-N 3.34Å; G689-K691 PolarHBondContact O-N 3.19Å
692	L	46.9	Very low	47.5	Very low	31 Å²	31	76.1 Å²	76.1	16%	0.162	41%	0.414	C	S	.	.			trans	-131.1	45.6	-158.8	-68.9	167.6	0	0	0	115.7	L659 P660 L661 H662 G690	L659-L692 HydrophobicContact CB-CD2 4.09Å; P660-L692 WeakPolarHBondContact O-CD1 3.36Å; L661-L692 HydrophobicContact CD2-CB 4.15Å; L661-L692 WeakPolarHBondContact CD2-O 3.19Å; H662-L692 HydrophobicContact CB-CD1 4.09Å; G690-L692 VanDerWaalsContact C-N 3.26Å; G690-L692 PolarHBondContact O-N 3.49Å
693	L	45.1	Very low	46.4	Very low	76 Å²	76	80.6 Å²	80.6	40%	0.398	44%	0.438	S	S	.	.			trans	-100.2	41.6	-179.3	-77.8	168.8	0	0	0	114.9	L715	L693-L715 HydrophobicContact CD1-CD2 3.91Å
694	T	41.6	Very low	45.3	Very low	57 Å²	57	82.5 Å²	82.5	35%	0.35	44%	0.441	S	S	.	.			trans	-94.8	-26.9	-170.1	51.2	0	0	0	0	116.8	V637	V637-T694 HydrophobicContact CG2-CG2 4.06Å
695	K	41.2	Very low	44.3	Very low	171 Å²	171	85.7 Å²	85.7	74%	0.743	46%	0.464	S	S	*	.	S	Bend	trans	-86.9	-40.3	-171.6	-79.7	-170.9	175.9	180	0	115.8	F697	K695-F697 PolarHBondContact O-N 3.36Å
696	S	41.7	Very low	43.5	Very low	78 Å²	78	92.5 Å²	92.5	55%	0.545	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-38.6	-175.2	-171.2	0	0	0	0	112.7	K698 S699	S696-K698 VanDerWaalsContact C-N 3.3Å; S696-K698 PolarHBondContact O-N 2.95Å; S696-K698 VanDerWaalsContact O-N 3.13Å; S696-S699 PolarHBondContact O-N 3.06Å; S696-S699 VanDerWaalsContact O-N 3.11Å; S696-S699 PolarHBondContact O-OG 2.76Å
697	F	41.1	Very low	43.3	Very low	41 Å²	41	87.2 Å²	87.2	18%	0.18	48%	0.484	C	S	.	.	H	α-helix	trans	-60.2	-30.7	-170.4	-106.2	-107	0	0	0	115.5	F642 K695 S699 Q700 C701 A711 L715	F642-F697 HydrophobicContact CE1-CB 4.43Å; K695-F697 PolarHBondContact O-N 3.36Å; F697-S699 VanDerWaalsContact C-N 3.27Å; F697-S699 PolarHBondContact O-N 2.73Å; F697-Q700 PolarHBondContact O-N 2.77Å; F697-C701 PolarHBondContact O-N 3.04Å; F697-C701 VanDerWaalsContact O-N 3.14Å; F697-A711 HydrophobicContact CE1-CB 3.58Å; F697-A711 HydrophobicContact CZ-CB 3.86Å; F697-L715 HydrophobicContact CD1-CD1 4.36Å; F697-L715 HydrophobicContact CE1-CD1 3.54Å; F697-L715 HydrophobicContact CE2-CD1 3.86Å; F697-L715 HydrophobicContact CE2-CD2 4.42Å; F697-L715 HydrophobicContact CE2-CG 4.33Å; F697-L715 HydrophobicContact CZ-CD1 3.25Å; F697-L715 HydrophobicContact CZ-CG 3.94Å
698	K	41	Very low	43.2	Very low	151 Å²	151	86.8 Å²	86.8	66%	0.657	47%	0.472	S	S	*	.	H	α-helix	trans	-69.6	-20.5	180	-75.6	-170.5	174.2	-178.8	0	113.6	S696	S696-K698 VanDerWaalsContact C-N 3.3Å; S696-K698 PolarHBondContact O-N 2.95Å; S696-K698 VanDerWaalsContact O-N 3.13Å
699	S	43.3	Very low	42.9	Very low	80 Å²	80	86 Å²	86	56%	0.559	48%	0.48	S	S	*	.	H	α-helix	trans	-84.5	-25.1	175.8	68.7	0	0	0	0	113.8	S696 F697 S702	S696-S699 PolarHBondContact O-N 3.06Å; S696-S699 VanDerWaalsContact O-N 3.11Å; S696-S699 PolarHBondContact O-OG 2.76Å; F697-S699 VanDerWaalsContact C-N 3.27Å; F697-S699 PolarHBondContact O-N 2.73Å; S699-S702 PolarHBondContact O-OG 3.17Å
700	Q	40.2	Very low	43	Very low	95 Å²	95	87.6 Å²	87.6	44%	0.444	50%	0.497	S	S	.	.	H	α-helix	trans	-86.5	-36.4	176.4	-71.5	-171	-21.1	0	0	112.6	F697 S702	F697-Q700 PolarHBondContact O-N 2.77Å; Q700-S702 VanDerWaalsContact C-N 3.32Å; Q700-S702 PolarHBondContact O-N 3.18Å
701	C	40.7	Very low	42.9	Very low	52 Å²	52	87.7 Å²	87.7	35%	0.351	50%	0.497	S	S	.	.	H	α-helix	trans	-72.3	-19.2	-178.1	-72.7	0	0	0	0	114.5	F697	F697-C701 PolarHBondContact O-N 3.04Å; F697-C701 VanDerWaalsContact O-N 3.14Å
702	S	42.3	Very low	43	Very low	83 Å²	83	84.4 Å²	84.4	58%	0.58	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-28.8	-179.8	56.2	0	0	0	0	113.6	S699 Q700	S699-S702 PolarHBondContact O-OG 3.17Å; Q700-S702 VanDerWaalsContact C-N 3.32Å; Q700-S702 PolarHBondContact O-N 3.18Å
703	N	39.8	Very low	43.1	Very low	142 Å²	142	90.5 Å²	90.5	76%	0.759	51%	0.51	S	S	*	.	S	Bend	trans	-109.2	-2.7	-164.6	-67.3	19.3	0	0	0	114.4
704	N	35.1	Very low	43.1	Very low	91 Å²	91	90.1 Å²	90.1	49%	0.487	52%	0.517	S	S	.	.			trans	-152.2	106	178.2	-159.4	-27.9	0	0	0	113.9	Q706 S707	N704-Q706 PolarHBondContact O-N 2.9Å; N704-Q706 VanDerWaalsContact O-N 3.11Å; N704-Q706 PolarHBondContact OD1-N 3.32Å; N704-S707 PolarHBondContact O-N 2.94Å
705	T	40.4	Very low	43.4	Very low	139 Å²	139	88.3 Å²	88.3	85%	0.853	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.8	-176.5	49.4	0	0	0	0	114.9
706	Q	39.8	Very low	43.9	Very low	175 Å²	175	81.5 Å²	81.5	82%	0.818	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-7.7	178	-61.8	-172.1	-1.8	0	0	114.2	N704	N704-Q706 PolarHBondContact O-N 2.9Å; N704-Q706 VanDerWaalsContact O-N 3.11Å; N704-Q706 PolarHBondContact OD1-N 3.32Å
707	S	50.3	Low	44.1	Very low	46 Å²	46	79.2 Å²	79.2	32%	0.322	47%	0.465	S	S	.	.			trans	-82.5	-33	-167.9	-170.1	0	0	0	0	115.6	N704 A709 G710 A711	N704-S707 PolarHBondContact O-N 2.94Å; S707-A709 VanDerWaalsContact C-N 3.34Å; S707-A709 PolarHBondContact O-N 3.44Å; S707-A709 VanDerWaalsContact O-N 3.13Å; S707-G710 PolarHBondContact O-N 3.4Å; S707-A711 PolarHBondContact O-N 3.34Å
708	T	45.6	Very low	44.2	Very low	79 Å²	79	82.6 Å²	82.6	49%	0.485	48%	0.481	S	S	.	.	H	α-helix	trans	-55.1	-41.3	-163.8	51.9	0	0	0	0	114.6	A711 L712	T708-A711 PolarHBondContact O-N 3.03Å; T708-L712 WeakPolarHBondContact O-CB 3.34Å; T708-L712 WeakPolarHBondContact O-CG 3.07Å; T708-L712 PolarHBondContact O-N 3.02Å
709	A	45.8	Very low	44.3	Very low	73 Å²	73	78.2 Å²	78.2	60%	0.603	46%	0.464	S	S	*	.	H	α-helix	trans	-70.2	-30	178.4	0	0	0	0	0	113.8	S707 K713	S707-A709 VanDerWaalsContact C-N 3.34Å; S707-A709 PolarHBondContact O-N 3.44Å; S707-A709 VanDerWaalsContact O-N 3.13Å; A709-K713 PolarHBondContact O-N 3.43Å
710	G	46.7	Very low	44.5	Very low	49 Å²	49	78.6 Å²	78.6	51%	0.505	45%	0.453	S	S	.	.	H	α-helix	trans	-75	-42.4	174.3	0	0	0	0	0	111.6	S707 K713 A714	S707-G710 PolarHBondContact O-N 3.4Å; G710-K713 PolarHBondContact O-N 2.88Å; G710-A714 PolarHBondContact O-N 3.11Å; G710-A714 VanDerWaalsContact O-N 3.1Å
711	A	46.6	Very low	44.6	Very low	15 Å²	15	82.5 Å²	82.5	12%	0.124	47%	0.469	C	S	.	.	H	α-helix	trans	-67.9	-40.6	180	0	0	0	0	0	112.5	F697 S707 T708 K713 A714 L715	F697-A711 HydrophobicContact CE1-CB 3.58Å; F697-A711 HydrophobicContact CZ-CB 3.86Å; S707-A711 PolarHBondContact O-N 3.34Å; T708-A711 PolarHBondContact O-N 3.03Å; A711-K713 VanDerWaalsContact C-N 3.32Å; A711-K713 PolarHBondContact O-N 2.77Å; A711-A714 PolarHBondContact O-N 3.27Å; A711-L715 PolarHBondContact O-N 3.07Å; A711-L715 VanDerWaalsContact O-N 3.08Å
712	L	47	Very low	44.7	Very low	49 Å²	49	82.5 Å²	82.5	26%	0.257	47%	0.468	S	S	.	.	H	α-helix	trans	-53.6	-48.4	168.6	-82.1	166.7	0	0	0	111.5	W639 T708 A714 L715 E716	W639-L712 HydrophobicContact CE3-CD2 4.47Å; W639-L712 HydrophobicContact CZ3-CD2 4.49Å; T708-L712 WeakPolarHBondContact O-CB 3.34Å; T708-L712 WeakPolarHBondContact O-CG 3.07Å; T708-L712 PolarHBondContact O-N 3.02Å; L712-A714 VanDerWaalsContact C-N 3.29Å; L712-A714 PolarHBondContact O-N 3.21Å; L712-L715 PolarHBondContact O-N 3.45Å; L712-E716 WeakPolarHBondContact O-CG 3.09Å; L712-E716 PolarHBondContact O-N 2.99Å
713	K	49.2	Very low	45	Very low	159 Å²	159	81.5 Å²	81.5	69%	0.691	46%	0.456	S	S	*	.	H	α-helix	trans	-66.3	-28.9	-177.4	-161.6	-178.8	-177.5	-169.7	0	113.4	A709 G710 A711 G717	A709-K713 PolarHBondContact O-N 3.43Å; G710-K713 PolarHBondContact O-N 2.88Å; A711-K713 VanDerWaalsContact C-N 3.32Å; A711-K713 PolarHBondContact O-N 2.77Å; K713-G717 PolarHBondContact O-N 3.38Å
714	A	46.7	Very low	45.5	Very low	67 Å²	67	80 Å²	80	55%	0.554	44%	0.439	S	S	*	.	H	α-helix	trans	-74.2	-41.8	173.8	0	0	0	0	0	112.1	G710 A711 L712 G717 Q718	G710-A714 PolarHBondContact O-N 3.11Å; G710-A714 VanDerWaalsContact O-N 3.1Å; A711-A714 PolarHBondContact O-N 3.27Å; L712-A714 VanDerWaalsContact C-N 3.29Å; L712-A714 PolarHBondContact O-N 3.21Å; A714-G717 PolarHBondContact O-N 3.42Å; A714-Q718 PolarHBondContact O-N 2.69Å
715	L	46.3	Very low	46	Very low	20 Å²	20	82.9 Å²	82.9	11%	0.105	44%	0.443	C	S	.	.	H	α-helix	trans	-66.1	-39.3	175.4	-78.5	159.7	0	0	0	112.5	W639 L693 F697 A711 L712 G717 Q718 M719	W639-L715 HydrophobicContact CH2-CD1 3.92Å; W639-L715 HydrophobicContact CZ3-CD1 4.38Å; L693-L715 HydrophobicContact CD1-CD2 3.91Å; F697-L715 HydrophobicContact CD1-CD1 4.36Å; F697-L715 HydrophobicContact CE1-CD1 3.54Å; F697-L715 HydrophobicContact CE2-CD1 3.86Å; F697-L715 HydrophobicContact CE2-CD2 4.42Å; F697-L715 HydrophobicContact CE2-CG 4.33Å; F697-L715 HydrophobicContact CZ-CD1 3.25Å; F697-L715 HydrophobicContact CZ-CG 3.94Å; A711-L715 PolarHBondContact O-N 3.07Å; A711-L715 VanDerWaalsContact O-N 3.08Å; L712-L715 PolarHBondContact O-N 3.45Å; L715-G717 VanDerWaalsContact C-N 3.31Å; L715-G717 PolarHBondContact O-N 3.44Å; L715-Q718 PolarHBondContact O-N 3.14Å; L715-Q718 VanDerWaalsContact O-N 3.1Å; L715-M719 PolarHBondContact O-N 2.94Å
716	E	51.6	Low	46.9	Very low	28 Å²	28	76.6 Å²	76.6	13%	0.131	40%	0.404	C	S	.	.	H	α-helix	trans	-55.8	-45.5	173.9	-84.4	-168.5	151.1	0	0	112.2	Y551 K555 L712 Q718 M719 W720	Y551-E716 PolarHBondContact OH-OE1 2.92Å; Y551-E716 PolarHBondContact OH-OE2 3.11Å; Y551-E716 VanDerWaalsContact OH-OE2 3.05Å; K555-E716 WeakPolarHBondContact CE-OE1 3.39Å; K555-E716 IonicContact NZ-OE1 3.95Å; K555-E716 PolarHBondContact NZ-OE1 2.59Å; L712-E716 WeakPolarHBondContact O-CG 3.09Å; L712-E716 PolarHBondContact O-N 2.99Å; E716-Q718 VanDerWaalsContact C-N 3.26Å; E716-Q718 PolarHBondContact O-N 3.1Å; E716-M719 PolarHBondContact O-N 3.34Å; E716-W720 HydrophobicContact CB-CH2 3.85Å; E716-W720 HydrophobicContact CB-CZ2 3.6Å; E716-W720 HydrophobicContact CB-CZ3 4.47Å; E716-W720 HydrophobicContact CG-CH2 4.36Å; E716-W720 HydrophobicContact CG-CZ2 3.79Å; E716-W720 VanDerWaalsContact O-CD2 3.24Å; E716-W720 VanDerWaalsContact O-CG 3.28Å; E716-W720 PolarHBondContact O-N 2.86Å
717	G	45.7	Very low	47.9	Very low	29 Å²	29	68.4 Å²	68.4	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-56	-40.6	175.4	0	0	0	0	0	112.5	K713 A714 L715 F721	K713-G717 PolarHBondContact O-N 3.38Å; A714-G717 PolarHBondContact O-N 3.42Å; L715-G717 VanDerWaalsContact C-N 3.31Å; L715-G717 PolarHBondContact O-N 3.44Å; G717-F721 WeakPolarHBondContact O-CD2 3.41Å
718	Q	44.2	Very low	48.6	Very low	113 Å²	113	67.3 Å²	67.3	53%	0.528	36%	0.356	S	S	.	.	H	α-helix	trans	-73.7	-43	178.6	-66.9	-175.9	-15.2	0	0	113	A714 L715 E716 W720 F721 T722	A714-Q718 PolarHBondContact O-N 2.69Å; L715-Q718 PolarHBondContact O-N 3.14Å; L715-Q718 VanDerWaalsContact O-N 3.1Å; E716-Q718 VanDerWaalsContact C-N 3.26Å; E716-Q718 PolarHBondContact O-N 3.1Å; Q718-W720 VanDerWaalsContact C-N 3.31Å; Q718-W720 PolarHBondContact O-N 3.17Å; Q718-F721 PolarHBondContact O-N 3.27Å; Q718-T722 PolarHBondContact O-N 2.97Å
719	M	43.6	Very low	49.1	Very low	58 Å²	58	65 Å²	65	29%	0.286	35%	0.345	S	S	.	.	H	α-helix	trans	-61.5	-34.7	-178.7	-87.7	-174.2	65.1	0	0	113.7	W639 L715 E716 F721 T722 N723	W639-M719 HydrophobicContact CZ2-SD 3.78Å; L715-M719 PolarHBondContact O-N 2.94Å; E716-M719 PolarHBondContact O-N 3.34Å; M719-F721 VanDerWaalsContact C-N 3.34Å; M719-T722 PolarHBondContact O-N 3.35Å; M719-T722 PolarHBondContact O-OG1 2.69Å; M719-N723 PolarHBondContact O-N 3Å
720	W	45.9	Very low	49.8	Very low	89 Å²	89	63.4 Å²	63.4	34%	0.337	32%	0.324	S	S	.	.	H	α-helix	trans	-74.1	-27.1	-178.5	-55	-24.2	0	0	0	112.6	E716 Q718	E716-W720 HydrophobicContact CB-CH2 3.85Å; E716-W720 HydrophobicContact CB-CZ2 3.6Å; E716-W720 HydrophobicContact CB-CZ3 4.47Å; E716-W720 HydrophobicContact CG-CH2 4.36Å; E716-W720 HydrophobicContact CG-CZ2 3.79Å; E716-W720 VanDerWaalsContact O-CD2 3.24Å; E716-W720 VanDerWaalsContact O-CG 3.28Å; E716-W720 PolarHBondContact O-N 2.86Å; Q718-W720 VanDerWaalsContact C-N 3.31Å; Q718-W720 PolarHBondContact O-N 3.17Å
721	F	43	Very low	50.8	Low	176 Å²	176	62.1 Å²	62.1	77%	0.772	31%	0.307	S	S	*	.	H	α-helix	trans	-77.9	-26.9	170.9	-69	-61.2	0	0	0	113.3	G717 Q718 M719	G717-F721 WeakPolarHBondContact O-CD2 3.41Å; Q718-F721 PolarHBondContact O-N 3.27Å; M719-F721 VanDerWaalsContact C-N 3.34Å
722	T	42.7	Very low	52.2	Low	53 Å²	53	66.4 Å²	66.4	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-88.9	-13.8	179.1	64.8	0	0	0	0	114.6	G689 Q718 M719	G689-T722 WeakPolarHBondContact O-CB 3.36Å; G689-T722 PolarHBondContact O-OG1 2.82Å; G689-T722 VanDerWaalsContact O-OG1 3.14Å; Q718-T722 PolarHBondContact O-N 2.97Å; M719-T722 PolarHBondContact O-N 3.35Å; M719-T722 PolarHBondContact O-OG1 2.69Å
723	N	48.6	Very low	53.9	Low	62 Å²	62	64.5 Å²	64.5	33%	0.332	31%	0.309	S	S	.	.			trans	-134.6	81	173.4	-174.1	10.6	0	0	0	111.4	M719 R725 H726	M719-N723 PolarHBondContact O-N 3Å; N723-R725 PolarHBondContact O-N 3.08Å; N723-R725 VanDerWaalsContact O-N 3.09Å; N723-R725 PolarHBondContact OD1-N 3.4Å; N723-H726 HydrophobicContact CB-CB 4.44Å; N723-H726 WeakPolarHBondContact O-CB 3.36Å; N723-H726 PolarHBondContact O-N 2.87Å
724	W	50.1	Low	55.6	Low	109 Å²	109	57.7 Å²	57.7	41%	0.413	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.1	175.4	64.8	-88.6	0	0	0	113.9	H726 Y730	W724-H726 VanDerWaalsContact C-N 3.28Å; W724-H726 PolarHBondContact O-N 3.3Å; W724-Y730 VanDerWaalsContact CZ3-OH 3.22Å; W724-Y730 WeakPolarHBondContact CZ3-OH 3.39Å; W724-Y730 WeakPolarHBondContact O-CE2 3.47Å
725	R	46.4	Very low	57.7	Low	152 Å²	152	54.5 Å²	54.5	57%	0.574	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-0.3	175.3	-70	-176.1	167.4	174.4	-6.9	114.1	N723	N723-R725 PolarHBondContact O-N 3.08Å; N723-R725 VanDerWaalsContact O-N 3.09Å; N723-R725 PolarHBondContact OD1-N 3.4Å
726	H	59	Low	59.8	Low	7 Å²	7	54.2 Å²	54.2	3%	0.032	25%	0.253	C	S	.	.	S	Bend	trans	-72.8	134.3	176.2	-157.9	-52.1	0	0	0	110.6	N723 W724 F728 A729	N723-H726 HydrophobicContact CB-CB 4.44Å; N723-H726 WeakPolarHBondContact O-CB 3.36Å; N723-H726 PolarHBondContact O-N 2.87Å; W724-H726 VanDerWaalsContact C-N 3.28Å; W724-H726 PolarHBondContact O-N 3.3Å; H726-F728 AromaticContact CE1-CD2 3.28Å; H726-F728 WeakPolarHBondContact CE1-CD2 3.27Å; H726-F728 AromaticContact CE1-CE2 3.45Å; H726-F728 VanDerWaalsContact CE1-CE2 3.45Å; H726-F728 WeakPolarHBondContact CE1-CE2 3.24Å; H726-F728 AromaticContact ND1-CD2 3.4Å; H726-F728 WeakPolarHBondContact ND1-CD2 3.45Å; H726-F728 AromaticContact ND1-CE2 3.99Å; H726-F728 PolarHBondContact O-N 3.16Å; H726-A729 VanDerWaalsContact O-CB 3.31Å; H726-A729 WeakPolarHBondContact O-CB 3.44Å; H726-A729 PolarHBondContact O-N 2.83Å
727	P	61.6	Low	61.8	Low	3 Å²	3	53.4 Å²	53.4	2%	0.019	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	-37.1	-179.2	-34.2	34.8	0	0	0	116.4	Q323 Y326 L327 H559 F626 A729	Q323-P727 HydrophobicContact CG-CG 4.32Å; Y326-P727 HydrophobicContact CD1-CG 4.42Å; L327-P727 HydrophobicContact CD1-CB 4.08Å; L327-P727 HydrophobicContact CD1-CG 4.2Å; L327-P727 HydrophobicContact CD2-CB 4.06Å; L327-P727 HydrophobicContact CD2-CG 3.76Å; L327-P727 HydrophobicContact CG-CB 4.31Å; L327-P727 HydrophobicContact CG-CG 3.93Å; H559-P727 PolarHBondContact CE1-O 3.36Å; F626-P727 HydrophobicContact CE1-CG 3.69Å; F626-P727 HydrophobicContact CZ-CB 4.39Å; F626-P727 HydrophobicContact CZ-CG 3.69Å; P727-A729 VanDerWaalsContact C-N 3.27Å; P727-A729 PolarHBondContact O-N 2.78Å
728	F	64	Low	63.9	Low	24 Å²	24	52.1 Å²	52.1	11%	0.105	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.2	178.9	-51.2	-55.5	0	0	0	114.3	L327 K555 I556 H559 H726	L327-F728 HydrophobicContact CD1-CZ 4.48Å; L327-F728 HydrophobicContact CD2-CE2 3.91Å; L327-F728 HydrophobicContact CD2-CZ 3.84Å; K555-F728 HydrophobicContact CD-CE2 4.01Å; K555-F728 HydrophobicContact CD-CZ 4.03Å; K555-F728 HydrophobicContact CG-CE1 4Å; K555-F728 HydrophobicContact CG-CE2 4.3Å; K555-F728 HydrophobicContact CG-CZ 3.84Å; I556-F728 HydrophobicContact CG1-CZ 4.03Å; H559-F728 HydrophobicContact CB-CD1 3.98Å; H559-F728 HydrophobicContact CB-CE1 3.71Å; H559-F728 AromaticContact CG-CD1 3.93Å; H559-F728 AromaticContact ND1-CD1 3.58Å; H726-F728 AromaticContact CE1-CD2 3.28Å; H726-F728 WeakPolarHBondContact CE1-CD2 3.27Å; H726-F728 AromaticContact CE1-CE2 3.45Å; H726-F728 VanDerWaalsContact CE1-CE2 3.45Å; H726-F728 WeakPolarHBondContact CE1-CE2 3.24Å; H726-F728 AromaticContact ND1-CD2 3.4Å; H726-F728 WeakPolarHBondContact ND1-CD2 3.45Å; H726-F728 AromaticContact ND1-CE2 3.99Å; H726-F728 PolarHBondContact O-N 3.16Å
729	A	56	Low	66.2	Low	31 Å²	31	46.9 Å²	46.9	26%	0.256	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-37.2	179.9	0	0	0	0	0	112.4	H726 P727 C731	H726-A729 VanDerWaalsContact O-CB 3.31Å; H726-A729 WeakPolarHBondContact O-CB 3.44Å; H726-A729 PolarHBondContact O-N 2.83Å; P727-A729 VanDerWaalsContact C-N 3.27Å; P727-A729 PolarHBondContact O-N 2.78Å; A729-C731 PolarHBondContact O-N 2.78Å
730	Y	60.6	Low	68.5	Low	39 Å²	39	44.3 Å²	44.3	15%	0.153	20%	0.199	C	C	.	.			trans	-67.6	12.7	-177.5	-77.9	-71.4	0	0	0	115.9	H624 W724 R732	H624-Y730 HydrophobicContact CB-CE2 4.3Å; H624-Y730 AromaticContact CD2-CD1 3.61Å; H624-Y730 AromaticContact CD2-CE1 3.55Å; H624-Y730 AromaticContact CD2-CG 3.93Å; H624-Y730 AromaticContact CD2-CZ 3.78Å; H624-Y730 AromaticContact CE1-CE1 3.76Å; H624-Y730 AromaticContact CE1-CZ 3.9Å; H624-Y730 AromaticContact CG-CZ 3.85Å; H624-Y730 AromaticContact ND1-CZ 3.92Å; H624-Y730 AromaticContact NE2-CD1 3.68Å; H624-Y730 AromaticContact NE2-CE1 3.32Å; H624-Y730 VanDerWaalsContact NE2-CE1 3.32Å; H624-Y730 WeakPolarHBondContact NE2-CE1 3.35Å; H624-Y730 AromaticContact NE2-CZ 3.82Å; W724-Y730 VanDerWaalsContact CZ3-OH 3.22Å; W724-Y730 WeakPolarHBondContact CZ3-OH 3.39Å; W724-Y730 WeakPolarHBondContact O-CE2 3.47Å; Y730-R732 PolarHBondContact O-N 3.03Å; Y730-R732 VanDerWaalsContact O-N 3.16Å
731	C	68.4	Low	70.6	Confident	22 Å²	22	40.1 Å²	40.1	15%	0.149	18%	0.183	C	C	.	.	S	Bend	trans	-81.3	21.1	175.9	-60.6	0	0	0	0	113.3	A729 K760 L761	A729-C731 PolarHBondContact O-N 2.78Å; C731-K760 CarbonylContact O-C 3.58Å; C731-K760 VanDerWaalsContact O-CA 3.3Å; C731-K760 WeakPolarHBondContact O-CA 3.28Å; C731-K760 VanDerWaalsContact O-CG 3.24Å; C731-K760 WeakPolarHBondContact O-CG 3.47Å; C731-L761 PolarHBondContact O-N 3Å
732	R	75.7	Confident	72.7	Confident	105 Å²	105	35.5 Å²	35.5	40%	0.396	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.8	-177.4	-100.8	-174.1	164.8	115.9	-2.5	111.5	D149 Y730 V759 K760	D149-R732 IonicContact OD1-CZ 3.21Å; D149-R732 IonicContact OD1-NH2 2.71Å; D149-R732 PolarHBondContact OD1-NH2 2.91Å; D149-R732 IonicContact OD2-CZ 3.45Å; D149-R732 IonicContact OD2-NH2 2.58Å; D149-R732 PolarHBondContact OD2-NH2 3.14Å; Y730-R732 PolarHBondContact O-N 3.03Å; Y730-R732 VanDerWaalsContact O-N 3.16Å; R732-V759 CarbonylContact C-O 3.44Å; R732-V759 VanDerWaalsContact CA-O 3.3Å; R732-V759 WeakPolarHBondContact CA-O 3.4Å; R732-K760 HydrophobicContact CG-CB 4.22Å
733	F	82.8	Confident	74.7	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.7	164.7	176.1	-98.8	0	0	0	108.8	A735 F757 S758 V759 L761 L802 A859 L862 D863 F866	F733-A735 HydrophobicContact CE1-CB 3.61Å; F733-A735 HydrophobicContact CZ-CB 3.74Å; F733-F757 HydrophobicContact CD1-CD1 4.15Å; F733-F757 AromaticContact CD1-CE1 3.98Å; F733-F757 HydrophobicContact CD1-CE1 3.98Å; F733-F757 AromaticContact CE1-CD1 3.99Å; F733-F757 HydrophobicContact CE1-CD1 3.99Å; F733-F757 AromaticContact CE1-CE1 3.95Å; F733-F757 HydrophobicContact CE1-CE1 3.95Å; F733-S758 WeakPolarHBondContact O-CA 3.37Å; F733-V759 PolarHBondContact N-O 3.06Å; F733-V759 PolarHBondContact O-N 3.02Å; F733-L761 HydrophobicContact CB-CD2 4.06Å; F733-L802 HydrophobicContact CD2-CD2 4.45Å; F733-L802 HydrophobicContact CE2-CD2 3.61Å; F733-L802 HydrophobicContact CZ-CD2 3.99Å; F733-A859 HydrophobicContact CB-CB 3.83Å; F733-A859 HydrophobicContact CD1-CB 3.98Å; F733-A859 HydrophobicContact CG-CB 4.03Å; F733-L862 HydrophobicContact CE1-CB 4.1Å; F733-L862 HydrophobicContact CE1-CD1 3.91Å; F733-L862 HydrophobicContact CE2-CB 4.24Å; F733-L862 HydrophobicContact CZ-CB 3.7Å; F733-L862 HydrophobicContact CZ-CD1 4.24Å; F733-D863 HydrophobicContact CD2-CB 3.9Å; F733-D863 HydrophobicContact CE2-CB 4.02Å; F733-F866 HydrophobicContact CE2-CD2 4.11Å; F733-F866 AromaticContact CZ-CD2 3.87Å; F733-F866 HydrophobicContact CZ-CD2 3.87Å; F733-F866 AromaticContact CZ-CE2 3.86Å; F733-F866 HydrophobicContact CZ-CE2 3.86Å
734	T	85.3	Confident	76.3	Confident	17 Å²	17	39.8 Å²	39.8	10%	0.104	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	125.6	173.8	-58.2	0	0	0	0	110.1	T756 F757 S758 L802 V1474	T734-T756 HydrophobicContact CG2-CG2 3.54Å; T734-F757 WeakPolarHBondContact CA-O 3.48Å; T734-S758 PolarHBondContact OG1-OG 3.46Å; T734-L802 WeakPolarHBondContact O-CD1 3.26Å; T734-V1474 HydrophobicContact CG2-CG2 4.1Å
735	A	90.1	Very high	77.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	173.6	175.5	0	0	0	0	0	109.5	F733 F757 V801 L802	F733-A735 HydrophobicContact CE1-CB 3.61Å; F733-A735 HydrophobicContact CZ-CB 3.74Å; A735-F757 PolarHBondContact N-O 3.35Å; A735-F757 WeakPolarHBondContact O-CA 3.46Å; A735-F757 PolarHBondContact O-N 2.95Å; A735-V801 WeakPolarHBondContact CA-O 3.49Å; A735-V801 WeakPolarHBondContact CB-O 3.25Å; A735-L802 HydrophobicContact CB-CB 4.32Å
736	L	90.6	Very high	79.3	Confident	13 Å²	13	33.9 Å²	33.9	7%	0.068	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.6	168.6	-164.4	81.3	0	0	0	109.5	P754 H755 F800 V801 Y1372 P1465	L736-P754 HydrophobicContact CD1-CB 4.46Å; L736-P754 HydrophobicContact CD2-CB 3.52Å; L736-P754 HydrophobicContact CG-CB 3.97Å; L736-H755 CarbonylContact C-O 3.36Å; L736-H755 WeakPolarHBondContact CA-O 3.47Å; L736-H755 VanDerWaalsContact CD1-C 3.48Å; L736-F800 CarbonylContact O-C 3.53Å; L736-F800 VanDerWaalsContact O-CA 3.25Å; L736-F800 WeakPolarHBondContact O-CA 3.28Å; L736-V801 HydrophobicContact CB-CB 4.27Å; L736-V801 PolarHBondContact N-O 2.89Å; L736-V801 PolarHBondContact O-N 3.17Å; L736-Y1372 HydrophobicContact CD2-CE1 4.11Å; L736-P1465 HydrophobicContact CD2-CB 3.52Å
737	L	92.7	Very high	80.1	Confident	12 Å²	12	38.3 Å²	38.3	6%	0.063	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.7	177.3	170.7	60.7	0	0	0	110.6	P754 H755 F757 R798 F800	L737-P754 CarbonylContact O-C 3.57Å; L737-P754 WeakPolarHBondContact O-CA 3.48Å; L737-H755 PolarHBondContact N-O 2.86Å; L737-H755 PolarHBondContact O-CE1 3.49Å; L737-H755 PolarHBondContact O-N 3.31Å; L737-H755 PolarHBondContact O-ND1 3.25Å; L737-F757 HydrophobicContact CB-CB 3.67Å; L737-F757 HydrophobicContact CB-CD2 4.49Å; L737-F757 HydrophobicContact CB-CG 4.3Å; L737-F757 HydrophobicContact CD2-CD2 3.89Å; L737-F757 HydrophobicContact CD2-CG 4.5Å; L737-R798 HydrophobicContact CD1-CB 4.48Å; L737-F800 HydrophobicContact CB-CD1 4.31Å; L737-F800 HydrophobicContact CB-CE1 4.35Å; L737-F800 HydrophobicContact CD1-CD1 4.04Å; L737-F800 HydrophobicContact CD1-CD2 4.44Å; L737-F800 HydrophobicContact CD1-CE1 3.71Å; L737-F800 HydrophobicContact CD1-CE2 4.12Å; L737-F800 HydrophobicContact CD1-CG 4.4Å; L737-F800 HydrophobicContact CD1-CZ 3.75Å; L737-F800 HydrophobicContact CD2-CE1 4.29Å; L737-F800 HydrophobicContact CG-CE1 4.33Å
738	S	91.8	Very high	81.2	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.014	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	162.6	166.9	63.7	0	0	0	0	110.6	I752 R798 R799	S738-I752 WeakPolarHBondContact CA-O 3.47Å; S738-R798 CarbonylContact O-C 3.57Å; S738-R798 WeakPolarHBondContact O-CA 3.28Å; S738-R799 PolarHBondContact N-O 3.21Å; S738-R799 PolarHBondContact O-N 2.9Å; S738-R799 PolarHBondContact OG-O 2.96Å
739	S	91.9	Very high	82	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	135.2	165.8	-175	0	0	0	0	110.6	Y750 C751 I752 I797	S739-Y750 CarbonylContact O-C 3.46Å; S739-Y750 WeakPolarHBondContact O-CA 3.21Å; S739-C751 PolarHBondContact O-N 2.89Å; S739-I752 PolarHBondContact N-O 3.47Å; S739-I752 PolarHBondContact O-N 3.48Å; S739-I797 CarbonylContact C-O 3.54Å; S739-I797 WeakPolarHBondContact CA-O 3.47Å; S739-I797 WeakPolarHBondContact CB-O 3.36Å; S739-I797 PolarHBondContact OG-O 2.79Å
740	Y	90.9	Very high	83.5	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.6	-177.7	60.9	-85.7	0	0	0	111.2	L742 R749 Y750 H796 I797 R799 E808 C1367 L1368	Y740-L742 HydrophobicContact CD2-CB 4.23Å; Y740-L742 HydrophobicContact CE2-CB 4.04Å; Y740-L742 HydrophobicContact CE2-CD2 4.37Å; Y740-R749 CarbonylContact C-O 3.58Å; Y740-R749 VanDerWaalsContact CA-O 3.24Å; Y740-R749 WeakPolarHBondContact CA-O 3.34Å; Y740-R749 WeakPolarHBondContact CB-O 3.18Å; Y740-Y750 HydrophobicContact CD1-CE1 4.3Å; Y740-H796 CarbonylContact O-C 3.59Å; Y740-H796 VanDerWaalsContact O-CA 3.25Å; Y740-H796 WeakPolarHBondContact O-CA 3.4Å; Y740-I797 HydrophobicContact CD1-CB 4.46Å; Y740-I797 HydrophobicContact CE1-CB 3.87Å; Y740-I797 HydrophobicContact CE1-CG2 3.86Å; Y740-I797 HydrophobicContact CE2-CB 4.04Å; Y740-I797 HydrophobicContact CE2-CD1 4.18Å; Y740-I797 HydrophobicContact CE2-CG1 4.39Å; Y740-I797 PolarHBondContact N-O 3.38Å; Y740-I797 PolarHBondContact O-N 3.45Å; Y740-I797 WeakPolarHBondContact OH-CD1 3.33Å; Y740-R799 HydrophobicContact CE1-CB 4.37Å; Y740-R799 PolarHBondContact OH-NH2 3.3Å; Y740-E808 PolarHBondContact OH-OE1 3.5Å; Y740-E808 VanDerWaalsContact OH-OE1 3.06Å; Y740-C1367 HydrophobicContact CD2-CB 4.1Å; Y740-C1367 HydrophobicContact CG-CB 4.05Å; Y740-L1368 HydrophobicContact CE2-CD2 3.88Å
741	L	90.2	Very high	84.7	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.6	170.5	-178.1	72.3	0	0	0	109	V746 S748 R749 E791 N795	L741-V746 HydrophobicContact CD2-CG1 3.74Å; L741-S748 WeakPolarHBondContact O-CA 3.23Å; L741-R749 HydrophobicContact CB-CG 4.13Å; L741-R749 HydrophobicContact CD2-CG 4.38Å; L741-R749 PolarHBondContact N-O 2.93Å; L741-E791 HydrophobicContact CD1-CB 3.62Å; L741-E791 HydrophobicContact CD1-CG 3.71Å; L741-E791 HydrophobicContact CD2-CG 4.23Å; L741-N795 HydrophobicContact CD1-CB 3.99Å; L741-N795 WeakPolarHBondContact CD1-O 3.5Å
742	L	87.2	Confident	85.6	Confident	78 Å²	78	41.7 Å²	41.7	41%	0.408	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	97.4	171.5	-175.7	65.7	0	0	0	109	Y740 N795 I797 L1368	Y740-L742 HydrophobicContact CD2-CB 4.23Å; Y740-L742 HydrophobicContact CE2-CB 4.04Å; Y740-L742 HydrophobicContact CE2-CD2 4.37Å; L742-N795 PolarHBondContact N-O 3.01Å; L742-I797 HydrophobicContact CD2-CD1 3.67Å; L742-L1368 HydrophobicContact CD1-CD2 4.32Å
743	K	85.5	Confident	86	Confident	79 Å²	79	39.8 Å²	39.8	34%	0.343	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	133.7	-176.2	-177.5	177.6	180	178.8	0	109.5	G745 V746 E791 N795	K743-G745 PolarHBondContact O-N 2.88Å; K743-V746 HydrophobicContact CB-CB 4.3Å; K743-V746 HydrophobicContact CB-CG2 4.34Å; K743-V746 HydrophobicContact CD-CG2 4.11Å; K743-V746 HydrophobicContact CG-CG2 4.24Å; K743-V746 PolarHBondContact O-N 2.91Å; K743-E791 WeakPolarHBondContact CD-OE1 3.34Å; K743-E791 WeakPolarHBondContact CD-OE2 3.49Å; K743-E791 IonicContact NZ-OE1 4Å; K743-E791 PolarHBondContact NZ-OE1 2.77Å; K743-E791 IonicContact NZ-OE2 2.67Å; K743-E791 PolarHBondContact NZ-OE2 3.17Å; K743-N795 HydrophobicContact CB-CB 4.48Å; K743-N795 HydrophobicContact CD-CB 4.45Å
744	S	80.9	Confident	86.2	Confident	127 Å²	127	40.3 Å²	40.3	89%	0.888	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	135.5	179.3	-169.4	0	0	0	0	111.2	V746	S744-V746 VanDerWaalsContact C-N 3.26Å; S744-V746 PolarHBondContact O-N 3.49Å
745	G	80.1	Confident	86.1	Confident	84 Å²	84	42.6 Å²	42.6	87%	0.866	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-2.4	-175.8	0	0	0	0	0	116	K743	K743-G745 PolarHBondContact O-N 2.88Å
746	V	80.8	Confident	85.7	Confident	52 Å²	52	46 Å²	46	32%	0.315	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.9	179.1	-172.7	0	0	0	0	110.4	L741 K743 S744 S748	L741-V746 HydrophobicContact CD2-CG1 3.74Å; K743-V746 HydrophobicContact CB-CB 4.3Å; K743-V746 HydrophobicContact CB-CG2 4.34Å; K743-V746 HydrophobicContact CD-CG2 4.11Å; K743-V746 HydrophobicContact CG-CG2 4.24Å; K743-V746 PolarHBondContact O-N 2.91Å; S744-V746 VanDerWaalsContact C-N 3.26Å; S744-V746 PolarHBondContact O-N 3.49Å; V746-S748 PolarHBondContact O-N 3.32Å
747	P	75.5	Confident	85.4	Confident	101 Å²	101	45.4 Å²	45.4	66%	0.656	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.5	128.5	177.2	-26.7	35.4	0	0	0	113.2	R749	P747-R749 PolarHBondContact O-N 3.18Å
748	S	83.4	Confident	85.1	Confident	24 Å²	24	46.9 Å²	46.9	17%	0.168	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	131.4	175.6	-61.2	0	0	0	0	111	L741 V746	L741-S748 WeakPolarHBondContact O-CA 3.23Å; V746-S748 PolarHBondContact O-N 3.32Å
749	R	82.8	Confident	84.7	Confident	95 Å²	95	46.9 Å²	46.9	36%	0.358	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	136.9	-178	62.7	-172.7	-168.8	159.1	9.3	112.2	Y740 L741 P747 C751 G788 C789 C1367	Y740-R749 CarbonylContact C-O 3.58Å; Y740-R749 VanDerWaalsContact CA-O 3.24Å; Y740-R749 WeakPolarHBondContact CA-O 3.34Å; Y740-R749 WeakPolarHBondContact CB-O 3.18Å; L741-R749 HydrophobicContact CB-CG 4.13Å; L741-R749 HydrophobicContact CD2-CG 4.38Å; L741-R749 PolarHBondContact N-O 2.93Å; P747-R749 PolarHBondContact O-N 3.18Å; R749-C751 PolarHBondContact O-N 3.12Å; R749-G788 PolarHBondContact NH2-O 3.34Å; R749-C789 PolarHBondContact NH2-SG 2.88Å; R749-C1367 VanDerWaalsContact C-SG 3.57Å; R749-C1367 VanDerWaalsContact CA-SG 3.6Å
750	Y	85.8	Confident	84.3	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.016	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	127.6	168.6	-75.5	-55.5	0	0	0	110	S739 Y740 N753 P754 R786 V1366 C1367 S1370	S739-Y750 CarbonylContact O-C 3.46Å; S739-Y750 WeakPolarHBondContact O-CA 3.21Å; Y740-Y750 HydrophobicContact CD1-CE1 4.3Å; Y750-N753 WeakPolarHBondContact CB-OD1 3.24Å; Y750-P754 HydrophobicContact CE1-CG 4.11Å; Y750-P754 HydrophobicContact CE2-CG 3.89Å; Y750-R786 VanDerWaalsContact O-CZ 3.31Å; Y750-R786 PolarHBondContact O-NH1 3.08Å; Y750-V1366 HydrophobicContact CD2-CG1 4.26Å; Y750-V1366 HydrophobicContact CE2-CG1 3.86Å; Y750-V1366 HydrophobicContact CE2-CG2 4.31Å; Y750-V1366 PolarHBondContact OH-O 3.26Å; Y750-V1366 VanDerWaalsContact OH-O 3.1Å; Y750-C1367 PolarHBondContact N-SG 3.2Å; Y750-S1370 PolarHBondContact OH-OG 3.39Å
751	C	86.5	Confident	84.1	Confident	12 Å²	12	51.9 Å²	51.9	8%	0.081	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-25.2	166.7	-71.3	0	0	0	0	111.9	S739 R749 R786 H796	S739-C751 PolarHBondContact O-N 2.89Å; R749-C751 PolarHBondContact O-N 3.12Å; C751-R786 HydrophobicContact CB-CB 4.44Å; C751-R786 WeakPolarHBondContact O-CD 3.46Å; C751-H796 PolarHBondContact SG-NE2 3.29Å
752	I	86.3	Confident	84	Confident	54 Å²	54	52.2 Å²	52.2	28%	0.277	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.6	161.8	-56.5	177.4	0	0	0	105.9	F157 S738 S739 H755	F157-I752 HydrophobicContact CZ-CD1 4.3Å; S738-I752 WeakPolarHBondContact CA-O 3.47Å; S739-I752 PolarHBondContact N-O 3.47Å; S739-I752 PolarHBondContact O-N 3.48Å; I752-H755 VanDerWaalsContact CG2-CE1 3.47Å; I752-H755 WeakPolarHBondContact CG2-CE1 3.3Å
753	N	85	Confident	83.8	Confident	65 Å²	65	48.8 Å²	48.8	35%	0.348	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	158.1	178.5	-67.9	-7.4	0	0	0	110.8	Y750 H755 I1462	Y750-N753 WeakPolarHBondContact CB-OD1 3.24Å; N753-H755 PolarHBondContact O-N 3.42Å; N753-H755 PolarHBondContact O-ND1 2.9Å; N753-I1462 HydrophobicContact CB-CG1 4.45Å; N753-I1462 WeakPolarHBondContact ND2-CD1 3.43Å
754	P	87	Confident	83.5	Confident	19 Å²	19	50.3 Å²	50.3	12%	0.123	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	122.9	173.7	-19.7	31.3	0	0	0	111.5	L736 L737 Y750 P1465	L736-P754 HydrophobicContact CD1-CB 4.46Å; L736-P754 HydrophobicContact CD2-CB 3.52Å; L736-P754 HydrophobicContact CG-CB 3.97Å; L737-P754 CarbonylContact O-C 3.57Å; L737-P754 WeakPolarHBondContact O-CA 3.48Å; Y750-P754 HydrophobicContact CE1-CG 4.11Å; Y750-P754 HydrophobicContact CE2-CG 3.89Å; P754-P1465 HydrophobicContact CB-CB 4.01Å; P754-P1465 HydrophobicContact CG-CB 4.43Å
755	H	83.3	Confident	83.7	Confident	66 Å²	66	45.6 Å²	45.6	31%	0.306	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	158.8	-179.3	67.3	-76.3	0	0	0	111.2	L736 L737 I752 N753 F757	L736-H755 CarbonylContact C-O 3.36Å; L736-H755 WeakPolarHBondContact CA-O 3.47Å; L736-H755 VanDerWaalsContact CD1-C 3.48Å; L737-H755 PolarHBondContact N-O 2.86Å; L737-H755 PolarHBondContact O-CE1 3.49Å; L737-H755 PolarHBondContact O-N 3.31Å; L737-H755 PolarHBondContact O-ND1 3.25Å; I752-H755 VanDerWaalsContact CG2-CE1 3.47Å; I752-H755 WeakPolarHBondContact CG2-CE1 3.3Å; N753-H755 PolarHBondContact O-N 3.42Å; N753-H755 PolarHBondContact O-ND1 2.9Å; H755-F757 PolarHBondContact O-N 3.35Å
756	T	82	Confident	84.2	Confident	70 Å²	70	42.2 Å²	42.2	43%	0.429	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	114.5	-178.2	-48.9	0	0	0	0	111.9	T734 V1474	T734-T756 HydrophobicContact CG2-CG2 3.54Å; T756-V1474 HydrophobicContact CG2-CG2 4Å
757	F	84.8	Confident	84.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.009	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	97.1	168.5	174.8	-97.3	0	0	0	108.4	P153 F154 F733 T734 A735 L737 H755 V759 F800 F858 L862	P153-F757 HydrophobicContact CG-CD2 3.64Å; P153-F757 HydrophobicContact CG-CE2 3.82Å; F154-F757 AromaticContact CE2-CE2 3.64Å; F154-F757 HydrophobicContact CE2-CE2 3.64Å; F154-F757 HydrophobicContact CE2-CZ 4.11Å; F154-F757 AromaticContact CZ-CE2 3.68Å; F154-F757 HydrophobicContact CZ-CE2 3.68Å; F154-F757 HydrophobicContact CZ-CZ 4.17Å; F733-F757 HydrophobicContact CD1-CD1 4.15Å; F733-F757 AromaticContact CD1-CE1 3.98Å; F733-F757 HydrophobicContact CD1-CE1 3.98Å; F733-F757 AromaticContact CE1-CD1 3.99Å; F733-F757 HydrophobicContact CE1-CD1 3.99Å; F733-F757 AromaticContact CE1-CE1 3.95Å; F733-F757 HydrophobicContact CE1-CE1 3.95Å; T734-F757 WeakPolarHBondContact CA-O 3.48Å; A735-F757 PolarHBondContact N-O 3.35Å; A735-F757 WeakPolarHBondContact O-CA 3.46Å; A735-F757 PolarHBondContact O-N 2.95Å; L737-F757 HydrophobicContact CB-CB 3.67Å; L737-F757 HydrophobicContact CB-CD2 4.49Å; L737-F757 HydrophobicContact CB-CG 4.3Å; L737-F757 HydrophobicContact CD2-CD2 3.89Å; L737-F757 HydrophobicContact CD2-CG 4.5Å; H755-F757 PolarHBondContact O-N 3.35Å; F757-V759 HydrophobicContact CD1-CG2 4.2Å; F757-V759 HydrophobicContact CD2-CG2 4.37Å; F757-V759 HydrophobicContact CE1-CB 4.48Å; F757-V759 HydrophobicContact CE1-CG2 3.63Å; F757-V759 HydrophobicContact CE2-CG2 3.81Å; F757-V759 HydrophobicContact CZ-CG2 3.41Å; F757-V759 VanDerWaalsContact CZ-CG2 3.41Å; F757-F800 HydrophobicContact CD1-CD1 4.17Å; F757-F800 HydrophobicContact CD1-CE1 4.04Å; F757-F800 HydrophobicContact CD2-CE1 4.29Å; F757-F800 HydrophobicContact CE1-CD1 4.39Å; F757-F800 AromaticContact CE1-CE1 3.97Å; F757-F800 HydrophobicContact CE1-CE1 3.97Å; F757-F800 HydrophobicContact CE2-CE1 4.24Å; F757-F800 HydrophobicContact CG-CD1 4.49Å; F757-F800 HydrophobicContact CG-CE1 4.2Å; F757-F800 HydrophobicContact CZ-CE1 4.07Å; F757-F858 HydrophobicContact CZ-CD1 4.15Å; F757-F858 AromaticContact CZ-CE1 3.97Å; F757-F858 HydrophobicContact CZ-CE1 3.97Å; F757-L862 HydrophobicContact CE1-CD1 4.13Å
758	S	84.7	Confident	85.7	Confident	43 Å²	43	36.8 Å²	36.8	30%	0.301	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.3	174.6	-165.5	0	0	0	0	110.4	F733 T734	F733-S758 WeakPolarHBondContact O-CA 3.37Å; T734-S758 PolarHBondContact OG1-OG 3.46Å
759	V	83.6	Confident	86.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	127.1	-173.6	170.9	0	0	0	0	109.7	R732 F733 F757 L761 D766 A859	R732-V759 CarbonylContact C-O 3.44Å; R732-V759 VanDerWaalsContact CA-O 3.3Å; R732-V759 WeakPolarHBondContact CA-O 3.4Å; F733-V759 PolarHBondContact N-O 3.06Å; F733-V759 PolarHBondContact O-N 3.02Å; F757-V759 HydrophobicContact CD1-CG2 4.2Å; F757-V759 HydrophobicContact CD2-CG2 4.37Å; F757-V759 HydrophobicContact CE1-CB 4.48Å; F757-V759 HydrophobicContact CE1-CG2 3.63Å; F757-V759 HydrophobicContact CE2-CG2 3.81Å; F757-V759 HydrophobicContact CZ-CG2 3.41Å; F757-V759 VanDerWaalsContact CZ-CG2 3.41Å; V759-L761 PolarHBondContact O-N 2.97Å; V759-D766 HydrophobicContact CG1-CB 3.47Å; V759-D766 VanDerWaalsContact CG1-CB 3.47Å; V759-A859 HydrophobicContact CB-CB 4.16Å; V759-A859 HydrophobicContact CG1-CB 3.84Å
760	K	83.2	Confident	86.8	Confident	104 Å²	104	31.1 Å²	31.1	45%	0.452	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	116.6	165.5	-172	-171	175.9	-179.8	0	109.8	C731 R732 Y762 G763 T765	C731-K760 CarbonylContact O-C 3.58Å; C731-K760 VanDerWaalsContact O-CA 3.3Å; C731-K760 WeakPolarHBondContact O-CA 3.28Å; C731-K760 VanDerWaalsContact O-CG 3.24Å; C731-K760 WeakPolarHBondContact O-CG 3.47Å; R732-K760 HydrophobicContact CG-CB 4.22Å; K760-Y762 PolarHBondContact O-N 3.16Å; K760-G763 WeakPolarHBondContact O-CA 3.33Å; K760-G763 PolarHBondContact O-N 3.37Å; K760-T765 PolarHBondContact N-OG1 3.38Å; K760-T765 PolarHBondContact O-OG1 3.01Å
761	L	86.5	Confident	87.1	Confident	9 Å²	9	32.1 Å²	32.1	5%	0.047	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	130	-178.1	-59.6	175.7	0	0	0	111.8	P621 F622 C731 F733 V759 G763 A859	P621-L761 HydrophobicContact CB-CD1 3.6Å; P621-L761 HydrophobicContact CG-CD1 3.73Å; F622-L761 HydrophobicContact CE2-CB 4.21Å; F622-L761 HydrophobicContact CE2-CD1 3.89Å; F622-L761 HydrophobicContact CZ-CB 3.88Å; F622-L761 HydrophobicContact CZ-CD1 4.03Å; C731-L761 PolarHBondContact O-N 3Å; F733-L761 HydrophobicContact CB-CD2 4.06Å; V759-L761 PolarHBondContact O-N 2.97Å; L761-G763 PolarHBondContact O-N 3.35Å; L761-G763 VanDerWaalsContact O-N 3.15Å; L761-A859 HydrophobicContact CD2-CB 3.55Å
762	Y	89.2	Confident	87.5	Confident	7 Å²	7	31.6 Å²	31.6	3%	0.027	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	34.7	-174.6	-53.6	-92.1	0	0	0	113.5	M364 S365 Y565 S566 L569 F622 K760 D766 S857	M364-Y762 HydrophobicContact CE-CD1 3.67Å; M364-Y762 HydrophobicContact CE-CE1 4.13Å; M364-Y762 HydrophobicContact CE-CG 4.34Å; S365-Y762 WeakPolarHBondContact CB-O 3.3Å; S365-Y762 PolarHBondContact OG-O 3.23Å; Y565-Y762 HydrophobicContact CD1-CD1 4.45Å; Y565-Y762 HydrophobicContact CD1-CE1 4.33Å; Y565-Y762 AromaticContact CE1-CD1 3.98Å; Y565-Y762 HydrophobicContact CE1-CD1 3.98Å; Y565-Y762 AromaticContact CE1-CE1 3.87Å; Y565-Y762 HydrophobicContact CE1-CE1 3.87Å; S566-Y762 VanDerWaalsContact OG-CE2 3.25Å; S566-Y762 WeakPolarHBondContact OG-CE2 3.46Å; S566-Y762 PolarHBondContact OG-OH 2.91Å; S566-Y762 VanDerWaalsContact OG-OH 3.12Å; L569-Y762 HydrophobicContact CD1-CE1 4.01Å; F622-Y762 HydrophobicContact CE2-CD2 4.12Å; F622-Y762 AromaticContact CE2-CE2 3.98Å; F622-Y762 HydrophobicContact CE2-CE2 3.98Å; F622-Y762 HydrophobicContact CZ-CD2 4.22Å; K760-Y762 PolarHBondContact O-N 3.16Å; Y762-D766 PolarHBondContact N-OD2 2.82Å; Y762-S857 PolarHBondContact OH-N 2.9Å
763	G	83.9	Confident	87.9	Confident	7 Å²	7	29 Å²	29	7%	0.072	16%	0.164	C	C	.	.	S	Bend	trans	-115.6	177.5	174.1	0	0	0	0	0	112.3	K760 L761 T765 D766	K760-G763 WeakPolarHBondContact O-CA 3.33Å; K760-G763 PolarHBondContact O-N 3.37Å; L761-G763 PolarHBondContact O-N 3.35Å; L761-G763 VanDerWaalsContact O-N 3.15Å; G763-T765 PolarHBondContact O-N 3.12Å; G763-D766 WeakPolarHBondContact O-CB 3.41Å; G763-D766 PolarHBondContact O-N 2.84Å
764	P	78.9	Confident	88.1	Confident	111 Å²	111	27.3 Å²	27.3	72%	0.721	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	3.9	-175.3	31.2	-38.1	0	0	0	114.9	T152	T152-P764 WeakPolarHBondContact CG2-O 3.26Å
765	T	83.6	Confident	88.1	Confident	28 Å²	28	30.8 Å²	30.8	17%	0.172	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-12.3	171.7	51.4	0	0	0	0	113.1	K760 G763	K760-T765 PolarHBondContact N-OG1 3.38Å; K760-T765 PolarHBondContact O-OG1 3.01Å; G763-T765 PolarHBondContact O-N 3.12Å
766	D	91	Very high	88.3	Confident	12 Å²	12	28.5 Å²	28.5	6%	0.064	16%	0.16	C	C	.	.			trans	-98.3	166.4	-175.2	-160.6	5.5	0	0	0	110.5	M364 V759 Y762 G763 S857	M364-D766 HydrophobicContact SD-CB 3.97Å; V759-D766 HydrophobicContact CG1-CB 3.47Å; V759-D766 VanDerWaalsContact CG1-CB 3.47Å; Y762-D766 PolarHBondContact N-OD2 2.82Å; G763-D766 WeakPolarHBondContact O-CB 3.41Å; G763-D766 PolarHBondContact O-N 2.84Å; D766-S857 VanDerWaalsContact CG-OG 3.29Å; D766-S857 PolarHBondContact OD1-OG 2.99Å; D766-S857 WeakPolarHBondContact OD2-CB 3.33Å; D766-S857 PolarHBondContact OD2-OG 3.05Å
767	L	91.9	Very high	88.7	Confident	32 Å²	32	25.2 Å²	25.2	17%	0.168	14%	0.141	C	C	.	.			trans	-132.1	147.1	171.6	-66.6	176.8	0	0	0	108.9	F154 V771 Y776 F858	F154-L767 HydrophobicContact CB-CD1 4.39Å; F154-L767 HydrophobicContact CD2-CD1 3.49Å; F154-L767 VanDerWaalsContact CD2-CD1 3.49Å; F154-L767 HydrophobicContact CD2-CG 4.18Å; F154-L767 HydrophobicContact CE2-CD1 3.87Å; F154-L767 HydrophobicContact CE2-CG 4.49Å; F154-L767 HydrophobicContact CG-CD1 3.97Å; L767-V771 HydrophobicContact CD2-CG1 4.2Å; L767-Y776 HydrophobicContact CD1-CD2 4.49Å; L767-Y776 HydrophobicContact CD1-CE2 3.77Å; L767-F858 WeakPolarHBondContact O-CB 3.47Å; L767-F858 PolarHBondContact O-N 2.94Å
768	P	95.4	Very high	88.9	Confident	7 Å²	7	25.5 Å²	25.5	5%	0.045	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-57.7	139.8	159.8	-18.1	30.3	0	0	0	109.7	T357 M364 G770 V771 Y772 W854 L856	T357-P768 HydrophobicContact CG2-CG 3.83Å; M364-P768 HydrophobicContact CB-CG 4.19Å; M364-P768 HydrophobicContact CE-CG 4.18Å; M364-P768 HydrophobicContact SD-CG 4.26Å; P768-G770 PolarHBondContact O-N 3.32Å; P768-G770 VanDerWaalsContact O-N 3.15Å; P768-V771 HydrophobicContact CB-CB 4.44Å; P768-V771 HydrophobicContact CB-CG2 3.99Å; P768-V771 HydrophobicContact CG-CB 4.44Å; P768-V771 HydrophobicContact CG-CG2 3.76Å; P768-V771 PolarHBondContact O-N 2.63Å; P768-Y772 PolarHBondContact O-N 2.82Å; P768-W854 HydrophobicContact CB-CE3 4.23Å; P768-W854 HydrophobicContact CB-CZ3 4.02Å; P768-W854 VanDerWaalsContact CB-O 3.28Å; P768-W854 WeakPolarHBondContact CB-O 3.29Å; P768-W854 HydrophobicContact CG-CZ3 4.23Å; P768-L856 CarbonylContact C-O 3.54Å; P768-L856 WeakPolarHBondContact CA-O 3.34Å
769	L	96.2	Very high	88.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-51.3	-38.8	175.1	173.7	62.2	0	0	0	111.2	V771 Y772 L773 M849 F853 L856 F858 F861 F892 F901	L769-V771 PolarHBondContact O-N 2.69Å; L769-Y772 PolarHBondContact O-N 2.84Å; L769-L773 HydrophobicContact CD1-CD1 4.35Å; L769-L773 HydrophobicContact CD1-CG 4.34Å; L769-L773 HydrophobicContact CG-CD1 4.15Å; L769-L773 WeakPolarHBondContact O-CG 3.33Å; L769-L773 PolarHBondContact O-N 3Å; L769-M849 HydrophobicContact CD2-CE 3.77Å; L769-M849 HydrophobicContact CG-CE 3.97Å; L769-F853 HydrophobicContact CD2-CD2 4.08Å; L769-F853 HydrophobicContact CD2-CE2 3.42Å; L769-F853 VanDerWaalsContact CD2-CE2 3.42Å; L769-F853 HydrophobicContact CD2-CZ 3.86Å; L769-L856 PolarHBondContact N-O 3.25Å; L769-F858 HydrophobicContact CD1-CD2 3.86Å; L769-F858 HydrophobicContact CD1-CE2 4.47Å; L769-F861 HydrophobicContact CD1-CB 4.43Å; L769-F861 HydrophobicContact CD1-CD1 3.61Å; L769-F861 HydrophobicContact CD1-CE1 4.11Å; L769-F861 HydrophobicContact CD1-CG 4.13Å; L769-F861 HydrophobicContact CD2-CB 4.18Å; L769-F861 HydrophobicContact CD2-CD1 3.96Å; L769-F861 HydrophobicContact CD2-CD2 3.99Å; L769-F861 HydrophobicContact CD2-CE1 4.33Å; L769-F861 HydrophobicContact CD2-CE2 4.37Å; L769-F861 HydrophobicContact CD2-CG 3.77Å; L769-F861 HydrophobicContact CG-CD1 4.44Å; L769-F892 HydrophobicContact CD2-CE1 4.41Å; L769-F892 HydrophobicContact CD2-CZ 4.13Å; L769-F901 HydrophobicContact CD1-CZ 4.27Å
770	G	94.2	Very high	88.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-37	176	0	0	0	0	0	115	P768 L773 E774 W854	P768-G770 PolarHBondContact O-N 3.32Å; P768-G770 VanDerWaalsContact O-N 3.15Å; G770-L773 PolarHBondContact O-N 3.42Å; G770-E774 WeakPolarHBondContact O-CB 3.3Å; G770-E774 VanDerWaalsContact O-CG 3.27Å; G770-E774 WeakPolarHBondContact O-CG 3.42Å; G770-E774 PolarHBondContact O-N 2.82Å; G770-W854 VanDerWaalsContact CA-CD1 3.41Å; G770-W854 VanDerWaalsContact CA-NE1 3.31Å; G770-W854 PolarHBondContact N-O 3.48Å
771	V	93	Very high	88.3	Confident	26 Å²	26	28.8 Å²	28.8	16%	0.158	17%	0.167	C	C	.	.	H	α-helix	trans	-70.2	-42.9	173.8	178	0	0	0	0	110.3	L767 P768 L769 L773 E774 D775 W854	L767-V771 HydrophobicContact CD2-CG1 4.2Å; P768-V771 HydrophobicContact CB-CB 4.44Å; P768-V771 HydrophobicContact CB-CG2 3.99Å; P768-V771 HydrophobicContact CG-CB 4.44Å; P768-V771 HydrophobicContact CG-CG2 3.76Å; P768-V771 PolarHBondContact O-N 2.63Å; L769-V771 PolarHBondContact O-N 2.69Å; V771-L773 VanDerWaalsContact C-N 3.27Å; V771-L773 PolarHBondContact O-N 3.3Å; V771-E774 PolarHBondContact O-N 3.15Å; V771-D775 WeakPolarHBondContact CG1-OD2 3.28Å; V771-D775 WeakPolarHBondContact O-CB 3.43Å; V771-D775 PolarHBondContact O-N 3.09Å; V771-W854 HydrophobicContact CG2-CH2 3.32Å; V771-W854 HydrophobicContact CG2-CZ2 3.74Å; V771-W854 HydrophobicContact CG2-CZ3 4.06Å
772	Y	93.6	Very high	88.1	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.7	-38.7	174.9	176.3	-98	0	0	0	112.2	F154 P768 L769 Y776 C777 R798 V809 F858 F901	F154-Y772 HydrophobicContact CE1-CD2 4.04Å; F154-Y772 AromaticContact CE1-CE2 3.84Å; F154-Y772 HydrophobicContact CE1-CE2 3.84Å; F154-Y772 HydrophobicContact CZ-CD2 4.01Å; F154-Y772 HydrophobicContact CZ-CE2 4.08Å; P768-Y772 PolarHBondContact O-N 2.82Å; L769-Y772 PolarHBondContact O-N 2.84Å; Y772-Y776 HydrophobicContact CD2-CD2 4.27Å; Y772-Y776 HydrophobicContact CD2-CG 4.26Å; Y772-Y776 WeakPolarHBondContact O-CB 3.44Å; Y772-Y776 PolarHBondContact O-N 3.32Å; Y772-C777 WeakPolarHBondContact CE1-SG 3.47Å; Y772-C777 VanDerWaalsContact CZ-SG 3.56Å; Y772-R798 WeakPolarHBondContact OH-CD 3.4Å; Y772-R798 PolarHBondContact OH-NH1 2.85Å; Y772-V809 HydrophobicContact CE1-CG1 4.34Å; Y772-F858 AromaticContact CD1-CD2 3.57Å; Y772-F858 HydrophobicContact CD1-CD2 3.57Å; Y772-F858 AromaticContact CD1-CE2 3.21Å; Y772-F858 HydrophobicContact CD1-CE2 3.21Å; Y772-F858 HydrophobicContact CD1-CG 4.44Å; Y772-F858 AromaticContact CD1-CZ 3.85Å; Y772-F858 HydrophobicContact CD1-CZ 3.85Å; Y772-F858 HydrophobicContact CD2-CD2 4.41Å; Y772-F858 HydrophobicContact CD2-CE1 4.23Å; Y772-F858 HydrophobicContact CD2-CE2 4.14Å; Y772-F858 HydrophobicContact CD2-CZ 4.03Å; Y772-F858 HydrophobicContact CE1-CD2 4.23Å; Y772-F858 AromaticContact CE1-CE2 3.4Å; Y772-F858 HydrophobicContact CE1-CE2 3.4Å; Y772-F858 VanDerWaalsContact CE1-CE2 3.4Å; Y772-F858 AromaticContact CE1-CZ 3.74Å; Y772-F858 HydrophobicContact CE1-CZ 3.74Å; Y772-F858 HydrophobicContact CE2-CE1 4.34Å; Y772-F858 HydrophobicContact CE2-CE2 4.3Å; Y772-F858 AromaticContact CE2-CZ 3.93Å; Y772-F858 HydrophobicContact CE2-CZ 3.93Å; Y772-F858 HydrophobicContact CG-CD1 4.45Å; Y772-F858 AromaticContact CG-CD2 3.67Å; Y772-F858 HydrophobicContact CG-CD2 3.67Å; Y772-F858 HydrophobicContact CG-CE1 4.4Å; Y772-F858 AromaticContact CG-CE2 3.61Å; Y772-F858 HydrophobicContact CG-CE2 3.61Å; Y772-F858 HydrophobicContact CG-CG 4.11Å; Y772-F858 AromaticContact CG-CZ 3.99Å; Y772-F858 HydrophobicContact CG-CZ 3.99Å; Y772-F858 AromaticContact CZ-CE2 3.96Å; Y772-F858 AromaticContact CZ-CZ 3.78Å; Y772-F901 HydrophobicContact CD1-CZ 4.24Å; Y772-F901 HydrophobicContact CE1-CE1 4.43Å; Y772-F901 AromaticContact CE1-CZ 3.87Å; Y772-F901 HydrophobicContact CE1-CZ 3.87Å
773	L	94.1	Very high	88	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-52.4	173.4	-72.7	170.5	0	0	0	111.6	L769 G770 V771 C777 L778 I831 M849 F892 V899 F901	L769-L773 HydrophobicContact CD1-CD1 4.35Å; L769-L773 HydrophobicContact CD1-CG 4.34Å; L769-L773 HydrophobicContact CG-CD1 4.15Å; L769-L773 WeakPolarHBondContact O-CG 3.33Å; L769-L773 PolarHBondContact O-N 3Å; G770-L773 PolarHBondContact O-N 3.42Å; V771-L773 VanDerWaalsContact C-N 3.27Å; V771-L773 PolarHBondContact O-N 3.3Å; L773-C777 CarbonylContact O-C 3.58Å; L773-C777 PolarHBondContact O-N 3.14Å; L773-C777 VanDerWaalsContact O-N 3.16Å; L773-L778 HydrophobicContact CB-CD1 3.98Å; L773-L778 HydrophobicContact CB-CG 4.5Å; L773-L778 WeakPolarHBondContact O-CB 3.4Å; L773-L778 WeakPolarHBondContact O-CG 3.35Å; L773-L778 PolarHBondContact O-N 3.46Å; L773-I831 HydrophobicContact CB-CD1 4.11Å; L773-I831 HydrophobicContact CD1-CD1 4.21Å; L773-M849 HydrophobicContact CD1-CE 3.95Å; L773-M849 HydrophobicContact CD1-SD 4.13Å; L773-F892 HydrophobicContact CD1-CB 4.15Å; L773-F892 HydrophobicContact CD1-CD1 3.62Å; L773-F892 HydrophobicContact CD1-CD2 4.36Å; L773-F892 HydrophobicContact CD1-CE1 4.05Å; L773-F892 HydrophobicContact CD1-CG 3.79Å; L773-F892 HydrophobicContact CD2-CB 3.95Å; L773-F892 HydrophobicContact CD2-CD2 4.11Å; L773-F892 HydrophobicContact CD2-CG 4.01Å; L773-V899 HydrophobicContact CD2-CB 4.2Å; L773-V899 HydrophobicContact CD2-CG1 4.09Å; L773-V899 HydrophobicContact CD2-CG2 4.2Å; L773-F901 HydrophobicContact CD2-CE2 4.14Å
774	E	91	Very high	88.1	Confident	29 Å²	29	35.9 Å²	35.9	14%	0.136	20%	0.201	C	C	.	.	H	α-helix	trans	-69.6	-41.9	-170.4	-72.6	172.4	-172.8	0	0	113.7	K358 G770 V771 I831 W854	K358-E774 WeakPolarHBondContact CE-OE2 3.43Å; K358-E774 VanDerWaalsContact NZ-CD 3.32Å; K358-E774 IonicContact NZ-OE1 2.64Å; K358-E774 PolarHBondContact NZ-OE1 3.09Å; K358-E774 IonicContact NZ-OE2 3.71Å; K358-E774 PolarHBondContact NZ-OE2 2.92Å; K358-E774 VanDerWaalsContact NZ-OE2 3.17Å; G770-E774 WeakPolarHBondContact O-CB 3.3Å; G770-E774 VanDerWaalsContact O-CG 3.27Å; G770-E774 WeakPolarHBondContact O-CG 3.42Å; G770-E774 PolarHBondContact O-N 2.82Å; V771-E774 PolarHBondContact O-N 3.15Å; E774-I831 HydrophobicContact CG-CD1 3.89Å; E774-I831 WeakPolarHBondContact OE1-CD1 3.15Å; E774-W854 PolarHBondContact OE1-NE1 2.77Å; E774-W854 PolarHBondContact OE2-NE1 3.27Å
775	D	87.1	Confident	88.2	Confident	92 Å²	92	33.8 Å²	33.8	49%	0.492	19%	0.187	S	C	.	.	H	α-helix	trans	-92.2	-24.3	-173.7	-65.7	-1.2	0	0	0	113.4	V771	V771-D775 WeakPolarHBondContact CG1-OD2 3.28Å; V771-D775 WeakPolarHBondContact O-CB 3.43Å; V771-D775 PolarHBondContact O-N 3.09Å
776	Y	87	Confident	88.1	Confident	18 Å²	18	37.1 Å²	37.1	7%	0.071	20%	0.197	C	C	.	.	H	α-helix	trans	-121.3	-12.5	-170.1	-53.2	-103.5	0	0	0	114.4	F154 F157 L767 Y772 R798	F154-Y776 HydrophobicContact CB-CE1 3.57Å; F154-Y776 AromaticContact CD1-CD1 3.94Å; F154-Y776 HydrophobicContact CD1-CD1 3.94Å; F154-Y776 AromaticContact CD1-CE1 3.72Å; F154-Y776 HydrophobicContact CD1-CE1 3.72Å; F154-Y776 AromaticContact CG-CE1 3.92Å; F154-Y776 HydrophobicContact CG-CE1 3.92Å; F157-Y776 HydrophobicContact CB-CD1 3.87Å; F157-Y776 HydrophobicContact CB-CE1 3.56Å; F157-Y776 HydrophobicContact CD1-CD1 4.41Å; F157-Y776 HydrophobicContact CD2-CD1 4.07Å; F157-Y776 AromaticContact CD2-CE1 3.91Å; F157-Y776 HydrophobicContact CD2-CE1 3.91Å; F157-Y776 AromaticContact CG-CD1 3.88Å; F157-Y776 HydrophobicContact CG-CD1 3.88Å; F157-Y776 AromaticContact CG-CE1 3.89Å; F157-Y776 HydrophobicContact CG-CE1 3.89Å; L767-Y776 HydrophobicContact CD1-CD2 4.49Å; L767-Y776 HydrophobicContact CD1-CE2 3.77Å; Y772-Y776 HydrophobicContact CD2-CD2 4.27Å; Y772-Y776 HydrophobicContact CD2-CG 4.26Å; Y772-Y776 WeakPolarHBondContact O-CB 3.44Å; Y772-Y776 PolarHBondContact O-N 3.32Å; Y776-R798 VanDerWaalsContact O-CZ 3.27Å; Y776-R798 PolarHBondContact O-NH1 2.95Å; Y776-R798 PolarHBondContact O-NH2 3.42Å
777	C	90.5	Very high	87.2	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.014	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.6	-31	-174	-56.3	0	0	0	0	114.4	Y772 L773 R798 V811 T897 V899	Y772-C777 WeakPolarHBondContact CE1-SG 3.47Å; Y772-C777 VanDerWaalsContact CZ-SG 3.56Å; L773-C777 CarbonylContact O-C 3.58Å; L773-C777 PolarHBondContact O-N 3.14Å; L773-C777 VanDerWaalsContact O-N 3.16Å; C777-R798 PolarHBondContact SG-NH1 3.17Å; C777-V811 HydrophobicContact CB-CG2 4.07Å; C777-V811 VanDerWaalsContact O-CG1 3.23Å; C777-V811 WeakPolarHBondContact O-CG1 3.46Å; C777-T897 WeakPolarHBondContact O-CG2 3.38Å; C777-V899 HydrophobicContact CB-CB 4.36Å; C777-V899 HydrophobicContact CB-CG1 3.85Å; C777-V899 HydrophobicContact CB-CG2 3.52Å
778	L	88.1	Confident	86.7	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	24%	0.242	C	C	.	.	S	Bend	trans	-102.1	11.2	-177.7	-64.7	171.9	0	0	0	113.2	L773 I831 R894 T897 V899	L773-L778 HydrophobicContact CB-CD1 3.98Å; L773-L778 HydrophobicContact CB-CG 4.5Å; L773-L778 WeakPolarHBondContact O-CB 3.4Å; L773-L778 WeakPolarHBondContact O-CG 3.35Å; L773-L778 PolarHBondContact O-N 3.46Å; L778-I831 HydrophobicContact CD1-CD1 3.63Å; L778-I831 HydrophobicContact CD1-CG1 3.76Å; L778-R894 HydrophobicContact CD1-CB 3.9Å; L778-R894 HydrophobicContact CD2-CB 3.98Å; L778-R894 HydrophobicContact CG-CB 4.4Å; L778-R894 PolarHBondContact O-NH2 3.19Å; L778-T897 HydrophobicContact CD2-CG2 4.15Å; L778-V899 HydrophobicContact CD2-CG2 3.53Å; L778-V899 HydrophobicContact CG-CG2 3.96Å
779	D	83.3	Confident	86.2	Confident	64 Å²	64	43.5 Å²	43.5	34%	0.342	24%	0.242	S	C	.	.			trans	-98.4	111.2	160.5	172.2	16.2	0	0	0	108.8	D781 C782	D779-D781 VanDerWaalsContact C-N 3.31Å; D779-D781 WeakPolarHBondContact OD1-CA 3.5Å; D779-D781 PolarHBondContact OD1-N 3.04Å; D779-C782 HydrophobicContact CB-CB 4.13Å; D779-C782 WeakPolarHBondContact O-CB 3.39Å; D779-C782 PolarHBondContact OD1-N 3.22Å; D779-C782 WeakPolarHBondContact OD2-CA 2.94Å; D779-C782 WeakPolarHBondContact OD2-CB 3.26Å; D779-C782 PolarHBondContact OD2-N 2.91Å
780	A	75.1	Confident	85.8	Confident	44 Å²	44	52.9 Å²	52.9	36%	0.364	29%	0.286	S	S	.	.	S	Bend	trans	-81.1	-7.2	180	0	0	0	0	0	113.9	K792	A780-K792 WeakPolarHBondContact O-CD 3.46Å; A780-K792 PolarHBondContact O-NZ 3.38Å; A780-K792 VanDerWaalsContact O-NZ 3.11Å
781	D	80.6	Confident	85.6	Confident	110 Å²	110	55 Å²	55	59%	0.588	30%	0.295	S	S	*	.	S	Bend	trans	-99.9	-8.5	174.2	-76.3	-53.4	0	0	0	113	D779 Q783 K792	D779-D781 VanDerWaalsContact C-N 3.31Å; D779-D781 WeakPolarHBondContact OD1-CA 3.5Å; D779-D781 PolarHBondContact OD1-N 3.04Å; D781-Q783 PolarHBondContact O-N 3.09Å; D781-Q783 VanDerWaalsContact O-N 3.08Å; D781-K792 WeakPolarHBondContact OD1-CE 3.37Å; D781-K792 IonicContact OD1-NZ 3.42Å; D781-K792 PolarHBondContact OD1-NZ 2.93Å
782	C	83.1	Confident	85.4	Confident	13 Å²	13	57.5 Å²	57.5	9%	0.088	30%	0.304	C	S	.	.			trans	-47.9	112.7	174.9	-171.4	0	0	0	0	111.8	D779 M793	D779-C782 HydrophobicContact CB-CB 4.13Å; D779-C782 WeakPolarHBondContact O-CB 3.39Å; D779-C782 PolarHBondContact OD1-N 3.22Å; D779-C782 WeakPolarHBondContact OD2-CA 2.94Å; D779-C782 WeakPolarHBondContact OD2-CB 3.26Å; D779-C782 PolarHBondContact OD2-N 2.91Å; C782-M793 HydrophobicContact CB-CB 4.3Å; C782-M793 HydrophobicContact CB-CG 4.4Å; C782-M793 WeakPolarHBondContact O-CB 3.36Å; C782-M793 PolarHBondContact O-N 3.27Å
783	Q	87.3	Confident	85.2	Confident	147 Å²	147	58 Å²	58	69%	0.687	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-84.9	153.9	-179.5	-64.7	-169.6	-7.4	0	0	111.9	D781	D781-Q783 PolarHBondContact O-N 3.09Å; D781-Q783 VanDerWaalsContact O-N 3.08Å
784	C	85.8	Confident	84.9	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.081	32%	0.319	C	S	.	.			trans	-65.3	126.6	171.7	-168.6	0	0	0	0	110.6	R786 C789 E791 M793 H796	C784-R786 PolarHBondContact O-N 3.07Å; C784-R786 VanDerWaalsContact O-N 3.12Å; C784-C789 HydrophobicContact CB-CB 4.02Å; C784-E791 VanDerWaalsContact CB-O 3.24Å; C784-E791 WeakPolarHBondContact CB-O 3.45Å; C784-E791 PolarHBondContact N-O 3.41Å; C784-M793 HydrophobicContact CB-SD 4.15Å; C784-H796 PolarHBondContact SG-NE2 3.42Å; C784-H796 VanDerWaalsContact SG-NE2 3.36Å
785	P	80.3	Confident	84.9	Confident	66 Å²	66	60.7 Å²	60.7	43%	0.429	32%	0.324	S	S	.	.			trans	-76	3.2	-177.2	32	-38.2	0	0	0	114.1	F157	F157-P785 HydrophobicContact CD1-CG 4.22Å; F157-P785 HydrophobicContact CE1-CG 3.61Å; F157-P785 HydrophobicContact CE2-CG 4.22Å; F157-P785 HydrophobicContact CZ-CG 3.61Å
786	R	80.9	Confident	85.1	Confident	98 Å²	98	56.6 Å²	56.6	37%	0.37	30%	0.301	S	S	.	.	S	Bend	trans	-84.8	124.4	-179	178.2	-176.1	-174.4	-173.1	19.6	111.3	Y750 C751 C784 G788 C789	Y750-R786 VanDerWaalsContact O-CZ 3.31Å; Y750-R786 PolarHBondContact O-NH1 3.08Å; C751-R786 HydrophobicContact CB-CB 4.44Å; C751-R786 WeakPolarHBondContact O-CD 3.46Å; C784-R786 PolarHBondContact O-N 3.07Å; C784-R786 VanDerWaalsContact O-N 3.12Å; R786-G788 PolarHBondContact O-N 3.28Å; R786-C789 HydrophobicContact CB-CB 4.22Å; R786-C789 PolarHBondContact O-N 2.93Å
787	E	73.3	Confident	85.3	Confident	117 Å²	117	56.8 Å²	56.8	55%	0.547	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	121.7	164.8	-77.7	-163.7	145.1	0	0	111.1	R65	R65-E787 WeakPolarHBondContact CD-OE2 3.23Å; R65-E787 IonicContact CZ-OE2 3.11Å; R65-E787 IonicContact NE-OE2 2.83Å; R65-E787 PolarHBondContact NE-OE2 3.44Å; R65-E787 IonicContact NH2-OE2 3.14Å
788	G	79.9	Confident	85.5	Confident	61 Å²	61	57.4 Å²	57.4	63%	0.629	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	10.9	-177.6	0	0	0	0	0	115.2	R749 R786	R749-G788 PolarHBondContact NH2-O 3.34Å; R786-G788 PolarHBondContact O-N 3.28Å
789	C	84.9	Confident	85.8	Confident	8 Å²	8	57.5 Å²	57.5	5%	0.054	31%	0.305	C	S	.	.			trans	-118.4	103.8	163	-156.1	0	0	0	0	110.7	R749 C784 R786 E791 H796	R749-C789 PolarHBondContact NH2-SG 2.88Å; C784-C789 HydrophobicContact CB-CB 4.02Å; R786-C789 HydrophobicContact CB-CB 4.22Å; R786-C789 PolarHBondContact O-N 2.93Å; C789-E791 PolarHBondContact O-N 3.18Å; C789-H796 PolarHBondContact SG-NE2 3.36Å; C789-H796 VanDerWaalsContact SG-NE2 3.43Å
790	E	89.3	Confident	86.4	Confident	197 Å²	197	54.4 Å²	54.4	92%	0.921	29%	0.289	S	S	*	.			trans	-88.7	7.6	-179.7	-58.2	-179.1	168.2	0	0	112.4
791	E	89.7	Confident	87.2	Confident	43 Å²	43	52.4 Å²	52.4	20%	0.201	27%	0.272	C	S	.	.	S	Bend	trans	-89.3	142.2	-178.6	-67.1	-73.7	174.8	0	0	111.5	L741 K743 C784 C789 N795	L741-E791 HydrophobicContact CD1-CB 3.62Å; L741-E791 HydrophobicContact CD1-CG 3.71Å; L741-E791 HydrophobicContact CD2-CG 4.23Å; K743-E791 WeakPolarHBondContact CD-OE1 3.34Å; K743-E791 WeakPolarHBondContact CD-OE2 3.49Å; K743-E791 IonicContact NZ-OE1 4Å; K743-E791 PolarHBondContact NZ-OE1 2.77Å; K743-E791 IonicContact NZ-OE2 2.67Å; K743-E791 PolarHBondContact NZ-OE2 3.17Å; C784-E791 VanDerWaalsContact CB-O 3.24Å; C784-E791 WeakPolarHBondContact CB-O 3.45Å; C784-E791 PolarHBondContact N-O 3.41Å; C789-E791 PolarHBondContact O-N 3.18Å; E791-N795 PolarHBondContact OE2-ND2 3.44Å
792	K	89.2	Confident	87.6	Confident	79 Å²	79	47.5 Å²	47.5	34%	0.343	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-66	155.5	174.2	-70.9	-180	164	-159.3	0	112.2	A780 D781 V794 N795 H796	A780-K792 WeakPolarHBondContact O-CD 3.46Å; A780-K792 PolarHBondContact O-NZ 3.38Å; A780-K792 VanDerWaalsContact O-NZ 3.11Å; D781-K792 WeakPolarHBondContact OD1-CE 3.37Å; D781-K792 IonicContact OD1-NZ 3.42Å; D781-K792 PolarHBondContact OD1-NZ 2.93Å; K792-V794 HydrophobicContact CB-CG1 3.89Å; K792-V794 PolarHBondContact O-N 3.21Å; K792-N795 PolarHBondContact O-N 3.31Å; K792-H796 PolarHBondContact O-ND1 2.7Å
793	M	88.9	Confident	87.7	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.049	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-63	-21.1	177.3	-74.8	-54.1	-50.8	0	0	113.8	F157 C782 C784 N795 H796 R798	F157-M793 HydrophobicContact CE1-CG 4.5Å; F157-M793 HydrophobicContact CE1-SD 4.3Å; C782-M793 HydrophobicContact CB-CB 4.3Å; C782-M793 HydrophobicContact CB-CG 4.4Å; C782-M793 WeakPolarHBondContact O-CB 3.36Å; C782-M793 PolarHBondContact O-N 3.27Å; C784-M793 HydrophobicContact CB-SD 4.15Å; M793-N795 PolarHBondContact O-N 3.26Å; M793-H796 HydrophobicContact CE-CB 3.7Å; M793-H796 WeakPolarHBondContact O-CB 3.34Å; M793-H796 PolarHBondContact O-N 2.86Å; M793-H796 HydrophobicContact SD-CB 4.39Å; M793-R798 HydrophobicContact CE-CG 4.47Å
794	V	87.7	Confident	87.7	Confident	41 Å²	41	41.8 Å²	41.8	25%	0.248	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-61.1	-27.4	170.8	71.4	0	0	0	0	113.1	K792 H796 V811	K792-V794 HydrophobicContact CB-CG1 3.89Å; K792-V794 PolarHBondContact O-N 3.21Å; V794-H796 VanDerWaalsContact C-N 3.25Å; V794-H796 PolarHBondContact O-N 2.74Å; V794-V811 HydrophobicContact CG2-CB 4.39Å; V794-V811 HydrophobicContact CG2-CG1 4.18Å; V794-V811 WeakPolarHBondContact CG2-O 3.38Å
795	N	90.3	Very high	87.8	Confident	46 Å²	46	41.4 Å²	41.4	25%	0.246	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-87.3	8.6	176	-63.1	-23.1	0	0	0	112.7	L741 L742 K743 E791 K792 M793	L741-N795 HydrophobicContact CD1-CB 3.99Å; L741-N795 WeakPolarHBondContact CD1-O 3.5Å; L742-N795 PolarHBondContact N-O 3.01Å; K743-N795 HydrophobicContact CB-CB 4.48Å; K743-N795 HydrophobicContact CD-CB 4.45Å; E791-N795 PolarHBondContact OE2-ND2 3.44Å; K792-N795 PolarHBondContact O-N 3.31Å; M793-N795 PolarHBondContact O-N 3.26Å
796	H	91.6	Very high	88.5	Confident	5 Å²	5	38.4 Å²	38.4	2%	0.023	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.4	-177.3	-65.7	77.4	0	0	0	111.5	Y740 C751 C784 C789 K792 M793 V794	Y740-H796 CarbonylContact O-C 3.59Å; Y740-H796 VanDerWaalsContact O-CA 3.25Å; Y740-H796 WeakPolarHBondContact O-CA 3.4Å; C751-H796 PolarHBondContact SG-NE2 3.29Å; C784-H796 PolarHBondContact SG-NE2 3.42Å; C784-H796 VanDerWaalsContact SG-NE2 3.36Å; C789-H796 PolarHBondContact SG-NE2 3.36Å; C789-H796 VanDerWaalsContact SG-NE2 3.43Å; K792-H796 PolarHBondContact O-ND1 2.7Å; M793-H796 HydrophobicContact CE-CB 3.7Å; M793-H796 WeakPolarHBondContact O-CB 3.34Å; M793-H796 PolarHBondContact O-N 2.86Å; M793-H796 HydrophobicContact SD-CB 4.39Å; V794-H796 VanDerWaalsContact C-N 3.25Å; V794-H796 PolarHBondContact O-N 2.74Å
797	I	92.2	Very high	89.2	Confident	22 Å²	22	33.8 Å²	33.8	11%	0.113	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	143.2	167.1	-62	-176.1	0	0	0	108.3	S739 Y740 L742 E808	S739-I797 CarbonylContact C-O 3.54Å; S739-I797 WeakPolarHBondContact CA-O 3.47Å; S739-I797 WeakPolarHBondContact CB-O 3.36Å; S739-I797 PolarHBondContact OG-O 2.79Å; Y740-I797 HydrophobicContact CD1-CB 4.46Å; Y740-I797 HydrophobicContact CE1-CB 3.87Å; Y740-I797 HydrophobicContact CE1-CG2 3.86Å; Y740-I797 HydrophobicContact CE2-CB 4.04Å; Y740-I797 HydrophobicContact CE2-CD1 4.18Å; Y740-I797 HydrophobicContact CE2-CG1 4.39Å; Y740-I797 PolarHBondContact N-O 3.38Å; Y740-I797 PolarHBondContact O-N 3.45Å; Y740-I797 WeakPolarHBondContact OH-CD1 3.33Å; L742-I797 HydrophobicContact CD2-CD1 3.67Å; I797-E808 HydrophobicContact CG2-CB 3.97Å; I797-E808 HydrophobicContact CG2-CG 4.13Å
798	R	94.3	Very high	90.2	Very high	15 Å²	15	29 Å²	29	6%	0.057	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.8	164.3	-59	-175.7	-173.2	116.2	4	107.9	L737 S738 Y772 Y776 C777 M793 V809	L737-R798 HydrophobicContact CD1-CB 4.48Å; S738-R798 CarbonylContact O-C 3.57Å; S738-R798 WeakPolarHBondContact O-CA 3.28Å; Y772-R798 WeakPolarHBondContact OH-CD 3.4Å; Y772-R798 PolarHBondContact OH-NH1 2.85Å; Y776-R798 VanDerWaalsContact O-CZ 3.27Å; Y776-R798 PolarHBondContact O-NH1 2.95Å; Y776-R798 PolarHBondContact O-NH2 3.42Å; C777-R798 PolarHBondContact SG-NH1 3.17Å; M793-R798 HydrophobicContact CE-CG 4.47Å; R798-V809 HydrophobicContact CB-CB 4.43Å; R798-V809 PolarHBondContact N-O 3.47Å; R798-V809 PolarHBondContact O-N 3.4Å
799	R	94.6	Very high	91	Very high	9 Å²	9	26.2 Å²	26.2	3%	0.034	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.2	178	-173.7	-172.2	-62.7	138.7	6.3	109.8	S738 Y740 V801 V807 E808 C1367 Y1372	S738-R799 PolarHBondContact N-O 3.21Å; S738-R799 PolarHBondContact O-N 2.9Å; S738-R799 PolarHBondContact OG-O 2.96Å; Y740-R799 HydrophobicContact CE1-CB 4.37Å; Y740-R799 PolarHBondContact OH-NH2 3.3Å; R799-V801 HydrophobicContact CG-CG2 3.88Å; R799-V807 WeakPolarHBondContact CA-O 3.17Å; R799-E808 HydrophobicContact CB-CG 4.11Å; R799-E808 HydrophobicContact CG-CG 3.84Å; R799-E808 IonicContact CZ-OE1 3.69Å; R799-E808 IonicContact NE-OE1 3.23Å; R799-E808 PolarHBondContact NE-OE1 2.56Å; R799-E808 IonicContact NH2-OE1 2.65Å; R799-E808 PolarHBondContact NH2-OE1 2.82Å; R799-C1367 PolarHBondContact NH1-O 3.48Å; R799-C1367 PolarHBondContact NH2-O 3.25Å; R799-Y1372 WeakPolarHBondContact CD-OH 3.47Å; R799-Y1372 PolarHBondContact NH1-OH 3.33Å
800	F	95.1	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	144.9	165.8	-60	-96.2	0	0	0	108.8	L736 L737 F757 S806 V807 V809 F858 L862 F866	L736-F800 CarbonylContact O-C 3.53Å; L736-F800 VanDerWaalsContact O-CA 3.25Å; L736-F800 WeakPolarHBondContact O-CA 3.28Å; L737-F800 HydrophobicContact CB-CD1 4.31Å; L737-F800 HydrophobicContact CB-CE1 4.35Å; L737-F800 HydrophobicContact CD1-CD1 4.04Å; L737-F800 HydrophobicContact CD1-CD2 4.44Å; L737-F800 HydrophobicContact CD1-CE1 3.71Å; L737-F800 HydrophobicContact CD1-CE2 4.12Å; L737-F800 HydrophobicContact CD1-CG 4.4Å; L737-F800 HydrophobicContact CD1-CZ 3.75Å; L737-F800 HydrophobicContact CD2-CE1 4.29Å; L737-F800 HydrophobicContact CG-CE1 4.33Å; F757-F800 HydrophobicContact CD1-CD1 4.17Å; F757-F800 HydrophobicContact CD1-CE1 4.04Å; F757-F800 HydrophobicContact CD2-CE1 4.29Å; F757-F800 HydrophobicContact CE1-CD1 4.39Å; F757-F800 AromaticContact CE1-CE1 3.97Å; F757-F800 HydrophobicContact CE1-CE1 3.97Å; F757-F800 HydrophobicContact CE2-CE1 4.24Å; F757-F800 HydrophobicContact CG-CD1 4.49Å; F757-F800 HydrophobicContact CG-CE1 4.2Å; F757-F800 HydrophobicContact CZ-CE1 4.07Å; F800-S806 CarbonylContact O-C 3.32Å; F800-S806 VanDerWaalsContact O-CA 3.26Å; F800-S806 WeakPolarHBondContact O-CA 3.31Å; F800-V807 HydrophobicContact CB-CB 4.43Å; F800-V807 PolarHBondContact N-O 2.83Å; F800-V807 PolarHBondContact O-N 3.17Å; F800-V809 HydrophobicContact CD2-CG2 4.28Å; F800-V809 HydrophobicContact CE2-CG2 3.98Å; F800-F858 HydrophobicContact CE1-CE1 4.02Å; F800-F858 HydrophobicContact CE1-CZ 4.25Å; F800-F858 HydrophobicContact CE2-CE1 4.49Å; F800-F858 AromaticContact CE2-CZ 3.92Å; F800-F858 HydrophobicContact CE2-CZ 3.92Å; F800-F858 AromaticContact CZ-CE1 3.68Å; F800-F858 HydrophobicContact CZ-CE1 3.68Å; F800-F858 AromaticContact CZ-CZ 3.54Å; F800-F858 HydrophobicContact CZ-CZ 3.54Å; F800-L862 HydrophobicContact CD1-CD1 3.62Å; F800-L862 HydrophobicContact CD2-CD1 4.34Å; F800-L862 HydrophobicContact CD2-CD2 4.13Å; F800-L862 HydrophobicContact CE1-CD1 3.7Å; F800-L862 HydrophobicContact CE2-CD1 4.43Å; F800-L862 HydrophobicContact CE2-CD2 4.49Å; F800-L862 HydrophobicContact CG-CD1 3.96Å; F800-L862 HydrophobicContact CG-CD2 4.26Å; F800-L862 HydrophobicContact CZ-CD1 4.12Å; F800-F866 HydrophobicContact CB-CE2 4.14Å; F800-F866 HydrophobicContact CB-CZ 3.81Å
801	V	92.4	Very high	91.4	Very high	1 Å²	1	18 Å²	18	1%	0.006	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	134.3	-179.1	-172.6	0	0	0	0	110.6	A735 L736 R799 I906 Y1372	A735-V801 WeakPolarHBondContact CA-O 3.49Å; A735-V801 WeakPolarHBondContact CB-O 3.25Å; L736-V801 HydrophobicContact CB-CB 4.27Å; L736-V801 PolarHBondContact N-O 2.89Å; L736-V801 PolarHBondContact O-N 3.17Å; R799-V801 HydrophobicContact CG-CG2 3.88Å; V801-I906 HydrophobicContact CG1-CD1 3.37Å; V801-I906 HydrophobicContact CG1-CG1 4.46Å; V801-Y1372 HydrophobicContact CB-CE1 4.35Å; V801-Y1372 HydrophobicContact CG1-CD1 4.19Å; V801-Y1372 HydrophobicContact CG1-CE1 4.11Å; V801-Y1372 HydrophobicContact CG2-CE1 3.91Å; V801-Y1372 HydrophobicContact CG2-CE2 4.48Å
802	L	89.4	Confident	91.1	Very high	8 Å²	8	19.4 Å²	19.4	4%	0.042	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	127.5	-178.2	-179.4	52.2	0	0	0	109.3	F733 T734 A735 T805 F866 P1468	F733-L802 HydrophobicContact CD2-CD2 4.45Å; F733-L802 HydrophobicContact CE2-CD2 3.61Å; F733-L802 HydrophobicContact CZ-CD2 3.99Å; T734-L802 WeakPolarHBondContact O-CD1 3.26Å; A735-L802 HydrophobicContact CB-CB 4.32Å; L802-T805 PolarHBondContact N-O 2.7Å; L802-T805 PolarHBondContact O-N 2.83Å; L802-T805 VanDerWaalsContact O-O 3.08Å; L802-F866 HydrophobicContact CB-CD1 3.72Å; L802-F866 HydrophobicContact CB-CD2 4.08Å; L802-F866 HydrophobicContact CB-CE1 3.75Å; L802-F866 HydrophobicContact CB-CE2 4.13Å; L802-F866 HydrophobicContact CB-CG 3.91Å; L802-F866 HydrophobicContact CB-CZ 3.97Å; L802-F866 HydrophobicContact CD2-CB 4.32Å; L802-F866 HydrophobicContact CD2-CD2 3.96Å; L802-F866 HydrophobicContact CD2-CG 4.09Å; L802-F866 HydrophobicContact CG-CG 4.4Å; L802-P1468 HydrophobicContact CD1-CB 4.01Å; L802-P1468 WeakPolarHBondContact CD1-O 3.49Å
803	G	84.8	Confident	90.6	Very high	18 Å²	18	19.8 Å²	19.8	19%	0.186	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-138.7	-171.2	0	0	0	0	0	112.2	T805 S1467 P1468	G803-T805 PolarHBondContact O-N 3.45Å; G803-S1467 PolarHBondContact N-OG 2.76Å; G803-S1467 VanDerWaalsContact N-OG 3.09Å; G803-S1467 WeakPolarHBondContact O-CB 3.43Å; G803-S1467 PolarHBondContact O-OG 3.36Å; G803-P1468 PolarHBondContact N-O 3.03Å
804	S	86.6	Confident	89.7	Confident	21 Å²	21	21.1 Å²	21.1	15%	0.147	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	16.7	177.3	51	0	0	0	0	114.2	I906	S804-I906 VanDerWaalsContact C-CG1 3.46Å; S804-I906 WeakPolarHBondContact O-CG1 3.44Å; S804-I906 PolarHBondContact O-N 2.93Å
805	T	89.2	Confident	88.5	Confident	5 Å²	5	23 Å²	23	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.3	-174.7	-65.2	0	0	0	0	112.6	T595 L802 G803 F866	T595-T805 HydrophobicContact CG2-CG2 4.43Å; T595-T805 WeakPolarHBondContact CG2-OG1 3.43Å; L802-T805 PolarHBondContact N-O 2.7Å; L802-T805 PolarHBondContact O-N 2.83Å; L802-T805 VanDerWaalsContact O-O 3.08Å; G803-T805 PolarHBondContact O-N 3.45Å; T805-F866 HydrophobicContact CG2-CD1 3.81Å; T805-F866 HydrophobicContact CG2-CE1 4.2Å; T805-F866 WeakPolarHBondContact O-CE1 3.35Å
806	S	93.3	Very high	87.1	Confident	3 Å²	3	25 Å²	25	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.4	170.9	66	0	0	0	0	111.2	F800 C903 Q904	F800-S806 CarbonylContact O-C 3.32Å; F800-S806 VanDerWaalsContact O-CA 3.26Å; F800-S806 WeakPolarHBondContact O-CA 3.31Å; S806-C903 CarbonylContact O-C 3.59Å; S806-C903 WeakPolarHBondContact O-CA 3.3Å; S806-Q904 PolarHBondContact N-O 3.02Å; S806-Q904 PolarHBondContact O-N 2.96Å; S806-Q904 PolarHBondContact OG-O 3.35Å
807	V	95.6	Very high	85.6	Confident	0 Å²	0	27 Å²	27	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	115.7	172.9	175.4	0	0	0	0	107.7	R799 F800 L862 L865 F866 F901	R799-V807 WeakPolarHBondContact CA-O 3.17Å; F800-V807 HydrophobicContact CB-CB 4.43Å; F800-V807 PolarHBondContact N-O 2.83Å; F800-V807 PolarHBondContact O-N 3.17Å; V807-L862 HydrophobicContact CB-CD2 4.45Å; V807-L862 HydrophobicContact CG1-CD2 3.99Å; V807-L865 HydrophobicContact CG1-CD1 3.87Å; V807-L865 HydrophobicContact CG2-CB 3.82Å; V807-F866 HydrophobicContact CB-CE1 4.32Å; V807-F866 HydrophobicContact CB-CE2 4.34Å; V807-F866 HydrophobicContact CB-CZ 3.89Å; V807-F866 HydrophobicContact CG2-CD1 4.02Å; V807-F866 HydrophobicContact CG2-CD2 4.23Å; V807-F866 HydrophobicContact CG2-CE1 3.65Å; V807-F866 HydrophobicContact CG2-CE2 3.84Å; V807-F866 HydrophobicContact CG2-CG 4.29Å; V807-F866 HydrophobicContact CG2-CZ 3.54Å; V807-F901 HydrophobicContact CG1-CD1 4.11Å
808	E	95.2	Very high	84.1	Confident	16 Å²	16	26.4 Å²	26.4	8%	0.075	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.6	176.7	-69.8	-177.5	150.9	0	0	110.6	Y740 I797 R799 F901 R902 Q904	Y740-E808 PolarHBondContact OH-OE1 3.5Å; Y740-E808 VanDerWaalsContact OH-OE1 3.06Å; I797-E808 HydrophobicContact CG2-CB 3.97Å; I797-E808 HydrophobicContact CG2-CG 4.13Å; R799-E808 HydrophobicContact CB-CG 4.11Å; R799-E808 HydrophobicContact CG-CG 3.84Å; R799-E808 IonicContact CZ-OE1 3.69Å; R799-E808 IonicContact NE-OE1 3.23Å; R799-E808 PolarHBondContact NE-OE1 2.56Å; R799-E808 IonicContact NH2-OE1 2.65Å; R799-E808 PolarHBondContact NH2-OE1 2.82Å; E808-F901 WeakPolarHBondContact O-CA 3.37Å; E808-R902 PolarHBondContact N-O 2.97Å; E808-R902 PolarHBondContact O-N 3.26Å; E808-Q904 PolarHBondContact OE2-NE2 2.8Å
809	V	95.8	Very high	82.4	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.2	170.6	-168.6	0	0	0	0	108.2	Y772 R798 F800 V899 S900 F901	Y772-V809 HydrophobicContact CE1-CG1 4.34Å; R798-V809 HydrophobicContact CB-CB 4.43Å; R798-V809 PolarHBondContact N-O 3.47Å; R798-V809 PolarHBondContact O-N 3.4Å; F800-V809 HydrophobicContact CD2-CG2 4.28Å; F800-V809 HydrophobicContact CE2-CG2 3.98Å; V809-V899 HydrophobicContact CG1-CG1 3.77Å; V809-S900 VanDerWaalsContact CA-O 3.31Å; V809-S900 WeakPolarHBondContact CA-O 3.42Å; V809-F901 HydrophobicContact CG1-CE1 4.42Å; V809-F901 HydrophobicContact CG1-CE2 4.3Å; V809-F901 HydrophobicContact CG1-CZ 4.22Å; V809-F901 HydrophobicContact CG2-CD1 3.62Å; V809-F901 HydrophobicContact CG2-CE1 3.52Å; V809-F901 HydrophobicContact CG2-CG 4.29Å; V809-F901 HydrophobicContact CG2-CZ 4.13Å
810	S	91.9	Very high	80.6	Confident	20 Å²	20	33.9 Å²	33.9	14%	0.14	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	142.9	176.1	69	0	0	0	0	111.2	H812 S900	S810-H812 PolarHBondContact OG-NE2 3.48Å; S810-S900 PolarHBondContact N-O 3.15Å; S810-S900 PolarHBondContact O-N 3.43Å; S810-S900 PolarHBondContact O-OG 3.44Å; S810-S900 PolarHBondContact OG-OG 2.86Å
811	V	90.6	Very high	78.6	Confident	13 Å²	13	35.2 Å²	35.2	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138	-176.9	-176.7	0	0	0	0	108.8	C777 V794 T897 L898 V899	C777-V811 HydrophobicContact CB-CG2 4.07Å; C777-V811 VanDerWaalsContact O-CG1 3.23Å; C777-V811 WeakPolarHBondContact O-CG1 3.46Å; V794-V811 HydrophobicContact CG2-CB 4.39Å; V794-V811 HydrophobicContact CG2-CG1 4.18Å; V794-V811 WeakPolarHBondContact CG2-O 3.38Å; V811-T897 HydrophobicContact CG1-CG2 3.54Å; V811-L898 CarbonylContact C-O 3.59Å; V811-L898 VanDerWaalsContact CA-O 3.31Å; V811-L898 WeakPolarHBondContact CA-O 3.44Å; V811-V899 HydrophobicContact CG2-CG2 4.47Å
812	H	84.2	Confident	76.5	Confident	72 Å²	72	38.8 Å²	38.8	33%	0.333	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	143.2	-176.3	-58.7	-89.6	0	0	0	110.4	S810 L898	S810-H812 PolarHBondContact OG-NE2 3.48Å; H812-L898 HydrophobicContact CB-CB 4.4Å; H812-L898 PolarHBondContact N-O 3.34Å; H812-L898 PolarHBondContact O-N 2.84Å
813	A	78.2	Confident	74.2	Confident	87 Å²	87	47.4 Å²	47.4	72%	0.719	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.7	169	0	0	0	0	0	109.8
814	M	70.8	Confident	72.2	Confident	38 Å²	38	55.8 Å²	55.8	19%	0.187	33%	0.333	C	S	.	.			trans	-86.4	131.1	176.4	-64.5	-109.2	-77.3	0	0	110.3	V816 P818 W834 N896 L898	M814-V816 VanDerWaalsContact C-N 3.29Å; M814-V816 WeakPolarHBondContact CE-O 3.29Å; M814-P818 HydrophobicContact CE-CG 3.75Å; M814-W834 HydrophobicContact CE-CH2 4.49Å; M814-N896 PolarHBondContact N-O 3.45Å; M814-L898 HydrophobicContact CG-CB 3.63Å; M814-L898 HydrophobicContact CG-CD2 4.44Å; M814-L898 HydrophobicContact SD-CB 4.03Å; M814-L898 HydrophobicContact SD-CD1 4.46Å; M814-L898 HydrophobicContact SD-CD2 3.86Å; M814-L898 HydrophobicContact SD-CG 4.35Å
815	G	61.5	Low	70	Confident	80 Å²	80	59.5 Å²	59.5	83%	0.825	36%	0.358	S	S	*	.	S	Bend	trans	-73.9	-18.9	173.1	0	0	0	0	0	114.1
816	V	61.4	Low	67.9	Low	90 Å²	90	64 Å²	64	55%	0.545	41%	0.407	S	S	.	.	S	Bend	trans	-140.3	128.9	176.3	-174.7	0	0	0	0	107.5	M814	M814-V816 VanDerWaalsContact C-N 3.29Å; M814-V816 WeakPolarHBondContact CE-O 3.29Å
817	P	59.9	Low	65.9	Low	47 Å²	47	65.8 Å²	65.8	31%	0.305	42%	0.419	S	S	.	.			trans	-68.7	159	176.7	28.6	-34.7	0	0	0	112
818	P	60.5	Low	63.9	Low	8 Å²	8	67.5 Å²	67.5	5%	0.052	44%	0.437	C	S	.	.			trans	-56.6	148.8	174.6	-24.1	34.1	0	0	0	113.3	M814 S820 L821 V832 W834 A893	M814-P818 HydrophobicContact CE-CG 3.75Å; P818-S820 PolarHBondContact O-N 3.5Å; P818-S820 VanDerWaalsContact O-N 3.16Å; P818-L821 HydrophobicContact CB-CD1 4.45Å; P818-L821 HydrophobicContact CG-CD1 4.08Å; P818-L821 PolarHBondContact O-N 3.09Å; P818-V832 HydrophobicContact CB-CG2 4.18Å; P818-V832 HydrophobicContact CG-CG2 4.03Å; P818-W834 HydrophobicContact CG-CH2 4.3Å; P818-W834 HydrophobicContact CG-CZ3 4.21Å; P818-A893 HydrophobicContact CG-CB 3.9Å
819	N	58.4	Low	62.8	Low	138 Å²	138	71.8 Å²	71.8	74%	0.738	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-61.2	-28	-178.2	-71.3	-26.4	0	0	0	112.6	L821 S822	N819-L821 PolarHBondContact O-N 3.39Å; N819-S822 PolarHBondContact O-OG 3.02Å; N819-S822 VanDerWaalsContact O-OG 3.1Å
820	S	56.9	Low	62.3	Low	44 Å²	44	75.2 Å²	75.2	31%	0.308	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-75.5	-0.9	175.3	58.9	0	0	0	0	115.1	P818 E846	P818-S820 PolarHBondContact O-N 3.5Å; P818-S820 VanDerWaalsContact O-N 3.16Å; S820-E846 WeakPolarHBondContact CB-OE2 3.46Å; S820-E846 PolarHBondContact N-OE2 3.22Å; S820-E846 PolarHBondContact OG-OE2 2.88Å
821	L	54.9	Low	62.2	Low	28 Å²	28	74.5 Å²	74.5	15%	0.147	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-116	-6.5	179.4	-77.4	169.1	0	0	0	114.4	P818 N819 E823 V832	P818-L821 HydrophobicContact CB-CD1 4.45Å; P818-L821 HydrophobicContact CG-CD1 4.08Å; P818-L821 PolarHBondContact O-N 3.09Å; N819-L821 PolarHBondContact O-N 3.39Å; L821-E823 PolarHBondContact O-N 3.37Å; L821-V832 HydrophobicContact CD1-CG1 4.41Å; L821-V832 HydrophobicContact CD1-CG2 3.77Å; L821-V832 HydrophobicContact CD2-CG1 4.44Å; L821-V832 HydrophobicContact CG-CG1 4.16Å; L821-V832 HydrophobicContact CG-CG2 4.3Å
822	S	47.3	Very low	62.3	Low	75 Å²	75	73.9 Å²	73.9	52%	0.524	47%	0.467	S	S	.	.	S	Bend	trans	-77.2	111.8	173.7	54	0	0	0	0	111.7	N819	N819-S822 PolarHBondContact O-OG 3.02Å; N819-S822 VanDerWaalsContact O-OG 3.1Å
823	E	42	Very low	62.8	Low	189 Å²	189	70.6 Å²	70.6	88%	0.883	45%	0.451	S	S	*	.	S	Bend	trans	21.6	98	153.3	-56.3	-176.3	153.1	0	0	116.3	L821	L821-E823 PolarHBondContact O-N 3.37Å
824	E	42.6	Very low	63.4	Low	195 Å²	195	67.9 Å²	67.9	91%	0.911	42%	0.423	S	S	*	.	S	Bend		-151.3	11.8	111	-130.8	177.7	-147.7	0	0	114.5
825	S	38.8	Very low	64.4	Low	98 Å²	98	66.1 Å²	66.1	69%	0.685	41%	0.414	S	S	*	.	S	Bend	trans	-148.2	133.9	178.8	-75.8	0	0	0	0	111.6	S827	S825-S827 PolarHBondContact O-N 2.97Å; S825-S827 PolarHBondContact O-OG 3.03Å
826	G	46.7	Very low	65.8	Low	101 Å²	101	64.8 Å²	64.8	100%	1.041	38%	0.384	S	S	*	.	S	Bend	trans	-62	65	-169.2	0	0	0	0	0	115.8
827	S	50.6	Low	67.1	Low	39 Å²	39	60.5 Å²	60.5	27%	0.273	36%	0.358	S	S	.	.			trans	-134.5	9.7	-167.7	62.8	0	0	0	0	113.2	S825 N829 Q830	S825-S827 PolarHBondContact O-N 2.97Å; S825-S827 PolarHBondContact O-OG 3.03Å; S827-N829 PolarHBondContact O-N 2.84Å; S827-Q830 PolarHBondContact O-N 2.72Å
828	G	53.2	Low	68.4	Low	37 Å²	37	60.5 Å²	60.5	38%	0.381	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	22.8	177.9	0	0	0	0	0	116.1	Q895	G828-Q895 VanDerWaalsContact O-CG 3.26Å; G828-Q895 WeakPolarHBondContact O-CG 3.31Å; G828-Q895 PolarHBondContact O-NE2 2.61Å
829	N	72.3	Confident	69.7	Low	105 Å²	105	64.7 Å²	64.7	56%	0.561	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	6.2	168.4	-162.8	19.4	0	0	0	111.8	S827 R894	S827-N829 PolarHBondContact O-N 2.84Å; N829-R894 WeakPolarHBondContact OD1-CD 3.22Å
830	Q	84.5	Confident	71	Confident	76 Å²	76	61 Å²	61	36%	0.355	36%	0.355	S	S	.	.	S	Bend	trans	-77.9	149.2	168.2	-70.3	-169.8	-67.9	0	0	111	S827	S827-Q830 PolarHBondContact O-N 2.72Å
831	I	91.6	Very high	72.4	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	37%	0.368	C	S	.	.			trans	-88.1	135.5	168.9	-57.9	175.1	0	0	0	108.3	L773 E774 L778 M849 F892 A893	L773-I831 HydrophobicContact CB-CD1 4.11Å; L773-I831 HydrophobicContact CD1-CD1 4.21Å; E774-I831 HydrophobicContact CG-CD1 3.89Å; E774-I831 WeakPolarHBondContact OE1-CD1 3.15Å; L778-I831 HydrophobicContact CD1-CD1 3.63Å; L778-I831 HydrophobicContact CD1-CG1 3.76Å; I831-M849 HydrophobicContact CB-CB 4.01Å; I831-M849 HydrophobicContact CB-SD 4.29Å; I831-M849 HydrophobicContact CD1-SD 4.06Å; I831-M849 HydrophobicContact CG2-CB 4.25Å; I831-M849 HydrophobicContact CG2-SD 4.22Å; I831-M849 PolarHBondContact O-N 3.02Å; I831-F892 HydrophobicContact CG2-CB 4.09Å; I831-F892 HydrophobicContact CG2-CD1 4.21Å; I831-A893 WeakPolarHBondContact CA-O 3.08Å
832	V	92.3	Very high	73.7	Confident	0 Å²	0	66 Å²	66	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154.4	169.7	-59.4	0	0	0	0	110.1	P818 L821 W834 R847 K848 F892 A893	P818-V832 HydrophobicContact CB-CG2 4.18Å; P818-V832 HydrophobicContact CG-CG2 4.03Å; L821-V832 HydrophobicContact CD1-CG1 4.41Å; L821-V832 HydrophobicContact CD1-CG2 3.77Å; L821-V832 HydrophobicContact CD2-CG1 4.44Å; L821-V832 HydrophobicContact CG-CG1 4.16Å; L821-V832 HydrophobicContact CG-CG2 4.3Å; V832-W834 HydrophobicContact CG2-CZ3 4.3Å; V832-R847 CarbonylContact C-O 3.59Å; V832-R847 VanDerWaalsContact CA-O 3.29Å; V832-R847 WeakPolarHBondContact CA-O 3.21Å; V832-K848 HydrophobicContact CG1-CG 4.16Å; V832-F892 CarbonylContact O-C 3.51Å; V832-F892 WeakPolarHBondContact O-CA 3.35Å; V832-A893 HydrophobicContact CG2-CB 4.04Å; V832-A893 PolarHBondContact N-O 2.64Å; V832-A893 PolarHBondContact O-N 2.78Å
833	L	94	Very high	75.6	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	154	-174.4	68.2	112	0	0	0	113.1	L577 R847 M849 F853 F891 F892	L577-L833 HydrophobicContact CD2-CD1 3.89Å; L833-R847 PolarHBondContact N-O 3.31Å; L833-R847 PolarHBondContact O-N 3.01Å; L833-M849 HydrophobicContact CD2-CB 3.76Å; L833-M849 HydrophobicContact CD2-CG 3.98Å; L833-F853 HydrophobicContact CD1-CE1 4.07Å; L833-F853 HydrophobicContact CD2-CD1 4.04Å; L833-F853 HydrophobicContact CD2-CE1 3.92Å; L833-F891 WeakPolarHBondContact CA-O 3.28Å; L833-F891 VanDerWaalsContact CB-O 3.28Å; L833-F891 WeakPolarHBondContact CB-O 3.17Å; L833-F892 HydrophobicContact CB-CD1 3.75Å; L833-F892 HydrophobicContact CB-CE1 4.04Å; L833-F892 HydrophobicContact CB-CG 4.43Å; L833-F892 HydrophobicContact CD2-CD1 4.47Å; L833-F892 HydrophobicContact CD2-CE1 4.33Å
834	W	92.1	Very high	77.8	Confident	31 Å²	31	55.6 Å²	55.6	12%	0.117	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	160	173.9	65	95.9	0	0	0	111.1	M814 P818 V832 T844 E846 F891 A893 L898	M814-W834 HydrophobicContact CE-CH2 4.49Å; P818-W834 HydrophobicContact CG-CH2 4.3Å; P818-W834 HydrophobicContact CG-CZ3 4.21Å; V832-W834 HydrophobicContact CG2-CZ3 4.3Å; W834-T844 WeakPolarHBondContact CA-OG1 3.22Å; W834-T844 WeakPolarHBondContact CB-OG1 3.35Å; W834-E846 HydrophobicContact CE3-CG 4.19Å; W834-F891 AromaticContact CD1-CD2 3.84Å; W834-F891 HydrophobicContact CD2-CB 3.85Å; W834-F891 AromaticContact CE2-CD2 3.86Å; W834-F891 AromaticContact CE2-CG 3.85Å; W834-F891 HydrophobicContact CE3-CB 4.32Å; W834-F891 HydrophobicContact CG-CB 4.3Å; W834-F891 HydrophobicContact CH2-CB 4.26Å; W834-F891 HydrophobicContact CZ2-CB 3.76Å; W834-F891 HydrophobicContact CZ2-CD2 4.33Å; W834-F891 AromaticContact CZ2-CG 3.99Å; W834-F891 HydrophobicContact CZ2-CG 3.99Å; W834-F891 PolarHBondContact N-O 3.05Å; W834-F891 AromaticContact NE1-CD2 3.28Å; W834-F891 VanDerWaalsContact NE1-CD2 3.28Å; W834-F891 AromaticContact NE1-CG 3.77Å; W834-F891 PolarHBondContact O-N 3.34Å; W834-A893 HydrophobicContact CH2-CB 4.08Å; W834-A893 HydrophobicContact CZ3-CB 3.96Å; W834-L898 HydrophobicContact CH2-CD1 3.54Å; W834-L898 HydrophobicContact CZ2-CD1 3.81Å; W834-L898 HydrophobicContact CZ3-CD1 4.47Å
835	S	90.6	Very high	79.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	146.9	169.8	-42.6	0	0	0	0	110.7	S843 T844 V889 Q890	S835-S843 CarbonylContact O-C 3.49Å; S835-S843 VanDerWaalsContact O-CA 3.24Å; S835-S843 WeakPolarHBondContact O-CA 3.3Å; S835-T844 PolarHBondContact N-OG1 2.71Å; S835-T844 PolarHBondContact O-N 2.89Å; S835-V889 WeakPolarHBondContact CA-O 3.31Å; S835-Q890 VanDerWaalsContact OG-CD 3.28Å; S835-Q890 PolarHBondContact OG-NE2 3.05Å; S835-Q890 PolarHBondContact OG-OE1 3.15Å
836	W	91.1	Very high	82.2	Confident	52 Å²	52	48 Å²	48	20%	0.197	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	124.3	172.1	175	73.2	0	0	0	111.5	R838 K841 H888 V889 F891	W836-R838 HydrophobicContact CE3-CG 4.15Å; W836-R838 HydrophobicContact CZ3-CB 4.41Å; W836-R838 HydrophobicContact CZ3-CG 3.75Å; W836-K841 HydrophobicContact CH2-CD 4.45Å; W836-K841 HydrophobicContact CZ2-CD 3.95Å; W836-K841 PolarHBondContact NE1-O 3.47Å; W836-H888 CarbonylContact O-C 3.58Å; W836-H888 WeakPolarHBondContact O-CA 3.5Å; W836-H888 WeakPolarHBondContact O-CB 3.5Å; W836-V889 HydrophobicContact CE3-CB 4.31Å; W836-V889 HydrophobicContact CE3-CG2 4.08Å; W836-V889 HydrophobicContact CZ3-CG2 4.41Å; W836-V889 PolarHBondContact N-O 3.08Å; W836-V889 PolarHBondContact O-N 3.34Å; W836-F891 HydrophobicContact CB-CD2 4.22Å; W836-F891 HydrophobicContact CB-CE2 3.77Å
837	C	88.6	Confident	84.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.9	-178.3	-174.5	0	0	0	0	111.9	H839 C840 K841 A842 L875	C837-H839 PolarHBondContact O-N 3.19Å; C837-C840 HydrophobicContact CB-CB 3.98Å; C837-C840 PolarHBondContact SG-N 3.14Å; C837-C840 VanDerWaalsContact SG-N 3.39Å; C837-K841 VanDerWaalsContact O-CA 3.3Å; C837-K841 WeakPolarHBondContact O-CA 3.31Å; C837-K841 PolarHBondContact O-N 3.29Å; C837-A842 PolarHBondContact N-O 2.98Å; C837-L875 HydrophobicContact CB-CD1 4.12Å
838	R	88.1	Confident	86.2	Confident	47 Å²	47	49.7 Å²	49.7	18%	0.177	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24	178.7	-68	-173.1	-67.3	-176.8	-4.1	113.9	W836 K841 H886 D887 V889 C903	W836-R838 HydrophobicContact CE3-CG 4.15Å; W836-R838 HydrophobicContact CZ3-CB 4.41Å; W836-R838 HydrophobicContact CZ3-CG 3.75Å; R838-K841 WeakPolarHBondContact O-CD 3.38Å; R838-K841 VanDerWaalsContact O-CE 3.32Å; R838-K841 WeakPolarHBondContact O-CE 3.44Å; R838-K841 PolarHBondContact O-NZ 2.77Å; R838-H886 PolarHBondContact NH2-O 3.5Å; R838-D887 VanDerWaalsContact CB-O 3.25Å; R838-D887 WeakPolarHBondContact CB-O 3.36Å; R838-D887 WeakPolarHBondContact CG-O 3.42Å; R838-D887 PolarHBondContact N-O 2.91Å; R838-D887 VanDerWaalsContact N-O 3.09Å; R838-D887 PolarHBondContact NE-O 3.37Å; R838-V889 HydrophobicContact CG-CG2 3.99Å; R838-C903 VanDerWaalsContact CZ-O 3.24Å; R838-C903 PolarHBondContact NH1-O 3.03Å; R838-C903 PolarHBondContact NH2-O 2.85Å
839	H	87.7	Confident	88.1	Confident	96 Å²	96	48.8 Å²	48.8	44%	0.444	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-57.1	-179.6	-54.6	-58.1	0	0	0	111.4	C837 K841 H882 D887	C837-H839 PolarHBondContact O-N 3.19Å; H839-K841 PolarHBondContact O-N 2.85Å; H839-H882 AromaticContact CD2-CD2 3.27Å; H839-H882 PolarHBondContact CD2-CD2 3.14Å; H839-H882 AromaticContact CD2-CG 3.66Å; H839-H882 AromaticContact CD2-NE2 3.81Å; H839-H882 AromaticContact CG-CD2 3.8Å; H839-H882 AromaticContact CG-NE2 3.85Å; H839-D887 IonicContact CD2-OD1 2.83Å; H839-D887 IonicContact CE1-OD1 3.17Å; H839-D887 VanDerWaalsContact NE2-CG 3.35Å; H839-D887 IonicContact NE2-OD1 3.59Å; H839-D887 PolarHBondContact NE2-OD1 3.48Å
840	C	85.9	Confident	89.1	Confident	60 Å²	60	45.9 Å²	45.9	41%	0.405	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-12.7	179.1	-60.6	0	0	0	0	114.4	C837 A842 L875 C880 H882	C837-C840 HydrophobicContact CB-CB 3.98Å; C837-C840 PolarHBondContact SG-N 3.14Å; C837-C840 VanDerWaalsContact SG-N 3.39Å; C840-A842 PolarHBondContact O-N 2.75Å; C840-L875 HydrophobicContact CB-CD1 4Å; C840-C880 PolarHBondContact SG-SG 2.86Å; C840-H882 PolarHBondContact SG-ND1 3.5Å
841	K	85.6	Confident	89.4	Confident	135 Å²	135	47.1 Å²	47.1	59%	0.587	24%	0.235	S	C	*	.			trans	60	4.5	-177.7	-48.7	-57.6	-178.6	-172.5	0	116.4	W836 C837 R838 H839	W836-K841 HydrophobicContact CH2-CD 4.45Å; W836-K841 HydrophobicContact CZ2-CD 3.95Å; W836-K841 PolarHBondContact NE1-O 3.47Å; C837-K841 VanDerWaalsContact O-CA 3.3Å; C837-K841 WeakPolarHBondContact O-CA 3.31Å; C837-K841 PolarHBondContact O-N 3.29Å; R838-K841 WeakPolarHBondContact O-CD 3.38Å; R838-K841 VanDerWaalsContact O-CE 3.32Å; R838-K841 WeakPolarHBondContact O-CE 3.44Å; R838-K841 PolarHBondContact O-NZ 2.77Å; H839-K841 PolarHBondContact O-N 2.85Å
842	A	82.2	Confident	89.4	Confident	42 Å²	42	50.4 Å²	50.4	35%	0.347	25%	0.25	S	S	.	.			trans	-104.2	162.4	178.4	0	0	0	0	0	113.1	C837 C840 L875	C837-A842 PolarHBondContact N-O 2.98Å; C840-A842 PolarHBondContact O-N 2.75Å; A842-L875 HydrophobicContact CB-CB 4.45Å; A842-L875 HydrophobicContact CB-CD1 4.05Å
843	S	87.3	Confident	89.5	Confident	37 Å²	37	50.4 Å²	50.4	26%	0.259	25%	0.25	S	S	.	.	B	Isolated β-bridge	trans	-111.5	160.8	-177.8	-58.6	0	0	0	0	112.9	S835 L875 A876	S835-S843 CarbonylContact O-C 3.49Å; S835-S843 VanDerWaalsContact O-CA 3.24Å; S835-S843 WeakPolarHBondContact O-CA 3.3Å; S843-L875 WeakPolarHBondContact O-CA 3.44Å; S843-A876 PolarHBondContact O-N 2.97Å
844	T	87.7	Confident	89.6	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.055	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-71	170.6	161.5	67.4	0	0	0	0	110.8	W834 S835 S873 L875	W834-T844 WeakPolarHBondContact CA-OG1 3.22Å; W834-T844 WeakPolarHBondContact CB-OG1 3.35Å; S835-T844 PolarHBondContact N-OG1 2.71Å; S835-T844 PolarHBondContact O-N 2.89Å; T844-S873 WeakPolarHBondContact CG2-OG 3.48Å; T844-L875 HydrophobicContact CG2-CD2 4.09Å
845	S	86.4	Confident	89.7	Confident	60 Å²	60	49.8 Å²	49.8	42%	0.42	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-64	148.5	164.9	72.2	0	0	0	0	111.5	Q578	Q578-S845 PolarHBondContact NE2-O 3.45Å; Q578-S845 PolarHBondContact NE2-OG 2.91Å; Q578-S845 PolarHBondContact OE1-OG 3.43Å
846	E	88	Confident	89.9	Confident	74 Å²	74	49.8 Å²	49.8	35%	0.346	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-68.1	129.7	171	-68.3	179.1	-166.2	0	0	110.1	S820 W834	S820-E846 WeakPolarHBondContact CB-OE2 3.46Å; S820-E846 PolarHBondContact N-OE2 3.22Å; S820-E846 PolarHBondContact OG-OE2 2.88Å; W834-E846 HydrophobicContact CE3-CG 4.19Å
847	R	89.8	Confident	90.1	Very high	85 Å²	85	47.3 Å²	47.3	32%	0.321	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	148.8	174.7	-73.4	-172.7	170.4	-150.5	6.4	111.8	D575 S576 V832 L833	D575-R847 PolarHBondContact O-NH1 3.19Å; D575-R847 IonicContact OD1-NH1 3.96Å; D575-R847 IonicContact OD2-CZ 3.74Å; D575-R847 IonicContact OD2-NH1 2.79Å; D575-R847 PolarHBondContact OD2-NH1 2.88Å; S576-R847 WeakPolarHBondContact O-CD 3.19Å; V832-R847 CarbonylContact C-O 3.59Å; V832-R847 VanDerWaalsContact CA-O 3.29Å; V832-R847 WeakPolarHBondContact CA-O 3.21Å; L833-R847 PolarHBondContact N-O 3.31Å; L833-R847 PolarHBondContact O-N 3.01Å
848	K	92	Very high	90.4	Very high	90 Å²	90	47.3 Å²	47.3	39%	0.391	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135	172.4	-68.1	-174.1	165.7	-157.8	0	109.9	V832 T850	V832-K848 HydrophobicContact CG1-CG 4.16Å; K848-T850 PolarHBondContact O-N 2.8Å
849	M	93	Very high	90.6	Very high	19 Å²	19	45.1 Å²	45.1	9%	0.094	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-67	123.8	178	-163.1	-175.2	-158.1	0	0	110.2	L769 L773 I831 L833 F853 W854 F892	L769-M849 HydrophobicContact CD2-CE 3.77Å; L769-M849 HydrophobicContact CG-CE 3.97Å; L773-M849 HydrophobicContact CD1-CE 3.95Å; L773-M849 HydrophobicContact CD1-SD 4.13Å; I831-M849 HydrophobicContact CB-CB 4.01Å; I831-M849 HydrophobicContact CB-SD 4.29Å; I831-M849 HydrophobicContact CD1-SD 4.06Å; I831-M849 HydrophobicContact CG2-CB 4.25Å; I831-M849 HydrophobicContact CG2-SD 4.22Å; I831-M849 PolarHBondContact O-N 3.02Å; L833-M849 HydrophobicContact CD2-CB 3.76Å; L833-M849 HydrophobicContact CD2-CG 3.98Å; M849-F853 HydrophobicContact CE-CD1 4.14Å; M849-F853 HydrophobicContact CE-CD2 4.32Å; M849-F853 HydrophobicContact CE-CE1 4.39Å; M849-F853 HydrophobicContact CE-CG 4.09Å; M849-F853 HydrophobicContact CG-CB 4.47Å; M849-F853 HydrophobicContact CG-CD1 4.09Å; M849-F853 HydrophobicContact CG-CG 4.47Å; M849-W854 HydrophobicContact CE-CB 4.48Å; M849-W854 HydrophobicContact SD-CB 4.17Å; M849-W854 HydrophobicContact SD-CG 4.5Å; M849-F892 HydrophobicContact CE-CE1 4.07Å
850	T	93	Very high	90.9	Very high	44 Å²	44	40.5 Å²	40.5	27%	0.27	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-79.9	160.5	179	71.7	0	0	0	0	111.4	E572 K848 Q852 F853 W854	E572-T850 WeakPolarHBondContact CG-OG1 3.33Å; E572-T850 WeakPolarHBondContact OE1-CB 3.42Å; E572-T850 VanDerWaalsContact OE1-CG2 3.26Å; E572-T850 WeakPolarHBondContact OE1-CG2 3.32Å; E572-T850 PolarHBondContact OE1-OG1 3.37Å; K848-T850 PolarHBondContact O-N 2.8Å; T850-Q852 VanDerWaalsContact C-N 3.25Å; T850-Q852 PolarHBondContact O-N 3.3Å; T850-F853 PolarHBondContact O-N 3.35Å; T850-F853 PolarHBondContact OG1-N 3.35Å; T850-W854 WeakPolarHBondContact O-CB 3.11Å; T850-W854 PolarHBondContact O-N 2.54Å
851	Q	90.7	Very high	91.3	Very high	101 Å²	101	37.7 Å²	37.7	47%	0.472	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-35	179.5	179.4	175	-24.8	0	0	111.7	W854 Q855	Q851-W854 PolarHBondContact O-N 2.65Å; Q851-Q855 WeakPolarHBondContact O-CB 3.4Å; Q851-Q855 WeakPolarHBondContact O-CG 3.24Å; Q851-Q855 PolarHBondContact O-N 2.85Å
852	Q	92.3	Very high	91.7	Very high	74 Å²	74	31.3 Å²	31.3	35%	0.346	16%	0.162	S	C	.	.	H	α-helix	trans	-66.1	-47.3	176.9	-62.9	91.6	-77.8	0	0	111.4	L569 E572 T850 W854 Q855 L856	L569-Q852 HydrophobicContact CD2-CB 3.8Å; L569-Q852 HydrophobicContact CD2-CG 4.34Å; E572-Q852 HydrophobicContact CB-CB 4.13Å; E572-Q852 HydrophobicContact CG-CB 3.67Å; E572-Q852 PolarHBondContact OE1-NE2 2.76Å; E572-Q852 PolarHBondContact OE2-NE2 2.68Å; T850-Q852 VanDerWaalsContact C-N 3.25Å; T850-Q852 PolarHBondContact O-N 3.3Å; Q852-W854 VanDerWaalsContact C-N 3.33Å; Q852-W854 PolarHBondContact O-N 3.31Å; Q852-Q855 PolarHBondContact O-N 2.91Å; Q852-Q855 VanDerWaalsContact O-N 3.11Å; Q852-L856 PolarHBondContact O-N 3.43Å
853	F	94.5	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.7	-34.8	176.3	-174.1	-159.5	0	0	0	111.8	E572 M573 L769 L833 M849 T850 Q855 L856 F861 F892	E572-F853 HydrophobicContact CG-CB 4.3Å; M573-F853 HydrophobicContact CB-CD2 3.74Å; M573-F853 HydrophobicContact CB-CE2 3.73Å; M573-F853 HydrophobicContact CB-CG 4.4Å; M573-F853 HydrophobicContact CB-CZ 4.36Å; M573-F853 HydrophobicContact CG-CD2 4.09Å; M573-F853 HydrophobicContact CG-CE2 3.52Å; M573-F853 HydrophobicContact CG-CZ 3.87Å; M573-F853 HydrophobicContact SD-CE2 4.28Å; L769-F853 HydrophobicContact CD2-CD2 4.08Å; L769-F853 HydrophobicContact CD2-CE2 3.42Å; L769-F853 VanDerWaalsContact CD2-CE2 3.42Å; L769-F853 HydrophobicContact CD2-CZ 3.86Å; L833-F853 HydrophobicContact CD1-CE1 4.07Å; L833-F853 HydrophobicContact CD2-CD1 4.04Å; L833-F853 HydrophobicContact CD2-CE1 3.92Å; M849-F853 HydrophobicContact CE-CD1 4.14Å; M849-F853 HydrophobicContact CE-CD2 4.32Å; M849-F853 HydrophobicContact CE-CE1 4.39Å; M849-F853 HydrophobicContact CE-CG 4.09Å; M849-F853 HydrophobicContact CG-CB 4.47Å; M849-F853 HydrophobicContact CG-CD1 4.09Å; M849-F853 HydrophobicContact CG-CG 4.47Å; T850-F853 PolarHBondContact O-N 3.35Å; T850-F853 PolarHBondContact OG1-N 3.35Å; F853-Q855 PolarHBondContact O-N 2.92Å; F853-L856 HydrophobicContact CD2-CB 4.2Å; F853-L856 HydrophobicContact CD2-CD2 3.95Å; F853-L856 HydrophobicContact CE2-CD2 3.84Å; F853-L856 VanDerWaalsContact O-CB 3.28Å; F853-L856 WeakPolarHBondContact O-CB 3.25Å; F853-L856 PolarHBondContact O-N 2.8Å; F853-F861 HydrophobicContact CE2-CD2 4.15Å; F853-F861 HydrophobicContact CE2-CE2 4.31Å; F853-F861 HydrophobicContact CZ-CD2 4.37Å; F853-F861 HydrophobicContact CZ-CE2 4.07Å; F853-F892 AromaticContact CE1-CE1 3.97Å; F853-F892 HydrophobicContact CE1-CE1 3.97Å; F853-F892 HydrophobicContact CE1-CZ 4.36Å; F853-F892 HydrophobicContact CZ-CE1 4.03Å; F853-F892 HydrophobicContact CZ-CZ 4Å
854	W	94.6	Very high	92.1	Very high	12 Å²	12	28.2 Å²	28.2	5%	0.045	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-35	170.9	-171.2	101.9	0	0	0	112.2	T357 K358 P768 G770 V771 E774 M849 T850 Q851 Q852	T357-W854 HydrophobicContact CG2-CZ3 4.39Å; K358-W854 HydrophobicContact CB-CE3 4.09Å; K358-W854 HydrophobicContact CB-CH2 3.59Å; K358-W854 HydrophobicContact CB-CZ2 4.07Å; K358-W854 HydrophobicContact CB-CZ3 3.62Å; K358-W854 HydrophobicContact CD-CD2 3.9Å; K358-W854 HydrophobicContact CD-CE3 4.32Å; K358-W854 HydrophobicContact CD-CG 4.48Å; K358-W854 HydrophobicContact CD-CH2 4.06Å; K358-W854 HydrophobicContact CD-CZ2 3.61Å; K358-W854 HydrophobicContact CD-CZ3 4.4Å; K358-W854 HydrophobicContact CG-CD2 4.5Å; K358-W854 HydrophobicContact CG-CH2 3.64Å; K358-W854 HydrophobicContact CG-CZ2 3.62Å; K358-W854 HydrophobicContact CG-CZ3 4.13Å; P768-W854 HydrophobicContact CB-CE3 4.23Å; P768-W854 HydrophobicContact CB-CZ3 4.02Å; P768-W854 VanDerWaalsContact CB-O 3.28Å; P768-W854 WeakPolarHBondContact CB-O 3.29Å; P768-W854 HydrophobicContact CG-CZ3 4.23Å; G770-W854 VanDerWaalsContact CA-CD1 3.41Å; G770-W854 VanDerWaalsContact CA-NE1 3.31Å; G770-W854 PolarHBondContact N-O 3.48Å; V771-W854 HydrophobicContact CG2-CH2 3.32Å; V771-W854 HydrophobicContact CG2-CZ2 3.74Å; V771-W854 HydrophobicContact CG2-CZ3 4.06Å; E774-W854 PolarHBondContact OE1-NE1 2.77Å; E774-W854 PolarHBondContact OE2-NE1 3.27Å; M849-W854 HydrophobicContact CE-CB 4.48Å; M849-W854 HydrophobicContact SD-CB 4.17Å; M849-W854 HydrophobicContact SD-CG 4.5Å; T850-W854 WeakPolarHBondContact O-CB 3.11Å; T850-W854 PolarHBondContact O-N 2.54Å; Q851-W854 PolarHBondContact O-N 2.65Å; Q852-W854 VanDerWaalsContact C-N 3.33Å; Q852-W854 PolarHBondContact O-N 3.31Å
855	Q	94	Very high	92.3	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.037	14%	0.135	C	C	.	.	H	α-helix	trans	-81	-10.9	177.8	-76	-176.6	5.1	0	0	115.2	P355 Y565 L569 Q851 Q852 F853	P355-Q855 PolarHBondContact O-NE2 3.22Å; Y565-Q855 PolarHBondContact OH-OE1 3.03Å; Y565-Q855 VanDerWaalsContact OH-OE1 3.14Å; L569-Q855 HydrophobicContact CD1-CB 4.07Å; Q851-Q855 WeakPolarHBondContact O-CB 3.4Å; Q851-Q855 WeakPolarHBondContact O-CG 3.24Å; Q851-Q855 PolarHBondContact O-N 2.85Å; Q852-Q855 PolarHBondContact O-N 2.91Å; Q852-Q855 VanDerWaalsContact O-N 3.11Å; F853-Q855 PolarHBondContact O-N 2.92Å
856	L	95.4	Very high	92.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	-56.8	139.8	177.8	-175.8	73.8	0	0	0	110.2	L569 E570 M573 P768 L769 Q852 F853 F858 T860 F861	L569-L856 HydrophobicContact CB-CB 4.4Å; L569-L856 HydrophobicContact CB-CD1 3.67Å; E570-L856 HydrophobicContact CG-CD1 4.02Å; M573-L856 HydrophobicContact CB-CD2 4.09Å; M573-L856 HydrophobicContact CG-CD2 4.22Å; M573-L856 HydrophobicContact SD-CD2 3.58Å; M573-L856 VanDerWaalsContact SD-CD2 3.58Å; P768-L856 CarbonylContact C-O 3.54Å; P768-L856 WeakPolarHBondContact CA-O 3.34Å; L769-L856 PolarHBondContact N-O 3.25Å; Q852-L856 PolarHBondContact O-N 3.43Å; F853-L856 HydrophobicContact CD2-CB 4.2Å; F853-L856 HydrophobicContact CD2-CD2 3.95Å; F853-L856 HydrophobicContact CE2-CD2 3.84Å; F853-L856 VanDerWaalsContact O-CB 3.28Å; F853-L856 WeakPolarHBondContact O-CB 3.25Å; F853-L856 PolarHBondContact O-N 2.8Å; L856-F858 PolarHBondContact O-N 3.32Å; L856-T860 HydrophobicContact CD1-CG2 4.04Å; L856-F861 HydrophobicContact CD2-CB 4.06Å; L856-F861 HydrophobicContact CD2-CD2 4.41Å
857	S	94.8	Very high	92.1	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-54.5	127.8	170.7	166	0	0	0	0	111	Y762 D766 A859 T860 F861	Y762-S857 PolarHBondContact OH-N 2.9Å; D766-S857 VanDerWaalsContact CG-OG 3.29Å; D766-S857 PolarHBondContact OD1-OG 2.99Å; D766-S857 WeakPolarHBondContact OD2-CB 3.33Å; D766-S857 PolarHBondContact OD2-OG 3.05Å; S857-A859 PolarHBondContact O-N 2.88Å; S857-A859 PolarHBondContact OG-N 3.49Å; S857-T860 WeakPolarHBondContact CB-OG1 3.31Å; S857-T860 PolarHBondContact O-N 3.04Å; S857-T860 VanDerWaalsContact O-N 3.11Å; S857-T860 PolarHBondContact OG-N 3.16Å; S857-F861 PolarHBondContact O-N 3.32Å
858	F	95.7	Very high	91.4	Very high	1 Å²	1	18 Å²	18	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-57.9	-39.1	172.6	172.9	-111.9	0	0	0	111	F154 F757 L767 L769 Y772 F800 L856 F861 L862 F901	F154-F858 HydrophobicContact CZ-CD1 4.43Å; F154-F858 HydrophobicContact CZ-CE1 4.08Å; F757-F858 HydrophobicContact CZ-CD1 4.15Å; F757-F858 AromaticContact CZ-CE1 3.97Å; F757-F858 HydrophobicContact CZ-CE1 3.97Å; L767-F858 WeakPolarHBondContact O-CB 3.47Å; L767-F858 PolarHBondContact O-N 2.94Å; L769-F858 HydrophobicContact CD1-CD2 3.86Å; L769-F858 HydrophobicContact CD1-CE2 4.47Å; Y772-F858 AromaticContact CD1-CD2 3.57Å; Y772-F858 HydrophobicContact CD1-CD2 3.57Å; Y772-F858 AromaticContact CD1-CE2 3.21Å; Y772-F858 HydrophobicContact CD1-CE2 3.21Å; Y772-F858 HydrophobicContact CD1-CG 4.44Å; Y772-F858 AromaticContact CD1-CZ 3.85Å; Y772-F858 HydrophobicContact CD1-CZ 3.85Å; Y772-F858 HydrophobicContact CD2-CD2 4.41Å; Y772-F858 HydrophobicContact CD2-CE1 4.23Å; Y772-F858 HydrophobicContact CD2-CE2 4.14Å; Y772-F858 HydrophobicContact CD2-CZ 4.03Å; Y772-F858 HydrophobicContact CE1-CD2 4.23Å; Y772-F858 AromaticContact CE1-CE2 3.4Å; Y772-F858 HydrophobicContact CE1-CE2 3.4Å; Y772-F858 VanDerWaalsContact CE1-CE2 3.4Å; Y772-F858 AromaticContact CE1-CZ 3.74Å; Y772-F858 HydrophobicContact CE1-CZ 3.74Å; Y772-F858 HydrophobicContact CE2-CE1 4.34Å; Y772-F858 HydrophobicContact CE2-CE2 4.3Å; Y772-F858 AromaticContact CE2-CZ 3.93Å; Y772-F858 HydrophobicContact CE2-CZ 3.93Å; Y772-F858 HydrophobicContact CG-CD1 4.45Å; Y772-F858 AromaticContact CG-CD2 3.67Å; Y772-F858 HydrophobicContact CG-CD2 3.67Å; Y772-F858 HydrophobicContact CG-CE1 4.4Å; Y772-F858 AromaticContact CG-CE2 3.61Å; Y772-F858 HydrophobicContact CG-CE2 3.61Å; Y772-F858 HydrophobicContact CG-CG 4.11Å; Y772-F858 AromaticContact CG-CZ 3.99Å; Y772-F858 HydrophobicContact CG-CZ 3.99Å; Y772-F858 AromaticContact CZ-CE2 3.96Å; Y772-F858 AromaticContact CZ-CZ 3.78Å; F800-F858 HydrophobicContact CE1-CE1 4.02Å; F800-F858 HydrophobicContact CE1-CZ 4.25Å; F800-F858 HydrophobicContact CE2-CE1 4.49Å; F800-F858 AromaticContact CE2-CZ 3.92Å; F800-F858 HydrophobicContact CE2-CZ 3.92Å; F800-F858 AromaticContact CZ-CE1 3.68Å; F800-F858 HydrophobicContact CZ-CE1 3.68Å; F800-F858 AromaticContact CZ-CZ 3.54Å; F800-F858 HydrophobicContact CZ-CZ 3.54Å; L856-F858 PolarHBondContact O-N 3.32Å; F858-F861 PolarHBondContact O-N 3.12Å; F858-L862 HydrophobicContact CD1-CD1 4.23Å; F858-L862 HydrophobicContact CE1-CD1 3.59Å; F858-L862 HydrophobicContact CE1-CG 4.24Å; F858-L862 HydrophobicContact CE2-CD1 4.44Å; F858-L862 HydrophobicContact CE2-CD2 4.45Å; F858-L862 HydrophobicContact CE2-CG 4.26Å; F858-L862 HydrophobicContact CZ-CD1 3.71Å; F858-L862 HydrophobicContact CZ-CD2 4.23Å; F858-L862 HydrophobicContact CZ-CG 3.99Å; F858-L862 PolarHBondContact O-N 2.7Å; F858-F901 AromaticContact CE2-CE1 3.94Å; F858-F901 HydrophobicContact CE2-CE1 3.94Å; F858-F901 HydrophobicContact CE2-CZ 4.14Å
859	A	93.1	Very high	90.5	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-67	-37.1	174.5	0	0	0	0	0	113	F733 V759 L761 S857 L862 D863	F733-A859 HydrophobicContact CB-CB 3.83Å; F733-A859 HydrophobicContact CD1-CB 3.98Å; F733-A859 HydrophobicContact CG-CB 4.03Å; V759-A859 HydrophobicContact CB-CB 4.16Å; V759-A859 HydrophobicContact CG1-CB 3.84Å; L761-A859 HydrophobicContact CD2-CB 3.55Å; S857-A859 PolarHBondContact O-N 2.88Å; S857-A859 PolarHBondContact OG-N 3.49Å; A859-L862 PolarHBondContact O-N 3.14Å; A859-D863 WeakPolarHBondContact O-CB 3.31Å; A859-D863 PolarHBondContact O-N 3.01Å
860	T	92.1	Very high	89.4	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.4	-39	170.5	-63.8	0	0	0	0	111.9	E570 P621 L856 S857 D863 Y864	E570-T860 HydrophobicContact CG-CG2 3.74Å; P621-T860 HydrophobicContact CG-CG2 4.21Å; L856-T860 HydrophobicContact CD1-CG2 4.04Å; S857-T860 WeakPolarHBondContact CB-OG1 3.31Å; S857-T860 PolarHBondContact O-N 3.04Å; S857-T860 VanDerWaalsContact O-N 3.11Å; S857-T860 PolarHBondContact OG-N 3.16Å; T860-D863 PolarHBondContact O-N 2.82Å; T860-Y864 HydrophobicContact CG2-CD2 4.13Å; T860-Y864 HydrophobicContact CG2-CE2 4.2Å; T860-Y864 PolarHBondContact O-N 2.8Å; T860-Y864 VanDerWaalsContact O-N 3.07Å
861	F	95.3	Very high	88.8	Confident	1 Å²	1	13.6 Å²	13.6	0%	0.004	6%	0.062	C	C	.	.	H	α-helix	trans	-63	-42.9	175.5	-176.6	-115.2	0	0	0	112	M573 L769 F853 L856 S857 F858 Y864 L865 F892 F901	M573-F861 HydrophobicContact SD-CD2 3.8Å; M573-F861 HydrophobicContact SD-CE2 4.36Å; L769-F861 HydrophobicContact CD1-CB 4.43Å; L769-F861 HydrophobicContact CD1-CD1 3.61Å; L769-F861 HydrophobicContact CD1-CE1 4.11Å; L769-F861 HydrophobicContact CD1-CG 4.13Å; L769-F861 HydrophobicContact CD2-CB 4.18Å; L769-F861 HydrophobicContact CD2-CD1 3.96Å; L769-F861 HydrophobicContact CD2-CD2 3.99Å; L769-F861 HydrophobicContact CD2-CE1 4.33Å; L769-F861 HydrophobicContact CD2-CE2 4.37Å; L769-F861 HydrophobicContact CD2-CG 3.77Å; L769-F861 HydrophobicContact CG-CD1 4.44Å; F853-F861 HydrophobicContact CE2-CD2 4.15Å; F853-F861 HydrophobicContact CE2-CE2 4.31Å; F853-F861 HydrophobicContact CZ-CD2 4.37Å; F853-F861 HydrophobicContact CZ-CE2 4.07Å; L856-F861 HydrophobicContact CD2-CB 4.06Å; L856-F861 HydrophobicContact CD2-CD2 4.41Å; S857-F861 PolarHBondContact O-N 3.32Å; F858-F861 PolarHBondContact O-N 3.12Å; F861-Y864 PolarHBondContact O-N 2.85Å; F861-L865 HydrophobicContact CD1-CD1 4.02Å; F861-L865 HydrophobicContact CE1-CD1 3.65Å; F861-L865 HydrophobicContact CE1-CG 4.44Å; F861-L865 HydrophobicContact CZ-CD1 4.02Å; F861-L865 HydrophobicContact CZ-CG 4.42Å; F861-L865 WeakPolarHBondContact O-CG 3.34Å; F861-L865 PolarHBondContact O-N 2.71Å; F861-L865 VanDerWaalsContact O-N 3.09Å; F861-F892 AromaticContact CE1-CE2 4Å; F861-F892 HydrophobicContact CE1-CE2 4Å; F861-F892 HydrophobicContact CE1-CZ 4.15Å; F861-F892 HydrophobicContact CE2-CZ 4.29Å; F861-F892 AromaticContact CZ-CE2 3.78Å; F861-F892 HydrophobicContact CZ-CE2 3.78Å; F861-F892 AromaticContact CZ-CZ 3.7Å; F861-F892 HydrophobicContact CZ-CZ 3.7Å; F861-F901 HydrophobicContact CD1-CD1 4.39Å; F861-F901 HydrophobicContact CD1-CE1 4.08Å; F861-F901 HydrophobicContact CD1-CZ 4.36Å; F861-F901 AromaticContact CE1-CD1 3.79Å; F861-F901 HydrophobicContact CE1-CD1 3.79Å; F861-F901 HydrophobicContact CE1-CD2 4.13Å; F861-F901 AromaticContact CE1-CE1 3.79Å; F861-F901 HydrophobicContact CE1-CE1 3.79Å; F861-F901 HydrophobicContact CE1-CE2 4.14Å; F861-F901 AromaticContact CE1-CG 3.97Å; F861-F901 HydrophobicContact CE1-CG 3.97Å; F861-F901 AromaticContact CE1-CZ 3.97Å; F861-F901 HydrophobicContact CE1-CZ 3.97Å
862	L	93.5	Very high	88.3	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-61.4	-43.1	171.2	-71.2	178.9	0	0	0	111.9	F733 F757 F800 V807 F858 A859 Y864 L865 F866 F901	F733-L862 HydrophobicContact CE1-CB 4.1Å; F733-L862 HydrophobicContact CE1-CD1 3.91Å; F733-L862 HydrophobicContact CE2-CB 4.24Å; F733-L862 HydrophobicContact CZ-CB 3.7Å; F733-L862 HydrophobicContact CZ-CD1 4.24Å; F757-L862 HydrophobicContact CE1-CD1 4.13Å; F800-L862 HydrophobicContact CD1-CD1 3.62Å; F800-L862 HydrophobicContact CD2-CD1 4.34Å; F800-L862 HydrophobicContact CD2-CD2 4.13Å; F800-L862 HydrophobicContact CE1-CD1 3.7Å; F800-L862 HydrophobicContact CE2-CD1 4.43Å; F800-L862 HydrophobicContact CE2-CD2 4.49Å; F800-L862 HydrophobicContact CG-CD1 3.96Å; F800-L862 HydrophobicContact CG-CD2 4.26Å; F800-L862 HydrophobicContact CZ-CD1 4.12Å; V807-L862 HydrophobicContact CB-CD2 4.45Å; V807-L862 HydrophobicContact CG1-CD2 3.99Å; F858-L862 HydrophobicContact CD1-CD1 4.23Å; F858-L862 HydrophobicContact CE1-CD1 3.59Å; F858-L862 HydrophobicContact CE1-CG 4.24Å; F858-L862 HydrophobicContact CE2-CD1 4.44Å; F858-L862 HydrophobicContact CE2-CD2 4.45Å; F858-L862 HydrophobicContact CE2-CG 4.26Å; F858-L862 HydrophobicContact CZ-CD1 3.71Å; F858-L862 HydrophobicContact CZ-CD2 4.23Å; F858-L862 HydrophobicContact CZ-CG 3.99Å; F858-L862 PolarHBondContact O-N 2.7Å; A859-L862 PolarHBondContact O-N 3.14Å; L862-Y864 VanDerWaalsContact C-N 3.27Å; L862-Y864 PolarHBondContact O-N 2.91Å; L862-L865 WeakPolarHBondContact O-CA 3.29Å; L862-L865 PolarHBondContact O-N 2.54Å; L862-F866 HydrophobicContact CB-CD2 4.38Å; L862-F866 HydrophobicContact CB-CE2 4.28Å; L862-F866 WeakPolarHBondContact O-CD2 3.4Å; L862-F866 PolarHBondContact O-N 3.45Å; L862-F901 HydrophobicContact CD2-CE1 4.48Å
863	D	88.7	Confident	87.6	Confident	14 Å²	14	5.3 Å²	5.3	8%	0.075	2%	0.023	C	C	.	.	H	α-helix	trans	-60.4	-36.3	-179.9	-159.2	44.2	0	0	0	112.3	F733 A859 T860 H867	F733-D863 HydrophobicContact CD2-CB 3.9Å; F733-D863 HydrophobicContact CE2-CB 4.02Å; A859-D863 WeakPolarHBondContact O-CB 3.31Å; A859-D863 PolarHBondContact O-N 3.01Å; T860-D863 PolarHBondContact O-N 2.82Å; D863-H867 WeakPolarHBondContact O-CB 3.38Å; D863-H867 PolarHBondContact O-N 2.96Å; D863-H867 PolarHBondContact O-ND1 3.18Å; D863-H867 IonicContact OD1-CE1 3.12Å; D863-H867 PolarHBondContact OD1-CE1 3.05Å; D863-H867 IonicContact OD1-CG 3.88Å; D863-H867 IonicContact OD1-ND1 2.66Å; D863-H867 PolarHBondContact OD1-ND1 2.89Å
864	Y	89.3	Confident	86.8	Confident	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-70.1	-36.6	170.1	-90.6	-95.2	0	0	0	113.5	E570 M573 L574 C619 T860 F861 L862 F866 G868 F885	E570-Y864 HydrophobicContact CB-CE2 4.36Å; E570-Y864 HydrophobicContact CG-CE2 3.9Å; E570-Y864 WeakPolarHBondContact OE2-CE2 3.14Å; E570-Y864 PolarHBondContact OE2-OH 2.81Å; M573-Y864 HydrophobicContact CE-CD1 3.67Å; M573-Y864 HydrophobicContact CE-CD2 3.81Å; M573-Y864 HydrophobicContact CE-CE1 3.89Å; M573-Y864 HydrophobicContact CE-CE2 4.02Å; M573-Y864 HydrophobicContact CE-CG 3.61Å; L574-Y864 HydrophobicContact CD2-CE1 4.49Å; C619-Y864 HydrophobicContact CB-CD1 4.33Å; C619-Y864 HydrophobicContact CB-CE1 4.04Å; T860-Y864 HydrophobicContact CG2-CD2 4.13Å; T860-Y864 HydrophobicContact CG2-CE2 4.2Å; T860-Y864 PolarHBondContact O-N 2.8Å; T860-Y864 VanDerWaalsContact O-N 3.07Å; F861-Y864 PolarHBondContact O-N 2.85Å; L862-Y864 VanDerWaalsContact C-N 3.27Å; L862-Y864 PolarHBondContact O-N 2.91Å; Y864-F866 VanDerWaalsContact C-N 3.33Å; Y864-F866 PolarHBondContact O-N 2.87Å; Y864-G868 VanDerWaalsContact O-CA 3.24Å; Y864-G868 WeakPolarHBondContact O-CA 3.48Å; Y864-G868 PolarHBondContact O-N 2.76Å; Y864-F885 HydrophobicContact CD1-CE1 4.03Å; Y864-F885 HydrophobicContact CD1-CE2 4.26Å; Y864-F885 AromaticContact CD1-CZ 3.71Å; Y864-F885 HydrophobicContact CD1-CZ 3.71Å; Y864-F885 HydrophobicContact CE1-CZ 4.49Å; Y864-F885 HydrophobicContact CG-CE1 4.48Å; Y864-F885 WeakPolarHBondContact O-CB 3.48Å; Y864-F885 WeakPolarHBondContact O-CG 3.29Å
865	L	92.2	Very high	86	Confident	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-66.6	-33.2	174.8	-72.2	174.2	0	0	0	112.8	V807 F861 L862 F885 H886 Q890 F901 C903	V807-L865 HydrophobicContact CG1-CD1 3.87Å; V807-L865 HydrophobicContact CG2-CB 3.82Å; F861-L865 HydrophobicContact CD1-CD1 4.02Å; F861-L865 HydrophobicContact CE1-CD1 3.65Å; F861-L865 HydrophobicContact CE1-CG 4.44Å; F861-L865 HydrophobicContact CZ-CD1 4.02Å; F861-L865 HydrophobicContact CZ-CG 4.42Å; F861-L865 WeakPolarHBondContact O-CG 3.34Å; F861-L865 PolarHBondContact O-N 2.71Å; F861-L865 VanDerWaalsContact O-N 3.09Å; L862-L865 WeakPolarHBondContact O-CA 3.29Å; L862-L865 PolarHBondContact O-N 2.54Å; L865-F885 HydrophobicContact CD2-CD1 4.4Å; L865-H886 PolarHBondContact O-CD2 2.89Å; L865-H886 VanDerWaalsContact O-CD2 3.31Å; L865-H886 PolarHBondContact O-NE2 2.89Å; L865-Q890 HydrophobicContact CD2-CG 4.15Å; L865-F901 HydrophobicContact CD1-CB 3.95Å; L865-F901 HydrophobicContact CD1-CD1 3.65Å; L865-F901 HydrophobicContact CD1-CG 4.13Å; L865-C903 PolarHBondContact O-SG 3.09Å
866	F	88.4	Confident	84.3	Confident	2 Å²	2	11.5 Å²	11.5	1%	0.009	7%	0.071	C	C	.	.	H	α-helix	trans	-78	-50.5	173.3	-73.3	-67.4	0	0	0	112.4	F733 F800 L802 T805 V807 L862 Y864 H886	F733-F866 HydrophobicContact CE2-CD2 4.11Å; F733-F866 AromaticContact CZ-CD2 3.87Å; F733-F866 HydrophobicContact CZ-CD2 3.87Å; F733-F866 AromaticContact CZ-CE2 3.86Å; F733-F866 HydrophobicContact CZ-CE2 3.86Å; F800-F866 HydrophobicContact CB-CE2 4.14Å; F800-F866 HydrophobicContact CB-CZ 3.81Å; L802-F866 HydrophobicContact CB-CD1 3.72Å; L802-F866 HydrophobicContact CB-CD2 4.08Å; L802-F866 HydrophobicContact CB-CE1 3.75Å; L802-F866 HydrophobicContact CB-CE2 4.13Å; L802-F866 HydrophobicContact CB-CG 3.91Å; L802-F866 HydrophobicContact CB-CZ 3.97Å; L802-F866 HydrophobicContact CD2-CB 4.32Å; L802-F866 HydrophobicContact CD2-CD2 3.96Å; L802-F866 HydrophobicContact CD2-CG 4.09Å; L802-F866 HydrophobicContact CG-CG 4.4Å; T805-F866 HydrophobicContact CG2-CD1 3.81Å; T805-F866 HydrophobicContact CG2-CE1 4.2Å; T805-F866 WeakPolarHBondContact O-CE1 3.35Å; V807-F866 HydrophobicContact CB-CE1 4.32Å; V807-F866 HydrophobicContact CB-CE2 4.34Å; V807-F866 HydrophobicContact CB-CZ 3.89Å; V807-F866 HydrophobicContact CG2-CD1 4.02Å; V807-F866 HydrophobicContact CG2-CD2 4.23Å; V807-F866 HydrophobicContact CG2-CE1 3.65Å; V807-F866 HydrophobicContact CG2-CE2 3.84Å; V807-F866 HydrophobicContact CG2-CG 4.29Å; V807-F866 HydrophobicContact CG2-CZ 3.54Å; L862-F866 HydrophobicContact CB-CD2 4.38Å; L862-F866 HydrophobicContact CB-CE2 4.28Å; L862-F866 WeakPolarHBondContact O-CD2 3.4Å; L862-F866 PolarHBondContact O-N 3.45Å; Y864-F866 VanDerWaalsContact C-N 3.33Å; Y864-F866 PolarHBondContact O-N 2.87Å; F866-H886 PolarHBondContact O-NE2 2.69Å
867	H	80.8	Confident	82.7	Confident	10 Å²	10	17.8 Å²	17.8	5%	0.046	10%	0.101	C	C	.	.	H	α-helix	trans	-109.5	-6.4	-164.7	-55.4	124.1	0	0	0	115.6	M599 C619 D863 V869 R1470	M599-H867 HydrophobicContact CE-CB 3.84Å; M599-H867 WeakPolarHBondContact CE-O 3.47Å; C619-H867 PolarHBondContact SG-O 2.66Å; D863-H867 WeakPolarHBondContact O-CB 3.38Å; D863-H867 PolarHBondContact O-N 2.96Å; D863-H867 PolarHBondContact O-ND1 3.18Å; D863-H867 IonicContact OD1-CE1 3.12Å; D863-H867 PolarHBondContact OD1-CE1 3.05Å; D863-H867 IonicContact OD1-CG 3.88Å; D863-H867 IonicContact OD1-ND1 2.66Å; D863-H867 PolarHBondContact OD1-ND1 2.89Å; H867-V869 PolarHBondContact O-N 3.47Å; H867-R1470 PolarHBondContact CD2-NE 3.5Å; H867-R1470 PolarHBondContact CE1-NE 3.09Å; H867-R1470 VanDerWaalsContact CE1-NE 3.33Å; H867-R1470 PolarHBondContact ND1-NE 2.74Å; H867-R1470 VanDerWaalsContact NE2-CD 3.32Å; H867-R1470 WeakPolarHBondContact NE2-CD 3.38Å; H867-R1470 PolarHBondContact NE2-NE 3.27Å
868	G	76.3	Confident	81.5	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.			trans	-67.4	114.6	-178.9	0	0	0	0	0	112.5	Y864 F885 H886	Y864-G868 VanDerWaalsContact O-CA 3.24Å; Y864-G868 WeakPolarHBondContact O-CA 3.48Å; Y864-G868 PolarHBondContact O-N 2.76Å; G868-F885 WeakPolarHBondContact O-CD2 3.48Å; G868-H886 PolarHBondContact O-CE1 3.28Å
869	V	72.2	Confident	80.3	Confident	8 Å²	8	27.4 Å²	27.4	5%	0.048	15%	0.149	C	C	.	.			trans	-124.5	155.9	-176.6	-66	0	0	0	0	112.9	C596 M599 D615 H867 L871	C596-V869 HydrophobicContact CB-CG1 4.36Å; M599-V869 HydrophobicContact CB-CG1 4.33Å; M599-V869 HydrophobicContact CE-CG1 4.22Å; D615-V869 HydrophobicContact CB-CG2 4.42Å; H867-V869 PolarHBondContact O-N 3.47Å; V869-L871 PolarHBondContact O-N 3.37Å; V869-L871 VanDerWaalsContact O-N 3.11Å
870	R	70.9	Confident	79.7	Confident	53 Å²	53	27.6 Å²	27.6	20%	0.2	15%	0.15	C	C	.	.	S	Bend	trans	58.9	15.5	175.1	-53.1	-176.3	80.6	-168.5	5.8	116.5	A610 D615	A610-R870 PolarHBondContact O-NH1 2.95Å; D615-R870 WeakPolarHBondContact OD2-CD 3.5Å; D615-R870 IonicContact OD2-CZ 3.2Å; D615-R870 IonicContact OD2-NE 3.06Å; D615-R870 IonicContact OD2-NH1 2.69Å; D615-R870 PolarHBondContact OD2-NH1 3.4Å
871	L	79	Confident	79.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	149	162.6	-77.1	-175.5	0	0	0	111.5	I308 L574 A579 V580 F612 L616 V869 C883 L884 F885	I308-L871 HydrophobicContact CD1-CD2 3.37Å; L574-L871 HydrophobicContact CD2-CD1 3.46Å; L574-L871 VanDerWaalsContact CD2-CD1 3.46Å; A579-L871 HydrophobicContact CB-CD1 4.01Å; A579-L871 HydrophobicContact CB-CD2 4.44Å; V580-L871 WeakPolarHBondContact O-CD2 3.45Å; F612-L871 HydrophobicContact CE2-CD2 3.57Å; F612-L871 HydrophobicContact CE2-CG 4.28Å; F612-L871 HydrophobicContact CZ-CD2 3.59Å; L616-L871 HydrophobicContact CD1-CD1 3.26Å; L616-L871 HydrophobicContact CD1-CD2 4.02Å; L616-L871 HydrophobicContact CD1-CG 3.64Å; V869-L871 PolarHBondContact O-N 3.37Å; V869-L871 VanDerWaalsContact O-N 3.11Å; L871-C883 CarbonylContact O-C 3.57Å; L871-C883 WeakPolarHBondContact O-CA 3.18Å; L871-L884 HydrophobicContact CB-CB 4.14Å; L871-L884 HydrophobicContact CB-CD2 4.27Å; L871-L884 HydrophobicContact CD1-CD2 4.35Å; L871-L884 PolarHBondContact O-N 2.88Å; L871-F885 HydrophobicContact CB-CE2 3.92Å; L871-F885 HydrophobicContact CD1-CE2 3.63Å; L871-F885 HydrophobicContact CD1-CZ 3.88Å; L871-F885 HydrophobicContact CG-CE2 4.25Å
872	S	80.5	Confident	78.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	-171.4	170.1	-172.8	0	0	0	0	109.7	A579 V580 C880 H882	A579-S872 WeakPolarHBondContact CA-O 3.39Å; V580-S872 PolarHBondContact N-O 3.02Å; V580-S872 PolarHBondContact O-N 3.41Å; S872-C880 VanDerWaalsContact CB-O 3.31Å; S872-C880 WeakPolarHBondContact CB-O 3.17Å; S872-C880 WeakPolarHBondContact OG-CB 3.37Å; S872-C880 PolarHBondContact OG-O 3.16Å; S872-H882 WeakPolarHBondContact CB-O 3.29Å; S872-H882 PolarHBondContact OG-O 2.8Å; S872-H882 VanDerWaalsContact OG-O 3.07Å
873	S	79.1	Confident	78.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	158	-179.5	-152.4	0	0	0	0	113.2	L577 Q578 T844 L875 C880	L577-S873 PolarHBondContact O-OG 3.06Å; Q578-S873 WeakPolarHBondContact O-CA 3.22Å; Q578-S873 PolarHBondContact O-OG 3.38Å; T844-S873 WeakPolarHBondContact CG2-OG 3.48Å; S873-L875 PolarHBondContact O-N 3.41Å; S873-C880 PolarHBondContact O-N 2.93Å; S873-C880 VanDerWaalsContact O-N 3.11Å
874	V	77.4	Confident	78.4	Confident	52 Å²	52	33.4 Å²	33.4	32%	0.315	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	109.3	166.7	-174.8	0	0	0	0	108.6	Q578 V580	Q578-V874 PolarHBondContact O-N 3.26Å; V580-V874 HydrophobicContact CB-CG2 4.49Å; V580-V874 HydrophobicContact CG1-CG2 3.56Å; V580-V874 HydrophobicContact CG2-CG2 4.1Å
875	L	76.3	Confident	78.4	Confident	11 Å²	11	33.5 Å²	33.5	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	166.3	169.2	-53.4	-179.2	0	0	0	108.6	C837 C840 A842 S843 T844 S873 E877 E878 C880	C837-L875 HydrophobicContact CB-CD1 4.12Å; C840-L875 HydrophobicContact CB-CD1 4Å; A842-L875 HydrophobicContact CB-CB 4.45Å; A842-L875 HydrophobicContact CB-CD1 4.05Å; S843-L875 WeakPolarHBondContact O-CA 3.44Å; T844-L875 HydrophobicContact CG2-CD2 4.09Å; S873-L875 PolarHBondContact O-N 3.41Å; L875-E877 PolarHBondContact O-N 2.89Å; L875-E878 CarbonylContact C-O 3.55Å; L875-E878 WeakPolarHBondContact CA-O 3.33Å; L875-E878 PolarHBondContact N-O 2.88Å; L875-E878 PolarHBondContact O-N 2.81Å; L875-E878 VanDerWaalsContact O-N 3.07Å; L875-E878 VanDerWaalsContact O-O 3.12Å; L875-C880 HydrophobicContact CD1-CB 3.71Å; L875-C880 HydrophobicContact CG-CB 3.97Å
876	A	60.1	Low	78.3	Confident	88 Å²	88	33.6 Å²	33.6	73%	0.727	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-42.5	-33.5	-159	0	0	0	0	0	118.5	S843	S843-A876 PolarHBondContact O-N 2.97Å
877	E	61.8	Low	78.4	Confident	132 Å²	132	33.9 Å²	33.9	62%	0.617	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-138.9	5.5	170.1	-101.2	158.1	-155.2	0	0	113.7	L875	L875-E877 PolarHBondContact O-N 2.89Å
878	E	69.1	Low	78.8	Confident	155 Å²	155	33.5 Å²	33.5	72%	0.724	18%	0.181	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.4	-172.7	-67.7	-170.8	159.7	0	0	113.6	L875	L875-E878 CarbonylContact C-O 3.55Å; L875-E878 WeakPolarHBondContact CA-O 3.33Å; L875-E878 PolarHBondContact N-O 2.88Å; L875-E878 PolarHBondContact O-N 2.81Å; L875-E878 VanDerWaalsContact O-N 3.07Å; L875-E878 VanDerWaalsContact O-O 3.12Å
879	T	69.8	Low	79.7	Confident	47 Å²	47	34 Å²	34	29%	0.288	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.2	169.6	50.2	0	0	0	0	111.5	L305	L305-T879 HydrophobicContact CD1-CG2 3.26Å
880	C	81.5	Confident	80.7	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.034	18%	0.182	C	C	.	.			trans	-73.2	155	160.7	-161.5	0	0	0	0	110.1	C840 S872 S873 L875 H882	C840-C880 PolarHBondContact SG-SG 2.86Å; S872-C880 VanDerWaalsContact CB-O 3.31Å; S872-C880 WeakPolarHBondContact CB-O 3.17Å; S872-C880 WeakPolarHBondContact OG-CB 3.37Å; S872-C880 PolarHBondContact OG-O 3.16Å; S873-C880 PolarHBondContact O-N 2.93Å; S873-C880 VanDerWaalsContact O-N 3.11Å; L875-C880 HydrophobicContact CD1-CB 3.71Å; L875-C880 HydrophobicContact CG-CB 3.97Å; C880-H882 PolarHBondContact SG-N 3.18Å; C880-H882 VanDerWaalsContact SG-N 3.45Å; C880-H882 PolarHBondContact SG-ND1 2.85Å; C880-H882 VanDerWaalsContact SG-ND1 3.4Å
881	D	80.1	Confident	81.8	Confident	86 Å²	86	32.1 Å²	32.1	46%	0.46	18%	0.177	S	C	.	.			trans	-109.8	1	167.4	-73.3	-54.9	0	0	0	112.8
882	H	85.6	Confident	82.6	Confident	43 Å²	43	32.1 Å²	32.1	20%	0.199	18%	0.177	C	C	.	.	S	Bend	trans	-86.8	157.7	179.1	-58.5	98.6	0	0	0	112.7	S592 H839 C840 S872 C880 L884 D887 H888	S592-H882 PolarHBondContact OG-CD2 2.91Å; H839-H882 AromaticContact CD2-CD2 3.27Å; H839-H882 PolarHBondContact CD2-CD2 3.14Å; H839-H882 AromaticContact CD2-CG 3.66Å; H839-H882 AromaticContact CD2-NE2 3.81Å; H839-H882 AromaticContact CG-CD2 3.8Å; H839-H882 AromaticContact CG-NE2 3.85Å; C840-H882 PolarHBondContact SG-ND1 3.5Å; S872-H882 WeakPolarHBondContact CB-O 3.29Å; S872-H882 PolarHBondContact OG-O 2.8Å; S872-H882 VanDerWaalsContact OG-O 3.07Å; C880-H882 PolarHBondContact SG-N 3.18Å; C880-H882 VanDerWaalsContact SG-N 3.45Å; C880-H882 PolarHBondContact SG-ND1 2.85Å; C880-H882 VanDerWaalsContact SG-ND1 3.4Å; H882-L884 PolarHBondContact O-N 2.97Å; H882-D887 HydrophobicContact CB-CB 3.79Å; H882-H888 PolarHBondContact O-CE1 2.95Å
883	C	87.1	Confident	83	Confident	8 Å²	8	32.1 Å²	32.1	5%	0.054	18%	0.177	C	C	.	.			trans	-65.2	125	-173.1	-174.6	0	0	0	0	113	C593 L871 F885 H886 D887 H888	C593-C883 HydrophobicContact CB-CB 4.12Å; L871-C883 CarbonylContact O-C 3.57Å; L871-C883 WeakPolarHBondContact O-CA 3.18Å; C883-F885 PolarHBondContact O-N 2.67Å; C883-H886 HydrophobicContact CB-CB 4.06Å; C883-H886 PolarHBondContact SG-N 3.37Å; C883-H886 VanDerWaalsContact SG-N 3.43Å; C883-H886 PolarHBondContact SG-ND1 2.82Å; C883-H886 VanDerWaalsContact SG-ND1 3.37Å; C883-D887 HydrophobicContact CB-CB 4.43Å; C883-D887 WeakPolarHBondContact CB-OD2 3.28Å; C883-D887 PolarHBondContact N-OD2 2.93Å; C883-D887 WeakPolarHBondContact O-CA 3.11Å; C883-D887 WeakPolarHBondContact O-CB 3.18Å; C883-D887 PolarHBondContact O-N 3.02Å; C883-H888 PolarHBondContact O-N 3.11Å; C883-H888 PolarHBondContact O-ND1 3Å
884	L	88.9	Confident	83.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.4	175.9	174.2	63.8	0	0	0	113.2	L577 A579 L871 H882 Q890	L577-L884 HydrophobicContact CB-CD1 4.32Å; L577-L884 HydrophobicContact CB-CD2 4.19Å; A579-L884 HydrophobicContact CB-CD2 3.61Å; L871-L884 HydrophobicContact CB-CB 4.14Å; L871-L884 HydrophobicContact CB-CD2 4.27Å; L871-L884 HydrophobicContact CD1-CD2 4.35Å; L871-L884 PolarHBondContact O-N 2.88Å; H882-L884 PolarHBondContact O-N 2.97Å; L884-Q890 PolarHBondContact O-NE2 3.02Å
885	F	90	Very high	83.7	Confident	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-39.1	-175.3	-57	-72.6	0	0	0	112.6	L574 L577 Y864 L865 G868 L871 C883 C903	L574-F885 HydrophobicContact CD2-CZ 3.88Å; L577-F885 HydrophobicContact CD1-CE1 4.23Å; Y864-F885 HydrophobicContact CD1-CE1 4.03Å; Y864-F885 HydrophobicContact CD1-CE2 4.26Å; Y864-F885 AromaticContact CD1-CZ 3.71Å; Y864-F885 HydrophobicContact CD1-CZ 3.71Å; Y864-F885 HydrophobicContact CE1-CZ 4.49Å; Y864-F885 HydrophobicContact CG-CE1 4.48Å; Y864-F885 WeakPolarHBondContact O-CB 3.48Å; Y864-F885 WeakPolarHBondContact O-CG 3.29Å; L865-F885 HydrophobicContact CD2-CD1 4.4Å; G868-F885 WeakPolarHBondContact O-CD2 3.48Å; L871-F885 HydrophobicContact CB-CE2 3.92Å; L871-F885 HydrophobicContact CD1-CE2 3.63Å; L871-F885 HydrophobicContact CD1-CZ 3.88Å; L871-F885 HydrophobicContact CG-CE2 4.25Å; C883-F885 PolarHBondContact O-N 2.67Å; F885-C903 PolarHBondContact O-SG 2.67Å
886	H	90.2	Very high	83.9	Confident	3 Å²	3	40 Å²	40	1%	0.014	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-40.1	-175.6	-56.2	127.2	0	0	0	113.6	C593 T595 C596 R838 L865 F866 G868 C883	C593-H886 WeakPolarHBondContact SG-CB 3.5Å; T595-H886 WeakPolarHBondContact CG2-NE2 3.31Å; C596-H886 PolarHBondContact SG-ND1 2.85Å; C596-H886 VanDerWaalsContact SG-ND1 3.43Å; R838-H886 PolarHBondContact NH2-O 3.5Å; L865-H886 PolarHBondContact O-CD2 2.89Å; L865-H886 VanDerWaalsContact O-CD2 3.31Å; L865-H886 PolarHBondContact O-NE2 2.89Å; F866-H886 PolarHBondContact O-NE2 2.69Å; G868-H886 PolarHBondContact O-CE1 3.28Å; C883-H886 HydrophobicContact CB-CB 4.06Å; C883-H886 PolarHBondContact SG-N 3.37Å; C883-H886 VanDerWaalsContact SG-N 3.43Å; C883-H886 PolarHBondContact SG-ND1 2.82Å; C883-H886 VanDerWaalsContact SG-ND1 3.37Å
887	D	89.8	Confident	85.2	Confident	9 Å²	9	36.6 Å²	36.6	5%	0.048	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-25.3	-174.6	-65.1	-53.4	0	0	0	113.4	C593 R838 H839 H882 C883	C593-D887 VanDerWaalsContact CB-OD2 3.24Å; C593-D887 WeakPolarHBondContact CB-OD2 3.47Å; C593-D887 PolarHBondContact SG-OD1 3.04Å; C593-D887 PolarHBondContact SG-OD2 3.15Å; C593-D887 VanDerWaalsContact SG-OD2 3.33Å; R838-D887 VanDerWaalsContact CB-O 3.25Å; R838-D887 WeakPolarHBondContact CB-O 3.36Å; R838-D887 WeakPolarHBondContact CG-O 3.42Å; R838-D887 PolarHBondContact N-O 2.91Å; R838-D887 VanDerWaalsContact N-O 3.09Å; R838-D887 PolarHBondContact NE-O 3.37Å; H839-D887 IonicContact CD2-OD1 2.83Å; H839-D887 IonicContact CE1-OD1 3.17Å; H839-D887 VanDerWaalsContact NE2-CG 3.35Å; H839-D887 IonicContact NE2-OD1 3.59Å; H839-D887 PolarHBondContact NE2-OD1 3.48Å; H882-D887 HydrophobicContact CB-CB 3.79Å; C883-D887 HydrophobicContact CB-CB 4.43Å; C883-D887 WeakPolarHBondContact CB-OD2 3.28Å; C883-D887 PolarHBondContact N-OD2 2.93Å; C883-D887 WeakPolarHBondContact O-CA 3.11Å; C883-D887 WeakPolarHBondContact O-CB 3.18Å; C883-D887 PolarHBondContact O-N 3.02Å
888	H	90.1	Very high	86.5	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	150.6	175.1	-59.8	64.1	0	0	0	111.7	W836 H882 C883	W836-H888 CarbonylContact O-C 3.58Å; W836-H888 WeakPolarHBondContact O-CA 3.5Å; W836-H888 WeakPolarHBondContact O-CB 3.5Å; H882-H888 PolarHBondContact O-CE1 2.95Å; C883-H888 PolarHBondContact O-N 3.11Å; C883-H888 PolarHBondContact O-ND1 3Å
889	V	93.5	Very high	87.6	Confident	10 Å²	10	23.1 Å²	23.1	6%	0.061	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132	164.1	178.5	0	0	0	0	107.9	S835 W836 R838 F891 R902	S835-V889 WeakPolarHBondContact CA-O 3.31Å; W836-V889 HydrophobicContact CE3-CB 4.31Å; W836-V889 HydrophobicContact CE3-CG2 4.08Å; W836-V889 HydrophobicContact CZ3-CG2 4.41Å; W836-V889 PolarHBondContact N-O 3.08Å; W836-V889 PolarHBondContact O-N 3.34Å; R838-V889 HydrophobicContact CG-CG2 3.99Å; V889-F891 HydrophobicContact CB-CE2 4.02Å; V889-F891 HydrophobicContact CB-CZ 4.28Å; V889-F891 HydrophobicContact CG1-CD1 4.39Å; V889-F891 HydrophobicContact CG1-CD2 4.18Å; V889-F891 HydrophobicContact CG1-CE1 3.97Å; V889-F891 HydrophobicContact CG1-CE2 3.75Å; V889-F891 HydrophobicContact CG1-CZ 3.64Å; V889-R902 HydrophobicContact CG2-CB 4.31Å; V889-R902 HydrophobicContact CG2-CG 4.26Å
890	Q	94.9	Very high	88.8	Confident	2 Å²	2	21.2 Å²	21.2	1%	0.009	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.7	179.4	-60.6	-61.5	-14.6	0	0	109.8	S835 L865 L884 S900 F901	S835-Q890 VanDerWaalsContact OG-CD 3.28Å; S835-Q890 PolarHBondContact OG-NE2 3.05Å; S835-Q890 PolarHBondContact OG-OE1 3.15Å; L865-Q890 HydrophobicContact CD2-CG 4.15Å; L884-Q890 PolarHBondContact O-NE2 3.02Å; Q890-S900 WeakPolarHBondContact O-CA 3.41Å; Q890-F901 HydrophobicContact CB-CB 4.26Å; Q890-F901 PolarHBondContact N-O 2.95Å; Q890-F901 PolarHBondContact O-N 3.09Å
891	F	94.1	Very high	89.6	Confident	20 Å²	20	21 Å²	21	9%	0.088	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140.9	-175.9	-71.5	-73.7	0	0	0	111.9	L833 W834 W836 V889 L898 V899	L833-F891 WeakPolarHBondContact CA-O 3.28Å; L833-F891 VanDerWaalsContact CB-O 3.28Å; L833-F891 WeakPolarHBondContact CB-O 3.17Å; W834-F891 AromaticContact CD1-CD2 3.84Å; W834-F891 HydrophobicContact CD2-CB 3.85Å; W834-F891 AromaticContact CE2-CD2 3.86Å; W834-F891 AromaticContact CE2-CG 3.85Å; W834-F891 HydrophobicContact CE3-CB 4.32Å; W834-F891 HydrophobicContact CG-CB 4.3Å; W834-F891 HydrophobicContact CH2-CB 4.26Å; W834-F891 HydrophobicContact CZ2-CB 3.76Å; W834-F891 HydrophobicContact CZ2-CD2 4.33Å; W834-F891 AromaticContact CZ2-CG 3.99Å; W834-F891 HydrophobicContact CZ2-CG 3.99Å; W834-F891 PolarHBondContact N-O 3.05Å; W834-F891 AromaticContact NE1-CD2 3.28Å; W834-F891 VanDerWaalsContact NE1-CD2 3.28Å; W834-F891 AromaticContact NE1-CG 3.77Å; W834-F891 PolarHBondContact O-N 3.34Å; W836-F891 HydrophobicContact CB-CD2 4.22Å; W836-F891 HydrophobicContact CB-CE2 3.77Å; V889-F891 HydrophobicContact CB-CE2 4.02Å; V889-F891 HydrophobicContact CB-CZ 4.28Å; V889-F891 HydrophobicContact CG1-CD1 4.39Å; V889-F891 HydrophobicContact CG1-CD2 4.18Å; V889-F891 HydrophobicContact CG1-CE1 3.97Å; V889-F891 HydrophobicContact CG1-CE2 3.75Å; V889-F891 HydrophobicContact CG1-CZ 3.64Å; F891-L898 HydrophobicContact CB-CD1 4.09Å; F891-L898 HydrophobicContact CD1-CD1 3.67Å; F891-L898 HydrophobicContact CD1-CD2 3.87Å; F891-L898 HydrophobicContact CD1-CG 3.9Å; F891-L898 HydrophobicContact CE1-CD1 4.48Å; F891-L898 HydrophobicContact CE1-CD2 3.84Å; F891-L898 HydrophobicContact CE1-CG 4.33Å; F891-L898 HydrophobicContact CG-CD1 4.23Å; F891-V899 WeakPolarHBondContact CA-O 3.28Å
892	F	94.4	Very high	90.2	Very high	1 Å²	1	22 Å²	22	0%	0.004	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.8	169.5	-59	-94	0	0	0	108.8	L769 L773 I831 V832 L833 M849 F853 F861 V899 F901	L769-F892 HydrophobicContact CD2-CE1 4.41Å; L769-F892 HydrophobicContact CD2-CZ 4.13Å; L773-F892 HydrophobicContact CD1-CB 4.15Å; L773-F892 HydrophobicContact CD1-CD1 3.62Å; L773-F892 HydrophobicContact CD1-CD2 4.36Å; L773-F892 HydrophobicContact CD1-CE1 4.05Å; L773-F892 HydrophobicContact CD1-CG 3.79Å; L773-F892 HydrophobicContact CD2-CB 3.95Å; L773-F892 HydrophobicContact CD2-CD2 4.11Å; L773-F892 HydrophobicContact CD2-CG 4.01Å; I831-F892 HydrophobicContact CG2-CB 4.09Å; I831-F892 HydrophobicContact CG2-CD1 4.21Å; V832-F892 CarbonylContact O-C 3.51Å; V832-F892 WeakPolarHBondContact O-CA 3.35Å; L833-F892 HydrophobicContact CB-CD1 3.75Å; L833-F892 HydrophobicContact CB-CE1 4.04Å; L833-F892 HydrophobicContact CB-CG 4.43Å; L833-F892 HydrophobicContact CD2-CD1 4.47Å; L833-F892 HydrophobicContact CD2-CE1 4.33Å; M849-F892 HydrophobicContact CE-CE1 4.07Å; F853-F892 AromaticContact CE1-CE1 3.97Å; F853-F892 HydrophobicContact CE1-CE1 3.97Å; F853-F892 HydrophobicContact CE1-CZ 4.36Å; F853-F892 HydrophobicContact CZ-CE1 4.03Å; F853-F892 HydrophobicContact CZ-CZ 4Å; F861-F892 AromaticContact CE1-CE2 4Å; F861-F892 HydrophobicContact CE1-CE2 4Å; F861-F892 HydrophobicContact CE1-CZ 4.15Å; F861-F892 HydrophobicContact CE2-CZ 4.29Å; F861-F892 AromaticContact CZ-CE2 3.78Å; F861-F892 HydrophobicContact CZ-CE2 3.78Å; F861-F892 AromaticContact CZ-CZ 3.7Å; F861-F892 HydrophobicContact CZ-CZ 3.7Å; F892-V899 HydrophobicContact CB-CB 4.43Å; F892-V899 PolarHBondContact N-O 3.49Å; F892-V899 PolarHBondContact O-N 2.92Å; F892-F901 AromaticContact CD2-CD2 3.89Å; F892-F901 HydrophobicContact CD2-CD2 3.89Å; F892-F901 AromaticContact CD2-CE2 3.83Å; F892-F901 HydrophobicContact CD2-CE2 3.83Å; F892-F901 AromaticContact CE2-CD2 3.76Å; F892-F901 HydrophobicContact CE2-CD2 3.76Å; F892-F901 AromaticContact CE2-CE2 3.78Å; F892-F901 HydrophobicContact CE2-CE2 3.78Å
893	A	89.7	Confident	90.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.6	-179.8	0	0	0	0	0	112.4	P818 I831 V832 W834 T897 L898	P818-A893 HydrophobicContact CG-CB 3.9Å; I831-A893 WeakPolarHBondContact CA-O 3.08Å; V832-A893 HydrophobicContact CG2-CB 4.04Å; V832-A893 PolarHBondContact N-O 2.64Å; V832-A893 PolarHBondContact O-N 2.78Å; W834-A893 HydrophobicContact CH2-CB 4.08Å; W834-A893 HydrophobicContact CZ3-CB 3.96Å; A893-T897 VanDerWaalsContact CA-O 3.31Å; A893-T897 WeakPolarHBondContact CA-O 3.33Å; A893-L898 HydrophobicContact CB-CD1 4.03Å
894	R	87.9	Confident	90.6	Very high	39 Å²	39	22.2 Å²	22.2	15%	0.147	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	123.8	167.3	-179	179.1	67.4	-178.6	-5.6	107.8	L778 N829 N896 T897	L778-R894 HydrophobicContact CD1-CB 3.9Å; L778-R894 HydrophobicContact CD2-CB 3.98Å; L778-R894 HydrophobicContact CG-CB 4.4Å; L778-R894 PolarHBondContact O-NH2 3.19Å; N829-R894 WeakPolarHBondContact OD1-CD 3.22Å; R894-N896 PolarHBondContact O-N 2.7Å; R894-T897 PolarHBondContact N-O 2.94Å; R894-T897 PolarHBondContact O-N 2.58Å
895	Q	82.4	Confident	90.6	Very high	108 Å²	108	25.5 Å²	25.5	51%	0.505	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	-126.5	-174.2	-58.3	166.2	2.8	0	0	109.9	G828	G828-Q895 VanDerWaalsContact O-CG 3.26Å; G828-Q895 WeakPolarHBondContact O-CG 3.31Å; G828-Q895 PolarHBondContact O-NE2 2.61Å
896	N	81.2	Confident	90.4	Very high	81 Å²	81	27 Å²	27	43%	0.433	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	11.3	179.4	-67.1	14.6	0	0	0	113.7	M814 R894	M814-N896 PolarHBondContact N-O 3.45Å; R894-N896 PolarHBondContact O-N 2.7Å
897	T	86.3	Confident	90.2	Very high	17 Å²	17	30.3 Å²	30.3	10%	0.104	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.2	177.5	-49.4	0	0	0	0	110.6	C777 L778 V811 A893 R894	C777-T897 WeakPolarHBondContact O-CG2 3.38Å; L778-T897 HydrophobicContact CD2-CG2 4.15Å; V811-T897 HydrophobicContact CG1-CG2 3.54Å; A893-T897 VanDerWaalsContact CA-O 3.31Å; A893-T897 WeakPolarHBondContact CA-O 3.33Å; R894-T897 PolarHBondContact N-O 2.94Å; R894-T897 PolarHBondContact O-N 2.58Å
898	L	89.6	Confident	90.1	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.8	176.3	-179.6	69.3	0	0	0	110.1	L289 V811 H812 M814 W834 F891 A893	L289-L898 HydrophobicContact CD1-CD2 4.26Å; V811-L898 CarbonylContact C-O 3.59Å; V811-L898 VanDerWaalsContact CA-O 3.31Å; V811-L898 WeakPolarHBondContact CA-O 3.44Å; H812-L898 HydrophobicContact CB-CB 4.4Å; H812-L898 PolarHBondContact N-O 3.34Å; H812-L898 PolarHBondContact O-N 2.84Å; M814-L898 HydrophobicContact CG-CB 3.63Å; M814-L898 HydrophobicContact CG-CD2 4.44Å; M814-L898 HydrophobicContact SD-CB 4.03Å; M814-L898 HydrophobicContact SD-CD1 4.46Å; M814-L898 HydrophobicContact SD-CD2 3.86Å; M814-L898 HydrophobicContact SD-CG 4.35Å; W834-L898 HydrophobicContact CH2-CD1 3.54Å; W834-L898 HydrophobicContact CZ2-CD1 3.81Å; W834-L898 HydrophobicContact CZ3-CD1 4.47Å; F891-L898 HydrophobicContact CB-CD1 4.09Å; F891-L898 HydrophobicContact CD1-CD1 3.67Å; F891-L898 HydrophobicContact CD1-CD2 3.87Å; F891-L898 HydrophobicContact CD1-CG 3.9Å; F891-L898 HydrophobicContact CE1-CD1 4.48Å; F891-L898 HydrophobicContact CE1-CD2 3.84Å; F891-L898 HydrophobicContact CE1-CG 4.33Å; F891-L898 HydrophobicContact CG-CD1 4.23Å; A893-L898 HydrophobicContact CB-CD1 4.03Å
899	V	93.7	Very high	90.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.8	171.9	-168.9	0	0	0	0	107.7	L773 C777 L778 V809 V811 F891 F892 F901	L773-V899 HydrophobicContact CD2-CB 4.2Å; L773-V899 HydrophobicContact CD2-CG1 4.09Å; L773-V899 HydrophobicContact CD2-CG2 4.2Å; C777-V899 HydrophobicContact CB-CB 4.36Å; C777-V899 HydrophobicContact CB-CG1 3.85Å; C777-V899 HydrophobicContact CB-CG2 3.52Å; L778-V899 HydrophobicContact CD2-CG2 3.53Å; L778-V899 HydrophobicContact CG-CG2 3.96Å; V809-V899 HydrophobicContact CG1-CG1 3.77Å; V811-V899 HydrophobicContact CG2-CG2 4.47Å; F891-V899 WeakPolarHBondContact CA-O 3.28Å; F892-V899 HydrophobicContact CB-CB 4.43Å; F892-V899 PolarHBondContact N-O 3.49Å; F892-V899 PolarHBondContact O-N 2.92Å; V899-F901 HydrophobicContact CG1-CD2 4.46Å; V899-F901 HydrophobicContact CG1-CE2 4.05Å
900	S	94.5	Very high	90	Very high	8 Å²	8	34.6 Å²	34.6	6%	0.056	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.3	177	61.4	0	0	0	0	110.8	V809 S810 Q890	V809-S900 VanDerWaalsContact CA-O 3.31Å; V809-S900 WeakPolarHBondContact CA-O 3.42Å; S810-S900 PolarHBondContact N-O 3.15Å; S810-S900 PolarHBondContact O-N 3.43Å; S810-S900 PolarHBondContact O-OG 3.44Å; S810-S900 PolarHBondContact OG-OG 2.86Å; Q890-S900 WeakPolarHBondContact O-CA 3.41Å
901	F	97	Very high	89.8	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.1	168.1	-70.1	-108.7	0	0	0	108	L769 Y772 L773 V807 E808 V809 F858 F861 L862 L865 Q890 F892 V899	L769-F901 HydrophobicContact CD1-CZ 4.27Å; Y772-F901 HydrophobicContact CD1-CZ 4.24Å; Y772-F901 HydrophobicContact CE1-CE1 4.43Å; Y772-F901 AromaticContact CE1-CZ 3.87Å; Y772-F901 HydrophobicContact CE1-CZ 3.87Å; L773-F901 HydrophobicContact CD2-CE2 4.14Å; V807-F901 HydrophobicContact CG1-CD1 4.11Å; E808-F901 WeakPolarHBondContact O-CA 3.37Å; V809-F901 HydrophobicContact CG1-CE1 4.42Å; V809-F901 HydrophobicContact CG1-CE2 4.3Å; V809-F901 HydrophobicContact CG1-CZ 4.22Å; V809-F901 HydrophobicContact CG2-CD1 3.62Å; V809-F901 HydrophobicContact CG2-CE1 3.52Å; V809-F901 HydrophobicContact CG2-CG 4.29Å; V809-F901 HydrophobicContact CG2-CZ 4.13Å; F858-F901 AromaticContact CE2-CE1 3.94Å; F858-F901 HydrophobicContact CE2-CE1 3.94Å; F858-F901 HydrophobicContact CE2-CZ 4.14Å; F861-F901 HydrophobicContact CD1-CD1 4.39Å; F861-F901 HydrophobicContact CD1-CE1 4.08Å; F861-F901 HydrophobicContact CD1-CZ 4.36Å; F861-F901 AromaticContact CE1-CD1 3.79Å; F861-F901 HydrophobicContact CE1-CD1 3.79Å; F861-F901 HydrophobicContact CE1-CD2 4.13Å; F861-F901 AromaticContact CE1-CE1 3.79Å; F861-F901 HydrophobicContact CE1-CE1 3.79Å; F861-F901 HydrophobicContact CE1-CE2 4.14Å; F861-F901 AromaticContact CE1-CG 3.97Å; F861-F901 HydrophobicContact CE1-CG 3.97Å; F861-F901 AromaticContact CE1-CZ 3.97Å; F861-F901 HydrophobicContact CE1-CZ 3.97Å; L862-F901 HydrophobicContact CD2-CE1 4.48Å; L865-F901 HydrophobicContact CD1-CB 3.95Å; L865-F901 HydrophobicContact CD1-CD1 3.65Å; L865-F901 HydrophobicContact CD1-CG 4.13Å; Q890-F901 HydrophobicContact CB-CB 4.26Å; Q890-F901 PolarHBondContact N-O 2.95Å; Q890-F901 PolarHBondContact O-N 3.09Å; F892-F901 AromaticContact CD2-CD2 3.89Å; F892-F901 HydrophobicContact CD2-CD2 3.89Å; F892-F901 AromaticContact CD2-CE2 3.83Å; F892-F901 HydrophobicContact CD2-CE2 3.83Å; F892-F901 AromaticContact CE2-CD2 3.76Å; F892-F901 HydrophobicContact CE2-CD2 3.76Å; F892-F901 AromaticContact CE2-CE2 3.78Å; F892-F901 HydrophobicContact CE2-CE2 3.78Å; V899-F901 HydrophobicContact CG1-CD2 4.46Å; V899-F901 HydrophobicContact CG1-CE2 4.05Å
902	R	93.3	Very high	89.5	Confident	107 Å²	107	36.1 Å²	36.1	40%	0.404	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	119.5	-176.6	173.2	178.2	166.2	167.8	-6.8	110.3	E808 V889 Q904	E808-R902 PolarHBondContact N-O 2.97Å; E808-R902 PolarHBondContact O-N 3.26Å; V889-R902 HydrophobicContact CG2-CB 4.31Å; V889-R902 HydrophobicContact CG2-CG 4.26Å; R902-Q904 HydrophobicContact CG-CG 4.08Å; R902-Q904 VanDerWaalsContact NE-CD 3.25Å
903	C	93.2	Very high	89	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.02	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.9	174.4	-62.6	0	0	0	0	111.1	S806 R838 L865 F885	S806-C903 CarbonylContact O-C 3.59Å; S806-C903 WeakPolarHBondContact O-CA 3.3Å; R838-C903 VanDerWaalsContact CZ-O 3.24Å; R838-C903 PolarHBondContact NH1-O 3.03Å; R838-C903 PolarHBondContact NH2-O 2.85Å; L865-C903 PolarHBondContact O-SG 3.09Å; F885-C903 PolarHBondContact O-SG 2.67Å
904	Q	88.5	Confident	87.8	Confident	51 Å²	51	37.8 Å²	37.8	24%	0.238	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	130.7	175.2	-41.7	-144.2	65.3	0	0	109.9	S806 E808 R902	S806-Q904 PolarHBondContact N-O 3.02Å; S806-Q904 PolarHBondContact O-N 2.96Å; S806-Q904 PolarHBondContact OG-O 3.35Å; E808-Q904 PolarHBondContact OE2-NE2 2.8Å; R902-Q904 HydrophobicContact CG-CG 4.08Å; R902-Q904 VanDerWaalsContact NE-CD 3.25Å
905	P	87.5	Confident	86.6	Confident	70 Å²	70	39 Å²	39	46%	0.455	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	149.8	172.1	29.9	-34.8	0	0	0	110.2
906	I	87.5	Confident	85.3	Confident	33 Å²	33	35.5 Å²	35.5	17%	0.169	20%	0.201	C	C	.	.			trans	-125.9	148.1	175.1	57.4	155.6	0	0	0	110.7	V801 S804 L908 Y1372	V801-I906 HydrophobicContact CG1-CD1 3.37Å; V801-I906 HydrophobicContact CG1-CG1 4.46Å; S804-I906 VanDerWaalsContact C-CG1 3.46Å; S804-I906 WeakPolarHBondContact O-CG1 3.44Å; S804-I906 PolarHBondContact O-N 2.93Å; I906-L908 HydrophobicContact CD1-CD2 3.81Å; I906-Y1372 HydrophobicContact CB-CD2 4.22Å; I906-Y1372 HydrophobicContact CD1-CD1 4.39Å; I906-Y1372 HydrophobicContact CD1-CD2 3.48Å; I906-Y1372 VanDerWaalsContact CD1-CD2 3.48Å; I906-Y1372 HydrophobicContact CD1-CE2 4.12Å; I906-Y1372 HydrophobicContact CD1-CG 3.65Å; I906-Y1372 HydrophobicContact CG1-CD2 4.47Å; I906-Y1372 HydrophobicContact CG2-CD2 4.28Å; I906-Y1372 HydrophobicContact CG2-CE2 4.22Å
907	S	84.8	Confident	84.1	Confident	71 Å²	71	34.2 Å²	34.2	50%	0.497	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-76.6	126.3	167.2	-62.5	0	0	0	0	109.6
908	L	88.4	Confident	82.9	Confident	50 Å²	50	34 Å²	34	26%	0.262	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-93.2	123.9	166.7	-65.2	-177.9	0	0	0	109.2	I906	I906-L908 HydrophobicContact CD1-CD2 3.81Å
909	F	90.4	Very high	81.3	Confident	13 Å²	13	36.1 Å²	36.1	6%	0.057	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-89.7	151.9	176.3	-68.8	-99.9	0	0	0	111.3	F1371 Y1372 L1373 N1374 V1406 S1411 L1413	F909-F1371 HydrophobicContact CD2-CD1 4.15Å; F909-F1371 HydrophobicContact CE1-CD1 4.26Å; F909-F1371 HydrophobicContact CE1-CE1 4.44Å; F909-F1371 AromaticContact CE2-CD1 3.76Å; F909-F1371 HydrophobicContact CE2-CD1 3.76Å; F909-F1371 HydrophobicContact CE2-CE1 4.38Å; F909-F1371 AromaticContact CZ-CD1 3.82Å; F909-F1371 HydrophobicContact CZ-CD1 3.82Å; F909-F1371 HydrophobicContact CZ-CE1 4.03Å; F909-Y1372 PolarHBondContact N-O 3.29Å; F909-L1373 HydrophobicContact CB-CD2 3.98Å; F909-N1374 PolarHBondContact O-ND2 3.19Å; F909-V1406 HydrophobicContact CE1-CG1 4.03Å; F909-S1411 WeakPolarHBondContact CA-O 3.25Å; F909-L1413 HydrophobicContact CB-CD1 4.3Å; F909-L1413 HydrophobicContact CB-CD2 4.44Å; F909-L1413 HydrophobicContact CB-CG 3.94Å; F909-L1413 HydrophobicContact CD1-CD2 3.61Å; F909-L1413 HydrophobicContact CD1-CG 4Å; F909-L1413 HydrophobicContact CE1-CD2 4.06Å; F909-L1413 HydrophobicContact CG-CD2 4.09Å; F909-L1413 HydrophobicContact CG-CG 4.14Å
910	S	91.2	Very high	79.7	Confident	48 Å²	48	39 Å²	39	34%	0.336	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	153.8	163.8	66.6	0	0	0	0	110.7	S1411 V1412 L1413	S910-S1411 PolarHBondContact N-O 2.88Å; S910-V1412 WeakPolarHBondContact O-CA 3.04Å; S910-L1413 PolarHBondContact O-N 2.82Å
911	T	90.3	Very high	77.8	Confident	16 Å²	16	43.5 Å²	43.5	10%	0.098	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.3	179.4	54.7	0	0	0	0	110.6	L1373 S1377 L1381 L1415	T911-L1373 HydrophobicContact CG2-CD1 3.61Å; T911-L1373 HydrophobicContact CG2-CD2 3.77Å; T911-L1373 HydrophobicContact CG2-CG 4.36Å; T911-S1377 WeakPolarHBondContact OG1-CB 3.4Å; T911-S1377 PolarHBondContact OG1-O 3.21Å; T911-L1381 HydrophobicContact CG2-CB 4.29Å; T911-L1381 HydrophobicContact CG2-CD2 4.47Å; T911-L1415 HydrophobicContact CG2-CD1 3.9Å
912	S	87.2	Confident	75.8	Confident	38 Å²	38	47.1 Å²	47.1	27%	0.266	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	143.8	163.3	-169.6	0	0	0	0	109.4	L1413 L1414 L1415	S912-L1413 PolarHBondContact N-O 3.31Å; S912-L1413 VanDerWaalsContact O-O 3.09Å; S912-L1414 WeakPolarHBondContact O-CA 3.36Å; S912-L1415 PolarHBondContact O-N 2.87Å
913	F	84.6	Confident	74	Confident	30 Å²	30	45.2 Å²	45.2	13%	0.132	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	160.3	178.6	-56.9	-77	0	0	0	110.2	S915 V1289 K1380 L1381 A1384 L1415	F913-S915 PolarHBondContact O-N 3.02Å; F913-S915 VanDerWaalsContact O-N 3.15Å; F913-V1289 HydrophobicContact CD2-CG1 3.79Å; F913-V1289 HydrophobicContact CE2-CG1 3.96Å; F913-V1289 HydrophobicContact CG-CG1 4.36Å; F913-K1380 HydrophobicContact CE2-CB 4.06Å; F913-K1380 HydrophobicContact CZ-CB 4.36Å; F913-L1381 HydrophobicContact CE1-CD1 3.79Å; F913-L1381 HydrophobicContact CZ-CB 4.2Å; F913-L1381 HydrophobicContact CZ-CD1 4.26Å; F913-A1384 HydrophobicContact CD1-CB 4.49Å; F913-A1384 HydrophobicContact CE1-CB 4.12Å; F913-A1384 HydrophobicContact CZ-CB 4.34Å; F913-L1415 WeakPolarHBondContact CA-O 3.29Å; F913-L1415 HydrophobicContact CD1-CB 4.13Å; F913-L1415 HydrophobicContact CE1-CB 4.23Å; F913-L1415 HydrophobicContact CE1-CD1 4.42Å
914	A	65	Low	72.3	Confident	6 Å²	6	55 Å²	55	5%	0.05	30%	0.3	C	S	.	.	S	Bend	trans	-36.7	116.5	161.8	0	0	0	0	0	111.2	V1293 K1294 E1320 L1322 L1415	A914-V1293 HydrophobicContact CB-CG2 4.33Å; A914-K1294 PolarHBondContact O-NZ 3.35Å; A914-E1320 WeakPolarHBondContact CA-OE1 3.5Å; A914-E1320 VanDerWaalsContact CB-OE1 3.3Å; A914-E1320 WeakPolarHBondContact CB-OE1 3.42Å; A914-E1320 WeakPolarHBondContact CB-OE2 3.33Å; A914-L1322 HydrophobicContact CB-CD1 3.8Å; A914-L1415 PolarHBondContact N-O 3.43Å
915	S	62.7	Low	70.9	Confident	63 Å²	63	53.3 Å²	53.3	44%	0.441	29%	0.292	S	S	.	.			trans	-74	142.1	-166	-170.5	0	0	0	0	111.3	F913 S917 E1320	F913-S915 PolarHBondContact O-N 3.02Å; F913-S915 VanDerWaalsContact O-N 3.15Å; S915-S917 VanDerWaalsContact CB-O 3.27Å; S915-S917 WeakPolarHBondContact CB-O 3.37Å; S915-S917 PolarHBondContact O-N 3.5Å; S915-S917 PolarHBondContact OG-N 3.01Å; S915-S917 VanDerWaalsContact OG-N 3.16Å; S915-S917 PolarHBondContact OG-O 2.9Å; S915-E1320 PolarHBondContact N-OE1 3.12Å
916	L	55.5	Low	70	Confident	36 Å²	36	53 Å²	53	19%	0.188	29%	0.289	C	S	.	.	S	Bend	trans	-75.2	-7	169.3	-72.8	161.1	0	0	0	112.5	L1215 S1279 A1280 K1287	L916-L1215 HydrophobicContact CB-CD2 4.42Å; L916-L1215 HydrophobicContact CD2-CD2 4.02Å; L916-L1215 VanDerWaalsContact O-CD2 3.28Å; L916-L1215 WeakPolarHBondContact O-CD2 3.48Å; L916-S1279 WeakPolarHBondContact CD1-O 3.49Å; L916-A1280 HydrophobicContact CD2-CB 4.48Å; L916-K1287 HydrophobicContact CD1-CD 4.36Å
917	S	55.9	Low	69.2	Low	54 Å²	54	55.5 Å²	55.5	38%	0.378	30%	0.301	S	S	.	.	S	Bend	trans	-144.6	121.8	168.6	-163	0	0	0	0	110	S915 A919 L1215 P1217	S915-S917 VanDerWaalsContact CB-O 3.27Å; S915-S917 WeakPolarHBondContact CB-O 3.37Å; S915-S917 PolarHBondContact O-N 3.5Å; S915-S917 PolarHBondContact OG-N 3.01Å; S915-S917 VanDerWaalsContact OG-N 3.16Å; S915-S917 PolarHBondContact OG-O 2.9Å; S917-A919 PolarHBondContact O-N 2.84Å; S917-L1215 VanDerWaalsContact CA-O 3.25Å; S917-L1215 WeakPolarHBondContact CA-O 3.46Å; S917-L1215 WeakPolarHBondContact CB-O 3.3Å; S917-L1215 PolarHBondContact OG-O 2.75Å; S917-L1215 VanDerWaalsContact OG-O 3.06Å; S917-P1217 WeakPolarHBondContact OG-CD 3.31Å
918	L	59.8	Low	68.8	Low	11 Å²	11	60.1 Å²	60.1	6%	0.058	31%	0.314	C	S	.	.			trans	-66.3	128.9	172.8	-70.1	169.5	0	0	0	108.1	F1216 P1217 F1218 F1252 F1296 E1320 Y1324	L918-F1216 HydrophobicContact CD1-CD1 4.21Å; L918-F1216 HydrophobicContact CD1-CE1 3.89Å; L918-P1217 VanDerWaalsContact O-CD 3.26Å; L918-P1217 WeakPolarHBondContact O-CD 3.33Å; L918-P1217 WeakPolarHBondContact O-CG 3.47Å; L918-F1218 HydrophobicContact CB-CE1 4.19Å; L918-F1218 HydrophobicContact CD1-CZ 4.18Å; L918-F1252 HydrophobicContact CD1-CE1 3.58Å; L918-F1252 HydrophobicContact CD1-CZ 3.76Å; L918-F1296 HydrophobicContact CD1-CE2 4.47Å; L918-E1320 HydrophobicContact CD2-CG 4.43Å; L918-Y1324 HydrophobicContact CD2-CD1 3.92Å; L918-Y1324 HydrophobicContact CD2-CE1 4.4Å
919	A	56.5	Low	68.1	Low	49 Å²	49	61.8 Å²	61.8	41%	0.405	32%	0.321	S	S	.	.			trans	-62.8	152.1	171.4	0	0	0	0	0	110	S917 E921 Y1324	S917-A919 PolarHBondContact O-N 2.84Å; A919-E921 HydrophobicContact CB-CG 3.94Å; A919-E921 PolarHBondContact O-N 3.32Å; A919-Y1324 WeakPolarHBondContact O-CE1 3.38Å; A919-Y1324 PolarHBondContact O-OH 2.75Å; A919-Y1324 VanDerWaalsContact O-OH 3.09Å
920	D	59.2	Low	67.4	Low	61 Å²	61	61.2 Å²	61.2	33%	0.326	32%	0.318	S	S	.	.			trans	-83.8	60.1	171.8	-169.8	58.4	0	0	0	110.4	Q922 Q1011	D920-Q922 PolarHBondContact O-N 2.84Å; D920-Q922 PolarHBondContact OD2-NE2 3.42Å; D920-Q922 VanDerWaalsContact OD2-NE2 3.11Å; D920-Q1011 PolarHBondContact OD1-NE2 3.07Å; D920-Q1011 VanDerWaalsContact OD2-CD 3.29Å; D920-Q1011 PolarHBondContact OD2-NE2 2.84Å; D920-Q1011 PolarHBondContact OD2-OE1 3.43Å
921	E	55.3	Low	66.8	Low	102 Å²	102	62 Å²	62	48%	0.477	32%	0.318	S	S	.	.			trans	-89.5	105.5	179.3	-75.1	-175	-178.2	0	0	110	A919 Y1324 G1325	A919-E921 HydrophobicContact CB-CG 3.94Å; A919-E921 PolarHBondContact O-N 3.32Å; E921-Y1324 WeakPolarHBondContact CA-OH 3.23Å; E921-Y1324 PolarHBondContact N-OH 3.16Å; E921-Y1324 VanDerWaalsContact N-OH 3.09Å; E921-Y1324 PolarHBondContact O-OH 2.93Å; E921-G1325 WeakPolarHBondContact OE2-CA 3.23Å
922	Q	55.3	Low	66.6	Low	78 Å²	78	64.6 Å²	64.6	36%	0.364	34%	0.337	S	S	.	.			trans	-74.3	142.8	-165.8	-68	157.1	29.1	0	0	112.3	D920 R924 Q1011	D920-Q922 PolarHBondContact O-N 2.84Å; D920-Q922 PolarHBondContact OD2-NE2 3.42Å; D920-Q922 VanDerWaalsContact OD2-NE2 3.11Å; Q922-R924 PolarHBondContact O-N 3.22Å; Q922-Q1011 HydrophobicContact CG-CB 4.48Å; Q922-Q1011 HydrophobicContact CG-CG 3.88Å
923	E	56	Low	66.4	Low	66 Å²	66	66 Å²	66	31%	0.308	34%	0.339	S	S	.	.			trans	-62.1	127.2	171.4	-174	171.6	-175.2	0	0	109.7	V925 R1248 D1249	E923-V925 HydrophobicContact CG-CG2 4.14Å; E923-V925 PolarHBondContact O-N 3.47Å; E923-R1248 WeakPolarHBondContact OE1-CD 3.45Å; E923-R1248 WeakPolarHBondContact OE1-CG 3.32Å; E923-R1248 IonicContact OE1-NE 2.62Å; E923-R1248 VanDerWaalsContact OE2-C 3.3Å; E923-D1249 HydrophobicContact CB-CB 4.1Å; E923-D1249 WeakPolarHBondContact OE2-CA 3.26Å; E923-D1249 WeakPolarHBondContact OE2-CB 3.41Å; E923-D1249 PolarHBondContact OE2-N 2.66Å
924	R	56.8	Low	66.4	Low	210 Å²	210	65.2 Å²	65.2	79%	0.792	34%	0.337	S	S	*	.			trans	-91.8	74.6	178.8	-65.4	-174.4	-174.7	176.8	1.6	110	Q922 T926	Q922-R924 PolarHBondContact O-N 3.22Å; R924-T926 PolarHBondContact O-N 2.93Å
925	V	59.6	Low	67.6	Low	14 Å²	14	70.3 Å²	70.3	9%	0.085	36%	0.36	C	S	.	.			trans	-62	133.9	166.8	-174.4	0	0	0	0	108.2	E923 E929 F930 W1014	E923-V925 HydrophobicContact CG-CG2 4.14Å; E923-V925 PolarHBondContact O-N 3.47Å; V925-E929 HydrophobicContact CG1-CB 3.97Å; V925-F930 HydrophobicContact CG1-CB 4.35Å; V925-W1014 HydrophobicContact CB-CH2 3.82Å; V925-W1014 HydrophobicContact CB-CZ2 3.73Å; V925-W1014 HydrophobicContact CB-CZ3 4.43Å; V925-W1014 HydrophobicContact CG1-CH2 3.57Å; V925-W1014 HydrophobicContact CG1-CZ2 3.76Å; V925-W1014 HydrophobicContact CG1-CZ3 4.44Å; V925-W1014 HydrophobicContact CG2-CH2 4.22Å; V925-W1014 HydrophobicContact CG2-CZ2 3.6Å
926	T	67.1	Low	68.8	Low	63 Å²	63	71.3 Å²	71.3	39%	0.387	36%	0.36	S	S	.	.			trans	-77.8	153.3	-179.2	63.5	0	0	0	0	110.7	R924 E928 E929 F930	R924-T926 PolarHBondContact O-N 2.93Å; T926-E928 PolarHBondContact O-N 3.32Å; T926-E929 PolarHBondContact O-N 3.2Å; T926-E929 WeakPolarHBondContact OG1-CB 3.42Å; T926-E929 WeakPolarHBondContact OG1-CG 3.48Å; T926-E929 PolarHBondContact OG1-N 2.82Å; T926-E929 VanDerWaalsContact OG1-N 3.09Å; T926-F930 WeakPolarHBondContact O-CB 3.41Å; T926-F930 PolarHBondContact O-N 3Å
927	E	71.5	Confident	70.5	Confident	87 Å²	87	69.6 Å²	69.6	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-59.6	-31.2	174.3	-178.7	174	-174.7	0	0	111.5	L931 K1001 F1007	E927-L931 HydrophobicContact CG-CD1 3.76Å; E927-L931 HydrophobicContact CG-CG 4.27Å; E927-L931 WeakPolarHBondContact O-CB 3.25Å; E927-L931 WeakPolarHBondContact O-CD1 3.48Å; E927-L931 WeakPolarHBondContact O-CG 3.26Å; E927-L931 PolarHBondContact O-N 2.96Å; E927-K1001 VanDerWaalsContact OE1-CE 3.24Å; E927-K1001 WeakPolarHBondContact OE1-CE 3.29Å; E927-K1001 IonicContact OE1-NZ 2.72Å; E927-K1001 PolarHBondContact OE1-NZ 3.03Å; E927-F1007 HydrophobicContact CB-CE2 4.38Å; E927-F1007 HydrophobicContact CB-CZ 4.43Å; E927-F1007 HydrophobicContact CG-CE2 4.06Å; E927-F1007 HydrophobicContact CG-CZ 4.02Å
928	E	76.7	Confident	72.2	Confident	167 Å²	167	69.4 Å²	69.4	78%	0.78	34%	0.344	S	S	*	.	H	α-helix	trans	-70.4	-50.6	177.9	-172.2	170.2	-160.6	0	0	112.5	T926 F930 L931 S932	T926-E928 PolarHBondContact O-N 3.32Å; E928-F930 VanDerWaalsContact C-N 3.3Å; E928-F930 PolarHBondContact O-N 2.79Å; E928-L931 PolarHBondContact O-N 3.42Å; E928-S932 PolarHBondContact O-N 3.11Å; E928-S932 VanDerWaalsContact O-N 3.16Å
929	E	74	Confident	73.8	Confident	86 Å²	86	73.9 Å²	73.9	40%	0.402	37%	0.365	S	S	.	.	H	α-helix	trans	-54.6	-49.5	171.8	-81.5	173	-131.8	0	0	110.7	V925 T926 L931 S932 E933 R1248	V925-E929 HydrophobicContact CG1-CB 3.97Å; T926-E929 PolarHBondContact O-N 3.2Å; T926-E929 WeakPolarHBondContact OG1-CB 3.42Å; T926-E929 WeakPolarHBondContact OG1-CG 3.48Å; T926-E929 PolarHBondContact OG1-N 2.82Å; T926-E929 VanDerWaalsContact OG1-N 3.09Å; E929-L931 PolarHBondContact O-N 2.94Å; E929-S932 PolarHBondContact O-N 3.48Å; E929-S932 PolarHBondContact O-OG 3.24Å; E929-E933 PolarHBondContact O-N 3.35Å; E929-R1248 IonicContact OE2-NH2 2.63Å; E929-R1248 PolarHBondContact OE2-NH2 2.78Å
930	F	74.3	Confident	75.6	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.5	-50.5	-177.4	169	-115.1	0	0	0	112.9	V925 T926 E928 S932 E933 V934 V997 F1007 W1014 V1017 L1021	V925-F930 HydrophobicContact CG1-CB 4.35Å; T926-F930 WeakPolarHBondContact O-CB 3.41Å; T926-F930 PolarHBondContact O-N 3Å; E928-F930 VanDerWaalsContact C-N 3.3Å; E928-F930 PolarHBondContact O-N 2.79Å; F930-S932 PolarHBondContact O-N 3.34Å; F930-E933 PolarHBondContact O-N 3.49Å; F930-E933 VanDerWaalsContact O-N 3.14Å; F930-V934 HydrophobicContact CD2-CG2 4.22Å; F930-V934 HydrophobicContact CE1-CG2 4.09Å; F930-V934 HydrophobicContact CE2-CG2 3.38Å; F930-V934 HydrophobicContact CZ-CG2 3.3Å; F930-V934 PolarHBondContact O-N 3.49Å; F930-V997 HydrophobicContact CE1-CB 4.29Å; F930-V997 HydrophobicContact CE1-CG1 3.93Å; F930-V997 HydrophobicContact CE1-CG2 3.38Å; F930-V997 HydrophobicContact CZ-CG2 3.31Å; F930-F1007 AromaticContact CD1-CE1 3.78Å; F930-F1007 HydrophobicContact CD1-CE1 3.78Å; F930-F1007 HydrophobicContact CD1-CZ 4.17Å; F930-F1007 HydrophobicContact CE1-CE1 4.36Å; F930-F1007 HydrophobicContact CG-CE1 4.43Å; F930-W1014 HydrophobicContact CB-CH2 3.77Å; F930-W1014 HydrophobicContact CB-CZ3 3.88Å; F930-W1014 HydrophobicContact CD1-CZ3 4.45Å; F930-W1014 AromaticContact CD2-CH2 3.43Å; F930-W1014 HydrophobicContact CD2-CH2 3.43Å; F930-W1014 VanDerWaalsContact CD2-CH2 3.43Å; F930-W1014 AromaticContact CD2-CZ3 3.49Å; F930-W1014 HydrophobicContact CD2-CZ3 3.49Å; F930-W1014 VanDerWaalsContact CD2-CZ3 3.49Å; F930-W1014 HydrophobicContact CE2-CH2 4.39Å; F930-W1014 HydrophobicContact CE2-CZ3 4.25Å; F930-W1014 AromaticContact CG-CH2 3.8Å; F930-W1014 HydrophobicContact CG-CH2 3.8Å; F930-W1014 AromaticContact CG-CZ3 3.62Å; F930-W1014 HydrophobicContact CG-CZ3 3.62Å; F930-V1017 HydrophobicContact CD2-CG1 3.91Å; F930-V1017 HydrophobicContact CE2-CG1 3.24Å; F930-V1017 HydrophobicContact CZ-CG1 3.9Å; F930-L1021 HydrophobicContact CE2-CD1 4.4Å
931	L	79.9	Confident	77.2	Confident	66 Å²	66	70.3 Å²	70.3	35%	0.346	34%	0.337	S	S	.	.	H	α-helix	trans	-63.3	-32.2	-179	-69.5	169	0	0	0	111.6	E927 E928 E929 V934 E935	E927-L931 HydrophobicContact CG-CD1 3.76Å; E927-L931 HydrophobicContact CG-CG 4.27Å; E927-L931 WeakPolarHBondContact O-CB 3.25Å; E927-L931 WeakPolarHBondContact O-CD1 3.48Å; E927-L931 WeakPolarHBondContact O-CG 3.26Å; E927-L931 PolarHBondContact O-N 2.96Å; E928-L931 PolarHBondContact O-N 3.42Å; E929-L931 PolarHBondContact O-N 2.94Å; L931-V934 PolarHBondContact O-N 3.31Å; L931-E935 PolarHBondContact O-N 2.96Å
932	S	84.7	Confident	79	Confident	70 Å²	70	70.3 Å²	70.3	49%	0.49	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-35.2	175.2	80.4	0	0	0	0	113.2	E928 E929 F930 L936	E928-S932 PolarHBondContact O-N 3.11Å; E928-S932 VanDerWaalsContact O-N 3.16Å; E929-S932 PolarHBondContact O-N 3.48Å; E929-S932 PolarHBondContact O-OG 3.24Å; F930-S932 PolarHBondContact O-N 3.34Å; S932-L936 WeakPolarHBondContact O-CB 3.4Å; S932-L936 PolarHBondContact O-N 2.93Å; S932-L936 VanDerWaalsContact O-N 3.09Å
933	E	83.8	Confident	80.8	Confident	67 Å²	67	71.4 Å²	71.4	31%	0.313	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-37.6	174.7	-69	-168.7	-145.8	0	0	111.4	E929 F930 V937 L1021 R1248	E929-E933 PolarHBondContact O-N 3.35Å; F930-E933 PolarHBondContact O-N 3.49Å; F930-E933 VanDerWaalsContact O-N 3.14Å; E933-V937 WeakPolarHBondContact O-CG2 3.31Å; E933-V937 PolarHBondContact O-N 3.33Å; E933-L1021 HydrophobicContact CB-CD1 4.38Å; E933-R1248 IonicContact OE1-CZ 2.73Å; E933-R1248 IonicContact OE1-NH1 3.91Å; E933-R1248 PolarHBondContact OE1-NH1 2.9Å; E933-R1248 IonicContact OE1-NH2 2.94Å; E933-R1248 PolarHBondContact OE1-NH2 2.96Å
934	V	85	Confident	82.5	Confident	14 Å²	14	68.3 Å²	68.3	9%	0.085	33%	0.328	C	S	.	.	H	α-helix	trans	-66.3	-49.2	174.5	-178	0	0	0	0	111.6	F930 L931 L936 V937 E938 M990 L993 L1021	F930-V934 HydrophobicContact CD2-CG2 4.22Å; F930-V934 HydrophobicContact CE1-CG2 4.09Å; F930-V934 HydrophobicContact CE2-CG2 3.38Å; F930-V934 HydrophobicContact CZ-CG2 3.3Å; F930-V934 PolarHBondContact O-N 3.49Å; L931-V934 PolarHBondContact O-N 3.31Å; V934-L936 VanDerWaalsContact C-N 3.26Å; V934-L936 PolarHBondContact O-N 3.09Å; V934-V937 WeakPolarHBondContact O-CB 3.02Å; V934-V937 PolarHBondContact O-N 3.21Å; V934-E938 PolarHBondContact O-N 3.29Å; V934-E938 VanDerWaalsContact O-N 3.12Å; V934-M990 HydrophobicContact CG1-SD 4.27Å; V934-L993 HydrophobicContact CG1-CD2 4.44Å; V934-L993 HydrophobicContact CG2-CD2 4.41Å; V934-L1021 HydrophobicContact CG2-CD2 4.27Å
935	E	88.9	Confident	84.3	Confident	112 Å²	112	59.1 Å²	59.1	52%	0.523	29%	0.293	S	S	.	.	H	α-helix	trans	-60.3	-39	-179	-162.2	-169.1	145.1	0	0	111.2	L931 V937 E938 Q939	L931-E935 PolarHBondContact O-N 2.96Å; E935-V937 VanDerWaalsContact C-N 3.29Å; E935-V937 PolarHBondContact O-N 3.39Å; E935-E938 PolarHBondContact O-N 3.31Å; E935-Q939 HydrophobicContact CG-CG 4.48Å; E935-Q939 WeakPolarHBondContact O-CB 3.42Å; E935-Q939 VanDerWaalsContact O-CG 3.29Å; E935-Q939 WeakPolarHBondContact O-CG 3.46Å; E935-Q939 PolarHBondContact O-N 3.35Å; E935-Q939 PolarHBondContact OE1-NE2 3.08Å
936	L	89.7	Confident	85.8	Confident	84 Å²	84	63.4 Å²	63.4	44%	0.44	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-31.7	175.9	-177.5	62.3	0	0	0	113.1	S932 V934 K940	S932-L936 WeakPolarHBondContact O-CB 3.4Å; S932-L936 PolarHBondContact O-N 2.93Å; S932-L936 VanDerWaalsContact O-N 3.09Å; V934-L936 VanDerWaalsContact C-N 3.26Å; V934-L936 PolarHBondContact O-N 3.09Å; L936-K940 VanDerWaalsContact O-CG 3.26Å; L936-K940 WeakPolarHBondContact O-CG 3.34Å; L936-K940 PolarHBondContact O-N 3.42Å
937	V	90.7	Very high	87	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-70.9	-44	173.5	173.2	0	0	0	0	110.8	E933 V934 E935 K940 A941 F986 M990 L1021 C1024	E933-V937 WeakPolarHBondContact O-CG2 3.31Å; E933-V937 PolarHBondContact O-N 3.33Å; V934-V937 WeakPolarHBondContact O-CB 3.02Å; V934-V937 PolarHBondContact O-N 3.21Å; E935-V937 VanDerWaalsContact C-N 3.29Å; E935-V937 PolarHBondContact O-N 3.39Å; V937-K940 PolarHBondContact O-N 3.31Å; V937-A941 PolarHBondContact O-N 2.77Å; V937-A941 VanDerWaalsContact O-N 3.11Å; V937-F986 HydrophobicContact CG1-CE2 3.73Å; V937-F986 HydrophobicContact CG1-CZ 3.94Å; V937-M990 HydrophobicContact CB-CE 4.32Å; V937-M990 HydrophobicContact CG1-CE 3.69Å; V937-L1021 HydrophobicContact CG2-CD2 3.77Å; V937-C1024 HydrophobicContact CG1-CB 3.71Å
938	E	91.9	Very high	88	Confident	51 Å²	51	59 Å²	59	24%	0.238	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-46	177.8	-64.9	-175.3	168.6	0	0	111.3	V934 E935 K940 A941 D942 M990 R994	V934-E938 PolarHBondContact O-N 3.29Å; V934-E938 VanDerWaalsContact O-N 3.12Å; E935-E938 PolarHBondContact O-N 3.31Å; E938-K940 VanDerWaalsContact C-N 3.34Å; E938-K940 PolarHBondContact O-N 2.83Å; E938-A941 WeakPolarHBondContact O-CB 3.43Å; E938-A941 PolarHBondContact O-N 3.01Å; E938-A941 VanDerWaalsContact O-N 3.12Å; E938-D942 PolarHBondContact O-N 3.05Å; E938-M990 HydrophobicContact CG-CE 3.77Å; E938-M990 HydrophobicContact CG-SD 4.12Å; E938-M990 VanDerWaalsContact OE1-SD 3.42Å; E938-R994 IonicContact OE1-CZ 3.22Å; E938-R994 IonicContact OE1-NE 2.67Å; E938-R994 PolarHBondContact OE1-NE 3.43Å; E938-R994 IonicContact OE1-NH2 2.81Å; E938-R994 PolarHBondContact OE1-NH2 3.37Å; E938-R994 IonicContact OE2-NH2 2.77Å; E938-R994 PolarHBondContact OE2-NH2 3.31Å
939	Q	93.3	Very high	88.8	Confident	105 Å²	105	55.3 Å²	55.3	49%	0.491	28%	0.276	S	S	.	.	H	α-helix	trans	-58.8	-39	176.2	-70.8	176.2	16.1	0	0	113.2	E935 Y943	E935-Q939 HydrophobicContact CG-CG 4.48Å; E935-Q939 WeakPolarHBondContact O-CB 3.42Å; E935-Q939 VanDerWaalsContact O-CG 3.29Å; E935-Q939 WeakPolarHBondContact O-CG 3.46Å; E935-Q939 PolarHBondContact O-N 3.35Å; E935-Q939 PolarHBondContact OE1-NE2 3.08Å; Q939-Y943 WeakPolarHBondContact O-CB 3.31Å; Q939-Y943 PolarHBondContact O-N 3.28Å; Q939-Y943 VanDerWaalsContact O-N 3.08Å
940	K	92.8	Very high	89.6	Confident	34 Å²	34	57 Å²	57	15%	0.148	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-37.9	175.6	-73.3	173.1	-171.1	171.4	0	112.3	L936 V937 E938 L944 H1025 L1028 P1109 F1110	L936-K940 VanDerWaalsContact O-CG 3.26Å; L936-K940 WeakPolarHBondContact O-CG 3.34Å; L936-K940 PolarHBondContact O-N 3.42Å; V937-K940 PolarHBondContact O-N 3.31Å; E938-K940 VanDerWaalsContact C-N 3.34Å; E938-K940 PolarHBondContact O-N 2.83Å; K940-L944 WeakPolarHBondContact O-CB 3.45Å; K940-L944 PolarHBondContact O-N 3.27Å; K940-L944 VanDerWaalsContact O-N 3.08Å; K940-H1025 PolarHBondContact NZ-NE2 2.84Å; K940-L1028 HydrophobicContact CB-CD1 4.26Å; K940-P1109 HydrophobicContact CB-CB 4.38Å; K940-P1109 HydrophobicContact CG-CB 4.27Å; K940-F1110 HydrophobicContact CD-CD1 4.39Å; K940-F1110 HydrophobicContact CD-CE1 3.79Å
941	A	93.5	Very high	90.4	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-49	177.9	0	0	0	0	0	111.2	V937 E938 Y943 L944 F945 F986 L1028	V937-A941 PolarHBondContact O-N 2.77Å; V937-A941 VanDerWaalsContact O-N 3.11Å; E938-A941 WeakPolarHBondContact O-CB 3.43Å; E938-A941 PolarHBondContact O-N 3.01Å; E938-A941 VanDerWaalsContact O-N 3.12Å; A941-Y943 VanDerWaalsContact C-N 3.31Å; A941-Y943 PolarHBondContact O-N 3.35Å; A941-L944 PolarHBondContact O-N 3.33Å; A941-L944 VanDerWaalsContact O-N 3.11Å; A941-F945 HydrophobicContact CB-CD2 4.25Å; A941-F945 HydrophobicContact CB-CE2 3.82Å; A941-F945 WeakPolarHBondContact O-CD2 3.4Å; A941-F945 WeakPolarHBondContact O-CG 3.3Å; A941-F945 PolarHBondContact O-N 2.93Å; A941-F986 HydrophobicContact CB-CD1 4.02Å; A941-F986 HydrophobicContact CB-CD2 4.27Å; A941-F986 HydrophobicContact CB-CE1 3.44Å; A941-F986 VanDerWaalsContact CB-CE1 3.44Å; A941-F986 HydrophobicContact CB-CE2 3.71Å; A941-F986 HydrophobicContact CB-CG 4.4Å; A941-F986 HydrophobicContact CB-CZ 3.26Å; A941-L1028 HydrophobicContact CB-CD1 3.96Å; A941-L1028 HydrophobicContact CB-CD2 3.76Å; A941-L1028 HydrophobicContact CB-CG 4.48Å
942	D	93	Very high	90.9	Very high	101 Å²	101	55.1 Å²	55.1	54%	0.54	27%	0.274	S	S	.	.	H	α-helix	trans	-58.1	-42.8	175.9	-82.3	-12	0	0	0	111.6	E938 N946	E938-D942 PolarHBondContact O-N 3.05Å; D942-N946 VanDerWaalsContact O-CB 3.3Å; D942-N946 WeakPolarHBondContact O-CB 3.42Å; D942-N946 PolarHBondContact O-N 3.29Å; D942-N946 VanDerWaalsContact O-N 3.12Å; D942-N946 PolarHBondContact O-ND2 3.25Å
943	Y	93	Very high	91.1	Very high	101 Å²	101	54.5 Å²	54.5	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-56.9	-51.6	173.1	175.1	-92.6	0	0	0	111.6	Q939 A941 Q947 P1109	Q939-Y943 WeakPolarHBondContact O-CB 3.31Å; Q939-Y943 PolarHBondContact O-N 3.28Å; Q939-Y943 VanDerWaalsContact O-N 3.08Å; A941-Y943 VanDerWaalsContact C-N 3.31Å; A941-Y943 PolarHBondContact O-N 3.35Å; Y943-Q947 HydrophobicContact CE1-CG 4.13Å; Y943-Q947 HydrophobicContact CE2-CG 4.39Å; Y943-Q947 WeakPolarHBondContact O-CG 3.46Å; Y943-Q947 PolarHBondContact O-N 3.06Å; Y943-Q947 VanDerWaalsContact O-N 3.15Å; Y943-P1109 HydrophobicContact CD1-CB 4.34Å
944	L	92.5	Very high	91.3	Very high	2 Å²	2	55 Å²	55	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-49.6	-174.6	-173.9	67	0	0	0	112.1	K940 A941 N946 Q947 M948 L1028 M1032 L1106	K940-L944 WeakPolarHBondContact O-CB 3.45Å; K940-L944 PolarHBondContact O-N 3.27Å; K940-L944 VanDerWaalsContact O-N 3.08Å; A941-L944 PolarHBondContact O-N 3.33Å; A941-L944 VanDerWaalsContact O-N 3.11Å; L944-N946 VanDerWaalsContact C-N 3.35Å; L944-N946 PolarHBondContact O-N 2.93Å; L944-Q947 PolarHBondContact O-N 3.22Å; L944-M948 HydrophobicContact CG-SD 4.17Å; L944-M948 WeakPolarHBondContact O-CG 3.4Å; L944-M948 PolarHBondContact O-N 2.82Å; L944-L1028 HydrophobicContact CD2-CB 4.03Å; L944-L1028 HydrophobicContact CD2-CD2 4.08Å; L944-L1028 WeakPolarHBondContact CD2-O 3.49Å; L944-M1032 HydrophobicContact CD1-CB 4.12Å; L944-M1032 HydrophobicContact CD1-CG 3.99Å; L944-M1032 HydrophobicContact CD1-SD 4.08Å; L944-M1032 HydrophobicContact CD2-CB 4.16Å; L944-L1106 HydrophobicContact CD1-CB 4.44Å; L944-L1106 HydrophobicContact CD1-CD1 3.96Å
945	F	93.9	Very high	91.3	Very high	16 Å²	16	54.3 Å²	54.3	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-64	-38.3	-179.2	-60.3	-41.1	0	0	0	112.1	A941 Q947 M948 L949 A982 Q983 F986 L1028	A941-F945 HydrophobicContact CB-CD2 4.25Å; A941-F945 HydrophobicContact CB-CE2 3.82Å; A941-F945 WeakPolarHBondContact O-CD2 3.4Å; A941-F945 WeakPolarHBondContact O-CG 3.3Å; A941-F945 PolarHBondContact O-N 2.93Å; F945-Q947 PolarHBondContact O-N 2.72Å; F945-M948 HydrophobicContact CD1-SD 3.99Å; F945-M948 PolarHBondContact O-N 2.83Å; F945-L949 WeakPolarHBondContact O-CG 3.12Å; F945-L949 PolarHBondContact O-N 2.89Å; F945-A982 HydrophobicContact CE1-CB 3.9Å; F945-Q983 HydrophobicContact CE1-CB 4.37Å; F945-Q983 HydrophobicContact CE2-CG 4.43Å; F945-Q983 HydrophobicContact CZ-CB 4.38Å; F945-F986 HydrophobicContact CE2-CB 4.37Å; F945-F986 AromaticContact CE2-CD1 3.96Å; F945-F986 HydrophobicContact CE2-CD1 3.96Å; F945-F986 HydrophobicContact CE2-CG 4.22Å; F945-F986 HydrophobicContact CZ-CB 3.91Å; F945-F986 HydrophobicContact CZ-CD1 4.33Å; F945-F986 HydrophobicContact CZ-CG 4.13Å; F945-L1028 HydrophobicContact CE1-CD2 4.25Å; F945-L1028 HydrophobicContact CE2-CD2 4.34Å; F945-L1028 HydrophobicContact CZ-CD2 3.78Å
946	N	92.2	Very high	91.2	Very high	104 Å²	104	51.7 Å²	51.7	56%	0.556	26%	0.264	S	S	*	.	H	α-helix	trans	-64.8	-36.6	174.4	-81.2	-71.4	0	0	0	112.6	D942 L944 K950	D942-N946 VanDerWaalsContact O-CB 3.3Å; D942-N946 WeakPolarHBondContact O-CB 3.42Å; D942-N946 PolarHBondContact O-N 3.29Å; D942-N946 VanDerWaalsContact O-N 3.12Å; D942-N946 PolarHBondContact O-ND2 3.25Å; L944-N946 VanDerWaalsContact C-N 3.35Å; L944-N946 PolarHBondContact O-N 2.93Å; N946-K950 WeakPolarHBondContact O-CB 3.38Å; N946-K950 PolarHBondContact O-N 2.97Å
947	Q	91	Very high	90.9	Very high	59 Å²	59	50.6 Å²	50.6	28%	0.276	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-39	173.6	-61.7	-65.4	-0.6	0	0	111.9	Y943 L944 F945 S951 L1106	Y943-Q947 HydrophobicContact CE1-CG 4.13Å; Y943-Q947 HydrophobicContact CE2-CG 4.39Å; Y943-Q947 WeakPolarHBondContact O-CG 3.46Å; Y943-Q947 PolarHBondContact O-N 3.06Å; Y943-Q947 VanDerWaalsContact O-N 3.15Å; L944-Q947 PolarHBondContact O-N 3.22Å; F945-Q947 PolarHBondContact O-N 2.72Å; Q947-S951 VanDerWaalsContact O-CB 3.29Å; Q947-S951 WeakPolarHBondContact O-CB 3.5Å; Q947-S951 PolarHBondContact O-N 2.88Å; Q947-S951 PolarHBondContact O-OG 3.38Å; Q947-L1106 HydrophobicContact CB-CD2 3.81Å
948	M	93.2	Very high	90.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-54.6	174.6	-70.2	168.5	93.8	0	0	111.3	L944 F945 K950 S951 V952 V978 H979 W1035 L1106	L944-M948 HydrophobicContact CG-SD 4.17Å; L944-M948 WeakPolarHBondContact O-CG 3.4Å; L944-M948 PolarHBondContact O-N 2.82Å; F945-M948 HydrophobicContact CD1-SD 3.99Å; F945-M948 PolarHBondContact O-N 2.83Å; M948-K950 VanDerWaalsContact C-N 3.35Å; M948-K950 PolarHBondContact O-N 3.1Å; M948-S951 WeakPolarHBondContact O-CB 3.38Å; M948-S951 PolarHBondContact O-N 2.82Å; M948-S951 VanDerWaalsContact O-N 3.12Å; M948-V952 WeakPolarHBondContact O-CG2 3.46Å; M948-V952 PolarHBondContact O-N 2.85Å; M948-V978 HydrophobicContact CE-CG1 4.12Å; M948-H979 HydrophobicContact CE-CB 4.03Å; M948-W1035 HydrophobicContact CB-CE3 4.36Å; M948-W1035 HydrophobicContact CB-CH2 3.9Å; M948-W1035 HydrophobicContact CB-CZ2 4.47Å; M948-W1035 HydrophobicContact CB-CZ3 3.83Å; M948-W1035 HydrophobicContact CE-CD2 4.11Å; M948-W1035 HydrophobicContact CE-CE3 3.38Å; M948-W1035 HydrophobicContact CE-CZ3 3.9Å; M948-W1035 HydrophobicContact CG-CD2 4.27Å; M948-W1035 HydrophobicContact CG-CE3 4.01Å; M948-W1035 HydrophobicContact CG-CH2 4.3Å; M948-W1035 HydrophobicContact CG-CZ3 4.01Å; M948-W1035 WeakPolarHBondContact O-CH2 3.15Å; M948-L1106 HydrophobicContact CG-CD1 3.58Å; M948-L1106 HydrophobicContact CG-CD2 4.12Å; M948-L1106 HydrophobicContact SD-CD1 4.33Å
949	L	92.9	Very high	89.3	Confident	88 Å²	88	52.9 Å²	52.9	46%	0.461	28%	0.281	S	S	.	.	H	α-helix	trans	-58.5	-44.4	179.1	-71.8	171.3	0	0	0	112.5	F945 S951 V952 A953	F945-L949 WeakPolarHBondContact O-CG 3.12Å; F945-L949 PolarHBondContact O-N 2.89Å; L949-S951 VanDerWaalsContact C-N 3.32Å; L949-S951 PolarHBondContact O-N 2.87Å; L949-V952 PolarHBondContact O-N 2.96Å; L949-A953 PolarHBondContact O-N 3.03Å
950	K	91.7	Very high	88.1	Confident	121 Å²	121	56 Å²	56	53%	0.526	30%	0.295	S	S	.	.	H	α-helix	trans	-60.8	-40.3	175.7	-178	-176.7	175.1	-169.4	0	112.1	N946 M948 A953 I954	N946-K950 WeakPolarHBondContact O-CB 3.38Å; N946-K950 PolarHBondContact O-N 2.97Å; M948-K950 VanDerWaalsContact C-N 3.35Å; M948-K950 PolarHBondContact O-N 3.1Å; K950-A953 PolarHBondContact O-N 3.13Å; K950-I954 HydrophobicContact CG-CD1 4.05Å; K950-I954 VanDerWaalsContact O-CG1 3.29Å; K950-I954 WeakPolarHBondContact O-CG1 3.32Å; K950-I954 PolarHBondContact O-N 2.73Å
951	S	91.2	Very high	86.8	Confident	14 Å²	14	59.8 Å²	59.8	10%	0.098	32%	0.321	C	S	.	.	H	α-helix	trans	-67	-41.6	176.8	-71	0	0	0	0	112.5	Q947 M948 L949 A953 I954 I955	Q947-S951 VanDerWaalsContact O-CB 3.29Å; Q947-S951 WeakPolarHBondContact O-CB 3.5Å; Q947-S951 PolarHBondContact O-N 2.88Å; Q947-S951 PolarHBondContact O-OG 3.38Å; M948-S951 WeakPolarHBondContact O-CB 3.38Å; M948-S951 PolarHBondContact O-N 2.82Å; M948-S951 VanDerWaalsContact O-N 3.12Å; L949-S951 VanDerWaalsContact C-N 3.32Å; L949-S951 PolarHBondContact O-N 2.87Å; S951-A953 VanDerWaalsContact C-N 3.34Å; S951-A953 PolarHBondContact O-N 2.97Å; S951-I954 PolarHBondContact O-N 2.63Å; S951-I955 WeakPolarHBondContact O-CG1 3.42Å; S951-I955 PolarHBondContact O-N 3.43Å; S951-I955 VanDerWaalsContact O-N 3.09Å
952	V	90.4	Very high	85.5	Confident	13 Å²	13	61 Å²	61	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-57.9	-49.4	171.2	-176	0	0	0	0	110.1	M948 L949 I954 I955 V956 V972 Q976 W1035	M948-V952 WeakPolarHBondContact O-CG2 3.46Å; M948-V952 PolarHBondContact O-N 2.85Å; L949-V952 PolarHBondContact O-N 2.96Å; V952-I954 VanDerWaalsContact C-N 3.3Å; V952-I954 PolarHBondContact O-N 2.61Å; V952-I955 PolarHBondContact O-N 3.45Å; V952-I955 VanDerWaalsContact O-N 3.14Å; V952-V956 HydrophobicContact CG1-CG2 3.98Å; V952-V956 WeakPolarHBondContact O-CG2 3.49Å; V952-V956 PolarHBondContact O-N 2.93Å; V952-V972 HydrophobicContact CG1-CG1 4.02Å; V952-Q976 HydrophobicContact CG1-CG 3.99Å; V952-Q976 HydrophobicContact CG2-CG 4.29Å; V952-W1035 HydrophobicContact CG2-CH2 3.68Å; V952-W1035 HydrophobicContact CG2-CZ3 4.28Å
953	A	89.2	Confident	84.2	Confident	58 Å²	58	58.6 Å²	58.6	48%	0.479	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-38.5	-177.8	0	0	0	0	0	112.7	L949 K950 S951 A957	L949-A953 PolarHBondContact O-N 3.03Å; K950-A953 PolarHBondContact O-N 3.13Å; S951-A953 VanDerWaalsContact C-N 3.34Å; S951-A953 PolarHBondContact O-N 2.97Å; A953-A957 VanDerWaalsContact O-CB 3.24Å; A953-A957 WeakPolarHBondContact O-CB 3.38Å; A953-A957 PolarHBondContact O-N 2.89Å
954	I	86.9	Confident	83	Confident	77 Å²	77	53.9 Å²	53.9	40%	0.395	31%	0.309	S	S	.	.	H	α-helix	trans	-66.9	-41.3	175.9	-70.4	165.9	0	0	0	111.8	K950 S951 V952 Q958 V1100	K950-I954 HydrophobicContact CG-CD1 4.05Å; K950-I954 VanDerWaalsContact O-CG1 3.29Å; K950-I954 WeakPolarHBondContact O-CG1 3.32Å; K950-I954 PolarHBondContact O-N 2.73Å; S951-I954 PolarHBondContact O-N 2.63Å; V952-I954 VanDerWaalsContact C-N 3.3Å; V952-I954 PolarHBondContact O-N 2.61Å; I954-Q958 WeakPolarHBondContact O-CG 3.24Å; I954-Q958 PolarHBondContact O-N 3.15Å; I954-V1100 HydrophobicContact CG2-CG1 4.13Å
955	I	86.6	Confident	82	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-45.2	177.5	-66.5	167.3	0	0	0	110.5	S951 V952 Q958 C959 I968 V972 L975 M1097 V1101 A1104	S951-I955 WeakPolarHBondContact O-CG1 3.42Å; S951-I955 PolarHBondContact O-N 3.43Å; S951-I955 VanDerWaalsContact O-N 3.09Å; V952-I955 PolarHBondContact O-N 3.45Å; V952-I955 VanDerWaalsContact O-N 3.14Å; I955-Q958 PolarHBondContact O-N 3.1Å; I955-C959 WeakPolarHBondContact O-CB 3.23Å; I955-C959 PolarHBondContact O-N 3.14Å; I955-I968 HydrophobicContact CG2-CG2 3.64Å; I955-V972 HydrophobicContact CB-CG2 4.41Å; I955-V972 HydrophobicContact CG2-CG2 3.67Å; I955-L975 HydrophobicContact CD1-CD1 3.84Å; I955-M1097 HydrophobicContact CG2-CE 4.31Å; I955-V1101 HydrophobicContact CD1-CG2 4.23Å; I955-V1101 HydrophobicContact CG1-CG2 4.31Å; I955-A1104 HydrophobicContact CD1-CB 3.8Å; I955-A1104 HydrophobicContact CG1-CB 4.43Å
956	V	86.5	Confident	81.2	Confident	56 Å²	56	61.7 Å²	61.7	34%	0.339	36%	0.355	S	S	.	.	H	α-helix	trans	-63.5	-49.1	179.4	171.8	0	0	0	0	111.5	V952 Q958 C959 E960 V972	V952-V956 HydrophobicContact CG1-CG2 3.98Å; V952-V956 WeakPolarHBondContact O-CG2 3.49Å; V952-V956 PolarHBondContact O-N 2.93Å; V956-Q958 PolarHBondContact O-N 3.16Å; V956-Q958 VanDerWaalsContact O-N 3.12Å; V956-C959 VanDerWaalsContact O-CB 3.24Å; V956-C959 WeakPolarHBondContact O-CB 3.5Å; V956-C959 PolarHBondContact O-N 3.5Å; V956-E960 PolarHBondContact O-N 2.97Å; V956-V972 HydrophobicContact CG2-CB 4.44Å; V956-V972 HydrophobicContact CG2-CG1 3.76Å; V956-V972 HydrophobicContact CG2-CG2 3.78Å
957	A	82.9	Confident	80.4	Confident	62 Å²	62	59.3 Å²	59.3	51%	0.512	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-20.4	-178.4	0	0	0	0	0	114	A953	A953-A957 VanDerWaalsContact O-CB 3.24Å; A953-A957 WeakPolarHBondContact O-CB 3.38Å; A953-A957 PolarHBondContact O-N 2.89Å
958	Q	76.6	Confident	79.8	Confident	76 Å²	76	56.5 Å²	56.5	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-95	-25.4	173.4	-65.6	-175.5	52.3	0	0	112.6	I954 I955 V956 E960 T961 M1097	I954-Q958 WeakPolarHBondContact O-CG 3.24Å; I954-Q958 PolarHBondContact O-N 3.15Å; I955-Q958 PolarHBondContact O-N 3.1Å; V956-Q958 PolarHBondContact O-N 3.16Å; V956-Q958 VanDerWaalsContact O-N 3.12Å; Q958-E960 PolarHBondContact O-N 3.19Å; Q958-T961 PolarHBondContact O-N 2.94Å; Q958-T961 VanDerWaalsContact O-N 3.09Å; Q958-T961 PolarHBondContact O-OG1 2.91Å; Q958-M1097 HydrophobicContact CB-CE 4.29Å; Q958-M1097 HydrophobicContact CB-SD 3.91Å
959	C	72	Confident	79.3	Confident	23 Å²	23	58.8 Å²	58.8	16%	0.155	35%	0.346	C	S	.	.	H	α-helix	trans	-56.4	-33.9	172.7	-171.2	0	0	0	0	113.4	I955 V956 T961 V962 I968	I955-C959 WeakPolarHBondContact O-CB 3.23Å; I955-C959 PolarHBondContact O-N 3.14Å; V956-C959 VanDerWaalsContact O-CB 3.24Å; V956-C959 WeakPolarHBondContact O-CB 3.5Å; V956-C959 PolarHBondContact O-N 3.5Å; C959-T961 PolarHBondContact O-N 3.3Å; C959-T961 VanDerWaalsContact O-N 3.07Å; C959-V962 PolarHBondContact O-N 3.49Å; C959-I968 HydrophobicContact CB-CB 4.4Å; C959-I968 HydrophobicContact CB-CD1 4.44Å; C959-I968 HydrophobicContact CB-CG2 3.75Å
960	E	67.4	Low	79	Confident	171 Å²	171	58.5 Å²	58.5	80%	0.799	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.3	178.1	-63	-174.5	162.7	0	0	113.6	V956 Q958	V956-E960 PolarHBondContact O-N 2.97Å; Q958-E960 PolarHBondContact O-N 3.19Å
961	T	66	Low	78.8	Confident	113 Å²	113	52.9 Å²	52.9	69%	0.693	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	5.3	-173.6	67.5	0	0	0	0	115.5	Q958 C959	Q958-T961 PolarHBondContact O-N 2.94Å; Q958-T961 VanDerWaalsContact O-N 3.09Å; Q958-T961 PolarHBondContact O-OG1 2.91Å; C959-T961 PolarHBondContact O-N 3.3Å; C959-T961 VanDerWaalsContact O-N 3.07Å
962	V	66.7	Low	78.7	Confident	25 Å²	25	52.9 Å²	52.9	15%	0.152	32%	0.32	C	S	.	.	S	Bend	trans	-138.3	143.3	-172.1	-71.9	0	0	0	0	113.3	C959 C964 I968 E1093 M1097	C959-V962 PolarHBondContact O-N 3.49Å; V962-C964 PolarHBondContact O-N 3.5Å; V962-I968 HydrophobicContact CG2-CD1 3.55Å; V962-E1093 HydrophobicContact CB-CB 4.29Å; V962-E1093 HydrophobicContact CG1-CB 4Å; V962-E1093 HydrophobicContact CG1-CG 4.12Å; V962-M1097 HydrophobicContact CG1-CG 4.39Å; V962-M1097 HydrophobicContact CG2-CG 3.92Å; V962-M1097 HydrophobicContact CG2-SD 4.2Å
963	G	65.5	Low	78.7	Confident	52 Å²	52	55.8 Å²	55.8	54%	0.536	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	9	-177.4	0	0	0	0	0	115.7	E1093	G963-E1093 PolarHBondContact N-OE2 2.96Å
964	C	68.1	Low	78.8	Confident	1 Å²	1	58 Å²	58	1%	0.007	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	24.3	-179.4	-64.6	0	0	0	0	113.1	V962 Q966 Q967 I968 L1094	V962-C964 PolarHBondContact O-N 3.5Å; C964-Q966 VanDerWaalsContact C-N 3.32Å; C964-Q966 PolarHBondContact O-N 2.96Å; C964-Q967 PolarHBondContact O-N 2.77Å; C964-Q967 PolarHBondContact O-OE1 2.9Å; C964-I968 HydrophobicContact CB-CD1 4.13Å; C964-I968 WeakPolarHBondContact O-CG1 3.48Å; C964-I968 PolarHBondContact O-N 2.7Å; C964-L1094 HydrophobicContact CB-CD1 4.26Å
965	A	70.6	Confident	79.1	Confident	50 Å²	50	54.4 Å²	54.4	41%	0.413	32%	0.323	S	S	.	.	H	α-helix	trans	-53.2	-40.3	-168.2	0	0	0	0	0	114.6	I968 A969	A965-I968 PolarHBondContact O-N 2.75Å; A965-A969 VanDerWaalsContact O-CB 3.31Å; A965-A969 WeakPolarHBondContact O-CB 3.44Å; A965-A969 PolarHBondContact O-N 2.87Å
966	Q	76.7	Confident	79.4	Confident	132 Å²	132	58.4 Å²	58.4	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-65.6	-42.4	-178.3	-173.1	64.1	70.9	0	0	112.8	C964 I968 A969 N970	C964-Q966 VanDerWaalsContact C-N 3.32Å; C964-Q966 PolarHBondContact O-N 2.96Å; Q966-I968 VanDerWaalsContact C-N 3.26Å; Q966-I968 PolarHBondContact O-N 2.9Å; Q966-A969 PolarHBondContact O-N 3.18Å; Q966-N970 PolarHBondContact NE2-OD1 2.87Å; Q966-N970 PolarHBondContact O-N 3.06Å; Q966-N970 VanDerWaalsContact O-N 3.1Å; Q966-N970 PolarHBondContact O-OD1 3.04Å
967	Q	76	Confident	79.8	Confident	54 Å²	54	59.1 Å²	59.1	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-67.3	-30.7	178.9	-67.8	81.8	-1	0	0	111.7	C964 L971	C964-Q967 PolarHBondContact O-N 2.77Å; C964-Q967 PolarHBondContact O-OE1 2.9Å; Q967-L971 PolarHBondContact O-N 2.72Å
968	I	79.8	Confident	80.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-79.4	-38.7	177.7	-57.1	158.2	0	0	0	110.5	I955 C959 V962 C964 A965 Q966 N970 L971 V972 M1097	I955-I968 HydrophobicContact CG2-CG2 3.64Å; C959-I968 HydrophobicContact CB-CB 4.4Å; C959-I968 HydrophobicContact CB-CD1 4.44Å; C959-I968 HydrophobicContact CB-CG2 3.75Å; V962-I968 HydrophobicContact CG2-CD1 3.55Å; C964-I968 HydrophobicContact CB-CD1 4.13Å; C964-I968 WeakPolarHBondContact O-CG1 3.48Å; C964-I968 PolarHBondContact O-N 2.7Å; A965-I968 PolarHBondContact O-N 2.75Å; Q966-I968 VanDerWaalsContact C-N 3.26Å; Q966-I968 PolarHBondContact O-N 2.9Å; I968-N970 VanDerWaalsContact C-N 3.33Å; I968-N970 PolarHBondContact O-N 3.41Å; I968-L971 WeakPolarHBondContact O-CB 3.32Å; I968-L971 PolarHBondContact O-N 2.95Å; I968-V972 HydrophobicContact CG2-CG2 4.35Å; I968-V972 WeakPolarHBondContact O-CB 3.2Å; I968-V972 WeakPolarHBondContact O-CG2 3.14Å; I968-V972 PolarHBondContact O-N 2.94Å; I968-M1097 HydrophobicContact CD1-CE 4.09Å; I968-M1097 HydrophobicContact CD1-CG 3.9Å; I968-M1097 HydrophobicContact CD1-SD 4.46Å; I968-M1097 HydrophobicContact CG1-CE 4.44Å; I968-M1097 HydrophobicContact CG2-CE 4.24Å
969	A	82.4	Confident	81	Confident	48 Å²	48	54 Å²	54	40%	0.397	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-40.2	174.7	0	0	0	0	0	112.2	A965 Q966 V972 S973	A965-A969 VanDerWaalsContact O-CB 3.31Å; A965-A969 WeakPolarHBondContact O-CB 3.44Å; A965-A969 PolarHBondContact O-N 2.87Å; Q966-A969 PolarHBondContact O-N 3.18Å; A969-V972 PolarHBondContact O-N 2.94Å; A969-S973 PolarHBondContact O-N 2.96Å
970	N	85.5	Confident	81.9	Confident	83 Å²	83	58.1 Å²	58.1	44%	0.444	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-50.3	173.5	-70.5	24	0	0	0	111.4	Q966 I968 V972 S973 E974	Q966-N970 PolarHBondContact NE2-OD1 2.87Å; Q966-N970 PolarHBondContact O-N 3.06Å; Q966-N970 VanDerWaalsContact O-N 3.1Å; Q966-N970 PolarHBondContact O-OD1 3.04Å; I968-N970 VanDerWaalsContact C-N 3.33Å; I968-N970 PolarHBondContact O-N 3.41Å; N970-V972 VanDerWaalsContact C-N 3.33Å; N970-V972 PolarHBondContact O-N 2.85Å; N970-S973 WeakPolarHBondContact O-CB 3.36Å; N970-S973 PolarHBondContact O-N 3.35Å; N970-S973 VanDerWaalsContact O-N 3.17Å; N970-E974 PolarHBondContact O-N 3.34Å
971	L	87.5	Confident	83.1	Confident	3 Å²	3	52 Å²	52	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-56.4	-46.3	175.7	172.8	69.8	0	0	0	111.8	Q967 I968 S973 E974 L975 I1038 F1042 V1101	Q967-L971 PolarHBondContact O-N 2.72Å; I968-L971 WeakPolarHBondContact O-CB 3.32Å; I968-L971 PolarHBondContact O-N 2.95Å; L971-S973 VanDerWaalsContact C-N 3.31Å; L971-S973 PolarHBondContact O-N 2.91Å; L971-E974 PolarHBondContact O-N 3.12Å; L971-L975 HydrophobicContact CD1-CD1 3.93Å; L971-L975 HydrophobicContact CD1-CG 4.01Å; L971-L975 HydrophobicContact CD2-CD1 4.42Å; L971-L975 HydrophobicContact CG-CD1 3.9Å; L971-L975 HydrophobicContact CG-CG 4.31Å; L971-L975 WeakPolarHBondContact O-CB 3.22Å; L971-L975 WeakPolarHBondContact O-CG 3.46Å; L971-L975 PolarHBondContact O-N 3.35Å; L971-I1038 HydrophobicContact CD1-CG2 3.66Å; L971-F1042 HydrophobicContact CB-CD2 3.91Å; L971-F1042 HydrophobicContact CB-CE2 3.88Å; L971-F1042 HydrophobicContact CD1-CB 4.03Å; L971-F1042 HydrophobicContact CD1-CD2 3.91Å; L971-F1042 HydrophobicContact CD1-CG 4.08Å; L971-F1042 HydrophobicContact CD2-CB 4.49Å; L971-F1042 HydrophobicContact CD2-CD1 4Å; L971-F1042 HydrophobicContact CD2-CD2 3.74Å; L971-F1042 HydrophobicContact CD2-CE1 4.11Å; L971-F1042 HydrophobicContact CD2-CE2 3.84Å; L971-F1042 HydrophobicContact CD2-CG 3.82Å; L971-F1042 HydrophobicContact CD2-CZ 4.02Å; L971-F1042 HydrophobicContact CG-CD2 4.05Å; L971-F1042 HydrophobicContact CG-CE2 4.32Å; L971-F1042 HydrophobicContact CG-CG 4.42Å; L971-V1101 HydrophobicContact CD2-CB 4.32Å; L971-V1101 HydrophobicContact CD2-CG1 3.78Å; L971-V1101 HydrophobicContact CD2-CG2 3.5Å
972	V	89.2	Confident	84.1	Confident	14 Å²	14	46.8 Å²	46.8	9%	0.085	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-43	178.4	163.5	0	0	0	0	110.7	V952 I955 V956 I968 A969 N970 E974 L975 Q976	V952-V972 HydrophobicContact CG1-CG1 4.02Å; I955-V972 HydrophobicContact CB-CG2 4.41Å; I955-V972 HydrophobicContact CG2-CG2 3.67Å; V956-V972 HydrophobicContact CG2-CB 4.44Å; V956-V972 HydrophobicContact CG2-CG1 3.76Å; V956-V972 HydrophobicContact CG2-CG2 3.78Å; I968-V972 HydrophobicContact CG2-CG2 4.35Å; I968-V972 WeakPolarHBondContact O-CB 3.2Å; I968-V972 WeakPolarHBondContact O-CG2 3.14Å; I968-V972 PolarHBondContact O-N 2.94Å; A969-V972 PolarHBondContact O-N 2.94Å; N970-V972 VanDerWaalsContact C-N 3.33Å; N970-V972 PolarHBondContact O-N 2.85Å; V972-E974 PolarHBondContact O-N 3.02Å; V972-L975 PolarHBondContact O-N 2.62Å; V972-Q976 HydrophobicContact CG1-CG 4.32Å; V972-Q976 VanDerWaalsContact O-CB 3.28Å; V972-Q976 WeakPolarHBondContact O-CB 3.49Å; V972-Q976 WeakPolarHBondContact O-CG 3.48Å; V972-Q976 PolarHBondContact O-N 3.15Å
973	S	89.8	Confident	85.3	Confident	74 Å²	74	49.8 Å²	49.8	52%	0.517	29%	0.29	S	S	.	.	H	α-helix	trans	-64.9	-37.5	177.1	-169.6	0	0	0	0	112.9	A969 N970 L971 S977	A969-S973 PolarHBondContact O-N 2.96Å; N970-S973 WeakPolarHBondContact O-CB 3.36Å; N970-S973 PolarHBondContact O-N 3.35Å; N970-S973 VanDerWaalsContact O-N 3.17Å; L971-S973 VanDerWaalsContact C-N 3.31Å; L971-S973 PolarHBondContact O-N 2.91Å; S973-S977 WeakPolarHBondContact O-CB 3.43Å; S973-S977 PolarHBondContact O-N 2.99Å
974	E	91.7	Very high	86.6	Confident	104 Å²	104	54 Å²	54	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-67.7	-47.4	175.9	-72.3	169.7	-158.3	0	0	111.3	N970 L971 V972 Q976 S977 V978 I1038	N970-E974 PolarHBondContact O-N 3.34Å; L971-E974 PolarHBondContact O-N 3.12Å; V972-E974 PolarHBondContact O-N 3.02Å; E974-Q976 PolarHBondContact O-N 2.84Å; E974-S977 WeakPolarHBondContact O-CB 3.18Å; E974-S977 PolarHBondContact O-N 2.93Å; E974-V978 PolarHBondContact O-N 3.29Å; E974-I1038 HydrophobicContact CB-CG2 4.43Å
975	L	93.8	Very high	87.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-63.9	-40.3	177.4	-66.9	178.3	0	0	0	112.3	I955 L971 V972 V978 H979 W1035 I1038 V1039	I955-L975 HydrophobicContact CD1-CD1 3.84Å; L971-L975 HydrophobicContact CD1-CD1 3.93Å; L971-L975 HydrophobicContact CD1-CG 4.01Å; L971-L975 HydrophobicContact CD2-CD1 4.42Å; L971-L975 HydrophobicContact CG-CD1 3.9Å; L971-L975 HydrophobicContact CG-CG 4.31Å; L971-L975 WeakPolarHBondContact O-CB 3.22Å; L971-L975 WeakPolarHBondContact O-CG 3.46Å; L971-L975 PolarHBondContact O-N 3.35Å; V972-L975 PolarHBondContact O-N 2.62Å; L975-V978 PolarHBondContact O-N 3.29Å; L975-H979 PolarHBondContact O-N 2.81Å; L975-W1035 HydrophobicContact CB-CE3 4.14Å; L975-W1035 HydrophobicContact CB-CH2 3.93Å; L975-W1035 HydrophobicContact CB-CZ3 3.73Å; L975-W1035 HydrophobicContact CD1-CH2 4.38Å; L975-W1035 HydrophobicContact CD1-CZ2 4.23Å; L975-W1035 HydrophobicContact CD2-CD2 3.75Å; L975-W1035 HydrophobicContact CD2-CE3 3.89Å; L975-W1035 HydrophobicContact CD2-CG 4.19Å; L975-W1035 HydrophobicContact CD2-CH2 4.45Å; L975-W1035 HydrophobicContact CD2-CZ2 4.3Å; L975-W1035 HydrophobicContact CD2-CZ3 4.26Å; L975-W1035 HydrophobicContact CG-CH2 4.49Å; L975-W1035 HydrophobicContact CG-CZ3 4.48Å; L975-W1035 VanDerWaalsContact O-CZ3 3.32Å; L975-W1035 WeakPolarHBondContact O-CZ3 3.49Å; L975-I1038 HydrophobicContact CD2-CB 4.1Å; L975-I1038 HydrophobicContact CD2-CG2 3.76Å; L975-I1038 HydrophobicContact CG-CG2 4.31Å; L975-V1039 HydrophobicContact CD2-CG2 4.18Å
976	Q	93.7	Very high	88.9	Confident	84 Å²	84	54.5 Å²	54.5	39%	0.393	29%	0.288	S	S	.	.	H	α-helix	trans	-62.2	-42.7	172.9	-77	173.3	-32.4	0	0	111.6	V952 V972 E974 V978 H979 E980	V952-Q976 HydrophobicContact CG1-CG 3.99Å; V952-Q976 HydrophobicContact CG2-CG 4.29Å; V972-Q976 HydrophobicContact CG1-CG 4.32Å; V972-Q976 VanDerWaalsContact O-CB 3.28Å; V972-Q976 WeakPolarHBondContact O-CB 3.49Å; V972-Q976 WeakPolarHBondContact O-CG 3.48Å; V972-Q976 PolarHBondContact O-N 3.15Å; E974-Q976 PolarHBondContact O-N 2.84Å; Q976-V978 PolarHBondContact O-N 2.77Å; Q976-H979 PolarHBondContact O-N 2.72Å; Q976-E980 WeakPolarHBondContact O-CG 3.26Å; Q976-E980 PolarHBondContact O-N 2.89Å
977	S	93.3	Very high	89.6	Confident	71 Å²	71	51.1 Å²	51.1	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-61.5	-41.7	177.2	-164.2	0	0	0	0	112.4	S973 E974 S981	S973-S977 WeakPolarHBondContact O-CB 3.43Å; S973-S977 PolarHBondContact O-N 2.99Å; E974-S977 WeakPolarHBondContact O-CB 3.18Å; E974-S977 PolarHBondContact O-N 2.93Å; S977-S981 WeakPolarHBondContact O-CB 3.3Å; S977-S981 PolarHBondContact O-N 3.1Å
978	V	91.7	Very high	90.4	Very high	21 Å²	21	53.6 Å²	53.6	13%	0.127	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-46	173.4	171.4	0	0	0	0	111.3	M948 E974 L975 Q976 S981 A982 W1035 I1038	M948-V978 HydrophobicContact CE-CG1 4.12Å; E974-V978 PolarHBondContact O-N 3.29Å; L975-V978 PolarHBondContact O-N 3.29Å; Q976-V978 PolarHBondContact O-N 2.77Å; V978-S981 PolarHBondContact O-N 2.94Å; V978-A982 VanDerWaalsContact O-CB 3.25Å; V978-A982 WeakPolarHBondContact O-CB 3.46Å; V978-A982 PolarHBondContact O-N 3.11Å; V978-W1035 HydrophobicContact CG1-CB 4.21Å; V978-W1035 HydrophobicContact CG1-CE3 4.47Å; V978-I1038 HydrophobicContact CG2-CD1 3.63Å
979	H	93.1	Very high	91	Very high	11 Å²	11	54.8 Å²	54.8	5%	0.051	30%	0.297	C	S	.	.	H	α-helix	trans	-59	-50.2	176.1	176.6	-92.3	0	0	0	112.3	M948 L975 Q976 S981 A982 Q983 W1035	M948-H979 HydrophobicContact CE-CB 4.03Å; L975-H979 PolarHBondContact O-N 2.81Å; Q976-H979 PolarHBondContact O-N 2.72Å; H979-S981 VanDerWaalsContact C-N 3.31Å; H979-S981 PolarHBondContact O-N 2.92Å; H979-A982 PolarHBondContact O-N 2.79Å; H979-Q983 PolarHBondContact CE1-OE1 2.89Å; H979-Q983 VanDerWaalsContact CE1-OE1 3.27Å; H979-Q983 WeakPolarHBondContact O-CB 3.16Å; H979-Q983 PolarHBondContact O-N 3.42Å; H979-W1035 HydrophobicContact CB-CZ3 4.38Å
980	E	92.6	Very high	91.5	Very high	109 Å²	109	52.7 Å²	52.7	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-34.9	178.9	-73.2	-179.2	-172.5	0	0	112.9	Q976 R984	Q976-E980 WeakPolarHBondContact O-CG 3.26Å; Q976-E980 PolarHBondContact O-N 2.89Å; E980-R984 WeakPolarHBondContact O-CB 3.18Å; E980-R984 WeakPolarHBondContact O-CG 3.14Å; E980-R984 PolarHBondContact O-N 2.97Å; E980-R984 PolarHBondContact O-NE 2.85Å
981	S	91.4	Very high	91.7	Very high	43 Å²	43	54.6 Å²	54.6	30%	0.301	29%	0.285	S	S	.	.	H	α-helix	trans	-69.9	-43.4	174.3	-168.5	0	0	0	0	111.3	S977 V978 H979 S985	S977-S981 WeakPolarHBondContact O-CB 3.3Å; S977-S981 PolarHBondContact O-N 3.1Å; V978-S981 PolarHBondContact O-N 2.94Å; H979-S981 VanDerWaalsContact C-N 3.31Å; H979-S981 PolarHBondContact O-N 2.92Å; S981-S985 PolarHBondContact O-N 2.98Å; S981-S985 PolarHBondContact O-OG 2.97Å
982	A	86.6	Confident	91.7	Very high	2 Å²	2	60.8 Å²	60.8	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-46.5	-178.9	0	0	0	0	0	111.8	F945 V978 H979 F986 Q1031	F945-A982 HydrophobicContact CE1-CB 3.9Å; V978-A982 VanDerWaalsContact O-CB 3.25Å; V978-A982 WeakPolarHBondContact O-CB 3.46Å; V978-A982 PolarHBondContact O-N 3.11Å; H979-A982 PolarHBondContact O-N 2.79Å; A982-F986 VanDerWaalsContact O-CB 3.32Å; A982-F986 WeakPolarHBondContact O-CB 3.21Å; A982-F986 PolarHBondContact O-N 2.87Å; A982-Q1031 HydrophobicContact CB-CB 3.53Å; A982-Q1031 HydrophobicContact CB-CG 3.5Å
983	Q	91.4	Very high	91.6	Very high	88 Å²	88	60.2 Å²	60.2	41%	0.411	31%	0.305	S	S	.	.	H	α-helix	trans	-63.8	-43.3	179.5	-167.9	178.9	10.7	0	0	111.6	F945 H979 V987	F945-Q983 HydrophobicContact CE1-CB 4.37Å; F945-Q983 HydrophobicContact CE2-CG 4.43Å; F945-Q983 HydrophobicContact CZ-CB 4.38Å; H979-Q983 PolarHBondContact CE1-OE1 2.89Å; H979-Q983 VanDerWaalsContact CE1-OE1 3.27Å; H979-Q983 WeakPolarHBondContact O-CB 3.16Å; H979-Q983 PolarHBondContact O-N 3.42Å; Q983-V987 WeakPolarHBondContact O-CB 3.46Å; Q983-V987 VanDerWaalsContact O-CG2 3.25Å; Q983-V987 WeakPolarHBondContact O-CG2 3.48Å; Q983-V987 PolarHBondContact O-N 3.44Å
984	R	93	Very high	91.4	Very high	141 Å²	141	62.6 Å²	62.6	53%	0.532	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-56.9	175.8	-79.9	177.2	-73.6	162.8	-7.3	112.2	E980 F986 V987 D988	E980-R984 WeakPolarHBondContact O-CB 3.18Å; E980-R984 WeakPolarHBondContact O-CG 3.14Å; E980-R984 PolarHBondContact O-N 2.97Å; E980-R984 PolarHBondContact O-NE 2.85Å; R984-F986 PolarHBondContact O-N 2.85Å; R984-V987 PolarHBondContact O-N 3.04Å; R984-D988 VanDerWaalsContact O-CG 3.24Å; R984-D988 PolarHBondContact O-N 2.66Å
985	S	92.6	Very high	91.1	Very high	48 Å²	48	60.3 Å²	60.3	34%	0.336	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-33.9	-177.5	-60.9	0	0	0	0	113.1	S981 E989	S981-S985 PolarHBondContact O-N 2.98Å; S981-S985 PolarHBondContact O-OG 2.97Å; S985-E989 PolarHBondContact O-N 2.94Å
986	F	94.1	Very high	90.4	Very high	14 Å²	14	60.8 Å²	60.8	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-69.2	-44.5	174.4	179.7	-93.4	0	0	0	112.2	V937 A941 F945 A982 R984 M990 C1024 I1027 L1028	V937-F986 HydrophobicContact CG1-CE2 3.73Å; V937-F986 HydrophobicContact CG1-CZ 3.94Å; A941-F986 HydrophobicContact CB-CD1 4.02Å; A941-F986 HydrophobicContact CB-CD2 4.27Å; A941-F986 HydrophobicContact CB-CE1 3.44Å; A941-F986 VanDerWaalsContact CB-CE1 3.44Å; A941-F986 HydrophobicContact CB-CE2 3.71Å; A941-F986 HydrophobicContact CB-CG 4.4Å; A941-F986 HydrophobicContact CB-CZ 3.26Å; F945-F986 HydrophobicContact CE2-CB 4.37Å; F945-F986 AromaticContact CE2-CD1 3.96Å; F945-F986 HydrophobicContact CE2-CD1 3.96Å; F945-F986 HydrophobicContact CE2-CG 4.22Å; F945-F986 HydrophobicContact CZ-CB 3.91Å; F945-F986 HydrophobicContact CZ-CD1 4.33Å; F945-F986 HydrophobicContact CZ-CG 4.13Å; A982-F986 VanDerWaalsContact O-CB 3.32Å; A982-F986 WeakPolarHBondContact O-CB 3.21Å; A982-F986 PolarHBondContact O-N 2.87Å; R984-F986 PolarHBondContact O-N 2.85Å; F986-M990 HydrophobicContact CE1-CB 4.35Å; F986-M990 HydrophobicContact CE1-CE 4.26Å; F986-M990 HydrophobicContact CE1-CG 4.48Å; F986-M990 HydrophobicContact CE2-CE 4.2Å; F986-M990 HydrophobicContact CZ-CE 3.62Å; F986-M990 WeakPolarHBondContact O-CB 3.27Å; F986-M990 PolarHBondContact O-N 2.81Å; F986-C1024 HydrophobicContact CD2-CB 4.33Å; F986-C1024 HydrophobicContact CE2-CB 3.99Å; F986-I1027 HydrophobicContact CB-CG2 4.11Å; F986-L1028 HydrophobicContact CD2-CD1 4.32Å; F986-L1028 HydrophobicContact CD2-CD2 3.76Å; F986-L1028 HydrophobicContact CD2-CG 3.91Å; F986-L1028 HydrophobicContact CE2-CD1 3.95Å; F986-L1028 HydrophobicContact CE2-CD2 4.12Å; F986-L1028 HydrophobicContact CE2-CG 4.07Å; F986-L1028 HydrophobicContact CG-CD2 4.26Å
987	V	93.4	Very high	89.6	Confident	61 Å²	61	57.5 Å²	57.5	37%	0.37	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-43.4	178.3	168.5	0	0	0	0	111.3	Q983 R984 E989 M990 E991	Q983-V987 WeakPolarHBondContact O-CB 3.46Å; Q983-V987 VanDerWaalsContact O-CG2 3.25Å; Q983-V987 WeakPolarHBondContact O-CG2 3.48Å; Q983-V987 PolarHBondContact O-N 3.44Å; R984-V987 PolarHBondContact O-N 3.04Å; V987-E989 PolarHBondContact O-N 2.85Å; V987-M990 PolarHBondContact O-N 2.99Å; V987-E991 HydrophobicContact CG1-CG 4.32Å; V987-E991 PolarHBondContact O-N 2.64Å
988	D	92.8	Very high	89	Confident	106 Å²	106	56.4 Å²	56.4	57%	0.567	29%	0.285	S	S	*	.	H	α-helix	trans	-57.2	-47.9	-179.7	-65.3	-27.9	0	0	0	112	R984 R992	R984-D988 VanDerWaalsContact O-CG 3.24Å; R984-D988 PolarHBondContact O-N 2.66Å; D988-R992 PolarHBondContact O-N 3.06Å
989	E	92.1	Very high	88.4	Confident	25 Å²	25	58.3 Å²	58.3	12%	0.117	30%	0.297	C	S	.	.	H	α-helix	trans	-76.6	-30.1	178.9	-170.3	66	-167	0	0	112.1	S985 V987 R992 L993 S1020 I1023 I1027	S985-E989 PolarHBondContact O-N 2.94Å; V987-E989 PolarHBondContact O-N 2.85Å; E989-R992 WeakPolarHBondContact O-CB 3.49Å; E989-R992 PolarHBondContact O-N 3.4Å; E989-R992 IonicContact OE1-CZ 3.86Å; E989-R992 IonicContact OE1-NH1 3.18Å; E989-R992 PolarHBondContact OE1-NH1 2.82Å; E989-R992 VanDerWaalsContact OE1-NH1 3.14Å; E989-R992 VanDerWaalsContact OE2-CD 3.27Å; E989-R992 WeakPolarHBondContact OE2-CD 3.38Å; E989-R992 IonicContact OE2-CZ 2.61Å; E989-R992 IonicContact OE2-NH1 2.77Å; E989-R992 PolarHBondContact OE2-NH1 3.14Å; E989-L993 WeakPolarHBondContact O-CB 3.18Å; E989-L993 PolarHBondContact O-N 3.33Å; E989-S1020 WeakPolarHBondContact OE1-CB 3.49Å; E989-S1020 PolarHBondContact OE1-OG 2.66Å; E989-I1023 HydrophobicContact CG-CB 4.39Å; E989-I1023 HydrophobicContact CG-CG2 3.9Å; E989-I1027 HydrophobicContact CB-CD1 4.37Å
990	M	91.5	Very high	87.4	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-69.4	-36.6	174.2	-173.9	55.7	71	0	0	112.3	V934 V937 E938 F986 V987 L993 R994	V934-M990 HydrophobicContact CG1-SD 4.27Å; V937-M990 HydrophobicContact CB-CE 4.32Å; V937-M990 HydrophobicContact CG1-CE 3.69Å; E938-M990 HydrophobicContact CG-CE 3.77Å; E938-M990 HydrophobicContact CG-SD 4.12Å; E938-M990 VanDerWaalsContact OE1-SD 3.42Å; F986-M990 HydrophobicContact CE1-CB 4.35Å; F986-M990 HydrophobicContact CE1-CE 4.26Å; F986-M990 HydrophobicContact CE1-CG 4.48Å; F986-M990 HydrophobicContact CE2-CE 4.2Å; F986-M990 HydrophobicContact CZ-CE 3.62Å; F986-M990 WeakPolarHBondContact O-CB 3.27Å; F986-M990 PolarHBondContact O-N 2.81Å; V987-M990 PolarHBondContact O-N 2.99Å; M990-L993 HydrophobicContact CE-CD2 4.27Å; M990-L993 PolarHBondContact O-N 2.85Å; M990-L993 HydrophobicContact SD-CB 4.47Å; M990-L993 HydrophobicContact SD-CD2 3.93Å; M990-R994 HydrophobicContact CG-CG 4.5Å; M990-R994 WeakPolarHBondContact O-CB 3.46Å; M990-R994 WeakPolarHBondContact O-CD 3.47Å; M990-R994 WeakPolarHBondContact O-CG 3.14Å; M990-R994 PolarHBondContact O-N 2.87Å; M990-R994 HydrophobicContact SD-CG 4.36Å
991	E	90.2	Very high	86.5	Confident	124 Å²	124	57.5 Å²	57.5	58%	0.579	29%	0.292	S	S	*	.	H	α-helix	trans	-64.2	-41.4	171	-74.9	-160.2	168.2	0	0	111.7	V987 R994 A995	V987-E991 HydrophobicContact CG1-CG 4.32Å; V987-E991 PolarHBondContact O-N 2.64Å; E991-R994 PolarHBondContact O-N 3.33Å; E991-A995 WeakPolarHBondContact O-CB 3.38Å; E991-A995 PolarHBondContact O-N 3.43Å
992	R	87.8	Confident	85.7	Confident	133 Å²	133	63.8 Å²	63.8	50%	0.502	31%	0.314	S	S	.	.	H	α-helix	trans	-58.9	-48.4	173	-177.7	-170.6	178.3	-168.9	-3.1	111.6	D988 E989 A995 V996	D988-R992 PolarHBondContact O-N 3.06Å; E989-R992 WeakPolarHBondContact O-CB 3.49Å; E989-R992 PolarHBondContact O-N 3.4Å; E989-R992 IonicContact OE1-CZ 3.86Å; E989-R992 IonicContact OE1-NH1 3.18Å; E989-R992 PolarHBondContact OE1-NH1 2.82Å; E989-R992 VanDerWaalsContact OE1-NH1 3.14Å; E989-R992 VanDerWaalsContact OE2-CD 3.27Å; E989-R992 WeakPolarHBondContact OE2-CD 3.38Å; E989-R992 IonicContact OE2-CZ 2.61Å; E989-R992 IonicContact OE2-NH1 2.77Å; E989-R992 PolarHBondContact OE2-NH1 3.14Å; R992-A995 WeakPolarHBondContact O-CB 3.33Å; R992-A995 PolarHBondContact O-N 2.87Å; R992-V996 PolarHBondContact O-N 2.84Å; R992-V996 VanDerWaalsContact O-N 3.11Å
993	L	86	Confident	84.7	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-57.3	-52.9	176.5	177.6	56.7	0	0	0	110.7	V934 E989 M990 A995 V996 V997 V1017 L1021	V934-L993 HydrophobicContact CG1-CD2 4.44Å; V934-L993 HydrophobicContact CG2-CD2 4.41Å; E989-L993 WeakPolarHBondContact O-CB 3.18Å; E989-L993 PolarHBondContact O-N 3.33Å; M990-L993 HydrophobicContact CE-CD2 4.27Å; M990-L993 PolarHBondContact O-N 2.85Å; M990-L993 HydrophobicContact SD-CB 4.47Å; M990-L993 HydrophobicContact SD-CD2 3.93Å; L993-A995 VanDerWaalsContact C-N 3.26Å; L993-A995 PolarHBondContact O-N 3.01Å; L993-V996 PolarHBondContact O-N 3.34Å; L993-V997 WeakPolarHBondContact O-CG2 3.22Å; L993-V997 PolarHBondContact O-N 3.24Å; L993-V1017 HydrophobicContact CD1-CB 4.13Å; L993-V1017 HydrophobicContact CD1-CG1 4.08Å; L993-V1017 HydrophobicContact CD1-CG2 3.79Å; L993-L1021 HydrophobicContact CD2-CD2 3.79Å; L993-L1021 HydrophobicContact CD2-CG 4.18Å
994	R	85.8	Confident	83.2	Confident	124 Å²	124	72 Å²	72	47%	0.468	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-35.4	176.9	-71.2	164.4	173.9	-177.8	-5.9	112.6	E938 M990 E991 V997 A998	E938-R994 IonicContact OE1-CZ 3.22Å; E938-R994 IonicContact OE1-NE 2.67Å; E938-R994 PolarHBondContact OE1-NE 3.43Å; E938-R994 IonicContact OE1-NH2 2.81Å; E938-R994 PolarHBondContact OE1-NH2 3.37Å; E938-R994 IonicContact OE2-NH2 2.77Å; E938-R994 PolarHBondContact OE2-NH2 3.31Å; M990-R994 HydrophobicContact CG-CG 4.5Å; M990-R994 WeakPolarHBondContact O-CB 3.46Å; M990-R994 WeakPolarHBondContact O-CD 3.47Å; M990-R994 WeakPolarHBondContact O-CG 3.14Å; M990-R994 PolarHBondContact O-N 2.87Å; M990-R994 HydrophobicContact SD-CG 4.36Å; E991-R994 PolarHBondContact O-N 3.33Å; R994-V997 PolarHBondContact O-N 3.31Å; R994-A998 WeakPolarHBondContact O-CB 3.1Å; R994-A998 PolarHBondContact O-N 3.4Å
995	A	85.3	Confident	81.7	Confident	57 Å²	57	69.2 Å²	69.2	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-35.6	175.5	0	0	0	0	0	113.3	E991 R992 L993 T999	E991-A995 WeakPolarHBondContact O-CB 3.38Å; E991-A995 PolarHBondContact O-N 3.43Å; R992-A995 WeakPolarHBondContact O-CB 3.33Å; R992-A995 PolarHBondContact O-N 2.87Å; L993-A995 VanDerWaalsContact C-N 3.26Å; L993-A995 PolarHBondContact O-N 3.01Å; A995-T999 PolarHBondContact O-N 3.26Å; A995-T999 PolarHBondContact O-OG1 3.11Å
996	V	80.1	Confident	80.1	Confident	11 Å²	11	67 Å²	67	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-45.6	171.8	-179.4	0	0	0	0	110.3	R992 L993 A998 T999 L1000 K1013 V1017	R992-V996 PolarHBondContact O-N 2.84Å; R992-V996 VanDerWaalsContact O-N 3.11Å; L993-V996 PolarHBondContact O-N 3.34Å; V996-A998 PolarHBondContact O-N 2.9Å; V996-T999 WeakPolarHBondContact O-CA 2.78Å; V996-T999 VanDerWaalsContact O-CB 3.25Å; V996-T999 WeakPolarHBondContact O-CB 3.34Å; V996-T999 PolarHBondContact O-N 3.24Å; V996-L1000 HydrophobicContact CG1-CD1 4.43Å; V996-L1000 PolarHBondContact O-N 2.99Å; V996-K1013 HydrophobicContact CG1-CB 3.74Å; V996-K1013 HydrophobicContact CG1-CD 4.23Å; V996-K1013 HydrophobicContact CG1-CG 4Å; V996-V1017 HydrophobicContact CB-CG2 4.23Å; V996-V1017 HydrophobicContact CG1-CG2 3.72Å
997	V	77	Confident	78.5	Confident	15 Å²	15	68.8 Å²	68.8	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-45.6	175.5	179.9	0	0	0	0	112.2	F930 L993 R994 T999 L1000 K1001	F930-V997 HydrophobicContact CE1-CB 4.29Å; F930-V997 HydrophobicContact CE1-CG1 3.93Å; F930-V997 HydrophobicContact CE1-CG2 3.38Å; F930-V997 HydrophobicContact CZ-CG2 3.31Å; L993-V997 WeakPolarHBondContact O-CG2 3.22Å; L993-V997 PolarHBondContact O-N 3.24Å; R994-V997 PolarHBondContact O-N 3.31Å; V997-T999 PolarHBondContact O-N 3.02Å; V997-T999 VanDerWaalsContact O-N 3.13Å; V997-L1000 PolarHBondContact O-N 3.12Å; V997-L1000 VanDerWaalsContact O-N 3.07Å; V997-K1001 HydrophobicContact CG1-CD 4.14Å; V997-K1001 HydrophobicContact CG1-CG 4.34Å; V997-K1001 PolarHBondContact O-N 3.37Å
998	A	81	Confident	76.8	Confident	48 Å²	48	69.4 Å²	69.4	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-10.3	176	0	0	0	0	0	113.7	R994 V996 K1002	R994-A998 WeakPolarHBondContact O-CB 3.1Å; R994-A998 PolarHBondContact O-N 3.4Å; V996-A998 PolarHBondContact O-N 2.9Å; A998-K1002 VanDerWaalsContact O-CD 3.24Å; A998-K1002 WeakPolarHBondContact O-CD 3.43Å; A998-K1002 WeakPolarHBondContact O-CE 3.47Å; A998-K1002 WeakPolarHBondContact O-CG 3.32Å
999	T	78.7	Confident	75.1	Confident	60 Å²	60	72.5 Å²	72.5	37%	0.368	35%	0.353	S	S	.	.	H	α-helix	trans	-88.3	-46.3	166.6	-48.1	0	0	0	0	111.1	A995 V996 V997 K1001 K1002 K1013	A995-T999 PolarHBondContact O-N 3.26Å; A995-T999 PolarHBondContact O-OG1 3.11Å; V996-T999 WeakPolarHBondContact O-CA 2.78Å; V996-T999 VanDerWaalsContact O-CB 3.25Å; V996-T999 WeakPolarHBondContact O-CB 3.34Å; V996-T999 PolarHBondContact O-N 3.24Å; V997-T999 PolarHBondContact O-N 3.02Å; V997-T999 VanDerWaalsContact O-N 3.13Å; T999-K1001 VanDerWaalsContact C-N 3.34Å; T999-K1001 PolarHBondContact O-N 2.97Å; T999-K1002 PolarHBondContact O-N 3.49Å; T999-K1002 VanDerWaalsContact O-N 3.15Å; T999-K1013 HydrophobicContact CG2-CD 4.39Å
1000	L	71.9	Confident	73.5	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.016	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-41.9	-179.8	-67.5	173.5	0	0	0	112.3	V996 V997 K1002 F1007 L1010 K1013	V996-L1000 HydrophobicContact CG1-CD1 4.43Å; V996-L1000 PolarHBondContact O-N 2.99Å; V997-L1000 PolarHBondContact O-N 3.12Å; V997-L1000 VanDerWaalsContact O-N 3.07Å; L1000-K1002 PolarHBondContact O-N 2.94Å; L1000-K1002 VanDerWaalsContact O-N 3.16Å; L1000-F1007 HydrophobicContact CB-CD1 4.42Å; L1000-F1007 HydrophobicContact CB-CD2 4.26Å; L1000-F1007 HydrophobicContact CB-CE1 4.16Å; L1000-F1007 HydrophobicContact CB-CE2 3.99Å; L1000-F1007 HydrophobicContact CB-CG 4.47Å; L1000-F1007 HydrophobicContact CB-CZ 3.94Å; L1000-F1007 HydrophobicContact CD1-CD1 4.2Å; L1000-F1007 HydrophobicContact CD1-CE1 3.92Å; L1000-F1007 HydrophobicContact CD1-CZ 4.44Å; L1000-L1010 HydrophobicContact CD2-CB 3.78Å; L1000-L1010 HydrophobicContact CD2-CD1 3.97Å; L1000-K1013 HydrophobicContact CD2-CB 4.06Å; L1000-K1013 HydrophobicContact CD2-CD 4.46Å
1001	K	73.3	Confident	71.9	Confident	100 Å²	100	76.7 Å²	76.7	44%	0.435	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-3.2	177.7	-68	-176.6	-176.3	-113.3	0	115.3	E927 V997 T999 F1007	E927-K1001 VanDerWaalsContact OE1-CE 3.24Å; E927-K1001 WeakPolarHBondContact OE1-CE 3.29Å; E927-K1001 IonicContact OE1-NZ 2.72Å; E927-K1001 PolarHBondContact OE1-NZ 3.03Å; V997-K1001 HydrophobicContact CG1-CD 4.14Å; V997-K1001 HydrophobicContact CG1-CG 4.34Å; V997-K1001 PolarHBondContact O-N 3.37Å; T999-K1001 VanDerWaalsContact C-N 3.34Å; T999-K1001 PolarHBondContact O-N 2.97Å; K1001-F1007 HydrophobicContact CG-CE2 3.95Å; K1001-F1007 HydrophobicContact CG-CZ 4.28Å
1002	K	74.5	Confident	70.7	Confident	176 Å²	176	74.2 Å²	74.2	77%	0.765	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-9.6	-178.9	-73.8	176.9	-177.1	168	0	114.7	A998 T999 L1000	A998-K1002 VanDerWaalsContact O-CD 3.24Å; A998-K1002 WeakPolarHBondContact O-CD 3.43Å; A998-K1002 WeakPolarHBondContact O-CE 3.47Å; A998-K1002 WeakPolarHBondContact O-CG 3.32Å; T999-K1002 PolarHBondContact O-N 3.49Å; T999-K1002 VanDerWaalsContact O-N 3.15Å; L1000-K1002 PolarHBondContact O-N 2.94Å; L1000-K1002 VanDerWaalsContact O-N 3.16Å
1003	D	66.1	Low	69.8	Low	63 Å²	63	70.1 Å²	70.1	34%	0.337	36%	0.356	S	S	.	.	S	Bend	trans	-111	125.4	171.8	174.9	-5.1	0	0	0	107.3	N1005 G1006	D1003-N1005 PolarHBondContact O-N 2.82Å; D1003-N1005 PolarHBondContact OD1-N 2.76Å; D1003-G1006 PolarHBondContact O-N 3Å
1004	E	60.5	Low	69	Low	200 Å²	200	72 Å²	72	94%	0.935	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.6	177.6	-63.7	-176.4	148.9	0	0	112.9
1005	N	60.5	Low	68.5	Low	81 Å²	81	68.2 Å²	68.2	43%	0.433	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	13.2	175.1	-63.7	-102.2	0	0	0	112.5	D1003 F1007 S1008 R1009	D1003-N1005 PolarHBondContact O-N 2.82Å; D1003-N1005 PolarHBondContact OD1-N 2.76Å; N1005-F1007 PolarHBondContact O-N 3.11Å; N1005-S1008 CarbonylContact O-C 3.48Å; N1005-S1008 WeakPolarHBondContact O-CA 3.47Å; N1005-S1008 PolarHBondContact O-N 3.11Å; N1005-R1009 HydrophobicContact CB-CG 4.42Å; N1005-R1009 PolarHBondContact O-N 2.93Å
1006	G	60.6	Low	68.1	Low	1 Å²	1	68.5 Å²	68.5	1%	0.01	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-59.1	-48.5	-168.9	0	0	0	0	0	113.8	D1003 S1008 R1009 L1010	D1003-G1006 PolarHBondContact O-N 3Å; G1006-S1008 PolarHBondContact O-N 2.92Å; G1006-S1008 VanDerWaalsContact O-N 3.15Å; G1006-R1009 PolarHBondContact O-N 3.25Å; G1006-R1009 VanDerWaalsContact O-N 3.12Å; G1006-L1010 PolarHBondContact O-N 3.33Å; G1006-L1010 VanDerWaalsContact O-N 3.08Å
1007	F	60.1	Low	68	Low	52 Å²	52	68 Å²	68	23%	0.228	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-60	-18.4	173.2	-76.2	-82.6	0	0	0	114	E927 F930 L1000 K1001 N1005	E927-F1007 HydrophobicContact CB-CE2 4.38Å; E927-F1007 HydrophobicContact CB-CZ 4.43Å; E927-F1007 HydrophobicContact CG-CE2 4.06Å; E927-F1007 HydrophobicContact CG-CZ 4.02Å; F930-F1007 AromaticContact CD1-CE1 3.78Å; F930-F1007 HydrophobicContact CD1-CE1 3.78Å; F930-F1007 HydrophobicContact CD1-CZ 4.17Å; F930-F1007 HydrophobicContact CE1-CE1 4.36Å; F930-F1007 HydrophobicContact CG-CE1 4.43Å; L1000-F1007 HydrophobicContact CB-CD1 4.42Å; L1000-F1007 HydrophobicContact CB-CD2 4.26Å; L1000-F1007 HydrophobicContact CB-CE1 4.16Å; L1000-F1007 HydrophobicContact CB-CE2 3.99Å; L1000-F1007 HydrophobicContact CB-CG 4.47Å; L1000-F1007 HydrophobicContact CB-CZ 3.94Å; L1000-F1007 HydrophobicContact CD1-CD1 4.2Å; L1000-F1007 HydrophobicContact CD1-CE1 3.92Å; L1000-F1007 HydrophobicContact CD1-CZ 4.44Å; K1001-F1007 HydrophobicContact CG-CE2 3.95Å; K1001-F1007 HydrophobicContact CG-CZ 4.28Å; N1005-F1007 PolarHBondContact O-N 3.11Å
1008	S	56.7	Low	68.2	Low	74 Å²	74	69.9 Å²	69.9	52%	0.517	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-104.5	7.1	177.9	-66.8	0	0	0	0	114.1	N1005 G1006	N1005-S1008 CarbonylContact O-C 3.48Å; N1005-S1008 WeakPolarHBondContact O-CA 3.47Å; N1005-S1008 PolarHBondContact O-N 3.11Å; G1006-S1008 PolarHBondContact O-N 2.92Å; G1006-S1008 VanDerWaalsContact O-N 3.15Å
1009	R	58.3	Low	68.5	Low	172 Å²	172	69 Å²	69	65%	0.649	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.8	-28.6	-174.6	-76.2	-176.2	165	-175.2	-4.1	115.8	N1005 G1006 Q1011	N1005-R1009 HydrophobicContact CB-CG 4.42Å; N1005-R1009 PolarHBondContact O-N 2.93Å; G1006-R1009 PolarHBondContact O-N 3.25Å; G1006-R1009 VanDerWaalsContact O-N 3.12Å; R1009-Q1011 PolarHBondContact O-N 3.29Å
1010	L	58.9	Low	69	Low	64 Å²	64	66.3 Å²	66.3	34%	0.335	32%	0.317	S	S	.	.			trans	-97.5	63.2	-167.4	-69.5	167	0	0	0	112.6	L1000 G1006 S1012 K1013 W1014	L1000-L1010 HydrophobicContact CD2-CB 3.78Å; L1000-L1010 HydrophobicContact CD2-CD1 3.97Å; G1006-L1010 PolarHBondContact O-N 3.33Å; G1006-L1010 VanDerWaalsContact O-N 3.08Å; L1010-S1012 VanDerWaalsContact C-N 3.34Å; L1010-S1012 PolarHBondContact O-N 3.31Å; L1010-K1013 HydrophobicContact CB-CB 4.31Å; L1010-K1013 HydrophobicContact CB-CD 4.39Å; L1010-K1013 HydrophobicContact CD1-CD 4.42Å; L1010-K1013 WeakPolarHBondContact O-CB 3.33Å; L1010-K1013 PolarHBondContact O-N 2.99Å; L1010-W1014 PolarHBondContact O-N 3.04Å
1011	Q	57.6	Low	69.8	Low	52 Å²	52	66.7 Å²	66.7	24%	0.243	32%	0.319	C	S	.	.	H	α-helix	trans	-49.5	-44	-173.3	-164	-168.5	37.5	0	0	115.3	D920 Q922 R1009 K1013 W1014 R1015	D920-Q1011 PolarHBondContact OD1-NE2 3.07Å; D920-Q1011 VanDerWaalsContact OD2-CD 3.29Å; D920-Q1011 PolarHBondContact OD2-NE2 2.84Å; D920-Q1011 PolarHBondContact OD2-OE1 3.43Å; Q922-Q1011 HydrophobicContact CG-CB 4.48Å; Q922-Q1011 HydrophobicContact CG-CG 3.88Å; R1009-Q1011 PolarHBondContact O-N 3.29Å; Q1011-K1013 VanDerWaalsContact C-N 3.26Å; Q1011-K1013 PolarHBondContact O-N 2.92Å; Q1011-W1014 PolarHBondContact O-N 3.18Å; Q1011-R1015 PolarHBondContact O-N 3.48Å
1012	S	63.3	Low	70.6	Confident	71 Å²	71	63.3 Å²	63.3	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-41.7	-178.9	77.5	0	0	0	0	110.8	L1010 W1014 R1015 E1016	L1010-S1012 VanDerWaalsContact C-N 3.34Å; L1010-S1012 PolarHBondContact O-N 3.31Å; S1012-W1014 VanDerWaalsContact C-N 3.31Å; S1012-W1014 PolarHBondContact O-N 2.67Å; S1012-R1015 WeakPolarHBondContact O-CB 3.39Å; S1012-R1015 PolarHBondContact O-N 3.25Å; S1012-R1015 VanDerWaalsContact O-N 3.13Å; S1012-E1016 VanDerWaalsContact O-CG 3.32Å; S1012-E1016 WeakPolarHBondContact O-CG 3.22Å; S1012-E1016 PolarHBondContact O-N 2.74Å; S1012-E1016 PolarHBondContact OG-OE1 2.79Å
1013	K	68.9	Low	71.4	Confident	47 Å²	47	56.9 Å²	56.9	20%	0.204	28%	0.281	C	S	.	.	H	α-helix	trans	-68.7	-28.3	-177.7	-74.4	-177.5	170	-71.9	0	112.9	V996 T999 L1000 L1010 Q1011 E1016 V1017	V996-K1013 HydrophobicContact CG1-CB 3.74Å; V996-K1013 HydrophobicContact CG1-CD 4.23Å; V996-K1013 HydrophobicContact CG1-CG 4Å; T999-K1013 HydrophobicContact CG2-CD 4.39Å; L1000-K1013 HydrophobicContact CD2-CB 4.06Å; L1000-K1013 HydrophobicContact CD2-CD 4.46Å; L1010-K1013 HydrophobicContact CB-CB 4.31Å; L1010-K1013 HydrophobicContact CB-CD 4.39Å; L1010-K1013 HydrophobicContact CD1-CD 4.42Å; L1010-K1013 WeakPolarHBondContact O-CB 3.33Å; L1010-K1013 PolarHBondContact O-N 2.99Å; Q1011-K1013 VanDerWaalsContact C-N 3.26Å; Q1011-K1013 PolarHBondContact O-N 2.92Å; K1013-E1016 WeakPolarHBondContact CA-OE1 3.38Å; K1013-E1016 PolarHBondContact N-OE1 3.41Å; K1013-V1017 WeakPolarHBondContact O-CB 3.3Å; K1013-V1017 WeakPolarHBondContact O-CG2 3.39Å; K1013-V1017 PolarHBondContact O-N 2.72Å
1014	W	71.2	Confident	72.7	Confident	41 Å²	41	53.9 Å²	53.9	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-67.9	-43	170.8	-174.8	-99.3	0	0	0	111.7	V925 F930 L1010 Q1011 S1012 V1017 E1018	V925-W1014 HydrophobicContact CB-CH2 3.82Å; V925-W1014 HydrophobicContact CB-CZ2 3.73Å; V925-W1014 HydrophobicContact CB-CZ3 4.43Å; V925-W1014 HydrophobicContact CG1-CH2 3.57Å; V925-W1014 HydrophobicContact CG1-CZ2 3.76Å; V925-W1014 HydrophobicContact CG1-CZ3 4.44Å; V925-W1014 HydrophobicContact CG2-CH2 4.22Å; V925-W1014 HydrophobicContact CG2-CZ2 3.6Å; F930-W1014 HydrophobicContact CB-CH2 3.77Å; F930-W1014 HydrophobicContact CB-CZ3 3.88Å; F930-W1014 HydrophobicContact CD1-CZ3 4.45Å; F930-W1014 AromaticContact CD2-CH2 3.43Å; F930-W1014 HydrophobicContact CD2-CH2 3.43Å; F930-W1014 VanDerWaalsContact CD2-CH2 3.43Å; F930-W1014 AromaticContact CD2-CZ3 3.49Å; F930-W1014 HydrophobicContact CD2-CZ3 3.49Å; F930-W1014 VanDerWaalsContact CD2-CZ3 3.49Å; F930-W1014 HydrophobicContact CE2-CH2 4.39Å; F930-W1014 HydrophobicContact CE2-CZ3 4.25Å; F930-W1014 AromaticContact CG-CH2 3.8Å; F930-W1014 HydrophobicContact CG-CH2 3.8Å; F930-W1014 AromaticContact CG-CZ3 3.62Å; F930-W1014 HydrophobicContact CG-CZ3 3.62Å; L1010-W1014 PolarHBondContact O-N 3.04Å; Q1011-W1014 PolarHBondContact O-N 3.18Å; S1012-W1014 VanDerWaalsContact C-N 3.31Å; S1012-W1014 PolarHBondContact O-N 2.67Å; W1014-V1017 HydrophobicContact CE3-CG1 4.34Å; W1014-V1017 HydrophobicContact CH2-CG1 4.43Å; W1014-V1017 HydrophobicContact CZ3-CG1 4.16Å; W1014-V1017 VanDerWaalsContact O-CB 3.32Å; W1014-V1017 WeakPolarHBondContact O-CB 3.26Å; W1014-V1017 PolarHBondContact O-N 2.74Å; W1014-V1017 VanDerWaalsContact O-N 3.13Å; W1014-E1018 HydrophobicContact CZ2-CG 4.25Å; W1014-E1018 PolarHBondContact NE1-OE1 3.04Å; W1014-E1018 PolarHBondContact O-N 2.77Å
1015	R	74.3	Confident	74.2	Confident	44 Å²	44	45.7 Å²	45.7	17%	0.166	23%	0.226	C	C	.	.	H	α-helix	trans	-66.4	-40.5	176.1	-57.7	175.3	-170.7	-162.3	1.4	111.7	Q1011 S1012 V1017 E1018 D1019 D1219 T1222	Q1011-R1015 PolarHBondContact O-N 3.48Å; S1012-R1015 WeakPolarHBondContact O-CB 3.39Å; S1012-R1015 PolarHBondContact O-N 3.25Å; S1012-R1015 VanDerWaalsContact O-N 3.13Å; R1015-V1017 PolarHBondContact O-N 2.89Å; R1015-E1018 PolarHBondContact O-N 2.99Å; R1015-D1019 VanDerWaalsContact O-CB 3.23Å; R1015-D1019 WeakPolarHBondContact O-CB 3.21Å; R1015-D1019 PolarHBondContact O-N 3.11Å; R1015-D1219 IonicContact NH1-OD1 2.85Å; R1015-T1222 PolarHBondContact NH1-OG1 3.29Å; R1015-T1222 PolarHBondContact NH2-OG1 3.14Å
1016	E	77.4	Confident	75.6	Confident	63 Å²	63	46 Å²	46	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-56.7	-38.6	171.2	-68.3	161.4	-120.1	0	0	111.3	S1012 K1013 S1020	S1012-E1016 VanDerWaalsContact O-CG 3.32Å; S1012-E1016 WeakPolarHBondContact O-CG 3.22Å; S1012-E1016 PolarHBondContact O-N 2.74Å; S1012-E1016 PolarHBondContact OG-OE1 2.79Å; K1013-E1016 WeakPolarHBondContact CA-OE1 3.38Å; K1013-E1016 PolarHBondContact N-OE1 3.41Å; E1016-S1020 WeakPolarHBondContact O-CB 3.39Å; E1016-S1020 PolarHBondContact O-N 3.41Å; E1016-S1020 PolarHBondContact O-OG 3.37Å; E1016-S1020 VanDerWaalsContact O-OG 3.12Å
1017	V	77.9	Confident	77	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.8	-48.7	177.2	156.2	0	0	0	0	112.4	F930 L993 V996 K1013 W1014 R1015 S1020 L1021	F930-V1017 HydrophobicContact CD2-CG1 3.91Å; F930-V1017 HydrophobicContact CE2-CG1 3.24Å; F930-V1017 HydrophobicContact CZ-CG1 3.9Å; L993-V1017 HydrophobicContact CD1-CB 4.13Å; L993-V1017 HydrophobicContact CD1-CG1 4.08Å; L993-V1017 HydrophobicContact CD1-CG2 3.79Å; V996-V1017 HydrophobicContact CB-CG2 4.23Å; V996-V1017 HydrophobicContact CG1-CG2 3.72Å; K1013-V1017 WeakPolarHBondContact O-CB 3.3Å; K1013-V1017 WeakPolarHBondContact O-CG2 3.39Å; K1013-V1017 PolarHBondContact O-N 2.72Å; W1014-V1017 HydrophobicContact CE3-CG1 4.34Å; W1014-V1017 HydrophobicContact CH2-CG1 4.43Å; W1014-V1017 HydrophobicContact CZ3-CG1 4.16Å; W1014-V1017 VanDerWaalsContact O-CB 3.32Å; W1014-V1017 WeakPolarHBondContact O-CB 3.26Å; W1014-V1017 PolarHBondContact O-N 2.74Å; W1014-V1017 VanDerWaalsContact O-N 3.13Å; R1015-V1017 PolarHBondContact O-N 2.89Å; V1017-S1020 PolarHBondContact O-N 2.9Å; V1017-L1021 HydrophobicContact CG1-CD1 4.19Å; V1017-L1021 WeakPolarHBondContact O-CG 3.39Å; V1017-L1021 PolarHBondContact O-N 3.36Å
1018	E	81.3	Confident	78.5	Confident	56 Å²	56	44.9 Å²	44.9	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-61.4	-46	176.4	-69.3	175.7	149.4	0	0	111.4	W1014 R1015 S1020 L1021 V1022	W1014-E1018 HydrophobicContact CZ2-CG 4.25Å; W1014-E1018 PolarHBondContact NE1-OE1 3.04Å; W1014-E1018 PolarHBondContact O-N 2.77Å; R1015-E1018 PolarHBondContact O-N 2.99Å; E1018-S1020 PolarHBondContact O-N 2.93Å; E1018-L1021 PolarHBondContact O-N 3.33Å; E1018-V1022 PolarHBondContact O-N 3.4Å; E1018-V1022 VanDerWaalsContact O-N 3.09Å
1019	D	87.5	Confident	80.1	Confident	29 Å²	29	41.5 Å²	41.5	16%	0.155	19%	0.194	C	C	.	.	H	α-helix	trans	-55.9	-48.6	175.6	-73.8	-0.6	0	0	0	110.7	R1015 V1022 I1023 P1124 R1225	R1015-D1019 VanDerWaalsContact O-CB 3.23Å; R1015-D1019 WeakPolarHBondContact O-CB 3.21Å; R1015-D1019 PolarHBondContact O-N 3.11Å; D1019-V1022 PolarHBondContact O-N 3.19Å; D1019-I1023 WeakPolarHBondContact O-CD1 3.48Å; D1019-I1023 VanDerWaalsContact O-CG1 3.25Å; D1019-I1023 WeakPolarHBondContact O-CG1 3.47Å; D1019-I1023 PolarHBondContact O-N 3.15Å; D1019-P1124 HydrophobicContact CB-CG 3.9Å; D1019-R1225 IonicContact OD1-CZ 2.77Å; D1019-R1225 IonicContact OD1-NE 3.37Å; D1019-R1225 PolarHBondContact OD1-NE 3.02Å; D1019-R1225 IonicContact OD1-NH2 2.65Å; D1019-R1225 PolarHBondContact OD1-NH2 2.75Å; D1019-R1225 IonicContact OD2-CZ 3.8Å; D1019-R1225 IonicContact OD2-NE 3.84Å; D1019-R1225 IonicContact OD2-NH2 2.67Å; D1019-R1225 PolarHBondContact OD2-NH2 2.56Å
1020	S	88.4	Confident	81.5	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-64.2	-38.9	177	-72.7	0	0	0	0	113.1	E989 E1016 V1017 E1018 V1022 I1023 C1024	E989-S1020 WeakPolarHBondContact OE1-CB 3.49Å; E989-S1020 PolarHBondContact OE1-OG 2.66Å; E1016-S1020 WeakPolarHBondContact O-CB 3.39Å; E1016-S1020 PolarHBondContact O-N 3.41Å; E1016-S1020 PolarHBondContact O-OG 3.37Å; E1016-S1020 VanDerWaalsContact O-OG 3.12Å; V1017-S1020 PolarHBondContact O-N 2.9Å; E1018-S1020 PolarHBondContact O-N 2.93Å; S1020-V1022 VanDerWaalsContact C-N 3.32Å; S1020-V1022 PolarHBondContact O-N 2.88Å; S1020-I1023 PolarHBondContact O-N 3.33Å; S1020-C1024 WeakPolarHBondContact O-CB 3.48Å; S1020-C1024 PolarHBondContact O-N 3.3Å; S1020-C1024 PolarHBondContact O-SG 3.02Å; S1020-C1024 VanDerWaalsContact O-SG 3.37Å
1021	L	88.5	Confident	83	Confident	11 Å²	11	34 Å²	34	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-38.4	176	-75	168.1	0	0	0	111.9	F930 E933 V934 V937 L993 V1017 E1018 H1025	F930-L1021 HydrophobicContact CE2-CD1 4.4Å; E933-L1021 HydrophobicContact CB-CD1 4.38Å; V934-L1021 HydrophobicContact CG2-CD2 4.27Å; V937-L1021 HydrophobicContact CG2-CD2 3.77Å; L993-L1021 HydrophobicContact CD2-CD2 3.79Å; L993-L1021 HydrophobicContact CD2-CG 4.18Å; V1017-L1021 HydrophobicContact CG1-CD1 4.19Å; V1017-L1021 WeakPolarHBondContact O-CG 3.39Å; V1017-L1021 PolarHBondContact O-N 3.36Å; E1018-L1021 PolarHBondContact O-N 3.33Å; L1021-H1025 PolarHBondContact O-N 2.63Å; L1021-H1025 PolarHBondContact O-ND1 2.73Å; L1021-H1025 VanDerWaalsContact O-ND1 3.15Å
1022	V	90.1	Very high	84.6	Confident	30 Å²	30	32.4 Å²	32.4	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-67.9	-41.9	173.1	173.6	0	0	0	0	111.3	E1018 D1019 S1020 H1025 R1026 P1124 A1126	E1018-V1022 PolarHBondContact O-N 3.4Å; E1018-V1022 VanDerWaalsContact O-N 3.09Å; D1019-V1022 PolarHBondContact O-N 3.19Å; S1020-V1022 VanDerWaalsContact C-N 3.32Å; S1020-V1022 PolarHBondContact O-N 2.88Å; V1022-H1025 PolarHBondContact O-N 3.04Å; V1022-R1026 PolarHBondContact O-N 3.14Å; V1022-P1124 HydrophobicContact CB-CB 3.95Å; V1022-P1124 HydrophobicContact CG1-CB 3.75Å; V1022-A1126 HydrophobicContact CG1-CB 4.24Å; V1022-A1126 HydrophobicContact CG2-CB 4.41Å
1023	I	91.4	Very high	85.7	Confident	41 Å²	41	33.5 Å²	33.5	21%	0.21	16%	0.16	C	C	.	.	H	α-helix	trans	-61.7	-46.3	176.7	-68.3	161.3	0	0	0	111.1	E989 D1019 S1020 H1025 R1026 I1027 I1120 P1124	E989-I1023 HydrophobicContact CG-CB 4.39Å; E989-I1023 HydrophobicContact CG-CG2 3.9Å; D1019-I1023 WeakPolarHBondContact O-CD1 3.48Å; D1019-I1023 VanDerWaalsContact O-CG1 3.25Å; D1019-I1023 WeakPolarHBondContact O-CG1 3.47Å; D1019-I1023 PolarHBondContact O-N 3.15Å; S1020-I1023 PolarHBondContact O-N 3.33Å; I1023-H1025 PolarHBondContact O-N 3.01Å; I1023-R1026 WeakPolarHBondContact O-CB 3.47Å; I1023-R1026 PolarHBondContact O-N 2.71Å; I1023-R1026 VanDerWaalsContact O-N 3.16Å; I1023-I1027 HydrophobicContact CG2-CD1 3.82Å; I1023-I1027 HydrophobicContact CG2-CG1 4.38Å; I1023-I1027 WeakPolarHBondContact O-CG1 3.48Å; I1023-I1027 PolarHBondContact O-N 2.51Å; I1023-I1120 HydrophobicContact CG1-CD1 3.69Å; I1023-P1124 HydrophobicContact CD1-CG 4.07Å; I1023-P1124 HydrophobicContact CG1-CB 4.31Å; I1023-P1124 HydrophobicContact CG1-CG 4.13Å
1024	C	92.3	Very high	86.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.5	-46.3	177.2	-74.6	0	0	0	0	112.1	V937 F986 S1020 R1026 I1027 L1028	V937-C1024 HydrophobicContact CG1-CB 3.71Å; F986-C1024 HydrophobicContact CD2-CB 4.33Å; F986-C1024 HydrophobicContact CE2-CB 3.99Å; S1020-C1024 WeakPolarHBondContact O-CB 3.48Å; S1020-C1024 PolarHBondContact O-N 3.3Å; S1020-C1024 PolarHBondContact O-SG 3.02Å; S1020-C1024 VanDerWaalsContact O-SG 3.37Å; C1024-R1026 VanDerWaalsContact C-N 3.35Å; C1024-R1026 PolarHBondContact O-N 3.31Å; C1024-I1027 PolarHBondContact O-N 3.05Å; C1024-L1028 WeakPolarHBondContact O-CG 3.47Å; C1024-L1028 PolarHBondContact O-N 3.18Å
1025	H	92.1	Very high	87.8	Confident	28 Å²	28	31 Å²	31	13%	0.13	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-41.5	174.6	-76.3	135.4	0	0	0	112.7	K940 L1021 V1022 I1023 L1028 A1029 F1110 F1116	K940-H1025 PolarHBondContact NZ-NE2 2.84Å; L1021-H1025 PolarHBondContact O-N 2.63Å; L1021-H1025 PolarHBondContact O-ND1 2.73Å; L1021-H1025 VanDerWaalsContact O-ND1 3.15Å; V1022-H1025 PolarHBondContact O-N 3.04Å; I1023-H1025 PolarHBondContact O-N 3.01Å; H1025-L1028 PolarHBondContact O-N 3.49Å; H1025-A1029 WeakPolarHBondContact O-CB 3.43Å; H1025-A1029 PolarHBondContact O-N 2.79Å; H1025-F1110 HydrophobicContact CB-CE1 4.44Å; H1025-F1110 AromaticContact CD2-CE1 3.5Å; H1025-F1116 HydrophobicContact CB-CD1 3.49Å; H1025-F1116 VanDerWaalsContact CB-CD1 3.49Å; H1025-F1116 HydrophobicContact CB-CE1 3.5Å; H1025-F1116 VanDerWaalsContact CB-CE1 3.5Å; H1025-F1116 HydrophobicContact CB-CG 4.07Å; H1025-F1116 HydrophobicContact CB-CZ 4.09Å; H1025-F1116 AromaticContact CG-CE1 3.85Å; H1025-F1116 AromaticContact ND1-CE1 3.94Å
1026	R	90.8	Very high	88.6	Confident	86 Å²	86	30 Å²	30	33%	0.325	15%	0.154	S	C	.	.	H	α-helix	trans	-63.4	-39.9	175.6	175.1	168.5	-171.6	-106.4	-3.1	113.1	V1022 I1023 C1024 A1029 A1030 F1116 L1118 I1120	V1022-R1026 PolarHBondContact O-N 3.14Å; I1023-R1026 WeakPolarHBondContact O-CB 3.47Å; I1023-R1026 PolarHBondContact O-N 2.71Å; I1023-R1026 VanDerWaalsContact O-N 3.16Å; C1024-R1026 VanDerWaalsContact C-N 3.35Å; C1024-R1026 PolarHBondContact O-N 3.31Å; R1026-A1029 PolarHBondContact O-N 3.03Å; R1026-A1030 VanDerWaalsContact O-CB 3.24Å; R1026-A1030 WeakPolarHBondContact O-CB 3.43Å; R1026-A1030 PolarHBondContact O-N 2.81Å; R1026-F1116 VanDerWaalsContact CG-O 3.28Å; R1026-F1116 WeakPolarHBondContact CG-O 3.47Å; R1026-L1118 PolarHBondContact NE-O 3.38Å; R1026-I1120 VanDerWaalsContact CD-CD1 3.48Å
1027	I	90.5	Very high	89	Confident	30 Å²	30	29 Å²	29	15%	0.154	15%	0.154	C	C	.	.	H	α-helix	trans	-59.9	-48.3	176.8	-69.8	163.9	0	0	0	110	F986 E989 I1023 C1024 Q1031	F986-I1027 HydrophobicContact CB-CG2 4.11Å; E989-I1027 HydrophobicContact CB-CD1 4.37Å; I1023-I1027 HydrophobicContact CG2-CD1 3.82Å; I1023-I1027 HydrophobicContact CG2-CG1 4.38Å; I1023-I1027 WeakPolarHBondContact O-CG1 3.48Å; I1023-I1027 PolarHBondContact O-N 2.51Å; C1024-I1027 PolarHBondContact O-N 3.05Å; I1027-Q1031 HydrophobicContact CG2-CG 4.48Å; I1027-Q1031 WeakPolarHBondContact O-CB 3.1Å; I1027-Q1031 WeakPolarHBondContact O-CG 3.47Å; I1027-Q1031 PolarHBondContact O-N 3.31Å; I1027-Q1031 VanDerWaalsContact O-N 3.14Å
1028	L	91.7	Very high	89.6	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-47.2	177.2	-62.4	175.8	0	0	0	111.9	K940 A941 L944 F945 F986 C1024 H1025 M1032 F1110	K940-L1028 HydrophobicContact CB-CD1 4.26Å; A941-L1028 HydrophobicContact CB-CD1 3.96Å; A941-L1028 HydrophobicContact CB-CD2 3.76Å; A941-L1028 HydrophobicContact CB-CG 4.48Å; L944-L1028 HydrophobicContact CD2-CB 4.03Å; L944-L1028 HydrophobicContact CD2-CD2 4.08Å; L944-L1028 WeakPolarHBondContact CD2-O 3.49Å; F945-L1028 HydrophobicContact CE1-CD2 4.25Å; F945-L1028 HydrophobicContact CE2-CD2 4.34Å; F945-L1028 HydrophobicContact CZ-CD2 3.78Å; F986-L1028 HydrophobicContact CD2-CD1 4.32Å; F986-L1028 HydrophobicContact CD2-CD2 3.76Å; F986-L1028 HydrophobicContact CD2-CG 3.91Å; F986-L1028 HydrophobicContact CE2-CD1 3.95Å; F986-L1028 HydrophobicContact CE2-CD2 4.12Å; F986-L1028 HydrophobicContact CE2-CG 4.07Å; F986-L1028 HydrophobicContact CG-CD2 4.26Å; C1024-L1028 WeakPolarHBondContact O-CG 3.47Å; C1024-L1028 PolarHBondContact O-N 3.18Å; H1025-L1028 PolarHBondContact O-N 3.49Å; L1028-M1032 VanDerWaalsContact O-CB 3.28Å; L1028-M1032 WeakPolarHBondContact O-CB 3.32Å; L1028-M1032 PolarHBondContact O-N 3.06Å; L1028-F1110 HydrophobicContact CB-CE2 4.35Å; L1028-F1110 HydrophobicContact CB-CZ 4.08Å; L1028-F1110 HydrophobicContact CD1-CZ 4.49Å
1029	A	90.1	Very high	90	Very high	3 Å²	3	28.1 Å²	28.1	3%	0.025	15%	0.151	C	C	.	.	H	α-helix	trans	-65.5	-47.1	-178.2	0	0	0	0	0	113.1	H1025 R1026 Q1031 M1032 F1033 F1110 F1116	H1025-A1029 WeakPolarHBondContact O-CB 3.43Å; H1025-A1029 PolarHBondContact O-N 2.79Å; R1026-A1029 PolarHBondContact O-N 3.03Å; A1029-Q1031 PolarHBondContact O-N 2.82Å; A1029-M1032 PolarHBondContact O-N 3.49Å; A1029-F1033 WeakPolarHBondContact O-CB 3.41Å; A1029-F1033 PolarHBondContact O-N 2.8Å; A1029-F1110 HydrophobicContact CB-CD2 4.15Å; A1029-F1110 HydrophobicContact CB-CE2 3.72Å; A1029-F1116 HydrophobicContact CB-CB 3.56Å
1030	A	88.1	Confident	90	Very high	40 Å²	40	29.5 Å²	29.5	33%	0.331	16%	0.162	S	C	.	.	H	α-helix	trans	-66.4	-37.5	-178.6	0	0	0	0	0	112.4	R1026 F1033 A1034	R1026-A1030 VanDerWaalsContact O-CB 3.24Å; R1026-A1030 WeakPolarHBondContact O-CB 3.43Å; R1026-A1030 PolarHBondContact O-N 2.81Å; A1030-F1033 PolarHBondContact O-N 3.04Å; A1030-A1034 WeakPolarHBondContact O-CB 3.33Å; A1030-A1034 PolarHBondContact O-N 2.88Å
1031	Q	88.6	Confident	89.8	Confident	39 Å²	39	34.8 Å²	34.8	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-75	-36.6	178.8	-64.7	-73.3	3.8	0	0	112.1	A982 I1027 A1029 F1033 A1034 W1035	A982-Q1031 HydrophobicContact CB-CB 3.53Å; A982-Q1031 HydrophobicContact CB-CG 3.5Å; I1027-Q1031 HydrophobicContact CG2-CG 4.48Å; I1027-Q1031 WeakPolarHBondContact O-CB 3.1Å; I1027-Q1031 WeakPolarHBondContact O-CG 3.47Å; I1027-Q1031 PolarHBondContact O-N 3.31Å; I1027-Q1031 VanDerWaalsContact O-N 3.14Å; A1029-Q1031 PolarHBondContact O-N 2.82Å; Q1031-F1033 VanDerWaalsContact C-N 3.32Å; Q1031-A1034 PolarHBondContact O-N 2.71Å; Q1031-W1035 WeakPolarHBondContact O-CB 3.41Å; Q1031-W1035 PolarHBondContact O-N 2.91Å
1032	M	91.2	Very high	89.7	Confident	18 Å²	18	35 Å²	35	9%	0.089	19%	0.191	C	C	.	.	H	α-helix	trans	-60.4	-41.5	168.1	-178.8	-174.6	69.6	0	0	111.7	L944 L1028 A1029 N1036 L1106	L944-M1032 HydrophobicContact CD1-CB 4.12Å; L944-M1032 HydrophobicContact CD1-CG 3.99Å; L944-M1032 HydrophobicContact CD1-SD 4.08Å; L944-M1032 HydrophobicContact CD2-CB 4.16Å; L1028-M1032 VanDerWaalsContact O-CB 3.28Å; L1028-M1032 WeakPolarHBondContact O-CB 3.32Å; L1028-M1032 PolarHBondContact O-N 3.06Å; A1029-M1032 PolarHBondContact O-N 3.49Å; M1032-N1036 WeakPolarHBondContact O-CB 3.17Å; M1032-N1036 PolarHBondContact O-N 2.82Å; M1032-L1106 HydrophobicContact CG-CB 3.92Å; M1032-L1106 HydrophobicContact CG-CD1 4.15Å
1033	F	88	Confident	89.4	Confident	94 Å²	94	36 Å²	36	41%	0.412	20%	0.196	S	C	.	.	H	α-helix	trans	-64.4	-45.5	176.2	-179.2	-101.9	0	0	0	111.7	A1029 A1030 Q1031 N1036 C1037 S1194	A1029-F1033 WeakPolarHBondContact O-CB 3.41Å; A1029-F1033 PolarHBondContact O-N 2.8Å; A1030-F1033 PolarHBondContact O-N 3.04Å; Q1031-F1033 VanDerWaalsContact C-N 3.32Å; F1033-N1036 PolarHBondContact O-N 2.95Å; F1033-C1037 PolarHBondContact O-N 3.39Å; F1033-C1037 PolarHBondContact O-SG 2.99Å; F1033-S1194 WeakPolarHBondContact CE2-OG 3.43Å
1034	A	89.2	Confident	88.8	Confident	34 Å²	34	37.7 Å²	37.7	28%	0.281	22%	0.216	S	C	.	.	H	α-helix	trans	-60	-46.1	175.9	0	0	0	0	0	112.4	A1030 Q1031 N1036 C1037 I1038	A1030-A1034 WeakPolarHBondContact O-CB 3.33Å; A1030-A1034 PolarHBondContact O-N 2.88Å; Q1031-A1034 PolarHBondContact O-N 2.71Å; A1034-N1036 PolarHBondContact O-N 2.94Å; A1034-C1037 PolarHBondContact O-N 2.78Å; A1034-I1038 WeakPolarHBondContact O-CG1 3.28Å; A1034-I1038 PolarHBondContact O-N 2.65Å; A1034-I1038 VanDerWaalsContact O-N 3.12Å
1035	W	93.5	Very high	87.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-55.8	-49.6	172.8	176.4	-72.9	0	0	0	111.8	M948 V952 L975 V978 H979 Q1031 C1037 I1038 V1039 A1104 L1106	M948-W1035 HydrophobicContact CB-CE3 4.36Å; M948-W1035 HydrophobicContact CB-CH2 3.9Å; M948-W1035 HydrophobicContact CB-CZ2 4.47Å; M948-W1035 HydrophobicContact CB-CZ3 3.83Å; M948-W1035 HydrophobicContact CE-CD2 4.11Å; M948-W1035 HydrophobicContact CE-CE3 3.38Å; M948-W1035 HydrophobicContact CE-CZ3 3.9Å; M948-W1035 HydrophobicContact CG-CD2 4.27Å; M948-W1035 HydrophobicContact CG-CE3 4.01Å; M948-W1035 HydrophobicContact CG-CH2 4.3Å; M948-W1035 HydrophobicContact CG-CZ3 4.01Å; M948-W1035 WeakPolarHBondContact O-CH2 3.15Å; V952-W1035 HydrophobicContact CG2-CH2 3.68Å; V952-W1035 HydrophobicContact CG2-CZ3 4.28Å; L975-W1035 HydrophobicContact CB-CE3 4.14Å; L975-W1035 HydrophobicContact CB-CH2 3.93Å; L975-W1035 HydrophobicContact CB-CZ3 3.73Å; L975-W1035 HydrophobicContact CD1-CH2 4.38Å; L975-W1035 HydrophobicContact CD1-CZ2 4.23Å; L975-W1035 HydrophobicContact CD2-CD2 3.75Å; L975-W1035 HydrophobicContact CD2-CE3 3.89Å; L975-W1035 HydrophobicContact CD2-CG 4.19Å; L975-W1035 HydrophobicContact CD2-CH2 4.45Å; L975-W1035 HydrophobicContact CD2-CZ2 4.3Å; L975-W1035 HydrophobicContact CD2-CZ3 4.26Å; L975-W1035 HydrophobicContact CG-CH2 4.49Å; L975-W1035 HydrophobicContact CG-CZ3 4.48Å; L975-W1035 VanDerWaalsContact O-CZ3 3.32Å; L975-W1035 WeakPolarHBondContact O-CZ3 3.49Å; V978-W1035 HydrophobicContact CG1-CB 4.21Å; V978-W1035 HydrophobicContact CG1-CE3 4.47Å; H979-W1035 HydrophobicContact CB-CZ3 4.38Å; Q1031-W1035 WeakPolarHBondContact O-CB 3.41Å; Q1031-W1035 PolarHBondContact O-N 2.91Å; W1035-C1037 VanDerWaalsContact C-N 3.29Å; W1035-C1037 PolarHBondContact O-N 2.98Å; W1035-I1038 PolarHBondContact O-N 3.2Å; W1035-V1039 WeakPolarHBondContact O-CG2 3.4Å; W1035-V1039 PolarHBondContact O-N 2.83Å; W1035-A1104 PolarHBondContact NE1-O 2.87Å; W1035-L1106 HydrophobicContact CB-CD1 4.03Å; W1035-L1106 VanDerWaalsContact CD1-CD1 3.43Å; W1035-L1106 HydrophobicContact CD2-CD1 3.92Å; W1035-L1106 HydrophobicContact CG-CD1 3.54Å; W1035-L1106 HydrophobicContact CG-CG 4.17Å
1036	N	91.1	Very high	86.4	Confident	23 Å²	23	42.6 Å²	42.6	12%	0.123	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-31.6	-179.3	-78.1	-9.2	0	0	0	112.4	M1032 F1033 A1034 C1040 Q1105 L1106	M1032-N1036 WeakPolarHBondContact O-CB 3.17Å; M1032-N1036 PolarHBondContact O-N 2.82Å; F1033-N1036 PolarHBondContact O-N 2.95Å; A1034-N1036 PolarHBondContact O-N 2.94Å; N1036-C1040 WeakPolarHBondContact O-CB 3.48Å; N1036-C1040 PolarHBondContact O-N 3.22Å; N1036-C1040 PolarHBondContact O-SG 3.07Å; N1036-Q1105 HydrophobicContact CB-CG 4.31Å; N1036-Q1105 WeakPolarHBondContact OD1-CG 3.47Å; N1036-L1106 PolarHBondContact ND2-O 3.2Å; N1036-L1106 PolarHBondContact OD1-N 2.67Å
1037	C	87.6	Confident	84.9	Confident	44 Å²	44	40.1 Å²	40.1	30%	0.297	25%	0.245	S	C	.	.	H	α-helix	trans	-63.8	-50.6	171.9	-65.9	0	0	0	0	111.5	F1033 A1034 W1035 V1039 C1040 D1041	F1033-C1037 PolarHBondContact O-N 3.39Å; F1033-C1037 PolarHBondContact O-SG 2.99Å; A1034-C1037 PolarHBondContact O-N 2.78Å; W1035-C1037 VanDerWaalsContact C-N 3.29Å; W1035-C1037 PolarHBondContact O-N 2.98Å; C1037-V1039 VanDerWaalsContact C-N 3.3Å; C1037-V1039 PolarHBondContact O-N 2.78Å; C1037-C1040 PolarHBondContact O-N 3.09Å; C1037-C1040 VanDerWaalsContact O-N 3.12Å; C1037-D1041 WeakPolarHBondContact O-CB 3.3Å; C1037-D1041 PolarHBondContact O-N 3.08Å
1038	I	89.6	Confident	83	Confident	36 Å²	36	47.3 Å²	47.3	19%	0.185	28%	0.275	C	S	.	.	H	α-helix	trans	-57.8	-43.2	178.1	-64.8	165.6	0	0	0	111.1	L971 E974 L975 V978 A1034 W1035 F1042	L971-I1038 HydrophobicContact CD1-CG2 3.66Å; E974-I1038 HydrophobicContact CB-CG2 4.43Å; L975-I1038 HydrophobicContact CD2-CB 4.1Å; L975-I1038 HydrophobicContact CD2-CG2 3.76Å; L975-I1038 HydrophobicContact CG-CG2 4.31Å; V978-I1038 HydrophobicContact CG2-CD1 3.63Å; A1034-I1038 WeakPolarHBondContact O-CG1 3.28Å; A1034-I1038 PolarHBondContact O-N 2.65Å; A1034-I1038 VanDerWaalsContact O-N 3.12Å; W1035-I1038 PolarHBondContact O-N 3.2Å; I1038-F1042 WeakPolarHBondContact O-CB 3.33Å; I1038-F1042 PolarHBondContact O-N 2.85Å
1039	V	89.4	Confident	81.3	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-50.6	174.1	164.5	0	0	0	0	111.5	L975 W1035 C1037 F1042 V1043 V1101 Q1105	L975-V1039 HydrophobicContact CD2-CG2 4.18Å; W1035-V1039 WeakPolarHBondContact O-CG2 3.4Å; W1035-V1039 PolarHBondContact O-N 2.83Å; C1037-V1039 VanDerWaalsContact C-N 3.3Å; C1037-V1039 PolarHBondContact O-N 2.78Å; V1039-F1042 PolarHBondContact O-N 3.04Å; V1039-V1043 VanDerWaalsContact O-CG2 3.29Å; V1039-V1043 WeakPolarHBondContact O-CG2 3.26Å; V1039-V1043 PolarHBondContact O-N 3.35Å; V1039-V1043 VanDerWaalsContact O-N 3.11Å; V1039-V1101 HydrophobicContact CG1-CG1 4.22Å; V1039-V1101 VanDerWaalsContact CG1-O 3.23Å; V1039-V1101 WeakPolarHBondContact CG1-O 3.4Å; V1039-V1101 HydrophobicContact CG2-CG1 4.48Å; V1039-Q1105 HydrophobicContact CG1-CB 4.12Å
1040	C	86.9	Confident	79.6	Confident	57 Å²	57	52.6 Å²	52.6	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-44.9	-179.5	-75.7	0	0	0	0	112.5	N1036 C1037 F1042 V1043 A1044	N1036-C1040 WeakPolarHBondContact O-CB 3.48Å; N1036-C1040 PolarHBondContact O-N 3.22Å; N1036-C1040 PolarHBondContact O-SG 3.07Å; C1037-C1040 PolarHBondContact O-N 3.09Å; C1037-C1040 VanDerWaalsContact O-N 3.12Å; C1040-F1042 VanDerWaalsContact C-N 3.32Å; C1040-F1042 PolarHBondContact O-N 2.87Å; C1040-V1043 PolarHBondContact O-N 3.49Å; C1040-V1043 VanDerWaalsContact O-N 3.16Å; C1040-A1044 WeakPolarHBondContact O-CB 3.49Å; C1040-A1044 PolarHBondContact O-N 2.81Å
1041	D	85.6	Confident	77.9	Confident	114 Å²	114	53.2 Å²	53.2	61%	0.61	30%	0.298	S	S	*	.	H	α-helix	trans	-62.6	-39.9	177.4	-74.3	-25.3	0	0	0	111.3	C1037 V1043 A1044 C1045	C1037-D1041 WeakPolarHBondContact O-CB 3.3Å; C1037-D1041 PolarHBondContact O-N 3.08Å; D1041-V1043 VanDerWaalsContact C-N 3.29Å; D1041-V1043 PolarHBondContact O-N 2.98Å; D1041-A1044 PolarHBondContact O-N 2.81Å; D1041-C1045 WeakPolarHBondContact O-CB 3.44Å; D1041-C1045 PolarHBondContact O-N 2.9Å
1042	F	85.3	Confident	75.8	Confident	17 Å²	17	54.8 Å²	54.8	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-36.3	175.5	-174.1	-83.7	0	0	0	112.5	L971 I1038 V1039 C1040 R1050 L1094 Q1098 V1101	L971-F1042 HydrophobicContact CB-CD2 3.91Å; L971-F1042 HydrophobicContact CB-CE2 3.88Å; L971-F1042 HydrophobicContact CD1-CB 4.03Å; L971-F1042 HydrophobicContact CD1-CD2 3.91Å; L971-F1042 HydrophobicContact CD1-CG 4.08Å; L971-F1042 HydrophobicContact CD2-CB 4.49Å; L971-F1042 HydrophobicContact CD2-CD1 4Å; L971-F1042 HydrophobicContact CD2-CD2 3.74Å; L971-F1042 HydrophobicContact CD2-CE1 4.11Å; L971-F1042 HydrophobicContact CD2-CE2 3.84Å; L971-F1042 HydrophobicContact CD2-CG 3.82Å; L971-F1042 HydrophobicContact CD2-CZ 4.02Å; L971-F1042 HydrophobicContact CG-CD2 4.05Å; L971-F1042 HydrophobicContact CG-CE2 4.32Å; L971-F1042 HydrophobicContact CG-CG 4.42Å; I1038-F1042 WeakPolarHBondContact O-CB 3.33Å; I1038-F1042 PolarHBondContact O-N 2.85Å; V1039-F1042 PolarHBondContact O-N 3.04Å; C1040-F1042 VanDerWaalsContact C-N 3.32Å; C1040-F1042 PolarHBondContact O-N 2.87Å; F1042-R1050 VanDerWaalsContact CD2-NH2 3.27Å; F1042-R1050 VanDerWaalsContact CE2-NH1 3.26Å; F1042-R1050 PolarHBondContact O-NH2 2.93Å; F1042-L1094 HydrophobicContact CZ-CD1 4.37Å; F1042-Q1098 HydrophobicContact CE1-CG 4.41Å; F1042-V1101 HydrophobicContact CB-CG1 4.25Å; F1042-V1101 HydrophobicContact CD1-CB 3.98Å; F1042-V1101 HydrophobicContact CD1-CG1 3.71Å; F1042-V1101 HydrophobicContact CD1-CG2 3.97Å; F1042-V1101 HydrophobicContact CE1-CB 4.28Å; F1042-V1101 HydrophobicContact CE1-CG1 4.43Å; F1042-V1101 HydrophobicContact CE1-CG2 3.84Å; F1042-V1101 HydrophobicContact CG-CG1 4.22Å
1043	V	84.1	Confident	73.4	Confident	49 Å²	49	60.7 Å²	60.7	30%	0.297	35%	0.346	S	S	.	.	H	α-helix	trans	-76.5	-38.8	178.8	173.7	0	0	0	0	111.7	V1039 C1040 D1041 Q1098 V1101 A1102	V1039-V1043 VanDerWaalsContact O-CG2 3.29Å; V1039-V1043 WeakPolarHBondContact O-CG2 3.26Å; V1039-V1043 PolarHBondContact O-N 3.35Å; V1039-V1043 VanDerWaalsContact O-N 3.11Å; C1040-V1043 PolarHBondContact O-N 3.49Å; C1040-V1043 VanDerWaalsContact O-N 3.16Å; D1041-V1043 VanDerWaalsContact C-N 3.29Å; D1041-V1043 PolarHBondContact O-N 2.98Å; V1043-Q1098 PolarHBondContact O-NE2 2.85Å; V1043-Q1098 VanDerWaalsContact O-NE2 3.1Å; V1043-V1101 HydrophobicContact CG2-CB 4.33Å; V1043-V1101 HydrophobicContact CG2-CG1 4.12Å; V1043-A1102 HydrophobicContact CG1-CB 4.39Å; V1043-A1102 HydrophobicContact CG2-CB 3.92Å
1044	A	79.5	Confident	71.2	Confident	77 Å²	77	68 Å²	68	64%	0.636	37%	0.371	S	S	*	.	H	α-helix	trans	-75	-26.8	-179	0	0	0	0	0	113.9	C1040 D1041 P1046	C1040-A1044 WeakPolarHBondContact O-CB 3.49Å; C1040-A1044 PolarHBondContact O-N 2.81Å; D1041-A1044 PolarHBondContact O-N 2.81Å; A1044-P1046 WeakPolarHBondContact O-CD 3.42Å
1045	C	72.2	Confident	68.8	Low	38 Å²	38	75.7 Å²	75.7	26%	0.257	40%	0.401	S	S	.	.	S	Bend	trans	-58.7	120.5	-174.9	-165.5	0	0	0	0	112.9	D1041 L1047 S1049 R1050 Q1098	D1041-C1045 WeakPolarHBondContact O-CB 3.44Å; D1041-C1045 PolarHBondContact O-N 2.9Å; C1045-L1047 PolarHBondContact O-N 2.85Å; C1045-S1049 PolarHBondContact SG-OG 3.33Å; C1045-R1050 VanDerWaalsContact CB-NH2 3.33Å; C1045-Q1098 PolarHBondContact O-NE2 2.68Å
1046	P	60.6	Low	66.1	Low	93 Å²	93	79.6 Å²	79.6	60%	0.604	43%	0.433	S	S	*	.			trans	-66.5	131.6	-176.7	-23.7	34.8	0	0	0	113.8	A1044 K1048 S1049	A1044-P1046 WeakPolarHBondContact O-CD 3.42Å; P1046-K1048 PolarHBondContact O-N 2.87Å; P1046-S1049 PolarHBondContact O-N 3.49Å; P1046-S1049 PolarHBondContact O-OG 2.81Å
1047	L	59.2	Low	63.4	Low	35 Å²	35	86.2 Å²	86.2	18%	0.183	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-21.2	-178.2	-67.7	157.5	0	0	0	116.2	C1045 L1094 K1095	C1045-L1047 PolarHBondContact O-N 2.85Å; L1047-L1094 HydrophobicContact CD2-CB 3.9Å; L1047-L1094 HydrophobicContact CD2-CD2 3.65Å; L1047-L1094 HydrophobicContact CD2-CG 3.71Å; L1047-K1095 HydrophobicContact CD1-CD 4.29Å; L1047-K1095 HydrophobicContact CD1-CG 3.94Å
1048	K	51.2	Low	61	Low	180 Å²	180	88.7 Å²	88.7	78%	0.783	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-35.2	177.1	-75.8	-172.8	175	-177.1	0	113.7	P1046 R1050	P1046-K1048 PolarHBondContact O-N 2.87Å; K1048-R1050 VanDerWaalsContact C-N 3.27Å; K1048-R1050 PolarHBondContact O-N 2.88Å
1049	S	55.2	Low	58.4	Low	70 Å²	70	93.8 Å²	93.8	49%	0.49	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11.2	-174.7	57.7	0	0	0	0	114.1	C1045 P1046	C1045-S1049 PolarHBondContact SG-OG 3.33Å; P1046-S1049 PolarHBondContact O-N 3.49Å; P1046-S1049 PolarHBondContact O-OG 2.81Å
1050	R	55.3	Low	55.8	Low	45 Å²	45	97 Å²	97	17%	0.17	55%	0.553	C	S	.	*	T	Hydrogen-bonded Turn	trans	-90.5	-4.4	-179.4	-66.8	-175.5	175.1	178.8	-0.1	114.4	F1042 C1045 K1048	F1042-R1050 VanDerWaalsContact CD2-NH2 3.27Å; F1042-R1050 VanDerWaalsContact CE2-NH1 3.26Å; F1042-R1050 PolarHBondContact O-NH2 2.93Å; C1045-R1050 VanDerWaalsContact CB-NH2 3.33Å; K1048-R1050 VanDerWaalsContact C-N 3.27Å; K1048-R1050 PolarHBondContact O-N 2.88Å
1051	W	53.4	Low	53.3	Low	53 Å²	53	103.8 Å²	103.8	20%	0.201	58%	0.576	C	S	.	*	S	Bend	trans	-137.1	45.4	-172.1	-60.2	-30.8	0	0	0	113.3	R1087 L1090 L1094	W1051-R1087 HydrophobicContact CE3-CG 3.97Å; W1051-R1087 HydrophobicContact CZ3-CG 3.7Å; W1051-R1087 PolarHBondContact O-NH2 2.57Å; W1051-R1087 VanDerWaalsContact O-NH2 3.17Å; W1051-L1090 HydrophobicContact CH2-CB 3.76Å; W1051-L1090 HydrophobicContact CZ2-CB 3.64Å; W1051-L1094 HydrophobicContact CZ2-CD2 4.24Å
1052	S	42.6	Very low	50.7	Low	73 Å²	73	107.5 Å²	107.5	51%	0.51	59%	0.587	S	S	.	*			trans	-153.4	140.8	167.3	60.3	0	0	0	0	106.5
1053	D	41.7	Very low	48.5	Very low	141 Å²	141	112.8 Å²	112.8	75%	0.754	62%	0.62	S	S	*	*	S	Bend	cis	-130.2	115.5	18.7	-57.6	-69.3	0	0	0	112.3
1054	R	42.8	Very low	46.5	Very low	249 Å²	249	115.2 Å²	115.2	94%	0.94	64%	0.637	S	S	*	*	S	Bend	trans	-145.3	3.9	169.9	-82.8	-157.9	173.3	-175	-1.7	116.8
1055	E	37.3	Very low	44.3	Very low	194 Å²	194	118 Å²	118	91%	0.907	64%	0.642	S	S	*	*	S	Bend	trans	-112.6	30.7	175.6	-66	-172.2	122	0	0	112.2
1056	A	37.3	Very low	42.5	Very low	83 Å²	83	122.9 Å²	122.9	69%	0.686	67%	0.665	S	S	*	*	S	Bend	trans	-131.7	39.5	-175.3	0	0	0	0	0	113.1
1057	D	35.1	Very low	41.4	Very low	161 Å²	161	125.4 Å²	125.4	86%	0.861	67%	0.673	S	S	*	*			trans	-155.4	128.2	149.2	-127.6	-21	0	0	0	113.1
1058	S	36	Very low	40.2	Very low	97 Å²	97	131 Å²	131	68%	0.678	70%	0.703	S	S	*	*			trans	-149.1	149.4	165.4	71.2	0	0	0	0	108.8
1059	T	35.8	Very low	39.5	Very low	142 Å²	142	125.3 Å²	125.3	87%	0.871	70%	0.695	S	S	*	*			trans	82.3	55.3	-178.7	73.6	0	0	0	0	119
1060	G	33.6	Very low	38.5	Very low	70 Å²	70	127.7 Å²	127.7	72%	0.722	71%	0.712	S	S	*	*				85.6	121.1	104.1	0	0	0	0	0	121.4
1061	K	35.3	Very low	37.6	Very low	199 Å²	199	129.3 Å²	129.3	87%	0.865	74%	0.735	S	S	*	*			trans	173.9	144.4	143	-97.2	155.4	-176	176	0	108
1062	F	31.2	Very low	36.7	Very low	191 Å²	191	135.2 Å²	135.2	84%	0.838	76%	0.762	S	S	*	*			cis	-165	143.6	-20.1	-145.7	-93.2	0	0	0	105
1063	V	39.8	Very low	36.5	Very low	128 Å²	128	137.4 Å²	137.4	78%	0.776	77%	0.768	S	S	*	*			trans	-103.8	140	-176.2	-175.2	0	0	0	0	110.7
1064	P	41.4	Very low	36.4	Very low	101 Å²	101	137.8 Å²	137.8	66%	0.656	76%	0.763	S	S	*	*				-136.1	161.4	121.4	15.1	7.1	0	0	0	112
1065	D	32.4	Very low	36	Very low	136 Å²	136	131.8 Å²	131.8	73%	0.727	75%	0.75	S	S	*	*			cis	-159.9	160.5	-7.8	-93.8	-27.6	0	0	0	109.4
1066	D	35.3	Very low	36.1	Very low	140 Å²	140	129.7 Å²	129.7	75%	0.749	74%	0.74	S	S	*	*			trans	58.9	141.7	147.1	-75.8	-12.5	0	0	0	121.9
1067	L	38	Very low	36	Very low	146 Å²	146	132.7 Å²	132.7	76%	0.764	74%	0.744	S	S	*	*			cis	-138.5	164.3	13.1	-75.9	178.7	0	0	0	114.8
1068	N	34.4	Very low	35.9	Very low	153 Å²	153	128 Å²	128	82%	0.818	73%	0.734	S	S	*	*			trans	-36.5	162.1	167.5	-59.8	-65.4	0	0	0	118.6
1069	G	34.8	Very low	35.7	Very low	60 Å²	60	129.2 Å²	129.2	62%	0.619	74%	0.743	S	S	*	*			cis	-173.6	156.8	4.5	0	0	0	0	0	111.8
1070	S	35	Very low	35.7	Very low	119 Å²	119	128 Å²	128	83%	0.832	74%	0.735	S	S	*	*				73	136.3	88	72.9	0	0	0	0	116.1
1071	A	36.1	Very low	36	Very low	79 Å²	79	130.3 Å²	130.3	65%	0.653	74%	0.74	S	S	*	*			cis	-175.3	-177.8	-11.8	0	0	0	0	0	110
1072	F	34.5	Very low	36.4	Very low	177 Å²	177	129.1 Å²	129.1	78%	0.776	74%	0.737	S	S	*	*			trans	74.4	146.5	170.6	-72.9	-107.3	0	0	0	117.1
1073	D	39	Very low	37.1	Very low	119 Å²	119	127.6 Å²	127.6	64%	0.636	74%	0.738	S	S	*	*			cis	-142.6	174.5	-0.5	-147.4	-2.9	0	0	0	115
1074	K	38.9	Very low	38	Very low	149 Å²	149	129 Å²	129	65%	0.648	74%	0.74	S	S	*	*			trans	-65.3	169.7	179.1	-55.1	146	-158.1	112.7	0	111.9
1075	N	34.9	Very low	38.8	Very low	123 Å²	123	126.6 Å²	126.6	66%	0.658	72%	0.724	S	S	*	*			cis	-155.3	-173.2	30.2	-131.6	-11.5	0	0	0	108.8
1076	H	40	Very low	40.3	Very low	151 Å²	151	123.8 Å²	123.8	70%	0.699	71%	0.712	S	S	*	*			cis	-152.8	-150.7	14.4	-142.5	-20.9	0	0	0	112.8
1077	N	34.1	Very low	41.7	Very low	145 Å²	145	124 Å²	124	78%	0.775	70%	0.702	S	S	*	*			trans	-108.8	158.7	-170.3	-52.1	-9	0	0	0	113.8
1078	G	33	Very low	43.2	Very low	64 Å²	64	124 Å²	124	66%	0.66	70%	0.696	S	S	*	*			trans	178.2	49.7	164.6	0	0	0	0	0	121.5
1079	S	32.2	Very low	44.8	Very low	122 Å²	122	121.2 Å²	121.2	85%	0.853	68%	0.678	S	S	*	*			trans	63.1	168.6	171.5	75.2	0	0	0	0	115.8
1080	T	36.6	Very low	46.3	Very low	116 Å²	116	120 Å²	120	71%	0.712	66%	0.658	S	S	*	*			cis	-123.1	176.8	-1.7	41.1	0	0	0	0	111.1
1081	S	38.3	Very low	48	Very low	118 Å²	118	115.5 Å²	115.5	83%	0.825	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-82.4	118.4	167.5	53.8	0	0	0	0	111.2
1082	E	44	Very low	49.8	Very low	174 Å²	174	116.9 Å²	116.9	81%	0.813	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-99.8	135.8	166.8	-64.9	-169.9	143.1	0	0	110	I1084	E1082-I1084 PolarHBondContact O-N 2.87Å
1083	D	46.6	Very low	51.7	Low	160 Å²	160	110.7 Å²	110.7	86%	0.856	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-70.9	123	178.9	-76.7	-55.6	0	0	0	110.8	P1085	D1083-P1085 WeakPolarHBondContact O-CD 3.36Å
1084	I	58.3	Low	53.3	Low	158 Å²	158	105 Å²	105	81%	0.81	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-64	118	172.9	-60	175.3	0	0	0	108.1	E1082 T1086	E1082-I1084 PolarHBondContact O-N 2.87Å; I1084-T1086 PolarHBondContact O-N 3.32Å
1085	P	58.3	Low	55.2	Low	50 Å²	50	102.8 Å²	102.8	33%	0.325	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-63.8	128.3	-173.1	24.8	-34	0	0	0	110.6	D1083 Q1089 L1090	D1083-P1085 WeakPolarHBondContact O-CD 3.36Å; P1085-Q1089 HydrophobicContact CB-CB 4.33Å; P1085-L1090 HydrophobicContact CB-CD2 4.25Å; P1085-L1090 HydrophobicContact CB-CG 4.25Å; P1085-L1090 HydrophobicContact CG-CD2 3.99Å; P1085-L1090 HydrophobicContact CG-CG 4.3Å
1086	T	64.2	Low	57.3	Low	76 Å²	76	99.2 Å²	99.2	47%	0.466	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-63.5	153.7	-177.4	62.2	0	0	0	0	111.3	I1084 K1088 Q1089 L1090	I1084-T1086 PolarHBondContact O-N 3.32Å; T1086-K1088 CarbonylContact O-C 3.59Å; T1086-K1088 PolarHBondContact O-N 3.11Å; T1086-Q1089 PolarHBondContact O-N 2.86Å; T1086-Q1089 PolarHBondContact OG1-N 3.07Å; T1086-Q1089 PolarHBondContact OG1-OE1 3.23Å; T1086-L1090 PolarHBondContact O-N 3.43Å; T1086-L1090 VanDerWaalsContact O-N 3.13Å
1087	R	65.4	Low	59.2	Low	144 Å²	144	92.2 Å²	92.2	54%	0.543	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-16.6	173.6	-168	172.3	-175.8	138.9	7	113.4	W1051 S1091	W1051-R1087 HydrophobicContact CE3-CG 3.97Å; W1051-R1087 HydrophobicContact CZ3-CG 3.7Å; W1051-R1087 PolarHBondContact O-NH2 2.57Å; W1051-R1087 VanDerWaalsContact O-NH2 3.17Å; R1087-S1091 WeakPolarHBondContact O-CB 3.43Å
1088	K	68.3	Low	61.6	Low	146 Å²	146	86.6 Å²	86.6	64%	0.635	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-46.7	170.7	-167.3	-173	173.4	-161.9	0	112.7	T1086 S1091 E1092	T1086-K1088 CarbonylContact O-C 3.59Å; T1086-K1088 PolarHBondContact O-N 3.11Å; K1088-S1091 WeakPolarHBondContact O-CA 3.2Å; K1088-S1091 WeakPolarHBondContact O-CB 3.45Å; K1088-S1091 PolarHBondContact O-N 2.89Å; K1088-E1092 WeakPolarHBondContact CE-OE1 3.31Å; K1088-E1092 IonicContact NZ-OE1 3.83Å; K1088-E1092 PolarHBondContact O-N 3.01Å; K1088-E1092 VanDerWaalsContact O-N 3.1Å
1089	Q	67.7	Low	64	Low	95 Å²	95	91.4 Å²	91.4	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-58.2	-52	176.2	-76.9	157.5	-83.4	0	0	111.2	P1085 T1086 S1091 E1092 E1093	P1085-Q1089 HydrophobicContact CB-CB 4.33Å; T1086-Q1089 PolarHBondContact O-N 2.86Å; T1086-Q1089 PolarHBondContact OG1-N 3.07Å; T1086-Q1089 PolarHBondContact OG1-OE1 3.23Å; Q1089-S1091 PolarHBondContact O-N 3.46Å; Q1089-E1092 PolarHBondContact O-N 2.82Å; Q1089-E1093 WeakPolarHBondContact O-CG 3.48Å; Q1089-E1093 PolarHBondContact O-N 2.88Å
1090	L	67.4	Low	66.4	Low	36 Å²	36	86.7 Å²	86.7	19%	0.188	45%	0.445	C	S	.	.	H	α-helix	trans	-54.5	-25.9	174.1	-64.5	172.4	0	0	0	112.7	W1051 P1085 T1086 L1094	W1051-L1090 HydrophobicContact CH2-CB 3.76Å; W1051-L1090 HydrophobicContact CZ2-CB 3.64Å; P1085-L1090 HydrophobicContact CB-CD2 4.25Å; P1085-L1090 HydrophobicContact CB-CG 4.25Å; P1085-L1090 HydrophobicContact CG-CD2 3.99Å; P1085-L1090 HydrophobicContact CG-CG 4.3Å; T1086-L1090 PolarHBondContact O-N 3.43Å; T1086-L1090 VanDerWaalsContact O-N 3.13Å; L1090-L1094 VanDerWaalsContact O-CB 3.22Å; L1090-L1094 WeakPolarHBondContact O-CB 3.21Å; L1090-L1094 PolarHBondContact O-N 3.33Å
1091	S	70.6	Confident	68.7	Low	23 Å²	23	81.1 Å²	81.1	16%	0.161	41%	0.411	C	S	.	.	H	α-helix	trans	-85.4	-24.5	-179.7	-168.5	0	0	0	0	113	R1087 K1088 Q1089 K1095	R1087-S1091 WeakPolarHBondContact O-CB 3.43Å; K1088-S1091 WeakPolarHBondContact O-CA 3.2Å; K1088-S1091 WeakPolarHBondContact O-CB 3.45Å; K1088-S1091 PolarHBondContact O-N 2.89Å; Q1089-S1091 PolarHBondContact O-N 3.46Å; S1091-K1095 VanDerWaalsContact O-CD 3.29Å; S1091-K1095 WeakPolarHBondContact O-CD 3.45Å; S1091-K1095 WeakPolarHBondContact O-CG 3.45Å; S1091-K1095 PolarHBondContact O-N 3.48Å
1092	E	74.6	Confident	70.9	Confident	109 Å²	109	77.6 Å²	77.6	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-87.6	-35.6	173.4	-68.5	-179.1	-167.4	0	0	110.6	K1088 Q1089 K1095 A1096	K1088-E1092 WeakPolarHBondContact CE-OE1 3.31Å; K1088-E1092 IonicContact NZ-OE1 3.83Å; K1088-E1092 PolarHBondContact O-N 3.01Å; K1088-E1092 VanDerWaalsContact O-N 3.1Å; Q1089-E1092 PolarHBondContact O-N 2.82Å; E1092-K1095 PolarHBondContact O-N 3.27Å; E1092-A1096 PolarHBondContact O-N 3.27Å
1093	E	73.1	Confident	72.9	Confident	47 Å²	47	73.3 Å²	73.3	22%	0.22	38%	0.384	C	S	.	.	H	α-helix	trans	-58.7	-49.8	167.4	-71.2	166.8	-135.6	0	0	112	V962 G963 Q1089 K1095 A1096 M1097	V962-E1093 HydrophobicContact CB-CB 4.29Å; V962-E1093 HydrophobicContact CG1-CB 4Å; V962-E1093 HydrophobicContact CG1-CG 4.12Å; G963-E1093 PolarHBondContact N-OE2 2.96Å; Q1089-E1093 WeakPolarHBondContact O-CG 3.48Å; Q1089-E1093 PolarHBondContact O-N 2.88Å; E1093-K1095 VanDerWaalsContact C-N 3.29Å; E1093-K1095 PolarHBondContact O-N 3.11Å; E1093-A1096 WeakPolarHBondContact O-CB 3.25Å; E1093-A1096 PolarHBondContact O-N 3.39Å; E1093-A1096 VanDerWaalsContact O-N 3.09Å; E1093-M1097 PolarHBondContact O-N 3.15Å
1094	L	73.6	Confident	74.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-29.7	179.1	-170.2	50.8	0	0	0	112.4	C964 F1042 L1047 W1051 L1090 Q1098	C964-L1094 HydrophobicContact CB-CD1 4.26Å; F1042-L1094 HydrophobicContact CZ-CD1 4.37Å; L1047-L1094 HydrophobicContact CD2-CB 3.9Å; L1047-L1094 HydrophobicContact CD2-CD2 3.65Å; L1047-L1094 HydrophobicContact CD2-CG 3.71Å; W1051-L1094 HydrophobicContact CZ2-CD2 4.24Å; L1090-L1094 VanDerWaalsContact O-CB 3.22Å; L1090-L1094 WeakPolarHBondContact O-CB 3.21Å; L1090-L1094 PolarHBondContact O-N 3.33Å; L1094-Q1098 WeakPolarHBondContact O-CG 3.35Å; L1094-Q1098 PolarHBondContact O-N 3.05Å
1095	K	78.5	Confident	76.3	Confident	101 Å²	101	63.2 Å²	63.2	44%	0.439	33%	0.329	S	S	.	.	H	α-helix	trans	-70.5	-35	169.9	-76.5	170.1	-169	170.4	0	112.8	L1047 S1091 E1092 E1093 Q1098 K1099	L1047-K1095 HydrophobicContact CD1-CD 4.29Å; L1047-K1095 HydrophobicContact CD1-CG 3.94Å; S1091-K1095 VanDerWaalsContact O-CD 3.29Å; S1091-K1095 WeakPolarHBondContact O-CD 3.45Å; S1091-K1095 WeakPolarHBondContact O-CG 3.45Å; S1091-K1095 PolarHBondContact O-N 3.48Å; E1092-K1095 PolarHBondContact O-N 3.27Å; E1093-K1095 VanDerWaalsContact C-N 3.29Å; E1093-K1095 PolarHBondContact O-N 3.11Å; K1095-Q1098 PolarHBondContact O-N 3.05Å; K1095-K1099 PolarHBondContact O-N 3.3Å
1096	A	79.2	Confident	77.8	Confident	49 Å²	49	61.4 Å²	61.4	41%	0.405	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-49.2	172.5	0	0	0	0	0	109.6	E1092 E1093 Q1098 K1099 V1100	E1092-A1096 PolarHBondContact O-N 3.27Å; E1093-A1096 WeakPolarHBondContact O-CB 3.25Å; E1093-A1096 PolarHBondContact O-N 3.39Å; E1093-A1096 VanDerWaalsContact O-N 3.09Å; A1096-Q1098 VanDerWaalsContact C-N 3.32Å; A1096-Q1098 PolarHBondContact O-N 3.07Å; A1096-K1099 WeakPolarHBondContact O-CB 3.49Å; A1096-K1099 PolarHBondContact O-N 3.42Å; A1096-V1100 WeakPolarHBondContact O-CG2 3.17Å; A1096-V1100 PolarHBondContact O-N 3.1Å
1097	M	79.8	Confident	78.8	Confident	4 Å²	4	63.6 Å²	63.6	2%	0.02	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-34.4	174.8	-71.4	-56.5	-57.4	0	0	113.5	I955 Q958 V962 I968 E1093 K1099 V1100 V1101	I955-M1097 HydrophobicContact CG2-CE 4.31Å; Q958-M1097 HydrophobicContact CB-CE 4.29Å; Q958-M1097 HydrophobicContact CB-SD 3.91Å; V962-M1097 HydrophobicContact CG1-CG 4.39Å; V962-M1097 HydrophobicContact CG2-CG 3.92Å; V962-M1097 HydrophobicContact CG2-SD 4.2Å; I968-M1097 HydrophobicContact CD1-CE 4.09Å; I968-M1097 HydrophobicContact CD1-CG 3.9Å; I968-M1097 HydrophobicContact CD1-SD 4.46Å; I968-M1097 HydrophobicContact CG1-CE 4.44Å; I968-M1097 HydrophobicContact CG2-CE 4.24Å; E1093-M1097 PolarHBondContact O-N 3.15Å; M1097-K1099 VanDerWaalsContact C-N 3.28Å; M1097-K1099 PolarHBondContact O-N 3.45Å; M1097-V1100 HydrophobicContact CE-CB 4.43Å; M1097-V1100 HydrophobicContact CE-CG1 4.35Å; M1097-V1100 WeakPolarHBondContact O-CB 3.48Å; M1097-V1100 PolarHBondContact O-N 3.21Å; M1097-V1100 VanDerWaalsContact O-N 3.1Å; M1097-V1100 HydrophobicContact SD-CG2 4.47Å; M1097-V1101 WeakPolarHBondContact O-CG2 3.04Å; M1097-V1101 PolarHBondContact O-N 3.3Å
1098	Q	83.5	Confident	79.8	Confident	27 Å²	27	59.8 Å²	59.8	13%	0.126	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-33.8	172.4	-80.4	177.2	-43.5	0	0	112.6	F1042 V1043 C1045 L1094 K1095 A1096 A1102	F1042-Q1098 HydrophobicContact CE1-CG 4.41Å; V1043-Q1098 PolarHBondContact O-NE2 2.85Å; V1043-Q1098 VanDerWaalsContact O-NE2 3.1Å; C1045-Q1098 PolarHBondContact O-NE2 2.68Å; L1094-Q1098 WeakPolarHBondContact O-CG 3.35Å; L1094-Q1098 PolarHBondContact O-N 3.05Å; K1095-Q1098 PolarHBondContact O-N 3.05Å; A1096-Q1098 VanDerWaalsContact C-N 3.32Å; A1096-Q1098 PolarHBondContact O-N 3.07Å; Q1098-A1102 VanDerWaalsContact O-CB 3.27Å; Q1098-A1102 WeakPolarHBondContact O-CB 3.38Å; Q1098-A1102 PolarHBondContact O-N 3.11Å
1099	K	83.4	Confident	80.7	Confident	164 Å²	164	54.3 Å²	54.3	71%	0.713	30%	0.3	S	S	*	.	H	α-helix	trans	-69.5	-35.7	171.9	-64.6	177.9	179.4	-179.2	0	112.6	K1095 A1096 M1097 A1103	K1095-K1099 PolarHBondContact O-N 3.3Å; A1096-K1099 WeakPolarHBondContact O-CB 3.49Å; A1096-K1099 PolarHBondContact O-N 3.42Å; M1097-K1099 VanDerWaalsContact C-N 3.28Å; M1097-K1099 PolarHBondContact O-N 3.45Å; K1099-A1103 PolarHBondContact O-N 3.05Å; K1099-A1103 VanDerWaalsContact O-N 3.14Å
1100	V	83.8	Confident	81.7	Confident	23 Å²	23	50.5 Å²	50.5	14%	0.139	28%	0.282	C	S	.	.	H	α-helix	trans	-69.8	-44.3	179.3	178.4	0	0	0	0	110.7	I954 A1096 M1097 A1103 A1104	I954-V1100 HydrophobicContact CG2-CG1 4.13Å; A1096-V1100 WeakPolarHBondContact O-CG2 3.17Å; A1096-V1100 PolarHBondContact O-N 3.1Å; M1097-V1100 HydrophobicContact CE-CB 4.43Å; M1097-V1100 HydrophobicContact CE-CG1 4.35Å; M1097-V1100 WeakPolarHBondContact O-CB 3.48Å; M1097-V1100 PolarHBondContact O-N 3.21Å; M1097-V1100 VanDerWaalsContact O-N 3.1Å; M1097-V1100 HydrophobicContact SD-CG2 4.47Å; V1100-A1103 WeakPolarHBondContact O-CB 3.32Å; V1100-A1103 PolarHBondContact O-N 3.17Å; V1100-A1104 PolarHBondContact O-N 3.47Å
1101	V	84.4	Confident	82.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-37.9	174.8	176.1	0	0	0	0	111	I955 L971 V1039 F1042 V1043 M1097 A1103 A1104	I955-V1101 HydrophobicContact CD1-CG2 4.23Å; I955-V1101 HydrophobicContact CG1-CG2 4.31Å; L971-V1101 HydrophobicContact CD2-CB 4.32Å; L971-V1101 HydrophobicContact CD2-CG1 3.78Å; L971-V1101 HydrophobicContact CD2-CG2 3.5Å; V1039-V1101 HydrophobicContact CG1-CG1 4.22Å; V1039-V1101 VanDerWaalsContact CG1-O 3.23Å; V1039-V1101 WeakPolarHBondContact CG1-O 3.4Å; V1039-V1101 HydrophobicContact CG2-CG1 4.48Å; F1042-V1101 HydrophobicContact CB-CG1 4.25Å; F1042-V1101 HydrophobicContact CD1-CB 3.98Å; F1042-V1101 HydrophobicContact CD1-CG1 3.71Å; F1042-V1101 HydrophobicContact CD1-CG2 3.97Å; F1042-V1101 HydrophobicContact CE1-CB 4.28Å; F1042-V1101 HydrophobicContact CE1-CG1 4.43Å; F1042-V1101 HydrophobicContact CE1-CG2 3.84Å; F1042-V1101 HydrophobicContact CG-CG1 4.22Å; V1043-V1101 HydrophobicContact CG2-CB 4.33Å; V1043-V1101 HydrophobicContact CG2-CG1 4.12Å; M1097-V1101 WeakPolarHBondContact O-CG2 3.04Å; M1097-V1101 PolarHBondContact O-N 3.3Å; V1101-A1103 PolarHBondContact O-N 3.12Å; V1101-A1104 WeakPolarHBondContact O-CA 3.3Å; V1101-A1104 VanDerWaalsContact O-CB 3.29Å; V1101-A1104 WeakPolarHBondContact O-CB 3.48Å; V1101-A1104 PolarHBondContact O-N 2.92Å
1102	A	85	Confident	83.6	Confident	43 Å²	43	53.6 Å²	53.6	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-59.3	-32.8	171.3	0	0	0	0	0	112.8	V1043 Q1098 A1104 Q1105	V1043-A1102 HydrophobicContact CG1-CB 4.39Å; V1043-A1102 HydrophobicContact CG2-CB 3.92Å; Q1098-A1102 VanDerWaalsContact O-CB 3.27Å; Q1098-A1102 WeakPolarHBondContact O-CB 3.38Å; Q1098-A1102 PolarHBondContact O-N 3.11Å; A1102-A1104 PolarHBondContact O-N 3.28Å; A1102-Q1105 PolarHBondContact O-N 3.11Å
1103	A	85.9	Confident	84.5	Confident	85 Å²	85	51 Å²	51	70%	0.702	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-3.7	174	0	0	0	0	0	114.3	K1099 V1100 V1101	K1099-A1103 PolarHBondContact O-N 3.05Å; K1099-A1103 VanDerWaalsContact O-N 3.14Å; V1100-A1103 WeakPolarHBondContact O-CB 3.32Å; V1100-A1103 PolarHBondContact O-N 3.17Å; V1101-A1103 PolarHBondContact O-N 3.12Å
1104	A	87.4	Confident	85.5	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.033	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5.3	172.8	0	0	0	0	0	113.3	I955 W1035 V1100 V1101 A1102	I955-A1104 HydrophobicContact CD1-CB 3.8Å; I955-A1104 HydrophobicContact CG1-CB 4.43Å; W1035-A1104 PolarHBondContact NE1-O 2.87Å; V1100-A1104 PolarHBondContact O-N 3.47Å; V1101-A1104 WeakPolarHBondContact O-CA 3.3Å; V1101-A1104 VanDerWaalsContact O-CB 3.29Å; V1101-A1104 WeakPolarHBondContact O-CB 3.48Å; V1101-A1104 PolarHBondContact O-N 2.92Å; A1102-A1104 PolarHBondContact O-N 3.28Å
1105	Q	87.3	Confident	86.4	Confident	102 Å²	102	51.5 Å²	51.5	48%	0.477	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-67.5	129.5	171.5	-165.6	177.2	6.1	0	0	110	N1036 V1039 A1102	N1036-Q1105 HydrophobicContact CB-CG 4.31Å; N1036-Q1105 WeakPolarHBondContact OD1-CG 3.47Å; V1039-Q1105 HydrophobicContact CG1-CB 4.12Å; A1102-Q1105 PolarHBondContact O-N 3.11Å
1106	L	89.6	Confident	87	Confident	12 Å²	12	47.4 Å²	47.4	6%	0.063	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-83.8	134.9	-175.4	-59.1	170.4	0	0	0	111.1	L944 Q947 M948 M1032 W1035 N1036	L944-L1106 HydrophobicContact CD1-CB 4.44Å; L944-L1106 HydrophobicContact CD1-CD1 3.96Å; Q947-L1106 HydrophobicContact CB-CD2 3.81Å; M948-L1106 HydrophobicContact CG-CD1 3.58Å; M948-L1106 HydrophobicContact CG-CD2 4.12Å; M948-L1106 HydrophobicContact SD-CD1 4.33Å; M1032-L1106 HydrophobicContact CG-CB 3.92Å; M1032-L1106 HydrophobicContact CG-CD1 4.15Å; W1035-L1106 HydrophobicContact CB-CD1 4.03Å; W1035-L1106 VanDerWaalsContact CD1-CD1 3.43Å; W1035-L1106 HydrophobicContact CD2-CD1 3.92Å; W1035-L1106 HydrophobicContact CG-CD1 3.54Å; W1035-L1106 HydrophobicContact CG-CG 4.17Å; N1036-L1106 PolarHBondContact ND2-O 3.2Å; N1036-L1106 PolarHBondContact OD1-N 2.67Å
1107	N	86.8	Confident	87.4	Confident	122 Å²	122	47.1 Å²	47.1	65%	0.652	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-78	142.2	169.7	-67	-55	0	0	0	110.6
1108	S	85	Confident	87.9	Confident	64 Å²	64	47.2 Å²	47.2	45%	0.448	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-66.5	129.6	178.3	-175	0	0	0	0	112.5	F1110	S1108-F1110 WeakPolarHBondContact CB-O 3.5Å; S1108-F1110 PolarHBondContact O-N 3.06Å; S1108-F1110 WeakPolarHBondContact OG-CA 3.09Å; S1108-F1110 WeakPolarHBondContact OG-CB 3.46Å; S1108-F1110 PolarHBondContact OG-N 3.16Å; S1108-F1110 PolarHBondContact OG-O 2.65Å
1109	P	87	Confident	88	Confident	31 Å²	31	49.7 Å²	49.7	20%	0.201	29%	0.285	C	S	.	.	S	Bend	trans	-79.8	3.8	164.1	35.2	-34.3	0	0	0	112.4	K940 Y943	K940-P1109 HydrophobicContact CB-CB 4.38Å; K940-P1109 HydrophobicContact CG-CB 4.27Å; Y943-P1109 HydrophobicContact CD1-CB 4.34Å
1110	F	89.4	Confident	88.1	Confident	15 Å²	15	44.6 Å²	44.6	7%	0.066	27%	0.265	C	S	.	.	S	Bend	trans	-112.3	145.7	176.6	-48.8	-64.2	0	0	0	110.6	K940 H1025 L1028 A1029 S1108 F1116	K940-F1110 HydrophobicContact CD-CD1 4.39Å; K940-F1110 HydrophobicContact CD-CE1 3.79Å; H1025-F1110 HydrophobicContact CB-CE1 4.44Å; H1025-F1110 AromaticContact CD2-CE1 3.5Å; L1028-F1110 HydrophobicContact CB-CE2 4.35Å; L1028-F1110 HydrophobicContact CB-CZ 4.08Å; L1028-F1110 HydrophobicContact CD1-CZ 4.49Å; A1029-F1110 HydrophobicContact CB-CD2 4.15Å; A1029-F1110 HydrophobicContact CB-CE2 3.72Å; S1108-F1110 WeakPolarHBondContact CB-O 3.5Å; S1108-F1110 PolarHBondContact O-N 3.06Å; S1108-F1110 WeakPolarHBondContact OG-CA 3.09Å; S1108-F1110 WeakPolarHBondContact OG-CB 3.46Å; S1108-F1110 PolarHBondContact OG-N 3.16Å; S1108-F1110 PolarHBondContact OG-O 2.65Å; F1110-F1116 HydrophobicContact CB-CD2 4.18Å; F1110-F1116 HydrophobicContact CB-CE2 4.15Å; F1110-F1116 AromaticContact CD1-CD2 3.66Å; F1110-F1116 HydrophobicContact CD1-CD2 3.66Å; F1110-F1116 AromaticContact CD1-CE2 3.36Å; F1110-F1116 HydrophobicContact CD1-CE2 3.36Å; F1110-F1116 HydrophobicContact CD1-CZ 4.31Å; F1110-F1116 HydrophobicContact CD2-CD2 4.09Å; F1110-F1116 HydrophobicContact CE1-CD2 4.04Å; F1110-F1116 AromaticContact CE1-CE2 3.88Å; F1110-F1116 HydrophobicContact CE1-CE2 3.88Å; F1110-F1116 HydrophobicContact CE2-CD2 4.44Å; F1110-F1116 AromaticContact CG-CD2 3.68Å; F1110-F1116 HydrophobicContact CG-CD2 3.68Å; F1110-F1116 AromaticContact CG-CE2 3.78Å; F1110-F1116 HydrophobicContact CG-CE2 3.78Å; F1110-F1116 HydrophobicContact CZ-CD2 4.41Å
1111	I	90.3	Very high	88.1	Confident	65 Å²	65	44.4 Å²	44.4	33%	0.333	27%	0.268	S	S	.	.			trans	-70.7	153.3	173.7	64.4	178.6	0	0	0	110.8	E1113 Q1114	I1111-E1113 WeakPolarHBondContact CB-OE2 3.37Å; I1111-E1113 HydrophobicContact CD1-CB 4.45Å; I1111-E1113 WeakPolarHBondContact CG1-OE2 3.44Å; I1111-E1113 PolarHBondContact O-N 2.96Å; I1111-Q1114 HydrophobicContact CD1-CG 4.02Å; I1111-Q1114 HydrophobicContact CG1-CB 4.17Å; I1111-Q1114 HydrophobicContact CG1-CG 3.68Å; I1111-Q1114 PolarHBondContact O-N 3.37Å; I1111-Q1114 VanDerWaalsContact O-N 3.13Å
1112	P	89	Confident	88.2	Confident	59 Å²	59	49.6 Å²	49.6	38%	0.383	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.1	-175.8	-25.9	36.7	0	0	0	116	H1115 N1305 T1308	P1112-H1115 PolarHBondContact O-NE2 3.29Å; P1112-N1305 PolarHBondContact O-ND2 3.42Å; P1112-N1305 VanDerWaalsContact O-ND2 3.14Å; P1112-T1308 HydrophobicContact CB-CG2 3.53Å; P1112-T1308 HydrophobicContact CG-CG2 4.38Å
1113	E	93.4	Very high	88.4	Confident	55 Å²	55	47.7 Å²	47.7	26%	0.257	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	4.1	179.1	-55.2	86.4	171	0	0	113.9	I1111 H1115 D1128 E1129 R1130	I1111-E1113 WeakPolarHBondContact CB-OE2 3.37Å; I1111-E1113 HydrophobicContact CD1-CB 4.45Å; I1111-E1113 WeakPolarHBondContact CG1-OE2 3.44Å; I1111-E1113 PolarHBondContact O-N 2.96Å; E1113-H1115 PolarHBondContact O-CD2 3.31Å; E1113-D1128 WeakPolarHBondContact O-CA 3.46Å; E1113-E1129 HydrophobicContact CB-CB 4.09Å; E1113-E1129 HydrophobicContact CB-CG 4.27Å; E1113-E1129 PolarHBondContact O-N 2.96Å; E1113-R1130 HydrophobicContact CB-CG 4.39Å
1114	Q	92.7	Very high	88.6	Confident	53 Å²	53	44.5 Å²	44.5	25%	0.248	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.7	-176.5	-72.6	-172.3	-31.5	0	0	113.1	I1111 F1116 V1127 D1128	I1111-Q1114 HydrophobicContact CD1-CG 4.02Å; I1111-Q1114 HydrophobicContact CG1-CB 4.17Å; I1111-Q1114 HydrophobicContact CG1-CG 3.68Å; I1111-Q1114 PolarHBondContact O-N 3.37Å; I1111-Q1114 VanDerWaalsContact O-N 3.13Å; Q1114-F1116 HydrophobicContact CB-CD2 4.14Å; Q1114-F1116 HydrophobicContact CB-CE2 3.61Å; Q1114-F1116 HydrophobicContact CB-CZ 4.28Å; Q1114-F1116 HydrophobicContact CG-CE2 4.4Å; Q1114-F1116 PolarHBondContact O-N 2.95Å; Q1114-V1127 WeakPolarHBondContact CA-O 3.24Å; Q1114-D1128 HydrophobicContact CG-CB 4.45Å; Q1114-D1128 PolarHBondContact NE2-OD2 3.03Å
1115	H	93.2	Very high	88.9	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.014	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	68.6	-163	-61.8	-85.5	0	0	0	112.3	P1112 E1113 C1117 L1118 V1127 E1129 D1193 F1198	P1112-H1115 PolarHBondContact O-NE2 3.29Å; E1113-H1115 PolarHBondContact O-CD2 3.31Å; H1115-C1117 VanDerWaalsContact C-N 3.31Å; H1115-C1117 PolarHBondContact O-N 3.28Å; H1115-L1118 HydrophobicContact CB-CD1 3.9Å; H1115-L1118 HydrophobicContact CB-CG 4.24Å; H1115-V1127 HydrophobicContact CB-CB 4.22Å; H1115-V1127 PolarHBondContact N-O 3.25Å; H1115-E1129 IonicContact CE1-OE1 3.03Å; H1115-E1129 IonicContact NE2-OE1 3.82Å; H1115-E1129 PolarHBondContact NE2-OE1 2.86Å; H1115-D1193 WeakPolarHBondContact CB-OD2 3.42Å; H1115-D1193 IonicContact CG-OD2 3.43Å; H1115-D1193 IonicContact ND1-OD1 2.68Å; H1115-D1193 PolarHBondContact ND1-OD1 2.91Å; H1115-D1193 IonicContact ND1-OD2 3.19Å; H1115-D1193 PolarHBondContact ND1-OD2 3.01Å; H1115-F1198 HydrophobicContact CB-CE2 4.37Å; H1115-F1198 HydrophobicContact CB-CZ 4.45Å; H1115-F1198 AromaticContact CD2-CZ 3.51Å; H1115-F1198 AromaticContact CG-CE2 3.86Å; H1115-F1198 AromaticContact CG-CZ 3.69Å; H1115-F1198 AromaticContact ND1-CE2 3.97Å; H1115-F1198 AromaticContact ND1-CZ 4Å; H1115-F1198 AromaticContact NE2-CZ 3.74Å
1116	F	91	Very high	89.1	Confident	16 Å²	16	41.1 Å²	41.1	7%	0.07	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-14.1	-179.1	-63.4	-73	0	0	0	114.3	H1025 R1026 A1029 F1110 Q1114 L1118 A1126	H1025-F1116 HydrophobicContact CB-CD1 3.49Å; H1025-F1116 VanDerWaalsContact CB-CD1 3.49Å; H1025-F1116 HydrophobicContact CB-CE1 3.5Å; H1025-F1116 VanDerWaalsContact CB-CE1 3.5Å; H1025-F1116 HydrophobicContact CB-CG 4.07Å; H1025-F1116 HydrophobicContact CB-CZ 4.09Å; H1025-F1116 AromaticContact CG-CE1 3.85Å; H1025-F1116 AromaticContact ND1-CE1 3.94Å; R1026-F1116 VanDerWaalsContact CG-O 3.28Å; R1026-F1116 WeakPolarHBondContact CG-O 3.47Å; A1029-F1116 HydrophobicContact CB-CB 3.56Å; F1110-F1116 HydrophobicContact CB-CD2 4.18Å; F1110-F1116 HydrophobicContact CB-CE2 4.15Å; F1110-F1116 AromaticContact CD1-CD2 3.66Å; F1110-F1116 HydrophobicContact CD1-CD2 3.66Å; F1110-F1116 AromaticContact CD1-CE2 3.36Å; F1110-F1116 HydrophobicContact CD1-CE2 3.36Å; F1110-F1116 HydrophobicContact CD1-CZ 4.31Å; F1110-F1116 HydrophobicContact CD2-CD2 4.09Å; F1110-F1116 HydrophobicContact CE1-CD2 4.04Å; F1110-F1116 AromaticContact CE1-CE2 3.88Å; F1110-F1116 HydrophobicContact CE1-CE2 3.88Å; F1110-F1116 HydrophobicContact CE2-CD2 4.44Å; F1110-F1116 AromaticContact CG-CD2 3.68Å; F1110-F1116 HydrophobicContact CG-CD2 3.68Å; F1110-F1116 AromaticContact CG-CE2 3.78Å; F1110-F1116 HydrophobicContact CG-CE2 3.78Å; F1110-F1116 HydrophobicContact CZ-CD2 4.41Å; Q1114-F1116 HydrophobicContact CB-CD2 4.14Å; Q1114-F1116 HydrophobicContact CB-CE2 3.61Å; Q1114-F1116 HydrophobicContact CB-CZ 4.28Å; Q1114-F1116 HydrophobicContact CG-CE2 4.4Å; Q1114-F1116 PolarHBondContact O-N 2.95Å; F1116-L1118 VanDerWaalsContact C-N 3.28Å; F1116-L1118 PolarHBondContact O-N 3.15Å; F1116-A1126 HydrophobicContact CD1-CB 3.79Å; F1116-A1126 HydrophobicContact CE1-CB 3.46Å; F1116-A1126 VanDerWaalsContact CE1-CB 3.46Å; F1116-A1126 HydrophobicContact CZ-CB 4.38Å
1117	C	87.8	Confident	89.3	Confident	42 Å²	42	40.5 Å²	40.5	28%	0.284	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.6	-179.7	-70.4	0	0	0	0	114.1	H1115 D1193	H1115-C1117 VanDerWaalsContact C-N 3.31Å; H1115-C1117 PolarHBondContact O-N 3.28Å; C1117-D1193 HydrophobicContact CB-CB 4.31Å
1118	L	89.8	Confident	89.6	Confident	6 Å²	6	35 Å²	35	3%	0.031	20%	0.202	C	C	.	.	S	Bend	trans	-61.7	152.6	179.1	-69.4	172	0	0	0	112.3	R1026 H1115 F1116 V1127 Y1138 F1191 D1193	R1026-L1118 PolarHBondContact NE-O 3.38Å; H1115-L1118 HydrophobicContact CB-CD1 3.9Å; H1115-L1118 HydrophobicContact CB-CG 4.24Å; F1116-L1118 VanDerWaalsContact C-N 3.28Å; F1116-L1118 PolarHBondContact O-N 3.15Å; L1118-V1127 HydrophobicContact CD1-CB 3.94Å; L1118-V1127 HydrophobicContact CD1-CG2 3.74Å; L1118-Y1138 HydrophobicContact CB-CE2 3.65Å; L1118-Y1138 HydrophobicContact CD1-CD2 4.23Å; L1118-Y1138 HydrophobicContact CD1-CE2 3.97Å; L1118-Y1138 HydrophobicContact CG-CE2 4.39Å; L1118-F1191 HydrophobicContact CD1-CD2 3.9Å; L1118-F1191 HydrophobicContact CD1-CE2 3.96Å; L1118-F1191 HydrophobicContact CD2-CD2 4.01Å; L1118-D1193 HydrophobicContact CD2-CB 4.04Å; L1118-D1193 HydrophobicContact CG-CB 4.45Å
1119	P	86.4	Confident	90	Very high	79 Å²	79	32.7 Å²	32.7	51%	0.513	19%	0.185	S	C	.	.	P	Polyproline II helix	trans	-54.9	138.2	169.3	-27.4	35.1	0	0	0	113.2	Y1138	P1119-Y1138 WeakPolarHBondContact CD-OH 3.34Å; P1119-Y1138 VanDerWaalsContact O-CE2 3.23Å; P1119-Y1138 WeakPolarHBondContact O-CE2 3.41Å; P1119-Y1138 PolarHBondContact O-OH 2.92Å
1120	I	85.5	Confident	90.3	Very high	57 Å²	57	38 Å²	38	29%	0.292	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-81.6	126.9	165.7	-78.7	176	0	0	0	108.4	I1023 R1026 P1124	I1023-I1120 HydrophobicContact CG1-CD1 3.69Å; R1026-I1120 VanDerWaalsContact CD-CD1 3.48Å; I1120-P1124 HydrophobicContact CD1-CB 4.05Å; I1120-P1124 HydrophobicContact CD1-CG 4.36Å; I1120-P1124 HydrophobicContact CG1-CB 4.44Å; I1120-P1124 HydrophobicContact CG2-CG 4.26Å
1121	G	83.8	Confident	90.5	Very high	20 Å²	20	39.3 Å²	39.3	21%	0.206	21%	0.207	C	C	.	.			trans	-95.2	-145.1	168.2	0	0	0	0	0	112.2	V1123 A1141	G1121-V1123 PolarHBondContact O-N 3.01Å; G1121-A1141 CarbonylContact C-O 3.6Å; G1121-A1141 VanDerWaalsContact CA-O 3.3Å; G1121-A1141 WeakPolarHBondContact CA-O 3.21Å
1122	K	85.5	Confident	90.6	Very high	108 Å²	108	36.4 Å²	36.4	47%	0.47	19%	0.192	S	C	.	.	S	Bend	trans	-62.6	-25.9	-176.3	-175.4	173.5	-178.9	178.9	0	114.5	A1141 Q1146	K1122-A1141 PolarHBondContact N-O 2.67Å; K1122-Q1146 HydrophobicContact CD-CG 4.37Å
1123	V	88.6	Confident	91	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.024	17%	0.174	C	C	.	.	S	Bend	trans	-130.8	132.6	174.5	179	0	0	0	0	107.8	G1121 V1125 A1141 V1224 R1225	G1121-V1123 PolarHBondContact O-N 3.01Å; V1123-V1125 HydrophobicContact CB-CG2 4.43Å; V1123-V1125 HydrophobicContact CG1-CG2 4.14Å; V1123-V1125 PolarHBondContact O-N 3.18Å; V1123-A1141 HydrophobicContact CB-CB 4.21Å; V1123-V1224 HydrophobicContact CB-CG1 3.92Å; V1123-V1224 HydrophobicContact CG1-CG1 4.05Å; V1123-V1224 HydrophobicContact CG2-CB 4.4Å; V1123-V1224 HydrophobicContact CG2-CG1 4.08Å; V1123-R1225 HydrophobicContact CG1-CG 3.7Å
1124	P	91.2	Very high	91.1	Very high	17 Å²	17	31 Å²	31	11%	0.11	16%	0.162	C	C	.	.			trans	-63.1	115	169	-22.9	35.9	0	0	0	110.5	D1019 V1022 I1023 I1120	D1019-P1124 HydrophobicContact CB-CG 3.9Å; V1022-P1124 HydrophobicContact CB-CB 3.95Å; V1022-P1124 HydrophobicContact CG1-CB 3.75Å; I1023-P1124 HydrophobicContact CD1-CG 4.07Å; I1023-P1124 HydrophobicContact CG1-CB 4.31Å; I1023-P1124 HydrophobicContact CG1-CG 4.13Å; I1120-P1124 HydrophobicContact CD1-CB 4.05Å; I1120-P1124 HydrophobicContact CD1-CG 4.36Å; I1120-P1124 HydrophobicContact CG1-CB 4.44Å; I1120-P1124 HydrophobicContact CG2-CG 4.26Å
1125	V	92.9	Very high	91.3	Very high	11 Å²	11	28.5 Å²	28.5	7%	0.067	15%	0.15	C	C	.	.			trans	-127.2	123.5	175.4	179.2	0	0	0	0	108.7	V1123 A1137 Y1138 A1141 V1224 A1228	V1123-V1125 HydrophobicContact CB-CG2 4.43Å; V1123-V1125 HydrophobicContact CG1-CG2 4.14Å; V1123-V1125 PolarHBondContact O-N 3.18Å; V1125-A1137 HydrophobicContact CG1-CB 3.95Å; V1125-A1137 HydrophobicContact CG2-CB 4.21Å; V1125-Y1138 HydrophobicContact CB-CD2 4.33Å; V1125-A1141 HydrophobicContact CG2-CB 4.13Å; V1125-V1224 HydrophobicContact CG2-CG1 3.99Å; V1125-A1228 HydrophobicContact CG1-CB 4.06Å; V1125-A1228 HydrophobicContact CG2-CB 4.25Å
1126	A	91.4	Very high	91.5	Very high	24 Å²	24	28.3 Å²	28.3	20%	0.198	15%	0.149	C	C	.	.			trans	-85.7	127.4	166.3	0	0	0	0	0	109.1	V1022 F1116	V1022-A1126 HydrophobicContact CG1-CB 4.24Å; V1022-A1126 HydrophobicContact CG2-CB 4.41Å; F1116-A1126 HydrophobicContact CD1-CB 3.79Å; F1116-A1126 HydrophobicContact CE1-CB 3.46Å; F1116-A1126 VanDerWaalsContact CE1-CB 3.46Å; F1116-A1126 HydrophobicContact CZ-CB 4.38Å
1127	V	94.9	Very high	91.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.8	176	175.4	0	0	0	0	109.7	Q1114 H1115 L1118 I1135 Y1138 F1191 F1198	Q1114-V1127 WeakPolarHBondContact CA-O 3.24Å; H1115-V1127 HydrophobicContact CB-CB 4.22Å; H1115-V1127 PolarHBondContact N-O 3.25Å; L1118-V1127 HydrophobicContact CD1-CB 3.94Å; L1118-V1127 HydrophobicContact CD1-CG2 3.74Å; V1127-I1135 HydrophobicContact CG1-CG1 3.79Å; V1127-Y1138 VanDerWaalsContact CG2-CB 3.45Å; V1127-Y1138 HydrophobicContact CG2-CD1 4.47Å; V1127-Y1138 HydrophobicContact CG2-CD2 3.81Å; V1127-Y1138 HydrophobicContact CG2-CG 3.64Å; V1127-F1191 HydrophobicContact CG2-CE2 4.07Å; V1127-F1198 HydrophobicContact CG1-CD1 4.16Å; V1127-F1198 HydrophobicContact CG1-CE1 3.67Å; V1127-F1198 HydrophobicContact CG1-CZ 3.9Å
1128	D	93.6	Very high	92.2	Very high	6 Å²	6	26.3 Å²	26.3	3%	0.032	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	113.1	179	-178.8	-28.8	0	0	0	107.9	E1113 Q1114 R1130 Q1131 T1134	E1113-D1128 WeakPolarHBondContact O-CA 3.46Å; Q1114-D1128 HydrophobicContact CG-CB 4.45Å; Q1114-D1128 PolarHBondContact NE2-OD2 3.03Å; D1128-R1130 PolarHBondContact O-N 2.84Å; D1128-R1130 VanDerWaalsContact OD1-CB 3.3Å; D1128-R1130 WeakPolarHBondContact OD1-CB 3.5Å; D1128-R1130 IonicContact OD1-CZ 2.69Å; D1128-R1130 PolarHBondContact OD1-N 3.26Å; D1128-R1130 VanDerWaalsContact OD1-N 3.1Å; D1128-R1130 IonicContact OD1-NE 3.65Å; D1128-R1130 PolarHBondContact OD1-NE 3.42Å; D1128-R1130 IonicContact OD1-NH2 3.14Å; D1128-R1130 PolarHBondContact OD1-NH2 3.49Å; D1128-R1130 IonicContact OD2-CZ 3.9Å; D1128-R1130 IonicContact OD2-NE 2.78Å; D1128-R1130 IonicContact OD2-NH2 3.83Å; D1128-R1130 PolarHBondContact OD2-NH2 2.78Å; D1128-Q1131 HydrophobicContact CB-CB 4.21Å; D1128-Q1131 HydrophobicContact CB-CG 4.32Å; D1128-Q1131 CarbonylContact O-C 2.95Å; D1128-Q1131 WeakPolarHBondContact O-CA 3.3Å; D1128-Q1131 PolarHBondContact O-N 3.09Å; D1128-Q1131 PolarHBondContact OD2-NE2 3.05Å; D1128-T1134 HydrophobicContact CB-CG2 4.29Å; D1128-T1134 PolarHBondContact N-OG1 2.83Å; D1128-T1134 PolarHBondContact O-OG1 2.85Å; D1128-T1134 VanDerWaalsContact O-OG1 3.11Å
1129	E	93.6	Very high	92.5	Very high	16 Å²	16	26 Å²	26	8%	0.075	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-25.8	-173.4	-65.3	-173.9	163	0	0	113.6	E1113 H1115 Q1131 F1198 F1303 N1305	E1113-E1129 HydrophobicContact CB-CB 4.09Å; E1113-E1129 HydrophobicContact CB-CG 4.27Å; E1113-E1129 PolarHBondContact O-N 2.96Å; H1115-E1129 IonicContact CE1-OE1 3.03Å; H1115-E1129 IonicContact NE2-OE1 3.82Å; H1115-E1129 PolarHBondContact NE2-OE1 2.86Å; E1129-Q1131 VanDerWaalsContact C-N 3.31Å; E1129-F1198 HydrophobicContact CG-CE1 4.26Å; E1129-F1198 HydrophobicContact CG-CZ 4.4Å; E1129-F1303 HydrophobicContact CB-CD1 4.44Å; E1129-F1303 HydrophobicContact CB-CE1 3.76Å; E1129-F1303 HydrophobicContact CB-CE2 4.07Å; E1129-F1303 HydrophobicContact CB-CZ 3.57Å; E1129-F1303 HydrophobicContact CG-CD1 4.38Å; E1129-F1303 HydrophobicContact CG-CD2 4.15Å; E1129-F1303 HydrophobicContact CG-CE1 4.13Å; E1129-F1303 HydrophobicContact CG-CE2 3.91Å; E1129-F1303 HydrophobicContact CG-CG 4.4Å; E1129-F1303 HydrophobicContact CG-CZ 3.92Å; E1129-F1303 WeakPolarHBondContact OE1-CD2 3.45Å; E1129-F1303 WeakPolarHBondContact OE2-CE2 3.44Å; E1129-N1305 VanDerWaalsContact OE1-CB 3.22Å; E1129-N1305 WeakPolarHBondContact OE1-CB 3.31Å; E1129-N1305 PolarHBondContact OE1-ND2 3.04Å
1130	R	91.5	Very high	93	Very high	141 Å²	141	22.6 Å²	22.6	53%	0.532	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-17	-177.9	-48.8	165.9	-59.5	168.9	8.5	111.6	E1113 D1128 P1132	E1113-R1130 HydrophobicContact CB-CG 4.39Å; D1128-R1130 PolarHBondContact O-N 2.84Å; D1128-R1130 VanDerWaalsContact OD1-CB 3.3Å; D1128-R1130 WeakPolarHBondContact OD1-CB 3.5Å; D1128-R1130 IonicContact OD1-CZ 2.69Å; D1128-R1130 PolarHBondContact OD1-N 3.26Å; D1128-R1130 VanDerWaalsContact OD1-N 3.1Å; D1128-R1130 IonicContact OD1-NE 3.65Å; D1128-R1130 PolarHBondContact OD1-NE 3.42Å; D1128-R1130 IonicContact OD1-NH2 3.14Å; D1128-R1130 PolarHBondContact OD1-NH2 3.49Å; D1128-R1130 IonicContact OD2-CZ 3.9Å; D1128-R1130 IonicContact OD2-NE 2.78Å; D1128-R1130 IonicContact OD2-NH2 3.83Å; D1128-R1130 PolarHBondContact OD2-NH2 2.78Å; R1130-P1132 WeakPolarHBondContact O-CD 3.46Å
1131	Q	93.7	Very high	93.4	Very high	44 Å²	44	20 Å²	20	21%	0.206	10%	0.098	C	C	.	.			trans	-115.8	86	-178.3	-62.2	-172.1	68.7	0	0	109.9	D1128 E1129 G1133 T1134 C1230	D1128-Q1131 HydrophobicContact CB-CB 4.21Å; D1128-Q1131 HydrophobicContact CB-CG 4.32Å; D1128-Q1131 CarbonylContact O-C 2.95Å; D1128-Q1131 WeakPolarHBondContact O-CA 3.3Å; D1128-Q1131 PolarHBondContact O-N 3.09Å; D1128-Q1131 PolarHBondContact OD2-NE2 3.05Å; E1129-Q1131 VanDerWaalsContact C-N 3.31Å; Q1131-G1133 PolarHBondContact O-N 3.45Å; Q1131-T1134 HydrophobicContact CB-CG2 3.75Å; Q1131-T1134 WeakPolarHBondContact O-CB 3.46Å; Q1131-T1134 WeakPolarHBondContact O-CG2 3.32Å; Q1131-T1134 PolarHBondContact O-N 2.98Å; Q1131-T1134 PolarHBondContact O-OG1 3.39Å; Q1131-C1230 PolarHBondContact OE1-O 3.42Å
1132	P	94.1	Very high	93.9	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.019	9%	0.094	C	C	.	.	H	α-helix	trans	-63.2	-16.6	-172.2	24.3	-34.4	0	0	0	114.7	R1130 T1134 F1245 I1301 L1316	R1130-P1132 WeakPolarHBondContact O-CD 3.46Å; P1132-T1134 VanDerWaalsContact C-N 3.27Å; P1132-T1134 PolarHBondContact O-N 3.2Å; P1132-F1245 HydrophobicContact CG-CD1 3.9Å; P1132-F1245 HydrophobicContact CG-CD2 3.82Å; P1132-F1245 HydrophobicContact CG-CE1 3.68Å; P1132-F1245 HydrophobicContact CG-CE2 3.62Å; P1132-F1245 HydrophobicContact CG-CG 3.98Å; P1132-F1245 HydrophobicContact CG-CZ 3.54Å; P1132-I1301 HydrophobicContact CB-CD1 3.48Å; P1132-I1301 VanDerWaalsContact CB-CD1 3.48Å; P1132-L1316 HydrophobicContact CB-CD1 3.95Å
1133	G	96.1	Very high	94.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.4	-34.1	169.4	0	0	0	0	0	113	Q1131 I1135 I1136 A1137 L1227 C1230	Q1131-G1133 PolarHBondContact O-N 3.45Å; G1133-I1135 VanDerWaalsContact C-N 3.35Å; G1133-I1135 PolarHBondContact O-N 2.91Å; G1133-I1136 PolarHBondContact O-N 2.64Å; G1133-I1136 VanDerWaalsContact O-N 3.17Å; G1133-A1137 WeakPolarHBondContact O-CB 3.35Å; G1133-A1137 PolarHBondContact O-N 2.99Å; G1133-L1227 CarbonylContact C-O 3.5Å; G1133-L1227 VanDerWaalsContact CA-O 3.3Å; G1133-L1227 WeakPolarHBondContact CA-O 3.14Å; G1133-C1230 PolarHBondContact N-SG 3.07Å
1134	T	96.3	Very high	94.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-64.5	-37.1	-178.2	65.5	0	0	0	0	112.6	D1128 Q1131 P1132 I1136 A1137 Y1138 L1227 A1228	D1128-T1134 HydrophobicContact CB-CG2 4.29Å; D1128-T1134 PolarHBondContact N-OG1 2.83Å; D1128-T1134 PolarHBondContact O-OG1 2.85Å; D1128-T1134 VanDerWaalsContact O-OG1 3.11Å; Q1131-T1134 HydrophobicContact CB-CG2 3.75Å; Q1131-T1134 WeakPolarHBondContact O-CB 3.46Å; Q1131-T1134 WeakPolarHBondContact O-CG2 3.32Å; Q1131-T1134 PolarHBondContact O-N 2.98Å; Q1131-T1134 PolarHBondContact O-OG1 3.39Å; P1132-T1134 VanDerWaalsContact C-N 3.27Å; P1132-T1134 PolarHBondContact O-N 3.2Å; T1134-I1136 VanDerWaalsContact C-N 3.33Å; T1134-I1136 PolarHBondContact O-N 3.48Å; T1134-A1137 PolarHBondContact O-N 2.94Å; T1134-Y1138 VanDerWaalsContact O-CB 3.3Å; T1134-Y1138 WeakPolarHBondContact O-CB 3.48Å; T1134-Y1138 PolarHBondContact O-N 3.48Å; T1134-L1227 PolarHBondContact N-O 2.58Å; T1134-A1228 WeakPolarHBondContact CG2-O 3.25Å
1135	I	97	Very high	94.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.9	-39.6	176.5	-62.3	169.7	0	0	0	110.4	V1127 G1133 A1139 F1191 F1198 I1301 F1303	V1127-I1135 HydrophobicContact CG1-CG1 3.79Å; G1133-I1135 VanDerWaalsContact C-N 3.35Å; G1133-I1135 PolarHBondContact O-N 2.91Å; I1135-A1139 WeakPolarHBondContact O-CB 3.16Å; I1135-A1139 PolarHBondContact O-N 3.04Å; I1135-A1139 VanDerWaalsContact O-N 3.14Å; I1135-F1191 HydrophobicContact CG2-CZ 4.08Å; I1135-F1198 HydrophobicContact CD1-CD1 4.09Å; I1135-F1198 HydrophobicContact CD1-CE1 4.25Å; I1135-F1198 HydrophobicContact CG1-CD1 4.08Å; I1135-F1198 HydrophobicContact CG1-CE1 4.34Å; I1135-I1301 HydrophobicContact CB-CD1 4.4Å; I1135-I1301 HydrophobicContact CD1-CD1 4.26Å; I1135-I1301 HydrophobicContact CG2-CB 4.03Å; I1135-I1301 HydrophobicContact CG2-CG2 3.96Å; I1135-F1303 HydrophobicContact CD1-CD1 3.81Å; I1135-F1303 HydrophobicContact CD1-CE1 4.44Å
1136	I	97.7	Very high	94.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-70.7	-45.1	175.9	-57.8	170.3	0	0	0	110.5	G1133 T1134 A1139 L1140 L1227 L1254 Y1299 I1301 L1316 V1318	G1133-I1136 PolarHBondContact O-N 2.64Å; G1133-I1136 VanDerWaalsContact O-N 3.17Å; T1134-I1136 VanDerWaalsContact C-N 3.33Å; T1134-I1136 PolarHBondContact O-N 3.48Å; I1136-A1139 PolarHBondContact O-N 2.74Å; I1136-L1140 HydrophobicContact CG2-CD1 3.89Å; I1136-L1140 HydrophobicContact CG2-CG 4.46Å; I1136-L1140 WeakPolarHBondContact O-CB 3.48Å; I1136-L1140 VanDerWaalsContact O-CG 3.31Å; I1136-L1140 WeakPolarHBondContact O-CG 3.48Å; I1136-L1140 PolarHBondContact O-N 2.82Å; I1136-L1227 HydrophobicContact CG2-CD1 3.94Å; I1136-L1254 HydrophobicContact CD1-CD2 4.12Å; I1136-Y1299 HydrophobicContact CD1-CD2 3.88Å; I1136-Y1299 HydrophobicContact CD1-CG 4.03Å; I1136-Y1299 HydrophobicContact CG1-CD2 4.5Å; I1136-Y1299 HydrophobicContact CG1-CG 4.24Å; I1136-Y1299 HydrophobicContact CG2-CD1 3.84Å; I1136-Y1299 HydrophobicContact CG2-CD2 4.04Å; I1136-Y1299 HydrophobicContact CG2-CE1 3.68Å; I1136-Y1299 HydrophobicContact CG2-CE2 3.87Å; I1136-Y1299 HydrophobicContact CG2-CG 4.02Å; I1136-I1301 HydrophobicContact CD1-CG2 4.4Å; I1136-I1301 HydrophobicContact CG1-CG2 3.7Å; I1136-L1316 HydrophobicContact CD1-CD1 4.06Å; I1136-V1318 HydrophobicContact CD1-CG2 4.49Å
1137	A	96.6	Very high	94.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.1	-46.2	178.2	0	0	0	0	0	111.8	V1125 G1133 T1134 L1140 A1141 V1224 L1227 A1228	V1125-A1137 HydrophobicContact CG1-CB 3.95Å; V1125-A1137 HydrophobicContact CG2-CB 4.21Å; G1133-A1137 WeakPolarHBondContact O-CB 3.35Å; G1133-A1137 PolarHBondContact O-N 2.99Å; T1134-A1137 PolarHBondContact O-N 2.94Å; A1137-L1140 CarbonylContact O-C 3.49Å; A1137-L1140 PolarHBondContact O-N 3.31Å; A1137-A1141 WeakPolarHBondContact O-CB 3.48Å; A1137-A1141 PolarHBondContact O-N 2.82Å; A1137-V1224 HydrophobicContact CB-CG1 4.25Å; A1137-V1224 WeakPolarHBondContact CB-O 3.22Å; A1137-V1224 WeakPolarHBondContact O-CG1 3.21Å; A1137-L1227 HydrophobicContact CB-CB 3.83Å; A1137-A1228 HydrophobicContact CB-CB 4.01Å
1138	Y	96.4	Very high	94	Very high	15 Å²	15	30.7 Å²	30.7	6%	0.059	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-46.2	177.6	-178.4	-82.1	0	0	0	111	L1118 P1119 V1125 V1127 T1134 L1140 A1141 T1142 F1191	L1118-Y1138 HydrophobicContact CB-CE2 3.65Å; L1118-Y1138 HydrophobicContact CD1-CD2 4.23Å; L1118-Y1138 HydrophobicContact CD1-CE2 3.97Å; L1118-Y1138 HydrophobicContact CG-CE2 4.39Å; P1119-Y1138 WeakPolarHBondContact CD-OH 3.34Å; P1119-Y1138 VanDerWaalsContact O-CE2 3.23Å; P1119-Y1138 WeakPolarHBondContact O-CE2 3.41Å; P1119-Y1138 PolarHBondContact O-OH 2.92Å; V1125-Y1138 HydrophobicContact CB-CD2 4.33Å; V1127-Y1138 VanDerWaalsContact CG2-CB 3.45Å; V1127-Y1138 HydrophobicContact CG2-CD1 4.47Å; V1127-Y1138 HydrophobicContact CG2-CD2 3.81Å; V1127-Y1138 HydrophobicContact CG2-CG 3.64Å; T1134-Y1138 VanDerWaalsContact O-CB 3.3Å; T1134-Y1138 WeakPolarHBondContact O-CB 3.48Å; T1134-Y1138 PolarHBondContact O-N 3.48Å; Y1138-L1140 VanDerWaalsContact C-N 3.32Å; Y1138-L1140 PolarHBondContact O-N 3Å; Y1138-A1141 WeakPolarHBondContact O-CA 3.4Å; Y1138-A1141 WeakPolarHBondContact O-CB 3.31Å; Y1138-A1141 PolarHBondContact O-N 2.8Å; Y1138-T1142 HydrophobicContact CD1-CG2 4.11Å; Y1138-T1142 HydrophobicContact CE1-CG2 3.78Å; Y1138-T1142 WeakPolarHBondContact O-CG2 3.06Å; Y1138-T1142 PolarHBondContact O-N 2.82Å; Y1138-T1142 VanDerWaalsContact O-N 3.11Å; Y1138-F1191 AromaticContact CD1-CD1 3.83Å; Y1138-F1191 HydrophobicContact CD1-CD1 3.83Å; Y1138-F1191 AromaticContact CD1-CD2 3.58Å; Y1138-F1191 HydrophobicContact CD1-CD2 3.58Å; Y1138-F1191 AromaticContact CD1-CE1 3.67Å; Y1138-F1191 HydrophobicContact CD1-CE1 3.67Å; Y1138-F1191 AromaticContact CD1-CE2 3.41Å; Y1138-F1191 HydrophobicContact CD1-CE2 3.41Å; Y1138-F1191 VanDerWaalsContact CD1-CE2 3.41Å; Y1138-F1191 AromaticContact CD1-CG 3.78Å; Y1138-F1191 HydrophobicContact CD1-CG 3.78Å; Y1138-F1191 AromaticContact CD1-CZ 3.44Å; Y1138-F1191 HydrophobicContact CD1-CZ 3.44Å; Y1138-F1191 VanDerWaalsContact CD1-CZ 3.44Å; Y1138-F1191 HydrophobicContact CE1-CB 3.92Å; Y1138-F1191 AromaticContact CE1-CD1 3.89Å; Y1138-F1191 HydrophobicContact CE1-CD1 3.89Å; Y1138-F1191 AromaticContact CE1-CD2 3.43Å; Y1138-F1191 HydrophobicContact CE1-CD2 3.43Å; Y1138-F1191 VanDerWaalsContact CE1-CD2 3.43Å; Y1138-F1191 HydrophobicContact CE1-CE1 4.22Å; Y1138-F1191 AromaticContact CE1-CE2 3.8Å; Y1138-F1191 HydrophobicContact CE1-CE2 3.8Å; Y1138-F1191 AromaticContact CE1-CG 3.48Å; Y1138-F1191 HydrophobicContact CE1-CG 3.48Å; Y1138-F1191 VanDerWaalsContact CE1-CG 3.48Å; Y1138-F1191 HydrophobicContact CE1-CZ 4.16Å; Y1138-F1191 HydrophobicContact CG-CD2 4.5Å; Y1138-F1191 HydrophobicContact CG-CE2 4.05Å; Y1138-F1191 HydrophobicContact CG-CZ 4.14Å
1139	A	96.5	Very high	93.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.9	-44.2	176.4	0	0	0	0	0	112.2	I1135 I1136 A1141 T1142 Y1145 V1189 F1191 C1200 M1202	I1135-A1139 WeakPolarHBondContact O-CB 3.16Å; I1135-A1139 PolarHBondContact O-N 3.04Å; I1135-A1139 VanDerWaalsContact O-N 3.14Å; I1136-A1139 PolarHBondContact O-N 2.74Å; A1139-A1141 VanDerWaalsContact C-N 3.26Å; A1139-A1141 PolarHBondContact O-N 2.83Å; A1139-T1142 PolarHBondContact O-N 2.82Å; A1139-T1142 PolarHBondContact O-OG1 2.87Å; A1139-Y1145 WeakPolarHBondContact O-CB 3.43Å; A1139-V1189 HydrophobicContact CB-CB 4.27Å; A1139-V1189 HydrophobicContact CB-CG1 4.29Å; A1139-F1191 HydrophobicContact CB-CE1 4.34Å; A1139-C1200 HydrophobicContact CB-CB 3.52Å; A1139-M1202 HydrophobicContact CB-CE 3.72Å
1140	L	96	Very high	93.4	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	17%	0.174	C	C	.	.	H	α-helix	trans	-71.3	-13.6	174.5	-67.3	170	0	0	0	114.1	I1136 A1137 Y1138 Y1145 M1202 F1223 V1224 L1227	I1136-L1140 HydrophobicContact CG2-CD1 3.89Å; I1136-L1140 HydrophobicContact CG2-CG 4.46Å; I1136-L1140 WeakPolarHBondContact O-CB 3.48Å; I1136-L1140 VanDerWaalsContact O-CG 3.31Å; I1136-L1140 WeakPolarHBondContact O-CG 3.48Å; I1136-L1140 PolarHBondContact O-N 2.82Å; A1137-L1140 CarbonylContact O-C 3.49Å; A1137-L1140 PolarHBondContact O-N 3.31Å; Y1138-L1140 VanDerWaalsContact C-N 3.32Å; Y1138-L1140 PolarHBondContact O-N 3Å; L1140-Y1145 HydrophobicContact CB-CD1 4.48Å; L1140-Y1145 HydrophobicContact CD2-CD1 4.3Å; L1140-Y1145 HydrophobicContact CD2-CD2 3.89Å; L1140-Y1145 HydrophobicContact CD2-CE1 3.94Å; L1140-Y1145 HydrophobicContact CD2-CE2 3.51Å; L1140-Y1145 HydrophobicContact CD2-CG 4.29Å; L1140-Y1145 WeakPolarHBondContact O-CD1 3.49Å; L1140-M1202 HydrophobicContact CD2-CE 3.86Å; L1140-M1202 HydrophobicContact CD2-SD 3.62Å; L1140-M1202 HydrophobicContact CG-CE 4.21Å; L1140-M1202 HydrophobicContact CG-SD 4.48Å; L1140-F1223 HydrophobicContact CD1-CD1 4.18Å; L1140-F1223 HydrophobicContact CD1-CE1 3.87Å; L1140-V1224 HydrophobicContact CB-CG2 3.72Å; L1140-L1227 HydrophobicContact CD1-CD1 4.11Å
1141	A	94.5	Very high	93.2	Very high	3 Å²	3	33.4 Å²	33.4	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-91.9	-15.6	174.5	0	0	0	0	0	113	G1121 K1122 V1123 V1125 A1137 Y1138 A1139 V1224	G1121-A1141 CarbonylContact C-O 3.6Å; G1121-A1141 VanDerWaalsContact CA-O 3.3Å; G1121-A1141 WeakPolarHBondContact CA-O 3.21Å; K1122-A1141 PolarHBondContact N-O 2.67Å; V1123-A1141 HydrophobicContact CB-CB 4.21Å; V1125-A1141 HydrophobicContact CG2-CB 4.13Å; A1137-A1141 WeakPolarHBondContact O-CB 3.48Å; A1137-A1141 PolarHBondContact O-N 2.82Å; Y1138-A1141 WeakPolarHBondContact O-CA 3.4Å; Y1138-A1141 WeakPolarHBondContact O-CB 3.31Å; Y1138-A1141 PolarHBondContact O-N 2.8Å; A1139-A1141 VanDerWaalsContact C-N 3.26Å; A1139-A1141 PolarHBondContact O-N 2.83Å; A1141-V1224 HydrophobicContact CB-CG1 4.16Å
1142	T	94.3	Very high	92.6	Very high	18 Å²	18	33 Å²	33	11%	0.11	18%	0.178	C	C	.	.	S	Bend	trans	-61.9	154.5	-176.3	61.6	0	0	0	0	113.4	Y1138 A1139 E1144 Y1145 Q1146 V1189	Y1138-T1142 HydrophobicContact CD1-CG2 4.11Å; Y1138-T1142 HydrophobicContact CE1-CG2 3.78Å; Y1138-T1142 WeakPolarHBondContact O-CG2 3.06Å; Y1138-T1142 PolarHBondContact O-N 2.82Å; Y1138-T1142 VanDerWaalsContact O-N 3.11Å; A1139-T1142 PolarHBondContact O-N 2.82Å; A1139-T1142 PolarHBondContact O-OG1 2.87Å; T1142-E1144 VanDerWaalsContact C-N 3.26Å; T1142-E1144 PolarHBondContact O-N 2.91Å; T1142-Y1145 PolarHBondContact O-N 2.94Å; T1142-Y1145 PolarHBondContact OG1-N 2.87Å; T1142-Y1145 VanDerWaalsContact OG1-N 3.16Å; T1142-Q1146 PolarHBondContact O-N 2.93Å; T1142-V1189 HydrophobicContact CG2-CG1 3.85Å
1143	N	89.9	Confident	91.7	Very high	107 Å²	107	35.9 Å²	35.9	57%	0.572	21%	0.208	S	C	*	.	H	α-helix	trans	-62.1	-35.4	171.4	-63.1	0.8	0	0	0	111.3	Y1145 Q1146 D1147	N1143-Y1145 PolarHBondContact O-N 2.87Å; N1143-Q1146 CarbonylContact O-C 3.47Å; N1143-Q1146 PolarHBondContact O-N 2.86Å; N1143-Q1146 VanDerWaalsContact O-N 3.09Å; N1143-D1147 WeakPolarHBondContact O-CB 3.41Å; N1143-D1147 VanDerWaalsContact O-CG 3.24Å; N1143-D1147 PolarHBondContact O-N 2.87Å
1144	E	91.7	Very high	90.6	Very high	98 Å²	98	38 Å²	38	46%	0.458	22%	0.219	S	C	.	.	H	α-helix	trans	-59.8	-43.7	175.9	178.4	170.8	-137.1	0	0	112.4	T1142 F1148 V1189	T1142-E1144 VanDerWaalsContact C-N 3.26Å; T1142-E1144 PolarHBondContact O-N 2.91Å; E1144-F1148 PolarHBondContact O-N 3.25Å; E1144-F1148 VanDerWaalsContact O-N 3.13Å; E1144-V1189 HydrophobicContact CG-CG2 4.39Å
1145	Y	93.4	Very high	89.7	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-67.9	-36.9	172.3	-179	-95.2	0	0	0	112.3	A1139 L1140 T1142 N1143 F1148 V1149 L1187 M1202 R1212 E1220	A1139-Y1145 WeakPolarHBondContact O-CB 3.43Å; L1140-Y1145 HydrophobicContact CB-CD1 4.48Å; L1140-Y1145 HydrophobicContact CD2-CD1 4.3Å; L1140-Y1145 HydrophobicContact CD2-CD2 3.89Å; L1140-Y1145 HydrophobicContact CD2-CE1 3.94Å; L1140-Y1145 HydrophobicContact CD2-CE2 3.51Å; L1140-Y1145 HydrophobicContact CD2-CG 4.29Å; L1140-Y1145 WeakPolarHBondContact O-CD1 3.49Å; T1142-Y1145 PolarHBondContact O-N 2.94Å; T1142-Y1145 PolarHBondContact OG1-N 2.87Å; T1142-Y1145 VanDerWaalsContact OG1-N 3.16Å; N1143-Y1145 PolarHBondContact O-N 2.87Å; Y1145-F1148 HydrophobicContact CD2-CD1 4.32Å; Y1145-F1148 HydrophobicContact CE2-CD1 4.15Å; Y1145-F1148 HydrophobicContact CE2-CE1 4.41Å; Y1145-F1148 WeakPolarHBondContact O-CB 3.3Å; Y1145-F1148 PolarHBondContact O-N 2.95Å; Y1145-V1149 HydrophobicContact CD1-CG2 3.99Å; Y1145-V1149 HydrophobicContact CE1-CG2 3.42Å; Y1145-V1149 VanDerWaalsContact CE1-CG2 3.42Å; Y1145-V1149 HydrophobicContact CE2-CG2 4.38Å; Y1145-V1149 WeakPolarHBondContact O-CG2 3.44Å; Y1145-V1149 PolarHBondContact O-N 3.33Å; Y1145-L1187 HydrophobicContact CD2-CD2 3.78Å; Y1145-L1187 HydrophobicContact CE2-CD2 4.5Å; Y1145-M1202 HydrophobicContact CD2-CE 3.78Å; Y1145-M1202 HydrophobicContact CD2-SD 3.65Å; Y1145-M1202 HydrophobicContact CE2-CE 4.44Å; Y1145-M1202 HydrophobicContact CE2-SD 3.79Å; Y1145-M1202 HydrophobicContact CG-CE 4.39Å; Y1145-R1212 PolarHBondContact OH-NH2 2.75Å; Y1145-E1220 WeakPolarHBondContact CE1-OE2 3.26Å; Y1145-E1220 VanDerWaalsContact OH-CD 3.22Å; Y1145-E1220 PolarHBondContact OH-OE1 3.43Å; Y1145-E1220 VanDerWaalsContact OH-OE1 3.1Å; Y1145-E1220 PolarHBondContact OH-OE2 3.09Å
1146	Q	90.2	Very high	88.4	Confident	33 Å²	33	46.4 Å²	46.4	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-67.8	-42.1	177.7	-177.6	56.3	34.3	0	0	112.6	K1122 T1142 N1143 F1148 V1149 D1150	K1122-Q1146 HydrophobicContact CD-CG 4.37Å; T1142-Q1146 PolarHBondContact O-N 2.93Å; N1143-Q1146 CarbonylContact O-C 3.47Å; N1143-Q1146 PolarHBondContact O-N 2.86Å; N1143-Q1146 VanDerWaalsContact O-N 3.09Å; Q1146-F1148 VanDerWaalsContact C-N 3.28Å; Q1146-F1148 PolarHBondContact O-N 3.26Å; Q1146-V1149 PolarHBondContact O-N 3.47Å; Q1146-V1149 VanDerWaalsContact O-N 3.12Å; Q1146-D1150 PolarHBondContact NE2-OD1 3.36Å; Q1146-D1150 PolarHBondContact NE2-OD2 2.92Å; Q1146-D1150 PolarHBondContact O-N 2.84Å
1147	D	89.9	Confident	87.2	Confident	110 Å²	110	53.7 Å²	53.7	59%	0.588	31%	0.305	S	S	*	.	H	α-helix	trans	-61.2	-39.2	174.3	-69.7	-29.6	0	0	0	110.3	N1143 S1151	N1143-D1147 WeakPolarHBondContact O-CB 3.41Å; N1143-D1147 VanDerWaalsContact O-CG 3.24Å; N1143-D1147 PolarHBondContact O-N 2.87Å; D1147-S1151 VanDerWaalsContact O-CB 3.29Å; D1147-S1151 WeakPolarHBondContact O-CB 3.33Å; D1147-S1151 PolarHBondContact O-N 3.02Å
1148	F	90.7	Very high	86.3	Confident	40 Å²	40	57.3 Å²	57.3	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-50.3	169.7	166.1	-96.4	0	0	0	111.7	E1144 Y1145 Q1146 D1150 S1151 L1152 L1187 P1205 K1206	E1144-F1148 PolarHBondContact O-N 3.25Å; E1144-F1148 VanDerWaalsContact O-N 3.13Å; Y1145-F1148 HydrophobicContact CD2-CD1 4.32Å; Y1145-F1148 HydrophobicContact CE2-CD1 4.15Å; Y1145-F1148 HydrophobicContact CE2-CE1 4.41Å; Y1145-F1148 WeakPolarHBondContact O-CB 3.3Å; Y1145-F1148 PolarHBondContact O-N 2.95Å; Q1146-F1148 VanDerWaalsContact C-N 3.28Å; Q1146-F1148 PolarHBondContact O-N 3.26Å; F1148-D1150 PolarHBondContact O-N 3.39Å; F1148-S1151 PolarHBondContact O-N 2.87Å; F1148-S1151 PolarHBondContact O-OG 2.97Å; F1148-L1152 HydrophobicContact CD1-CD1 4.45Å; F1148-L1152 HydrophobicContact CE1-CD1 3.82Å; F1148-L1152 HydrophobicContact CE2-CD1 4.43Å; F1148-L1152 HydrophobicContact CZ-CD1 3.82Å; F1148-L1152 HydrophobicContact CZ-CG 4.47Å; F1148-L1152 WeakPolarHBondContact O-CG 3.48Å; F1148-L1152 PolarHBondContact O-N 2.76Å; F1148-L1187 HydrophobicContact CB-CD2 3.95Å; F1148-L1187 HydrophobicContact CD1-CD2 3.92Å; F1148-L1187 HydrophobicContact CD2-CD2 4.31Å; F1148-L1187 HydrophobicContact CG-CD2 3.79Å; F1148-P1205 HydrophobicContact CE1-CB 3.87Å; F1148-P1205 HydrophobicContact CE1-CG 4.31Å; F1148-P1205 HydrophobicContact CE2-CG 4.34Å; F1148-P1205 HydrophobicContact CZ-CB 3.83Å; F1148-P1205 HydrophobicContact CZ-CG 3.77Å; F1148-K1206 HydrophobicContact CZ-CB 4.19Å
1149	V	88.4	Confident	85.2	Confident	27 Å²	27	57.2 Å²	57.2	16%	0.164	32%	0.324	C	S	.	.	H	α-helix	trans	-58.9	-46.4	178.5	169.9	0	0	0	0	111.5	Y1145 Q1146 S1151 L1152 L1209	Y1145-V1149 HydrophobicContact CD1-CG2 3.99Å; Y1145-V1149 HydrophobicContact CE1-CG2 3.42Å; Y1145-V1149 VanDerWaalsContact CE1-CG2 3.42Å; Y1145-V1149 HydrophobicContact CE2-CG2 4.38Å; Y1145-V1149 WeakPolarHBondContact O-CG2 3.44Å; Y1145-V1149 PolarHBondContact O-N 3.33Å; Q1146-V1149 PolarHBondContact O-N 3.47Å; Q1146-V1149 VanDerWaalsContact O-N 3.12Å; V1149-S1151 VanDerWaalsContact C-N 3.33Å; V1149-S1151 PolarHBondContact O-N 2.98Å; V1149-L1152 WeakPolarHBondContact O-CB 3.47Å; V1149-L1152 PolarHBondContact O-N 3.08Å; V1149-L1152 VanDerWaalsContact O-N 3.15Å; V1149-L1209 HydrophobicContact CG1-CD2 4.39Å; V1149-L1209 HydrophobicContact CG2-CD2 4.09Å
1150	D	86.8	Confident	84.1	Confident	102 Å²	102	59.4 Å²	59.4	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-70.3	-29.9	-178	-68.4	-23.8	0	0	0	111.9	Q1146 F1148 L1152 G1153	Q1146-D1150 PolarHBondContact NE2-OD1 3.36Å; Q1146-D1150 PolarHBondContact NE2-OD2 2.92Å; Q1146-D1150 PolarHBondContact O-N 2.84Å; F1148-D1150 PolarHBondContact O-N 3.39Å; D1150-L1152 PolarHBondContact O-N 2.81Å; D1150-G1153 PolarHBondContact O-N 3.03Å
1151	S	86.6	Confident	83.2	Confident	92 Å²	92	62.5 Å²	62.5	64%	0.643	36%	0.357	S	S	*	.	H	α-helix	trans	-65	-20.8	172.2	81	0	0	0	0	114	D1147 F1148 V1149	D1147-S1151 VanDerWaalsContact O-CB 3.29Å; D1147-S1151 WeakPolarHBondContact O-CB 3.33Å; D1147-S1151 PolarHBondContact O-N 3.02Å; F1148-S1151 PolarHBondContact O-N 2.87Å; F1148-S1151 PolarHBondContact O-OG 2.97Å; V1149-S1151 VanDerWaalsContact C-N 3.33Å; V1149-S1151 PolarHBondContact O-N 2.98Å
1152	L	82.6	Confident	82.5	Confident	35 Å²	35	63 Å²	63	18%	0.183	36%	0.359	C	S	.	.	H	α-helix	trans	-79.5	-30.6	179.6	-65.3	174.2	0	0	0	112.8	F1148 V1149 D1150 M1154 K1206 L1209	F1148-L1152 HydrophobicContact CD1-CD1 4.45Å; F1148-L1152 HydrophobicContact CE1-CD1 3.82Å; F1148-L1152 HydrophobicContact CE2-CD1 4.43Å; F1148-L1152 HydrophobicContact CZ-CD1 3.82Å; F1148-L1152 HydrophobicContact CZ-CG 4.47Å; F1148-L1152 WeakPolarHBondContact O-CG 3.48Å; F1148-L1152 PolarHBondContact O-N 2.76Å; V1149-L1152 WeakPolarHBondContact O-CB 3.47Å; V1149-L1152 PolarHBondContact O-N 3.08Å; V1149-L1152 VanDerWaalsContact O-N 3.15Å; D1150-L1152 PolarHBondContact O-N 2.81Å; L1152-M1154 HydrophobicContact CB-CG 4.05Å; L1152-M1154 HydrophobicContact CB-SD 4.17Å; L1152-M1154 HydrophobicContact CD1-SD 4.43Å; L1152-M1154 WeakPolarHBondContact O-CG 3.32Å; L1152-M1154 PolarHBondContact O-N 3.27Å; L1152-K1206 HydrophobicContact CD1-CB 4.42Å; L1152-K1206 HydrophobicContact CD1-CG 3.99Å; L1152-K1206 HydrophobicContact CD2-CD 3.65Å; L1152-K1206 HydrophobicContact CD2-CG 3.92Å; L1152-L1209 HydrophobicContact CD1-CD2 3.57Å
1153	G	73.8	Confident	81.7	Confident	63 Å²	63	62.1 Å²	62.1	65%	0.649	35%	0.354	S	S	*	.			trans	58.9	13.3	176.4	0	0	0	0	0	116.6	D1150	D1150-G1153 PolarHBondContact O-N 3.03Å
1154	M	73.3	Confident	80.9	Confident	44 Å²	44	60.6 Å²	60.6	22%	0.217	34%	0.342	C	S	.	.			trans	-72.3	128.4	-163.3	-70.4	174.5	57.6	0	0	114.1	L1152 D1158 I1159 L1162 K1206 A1210	L1152-M1154 HydrophobicContact CB-CG 4.05Å; L1152-M1154 HydrophobicContact CB-SD 4.17Å; L1152-M1154 HydrophobicContact CD1-SD 4.43Å; L1152-M1154 WeakPolarHBondContact O-CG 3.32Å; L1152-M1154 PolarHBondContact O-N 3.27Å; M1154-D1158 HydrophobicContact CB-CB 4.01Å; M1154-D1158 HydrophobicContact CE-CB 4.48Å; M1154-D1158 HydrophobicContact CG-CB 4.16Å; M1154-I1159 HydrophobicContact CB-CG1 4.46Å; M1154-I1159 HydrophobicContact CE-CB 4.35Å; M1154-I1159 HydrophobicContact CE-CG1 3.71Å; M1154-L1162 HydrophobicContact CE-CB 4.33Å; M1154-L1162 HydrophobicContact CE-CD2 3.77Å; M1154-L1162 HydrophobicContact SD-CD2 4.3Å; M1154-K1206 VanDerWaalsContact SD-CE 3.58Å; M1154-K1206 HydrophobicContact SD-CG 4.19Å; M1154-A1210 HydrophobicContact CE-CB 4.02Å
1155	D	77	Confident	80	Confident	91 Å²	91	61.3 Å²	61.3	49%	0.487	35%	0.345	S	S	.	.			trans	-92	-174	168.4	85.4	11.8	0	0	0	113.8	E1157 D1158 I1159	D1155-E1157 VanDerWaalsContact C-N 3.33Å; D1155-E1157 PolarHBondContact O-N 3.45Å; D1155-E1157 WeakPolarHBondContact OD1-CA 3.24Å; D1155-E1157 WeakPolarHBondContact OD1-CB 3.41Å; D1155-E1157 PolarHBondContact OD1-N 3.4Å; D1155-D1158 PolarHBondContact N-OD2 3.02Å; D1155-D1158 PolarHBondContact O-N 3.45Å; D1155-D1158 PolarHBondContact OD1-N 3.45Å; D1155-I1159 WeakPolarHBondContact O-CD1 3.4Å; D1155-I1159 VanDerWaalsContact O-CG1 3.25Å; D1155-I1159 WeakPolarHBondContact O-CG1 3.38Å; D1155-I1159 PolarHBondContact O-N 2.83Å
1156	S	70.1	Confident	78.7	Confident	87 Å²	87	61.2 Å²	61.2	61%	0.608	35%	0.345	S	S	*	.	H	α-helix	trans	-69.8	-25.2	-178.4	-164	0	0	0	0	113.9	Q1160	S1156-Q1160 VanDerWaalsContact O-CG 3.31Å; S1156-Q1160 WeakPolarHBondContact O-CG 3.32Å; S1156-Q1160 PolarHBondContact O-NE2 3.31Å
1157	E	72.9	Confident	77.4	Confident	153 Å²	153	61.1 Å²	61.1	72%	0.715	35%	0.35	S	S	*	.	H	α-helix	trans	-81.7	-38.5	172.6	-58.4	-158	162.3	0	0	110.7	D1155 Q1160 S1161	D1155-E1157 VanDerWaalsContact C-N 3.33Å; D1155-E1157 PolarHBondContact O-N 3.45Å; D1155-E1157 WeakPolarHBondContact OD1-CA 3.24Å; D1155-E1157 WeakPolarHBondContact OD1-CB 3.41Å; D1155-E1157 PolarHBondContact OD1-N 3.4Å; E1157-Q1160 WeakPolarHBondContact O-CB 3.35Å; E1157-Q1160 PolarHBondContact O-N 2.79Å; E1157-S1161 WeakPolarHBondContact O-CB 3.3Å; E1157-S1161 PolarHBondContact O-N 3.39Å
1158	D	77.2	Confident	76	Confident	76 Å²	76	59.4 Å²	59.4	41%	0.406	35%	0.347	S	S	.	.	H	α-helix	trans	-59	-47.1	173.6	-71.7	-43.9	0	0	0	112.5	M1154 D1155 Q1160 S1161 L1162	M1154-D1158 HydrophobicContact CB-CB 4.01Å; M1154-D1158 HydrophobicContact CE-CB 4.48Å; M1154-D1158 HydrophobicContact CG-CB 4.16Å; D1155-D1158 PolarHBondContact N-OD2 3.02Å; D1155-D1158 PolarHBondContact O-N 3.45Å; D1155-D1158 PolarHBondContact OD1-N 3.45Å; D1158-Q1160 PolarHBondContact O-N 2.68Å; D1158-S1161 WeakPolarHBondContact O-CB 3.45Å; D1158-S1161 PolarHBondContact O-N 3.25Å; D1158-S1161 VanDerWaalsContact O-N 3.1Å; D1158-L1162 WeakPolarHBondContact O-CB 3.13Å; D1158-L1162 PolarHBondContact O-N 3.13Å
1159	I	74	Confident	74.4	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.067	35%	0.347	C	S	.	.	H	α-helix	trans	-53.7	-43.6	175.6	-74.4	162.2	0	0	0	110.7	M1154 D1155 L1163 A1210 T1213 L1214	M1154-I1159 HydrophobicContact CB-CG1 4.46Å; M1154-I1159 HydrophobicContact CE-CB 4.35Å; M1154-I1159 HydrophobicContact CE-CG1 3.71Å; D1155-I1159 WeakPolarHBondContact O-CD1 3.4Å; D1155-I1159 VanDerWaalsContact O-CG1 3.25Å; D1155-I1159 WeakPolarHBondContact O-CG1 3.38Å; D1155-I1159 PolarHBondContact O-N 2.83Å; I1159-L1163 HydrophobicContact CG2-CD1 4.26Å; I1159-L1163 WeakPolarHBondContact O-CG 3.27Å; I1159-L1163 PolarHBondContact O-N 3.13Å; I1159-A1210 HydrophobicContact CG1-CB 4.43Å; I1159-A1210 HydrophobicContact CG2-CB 4.22Å; I1159-A1210 WeakPolarHBondContact CG2-O 3.3Å; I1159-T1213 HydrophobicContact CD1-CG2 3.47Å; I1159-T1213 VanDerWaalsContact CD1-CG2 3.47Å; I1159-L1214 HydrophobicContact CG2-CB 4.13Å
1160	Q	72.6	Confident	72.7	Confident	47 Å²	47	60.1 Å²	60.1	22%	0.22	36%	0.358	C	S	.	.	H	α-helix	trans	-72.2	-37.8	178.4	-69	-176.6	49.6	0	0	112.6	S1156 E1157 D1158 K1164 L1282	S1156-Q1160 VanDerWaalsContact O-CG 3.31Å; S1156-Q1160 WeakPolarHBondContact O-CG 3.32Å; S1156-Q1160 PolarHBondContact O-NE2 3.31Å; E1157-Q1160 WeakPolarHBondContact O-CB 3.35Å; E1157-Q1160 PolarHBondContact O-N 2.79Å; D1158-Q1160 PolarHBondContact O-N 2.68Å; Q1160-K1164 VanDerWaalsContact O-CB 3.31Å; Q1160-K1164 WeakPolarHBondContact O-CB 3.4Å; Q1160-K1164 WeakPolarHBondContact O-CD 3.37Å; Q1160-K1164 WeakPolarHBondContact O-CG 3.45Å; Q1160-K1164 PolarHBondContact O-N 3.38Å; Q1160-K1164 VanDerWaalsContact OE1-NZ 3.11Å; Q1160-L1282 HydrophobicContact CB-CD1 4.35Å; Q1160-L1282 HydrophobicContact CG-CB 4.33Å; Q1160-L1282 HydrophobicContact CG-CD1 4.21Å; Q1160-L1282 HydrophobicContact CG-CD2 3.95Å; Q1160-L1282 HydrophobicContact CG-CG 4.39Å; Q1160-L1282 PolarHBondContact OE1-O 3.34Å
1161	S	78.1	Confident	70.7	Confident	71 Å²	71	59.9 Å²	59.9	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-51.5	177.4	-166	0	0	0	0	110.7	E1157 D1158 L1163 K1164 E1165	E1157-S1161 WeakPolarHBondContact O-CB 3.3Å; E1157-S1161 PolarHBondContact O-N 3.39Å; D1158-S1161 WeakPolarHBondContact O-CB 3.45Å; D1158-S1161 PolarHBondContact O-N 3.25Å; D1158-S1161 VanDerWaalsContact O-N 3.1Å; S1161-L1163 PolarHBondContact O-N 3.43Å; S1161-K1164 CarbonylContact O-C 3.42Å; S1161-K1164 WeakPolarHBondContact O-CA 3.28Å; S1161-K1164 WeakPolarHBondContact O-CB 3.31Å; S1161-K1164 PolarHBondContact O-N 2.93Å; S1161-E1165 PolarHBondContact O-N 3.12Å
1162	L	79.3	Confident	68.7	Low	14 Å²	14	58.8 Å²	58.8	7%	0.073	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-44.7	179.5	-172.4	73.8	0	0	0	112.4	M1154 D1158 K1164 E1165 A1166 T1183 K1206 L1207 A1210	M1154-L1162 HydrophobicContact CE-CB 4.33Å; M1154-L1162 HydrophobicContact CE-CD2 3.77Å; M1154-L1162 HydrophobicContact SD-CD2 4.3Å; D1158-L1162 WeakPolarHBondContact O-CB 3.13Å; D1158-L1162 PolarHBondContact O-N 3.13Å; L1162-K1164 VanDerWaalsContact C-N 3.34Å; L1162-E1165 PolarHBondContact O-N 2.8Å; L1162-A1166 PolarHBondContact O-N 3.1Å; L1162-T1183 HydrophobicContact CD1-CG2 4.14Å; L1162-K1206 HydrophobicContact CD2-CD 4.1Å; L1162-K1206 HydrophobicContact CD2-CG 3.84Å; L1162-L1207 HydrophobicContact CD2-CD2 3.82Å; L1162-L1207 HydrophobicContact CG-CD2 3.87Å; L1162-A1210 HydrophobicContact CD2-CB 4.13Å
1163	L	77.7	Confident	66.7	Low	0 Å²	0	63.4 Å²	63.4	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-71.3	-27.5	178.1	-69.4	172.2	0	0	0	112.7	I1159 S1161 A1167 L1207 A1210 L1214 F1273 A1277 L1282	I1159-L1163 HydrophobicContact CG2-CD1 4.26Å; I1159-L1163 WeakPolarHBondContact O-CG 3.27Å; I1159-L1163 PolarHBondContact O-N 3.13Å; S1161-L1163 PolarHBondContact O-N 3.43Å; L1163-A1167 WeakPolarHBondContact O-CB 3.26Å; L1163-A1167 PolarHBondContact O-N 3.49Å; L1163-L1207 HydrophobicContact CD2-CD2 4.47Å; L1163-A1210 HydrophobicContact CD1-CB 4.46Å; L1163-A1210 HydrophobicContact CG-CB 4.41Å; L1163-L1214 HydrophobicContact CD1-CD2 3.54Å; L1163-F1273 HydrophobicContact CD2-CB 4.23Å; L1163-F1273 HydrophobicContact CD2-CD1 4.43Å; L1163-A1277 HydrophobicContact CB-CB 3.83Å; L1163-A1277 HydrophobicContact CD1-CB 4.49Å; L1163-L1282 HydrophobicContact CB-CD1 4.39Å
1164	K	72.1	Confident	64.9	Low	74 Å²	74	68.4 Å²	68.4	32%	0.322	40%	0.395	S	S	.	.	H	α-helix	trans	-76	-32.5	172.2	-71.5	163.2	-163	179.2	0	112	Q1160 S1161 L1162 A1167 S1168 L1282 N1283	Q1160-K1164 VanDerWaalsContact O-CB 3.31Å; Q1160-K1164 WeakPolarHBondContact O-CB 3.4Å; Q1160-K1164 WeakPolarHBondContact O-CD 3.37Å; Q1160-K1164 WeakPolarHBondContact O-CG 3.45Å; Q1160-K1164 PolarHBondContact O-N 3.38Å; Q1160-K1164 VanDerWaalsContact OE1-NZ 3.11Å; S1161-K1164 CarbonylContact O-C 3.42Å; S1161-K1164 WeakPolarHBondContact O-CA 3.28Å; S1161-K1164 WeakPolarHBondContact O-CB 3.31Å; S1161-K1164 PolarHBondContact O-N 2.93Å; L1162-K1164 VanDerWaalsContact C-N 3.34Å; K1164-A1167 WeakPolarHBondContact O-CB 3.28Å; K1164-A1167 PolarHBondContact O-N 3.21Å; K1164-S1168 PolarHBondContact O-N 3.2Å; K1164-L1282 VanDerWaalsContact CE-CB 3.46Å; K1164-L1282 PolarHBondContact NZ-O 3.37Å; K1164-N1283 WeakPolarHBondContact CE-OD1 3.43Å; K1164-N1283 PolarHBondContact NZ-OD1 3.02Å
1165	E	72.1	Confident	63.1	Low	113 Å²	113	70.1 Å²	70.1	53%	0.528	42%	0.424	S	S	.	.	H	α-helix	trans	-70.8	-44	174.1	-174.9	171.5	-148.9	0	0	111.7	S1161 L1162 A1167 S1168 S1169	S1161-E1165 PolarHBondContact O-N 3.12Å; L1162-E1165 PolarHBondContact O-N 2.8Å; E1165-A1167 PolarHBondContact O-N 3.37Å; E1165-S1168 PolarHBondContact O-N 3.04Å; E1165-S1168 PolarHBondContact O-OG 3.45Å; E1165-S1169 PolarHBondContact O-N 2.84Å
1166	A	67.5	Low	61.3	Low	0 Å²	0	74.6 Å²	74.6	0%	0	44%	0.439	C	S	.	.	H	α-helix	trans	-54.2	-40.4	168	0	0	0	0	0	111.4	L1162 S1169 L1179 L1207	L1162-A1166 PolarHBondContact O-N 3.1Å; A1166-S1169 PolarHBondContact O-OG 3.06Å; A1166-L1179 HydrophobicContact CB-CD2 4.18Å; A1166-L1207 HydrophobicContact CB-CD2 4.48Å
1167	A	61.6	Low	60	Low	32 Å²	32	73 Å²	73	26%	0.264	43%	0.431	S	S	.	.	H	α-helix	trans	-68.4	-43.5	177.4	0	0	0	0	0	114.7	L1163 K1164 E1165 S1169 S1170 A1274	L1163-A1167 WeakPolarHBondContact O-CB 3.26Å; L1163-A1167 PolarHBondContact O-N 3.49Å; K1164-A1167 WeakPolarHBondContact O-CB 3.28Å; K1164-A1167 PolarHBondContact O-N 3.21Å; E1165-A1167 PolarHBondContact O-N 3.37Å; A1167-S1169 VanDerWaalsContact C-N 3.32Å; A1167-S1169 PolarHBondContact O-N 2.84Å; A1167-S1170 PolarHBondContact O-N 3.09Å; A1167-S1170 PolarHBondContact O-OG 3.18Å; A1167-A1274 VanDerWaalsContact CA-CB 3.44Å; A1167-A1274 HydrophobicContact CB-CB 3.64Å
1168	S	61.9	Low	58.7	Low	74 Å²	74	71.6 Å²	71.6	52%	0.517	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-38.5	-179.4	67.1	0	0	0	0	111.9	K1164 E1165 S1170 S1171	K1164-S1168 PolarHBondContact O-N 3.2Å; E1165-S1168 PolarHBondContact O-N 3.04Å; E1165-S1168 PolarHBondContact O-OG 3.45Å; S1168-S1170 PolarHBondContact O-N 2.94Å; S1168-S1171 PolarHBondContact O-N 3.12Å; S1168-S1171 PolarHBondContact O-OG 3.25Å
1169	S	57.7	Low	57.7	Low	26 Å²	26	68.8 Å²	68.8	18%	0.182	42%	0.422	C	S	.	.	H	α-helix	trans	-55.7	-33.4	179.4	81.5	0	0	0	0	113.4	E1165 A1166 A1167 S1171 A1177	E1165-S1169 PolarHBondContact O-N 2.84Å; A1166-S1169 PolarHBondContact O-OG 3.06Å; A1167-S1169 VanDerWaalsContact C-N 3.32Å; A1167-S1169 PolarHBondContact O-N 2.84Å; S1169-S1171 PolarHBondContact O-N 3.4Å; S1169-S1171 VanDerWaalsContact O-N 3.15Å; S1169-A1177 WeakPolarHBondContact O-CB 3.34Å
1170	S	50.9	Low	57.1	Low	55 Å²	55	70.7 Å²	70.7	39%	0.385	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-8.1	-176.3	72.5	0	0	0	0	115.7	A1167 S1168	A1167-S1170 PolarHBondContact O-N 3.09Å; A1167-S1170 PolarHBondContact O-OG 3.18Å; S1168-S1170 PolarHBondContact O-N 2.94Å
1171	S	46.7	Very low	56.6	Low	98 Å²	98	75.6 Å²	75.6	69%	0.685	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-3.5	-164.3	68.2	0	0	0	0	116.1	S1168 S1169	S1168-S1171 PolarHBondContact O-N 3.12Å; S1168-S1171 PolarHBondContact O-OG 3.25Å; S1169-S1171 PolarHBondContact O-N 3.4Å; S1169-S1171 VanDerWaalsContact O-N 3.15Å
1172	S	43.7	Very low	56.1	Low	69 Å²	69	76.2 Å²	76.2	48%	0.483	46%	0.463	S	S	.	.			trans	-77.4	132.5	174.4	-176.2	0	0	0	0	111.7	E1174	S1172-E1174 PolarHBondContact O-N 3.46Å; S1172-E1174 PolarHBondContact OG-N 3.38Å; S1172-E1174 VanDerWaalsContact OG-N 3.16Å
1173	P	40.1	Very low	55.6	Low	131 Å²	131	75.8 Å²	75.8	85%	0.851	46%	0.461	S	S	*	.	S	Bend	trans	-66.9	-16.9	168.9	-18.6	32.5	0	0	0	113.8
1174	E	36	Very low	55.3	Low	168 Å²	168	76.9 Å²	76.9	79%	0.785	47%	0.468	S	S	*	.	S	Bend	trans	-112.2	67.8	-167.5	-70	175.2	-177.7	0	0	111.9	S1172 K1176	S1172-E1174 PolarHBondContact O-N 3.46Å; S1172-E1174 PolarHBondContact OG-N 3.38Å; S1172-E1174 VanDerWaalsContact OG-N 3.16Å; E1174-K1176 VanDerWaalsContact C-N 3.28Å; E1174-K1176 PolarHBondContact O-N 3.08Å
1175	G	35.9	Very low	55.7	Low	80 Å²	80	77.9 Å²	77.9	83%	0.825	48%	0.476	S	S	*	.	S	Bend	trans	65	-16.2	141	0	0	0	0	0	121.6
1176	K	39.8	Very low	56.4	Low	185 Å²	185	73.6 Å²	73.6	80%	0.804	46%	0.458	S	S	*	.			trans	-130.5	83.2	-174	-67.8	-168.4	175.8	-173.6	0	112.7	E1174 C1178	E1174-K1176 VanDerWaalsContact C-N 3.28Å; E1174-K1176 PolarHBondContact O-N 3.08Å; K1176-C1178 PolarHBondContact O-N 3.34Å
1177	A	42.8	Very low	57.5	Low	53 Å²	53	75 Å²	75	44%	0.438	47%	0.465	S	S	.	.			trans	-88.4	90.4	170.2	0	0	0	0	0	109.9	S1169 L1179	S1169-A1177 WeakPolarHBondContact O-CB 3.34Å; A1177-L1179 PolarHBondContact O-N 3.5Å; A1177-L1179 VanDerWaalsContact O-N 3.15Å
1178	C	46.1	Very low	59.1	Low	124 Å²	124	75.8 Å²	75.8	84%	0.838	46%	0.464	S	S	*	.			trans	-80.5	92.3	175.2	-157.6	0	0	0	0	110	K1176	K1176-C1178 PolarHBondContact O-N 3.34Å
1179	L	55.7	Low	60.6	Low	18 Å²	18	72.3 Å²	72.3	9%	0.094	44%	0.439	C	S	.	.			trans	-56.9	154.9	149	-79.4	171.5	0	0	0	108.4	A1166 A1177 E1181 T1183 T1184 L1207 P1270	A1166-L1179 HydrophobicContact CB-CD2 4.18Å; A1177-L1179 PolarHBondContact O-N 3.5Å; A1177-L1179 VanDerWaalsContact O-N 3.15Å; L1179-E1181 PolarHBondContact O-N 2.89Å; L1179-T1183 HydrophobicContact CD2-CG2 4.48Å; L1179-T1184 HydrophobicContact CB-CG2 3.86Å; L1179-T1184 HydrophobicContact CD1-CG2 3.8Å; L1179-L1207 HydrophobicContact CD1-CD1 4.31Å; L1179-P1270 HydrophobicContact CD1-CB 4.06Å; L1179-P1270 HydrophobicContact CD1-CG 3.83Å
1180	S	61.9	Low	62.3	Low	52 Å²	52	75.6 Å²	75.6	36%	0.364	45%	0.451	S	S	.	.			trans	-60.9	138.1	169.4	79.7	0	0	0	0	109.1	S1182 T1183	S1180-S1182 PolarHBondContact O-N 3.24Å; S1180-S1182 PolarHBondContact OG-OG 2.84Å; S1180-T1183 WeakPolarHBondContact O-CA 3.49Å; S1180-T1183 WeakPolarHBondContact O-CB 3.39Å; S1180-T1183 PolarHBondContact O-N 3.37Å; S1180-T1183 WeakPolarHBondContact OG-CB 3.32Å; S1180-T1183 PolarHBondContact OG-N 3.42Å; S1180-T1183 PolarHBondContact OG-OG1 2.99Å
1181	E	61.6	Low	64.4	Low	151 Å²	151	73.9 Å²	73.9	71%	0.706	44%	0.437	S	S	*	.	H	α-helix	trans	-55.8	-39	-178.8	-161.9	163.5	-144.5	0	0	110.9	L1179 T1183 T1184 I1185	L1179-E1181 PolarHBondContact O-N 2.89Å; E1181-T1183 PolarHBondContact O-N 3.17Å; E1181-T1183 VanDerWaalsContact O-N 3.12Å; E1181-T1184 PolarHBondContact O-N 3.43Å; E1181-T1184 PolarHBondContact O-OG1 2.89Å; E1181-I1185 HydrophobicContact CG-CD1 4.34Å; E1181-I1185 VanDerWaalsContact O-CG1 3.32Å; E1181-I1185 WeakPolarHBondContact O-CG1 3.25Å; E1181-I1185 PolarHBondContact O-N 2.74Å
1182	S	67.5	Low	66.6	Low	84 Å²	84	72.5 Å²	72.5	59%	0.587	43%	0.428	S	S	*	.	H	α-helix	trans	-59.9	-13.3	171.1	55.8	0	0	0	0	116.5	S1180	S1180-S1182 PolarHBondContact O-N 3.24Å; S1180-S1182 PolarHBondContact OG-OG 2.84Å
1183	T	69.1	Low	68.7	Low	4 Å²	4	70.9 Å²	70.9	3%	0.025	41%	0.414	C	S	.	.	H	α-helix	trans	-98.1	-16.9	175.3	-59.5	0	0	0	0	111.8	L1162 L1179 S1180 E1181 L1207	L1162-T1183 HydrophobicContact CD1-CG2 4.14Å; L1179-T1183 HydrophobicContact CD2-CG2 4.48Å; S1180-T1183 WeakPolarHBondContact O-CA 3.49Å; S1180-T1183 WeakPolarHBondContact O-CB 3.39Å; S1180-T1183 PolarHBondContact O-N 3.37Å; S1180-T1183 WeakPolarHBondContact OG-CB 3.32Å; S1180-T1183 PolarHBondContact OG-N 3.42Å; S1180-T1183 PolarHBondContact OG-OG1 2.99Å; E1181-T1183 PolarHBondContact O-N 3.17Å; E1181-T1183 VanDerWaalsContact O-N 3.12Å; T1183-L1207 HydrophobicContact CG2-CD1 3.89Å; T1183-L1207 HydrophobicContact CG2-CD2 3.81Å; T1183-L1207 HydrophobicContact CG2-CG 3.65Å
1184	T	71.6	Confident	70.8	Confident	24 Å²	24	68.1 Å²	68.1	15%	0.147	40%	0.397	C	S	.	.	H	α-helix	trans	-104.8	-23.4	-178.7	49.6	0	0	0	0	114.4	L1179 E1181 P1186 F1204	L1179-T1184 HydrophobicContact CB-CG2 3.86Å; L1179-T1184 HydrophobicContact CD1-CG2 3.8Å; E1181-T1184 PolarHBondContact O-N 3.43Å; E1181-T1184 PolarHBondContact O-OG1 2.89Å; T1184-P1186 WeakPolarHBondContact O-CD 3.41Å; T1184-F1204 HydrophobicContact CG2-CE1 4.18Å
1185	I	79.7	Confident	73.3	Confident	94 Å²	94	60.6 Å²	60.6	48%	0.482	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-54.9	125.4	176.1	-74.9	162.3	0	0	0	110.3	E1181 P1205	E1181-I1185 HydrophobicContact CG-CD1 4.34Å; E1181-I1185 VanDerWaalsContact O-CG1 3.32Å; E1181-I1185 WeakPolarHBondContact O-CG1 3.25Å; E1181-I1185 PolarHBondContact O-N 2.74Å; I1185-P1205 WeakPolarHBondContact O-CD 3.49Å
1186	P	86.7	Confident	76	Confident	24 Å²	24	56.9 Å²	56.9	16%	0.156	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.1	147	170	-17.1	31.4	0	0	0	111.3	T1184 K1201 M1202 Y1203	T1184-P1186 WeakPolarHBondContact O-CD 3.41Å; P1186-K1201 HydrophobicContact CB-CD 4.35Å; P1186-K1201 HydrophobicContact CB-CG 3.92Å; P1186-M1202 VanDerWaalsContact CA-O 3.22Å; P1186-M1202 WeakPolarHBondContact CA-O 3.37Å; P1186-M1202 WeakPolarHBondContact CB-O 3.47Å; P1186-Y1203 HydrophobicContact CG-CD1 4.27Å
1187	L	91.4	Very high	78.6	Confident	30 Å²	30	51.9 Å²	51.9	16%	0.157	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	131	167.7	177.2	61.7	0	0	0	108.6	Y1145 F1148 V1189 K1201 M1202 P1205	Y1145-L1187 HydrophobicContact CD2-CD2 3.78Å; Y1145-L1187 HydrophobicContact CE2-CD2 4.5Å; F1148-L1187 HydrophobicContact CB-CD2 3.95Å; F1148-L1187 HydrophobicContact CD1-CD2 3.92Å; F1148-L1187 HydrophobicContact CD2-CD2 4.31Å; F1148-L1187 HydrophobicContact CG-CD2 3.79Å; L1187-V1189 HydrophobicContact CG-CG2 4.33Å; L1187-K1201 CarbonylContact O-C 3.57Å; L1187-K1201 WeakPolarHBondContact O-CA 3.47Å; L1187-M1202 HydrophobicContact CD2-SD 4.47Å; L1187-M1202 PolarHBondContact N-O 3.3Å; L1187-M1202 VanDerWaalsContact N-O 3.08Å; L1187-M1202 PolarHBondContact O-N 3Å; L1187-P1205 HydrophobicContact CB-CB 4.26Å; L1187-P1205 HydrophobicContact CB-CG 3.87Å
1188	E	93.5	Very high	81.1	Confident	48 Å²	48	49.4 Å²	49.4	22%	0.224	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.7	177.2	-171.9	176.9	118.3	0	0	109.3	Q1190 Y1199 K1201	E1188-Q1190 PolarHBondContact OE1-NE2 3.14Å; E1188-Y1199 HydrophobicContact CG-CD2 4.4Å; E1188-Y1199 HydrophobicContact CG-CE2 3.76Å; E1188-Y1199 VanDerWaalsContact OE1-CE2 3.23Å; E1188-Y1199 WeakPolarHBondContact OE1-CE2 3.47Å; E1188-Y1199 WeakPolarHBondContact OE2-CE2 3.35Å; E1188-Y1199 PolarHBondContact OE2-OH 2.95Å; E1188-K1201 HydrophobicContact CB-CB 4.46Å; E1188-K1201 HydrophobicContact CB-CG 4.35Å; E1188-K1201 HydrophobicContact CG-CB 4.25Å; E1188-K1201 WeakPolarHBondContact OE2-CD 3.43Å; E1188-K1201 IonicContact OE2-NZ 2.81Å; E1188-K1201 PolarHBondContact OE2-NZ 3.39Å
1189	V	93.9	Very high	83.4	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126	179.4	177.6	0	0	0	0	107.8	A1139 T1142 E1144 L1187 F1191 C1200 M1202	A1139-V1189 HydrophobicContact CB-CB 4.27Å; A1139-V1189 HydrophobicContact CB-CG1 4.29Å; T1142-V1189 HydrophobicContact CG2-CG1 3.85Å; E1144-V1189 HydrophobicContact CG-CG2 4.39Å; L1187-V1189 HydrophobicContact CG-CG2 4.33Å; V1189-F1191 HydrophobicContact CG1-CD1 4.24Å; V1189-C1200 PolarHBondContact N-O 3.32Å; V1189-C1200 PolarHBondContact O-N 2.85Å; V1189-M1202 HydrophobicContact CG2-CE 3.94Å
1190	Q	94	Very high	85.3	Confident	94 Å²	94	42.7 Å²	42.7	44%	0.439	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.6	176.9	-60.9	-173.1	24.3	0	0	109.8	E1188 Y1199	E1188-Q1190 PolarHBondContact OE1-NE2 3.14Å; Q1190-Y1199 HydrophobicContact CG-CD2 4.3Å
1191	F	94.1	Very high	86.9	Confident	20 Å²	20	40.9 Å²	40.9	9%	0.088	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	156.5	-179.1	56.9	-84.9	0	0	0	111.2	L1118 V1127 I1135 Y1138 A1139 V1189 F1198	L1118-F1191 HydrophobicContact CD1-CD2 3.9Å; L1118-F1191 HydrophobicContact CD1-CE2 3.96Å; L1118-F1191 HydrophobicContact CD2-CD2 4.01Å; V1127-F1191 HydrophobicContact CG2-CE2 4.07Å; I1135-F1191 HydrophobicContact CG2-CZ 4.08Å; Y1138-F1191 AromaticContact CD1-CD1 3.83Å; Y1138-F1191 HydrophobicContact CD1-CD1 3.83Å; Y1138-F1191 AromaticContact CD1-CD2 3.58Å; Y1138-F1191 HydrophobicContact CD1-CD2 3.58Å; Y1138-F1191 AromaticContact CD1-CE1 3.67Å; Y1138-F1191 HydrophobicContact CD1-CE1 3.67Å; Y1138-F1191 AromaticContact CD1-CE2 3.41Å; Y1138-F1191 HydrophobicContact CD1-CE2 3.41Å; Y1138-F1191 VanDerWaalsContact CD1-CE2 3.41Å; Y1138-F1191 AromaticContact CD1-CG 3.78Å; Y1138-F1191 HydrophobicContact CD1-CG 3.78Å; Y1138-F1191 AromaticContact CD1-CZ 3.44Å; Y1138-F1191 HydrophobicContact CD1-CZ 3.44Å; Y1138-F1191 VanDerWaalsContact CD1-CZ 3.44Å; Y1138-F1191 HydrophobicContact CE1-CB 3.92Å; Y1138-F1191 AromaticContact CE1-CD1 3.89Å; Y1138-F1191 HydrophobicContact CE1-CD1 3.89Å; Y1138-F1191 AromaticContact CE1-CD2 3.43Å; Y1138-F1191 HydrophobicContact CE1-CD2 3.43Å; Y1138-F1191 VanDerWaalsContact CE1-CD2 3.43Å; Y1138-F1191 HydrophobicContact CE1-CE1 4.22Å; Y1138-F1191 AromaticContact CE1-CE2 3.8Å; Y1138-F1191 HydrophobicContact CE1-CE2 3.8Å; Y1138-F1191 AromaticContact CE1-CG 3.48Å; Y1138-F1191 HydrophobicContact CE1-CG 3.48Å; Y1138-F1191 VanDerWaalsContact CE1-CG 3.48Å; Y1138-F1191 HydrophobicContact CE1-CZ 4.16Å; Y1138-F1191 HydrophobicContact CG-CD2 4.5Å; Y1138-F1191 HydrophobicContact CG-CE2 4.05Å; Y1138-F1191 HydrophobicContact CG-CZ 4.14Å; A1139-F1191 HydrophobicContact CB-CE1 4.34Å; V1189-F1191 HydrophobicContact CG1-CD1 4.24Å; F1191-F1198 HydrophobicContact CD1-CB 4.08Å; F1191-F1198 HydrophobicContact CD2-CB 3.58Å; F1191-F1198 AromaticContact CD2-CD2 3.78Å; F1191-F1198 HydrophobicContact CD2-CD2 3.78Å; F1191-F1198 AromaticContact CD2-CG 3.89Å; F1191-F1198 HydrophobicContact CD2-CG 3.89Å; F1191-F1198 HydrophobicContact CE1-CB 3.85Å; F1191-F1198 HydrophobicContact CE2-CB 3.3Å; F1191-F1198 HydrophobicContact CE2-CD1 4.15Å; F1191-F1198 AromaticContact CE2-CD2 3.66Å; F1191-F1198 HydrophobicContact CE2-CD2 3.66Å; F1191-F1198 AromaticContact CE2-CG 3.43Å; F1191-F1198 HydrophobicContact CE2-CG 3.43Å; F1191-F1198 VanDerWaalsContact CE2-CG 3.43Å; F1191-F1198 HydrophobicContact CG-CB 3.97Å; F1191-F1198 HydrophobicContact CZ-CB 3.47Å; F1191-F1198 VanDerWaalsContact CZ-CB 3.47Å; F1191-F1198 HydrophobicContact CZ-CD1 4.44Å; F1191-F1198 AromaticContact CZ-CG 3.95Å; F1191-F1198 HydrophobicContact CZ-CG 3.95Å; F1191-F1198 PolarHBondContact N-O 2.75Å; F1191-F1198 WeakPolarHBondContact O-CA 3.38Å; F1191-F1198 WeakPolarHBondContact O-CB 3.46Å; F1191-F1198 PolarHBondContact O-N 3.24Å
1192	S	93	Very high	88.6	Confident	69 Å²	69	33.9 Å²	33.9	48%	0.483	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	152.2	-177	58.1	0	0	0	0	112	A1196	S1192-A1196 VanDerWaalsContact CA-O 3.25Å; S1192-A1196 WeakPolarHBondContact CA-O 3.22Å; S1192-A1196 WeakPolarHBondContact CB-O 3.5Å
1193	D	89	Confident	89.8	Confident	35 Å²	35	31.1 Å²	31.1	19%	0.187	17%	0.17	C	C	.	.			trans	-112.9	-161.5	161.3	68.6	7.9	0	0	0	110.4	H1115 C1117 L1118 A1195 A1196	H1115-D1193 WeakPolarHBondContact CB-OD2 3.42Å; H1115-D1193 IonicContact CG-OD2 3.43Å; H1115-D1193 IonicContact ND1-OD1 2.68Å; H1115-D1193 PolarHBondContact ND1-OD1 2.91Å; H1115-D1193 IonicContact ND1-OD2 3.19Å; H1115-D1193 PolarHBondContact ND1-OD2 3.01Å; C1117-D1193 HydrophobicContact CB-CB 4.31Å; L1118-D1193 HydrophobicContact CD2-CB 4.04Å; L1118-D1193 HydrophobicContact CG-CB 4.45Å; D1193-A1195 PolarHBondContact O-N 3.09Å; D1193-A1195 WeakPolarHBondContact OD1-CA 3.2Å; D1193-A1195 WeakPolarHBondContact OD1-CB 3.46Å; D1193-A1195 PolarHBondContact OD1-N 2.9Å; D1193-A1196 PolarHBondContact N-O 3.01Å; D1193-A1196 VanDerWaalsContact N-O 3.1Å; D1193-A1196 PolarHBondContact OD1-N 2.85Å
1194	S	83.4	Confident	91	Very high	72 Å²	72	31.6 Å²	31.6	50%	0.503	17%	0.171	S	C	.	.	S	Bend	trans	-78.8	-1.9	177.7	52.5	0	0	0	0	114.4	F1033	F1033-S1194 WeakPolarHBondContact CE2-OG 3.43Å
1195	A	88	Confident	91.9	Very high	10 Å²	10	30.8 Å²	30.8	8%	0.083	17%	0.166	C	C	.	.	S	Bend	trans	-110.6	-46.1	179.4	0	0	0	0	0	112.2	D1193 S1306 Q1307	D1193-A1195 PolarHBondContact O-N 3.09Å; D1193-A1195 WeakPolarHBondContact OD1-CA 3.2Å; D1193-A1195 WeakPolarHBondContact OD1-CB 3.46Å; D1193-A1195 PolarHBondContact OD1-N 2.9Å; A1195-S1306 PolarHBondContact O-N 3Å; A1195-Q1307 HydrophobicContact CB-CG 3.98Å
1196	A	92.3	Very high	92.5	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151	-171.1	0	0	0	0	0	114.2	S1192 D1193 F1198 K1304 N1305	S1192-A1196 VanDerWaalsContact CA-O 3.25Å; S1192-A1196 WeakPolarHBondContact CA-O 3.22Å; S1192-A1196 WeakPolarHBondContact CB-O 3.5Å; D1193-A1196 PolarHBondContact N-O 3.01Å; D1193-A1196 VanDerWaalsContact N-O 3.1Å; D1193-A1196 PolarHBondContact OD1-N 2.85Å; A1196-F1198 HydrophobicContact CB-CD2 4.43Å; A1196-F1198 HydrophobicContact CB-CE2 3.59Å; A1196-F1198 HydrophobicContact CB-CZ 3.69Å; A1196-K1304 WeakPolarHBondContact CA-O 3.44Å; A1196-N1305 HydrophobicContact CB-CB 3.9Å
1197	Q	94.5	Very high	92.7	Very high	81 Å²	81	27.1 Å²	27.1	38%	0.379	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.7	169.8	-66.1	176.9	-22.1	0	0	109.4	W220 F1303 K1304	W220-Q1197 HydrophobicContact CH2-CB 4.11Å; W220-Q1197 HydrophobicContact CZ2-CB 3.88Å; Q1197-F1303 CarbonylContact O-C 3.46Å; Q1197-F1303 WeakPolarHBondContact O-CA 3.29Å; Q1197-F1303 WeakPolarHBondContact O-CB 3.39Å; Q1197-K1304 PolarHBondContact N-O 3.04Å; Q1197-K1304 PolarHBondContact O-N 2.81Å
1198	F	95.6	Very high	92.8	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	152.6	-175.3	-64	-86.4	0	0	0	112.1	H1115 V1127 E1129 I1135 F1191 A1196 F1303	H1115-F1198 HydrophobicContact CB-CE2 4.37Å; H1115-F1198 HydrophobicContact CB-CZ 4.45Å; H1115-F1198 AromaticContact CD2-CZ 3.51Å; H1115-F1198 AromaticContact CG-CE2 3.86Å; H1115-F1198 AromaticContact CG-CZ 3.69Å; H1115-F1198 AromaticContact ND1-CE2 3.97Å; H1115-F1198 AromaticContact ND1-CZ 4Å; H1115-F1198 AromaticContact NE2-CZ 3.74Å; V1127-F1198 HydrophobicContact CG1-CD1 4.16Å; V1127-F1198 HydrophobicContact CG1-CE1 3.67Å; V1127-F1198 HydrophobicContact CG1-CZ 3.9Å; E1129-F1198 HydrophobicContact CG-CE1 4.26Å; E1129-F1198 HydrophobicContact CG-CZ 4.4Å; I1135-F1198 HydrophobicContact CD1-CD1 4.09Å; I1135-F1198 HydrophobicContact CD1-CE1 4.25Å; I1135-F1198 HydrophobicContact CG1-CD1 4.08Å; I1135-F1198 HydrophobicContact CG1-CE1 4.34Å; F1191-F1198 HydrophobicContact CD1-CB 4.08Å; F1191-F1198 HydrophobicContact CD2-CB 3.58Å; F1191-F1198 AromaticContact CD2-CD2 3.78Å; F1191-F1198 HydrophobicContact CD2-CD2 3.78Å; F1191-F1198 AromaticContact CD2-CG 3.89Å; F1191-F1198 HydrophobicContact CD2-CG 3.89Å; F1191-F1198 HydrophobicContact CE1-CB 3.85Å; F1191-F1198 HydrophobicContact CE2-CB 3.3Å; F1191-F1198 HydrophobicContact CE2-CD1 4.15Å; F1191-F1198 AromaticContact CE2-CD2 3.66Å; F1191-F1198 HydrophobicContact CE2-CD2 3.66Å; F1191-F1198 AromaticContact CE2-CG 3.43Å; F1191-F1198 HydrophobicContact CE2-CG 3.43Å; F1191-F1198 VanDerWaalsContact CE2-CG 3.43Å; F1191-F1198 HydrophobicContact CG-CB 3.97Å; F1191-F1198 HydrophobicContact CZ-CB 3.47Å; F1191-F1198 VanDerWaalsContact CZ-CB 3.47Å; F1191-F1198 HydrophobicContact CZ-CD1 4.44Å; F1191-F1198 AromaticContact CZ-CG 3.95Å; F1191-F1198 HydrophobicContact CZ-CG 3.95Å; F1191-F1198 PolarHBondContact N-O 2.75Å; F1191-F1198 WeakPolarHBondContact O-CA 3.38Å; F1191-F1198 WeakPolarHBondContact O-CB 3.46Å; F1191-F1198 PolarHBondContact O-N 3.24Å; A1196-F1198 HydrophobicContact CB-CD2 4.43Å; A1196-F1198 HydrophobicContact CB-CE2 3.59Å; A1196-F1198 HydrophobicContact CB-CZ 3.69Å; F1198-F1303 HydrophobicContact CD1-CB 3.51Å; F1198-F1303 HydrophobicContact CD1-CG 4.41Å; F1198-F1303 HydrophobicContact CE1-CB 3.63Å; F1198-F1303 HydrophobicContact CE1-CD1 4.47Å; F1198-F1303 HydrophobicContact CE1-CG 4.14Å; F1198-F1303 HydrophobicContact CG-CB 4.32Å
1199	Y	94.9	Very high	92.7	Very high	1 Å²	1	24.3 Å²	24.3	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	132.1	-174.6	177.2	-84.7	0	0	0	110	P218 L221 E1188 Q1190 K1201 R1300 I1301 G1302	P218-Y1199 HydrophobicContact CG-CD2 3.8Å; P218-Y1199 HydrophobicContact CG-CE2 3.92Å; L221-Y1199 HydrophobicContact CD2-CD1 4.21Å; L221-Y1199 HydrophobicContact CD2-CD2 4.12Å; L221-Y1199 HydrophobicContact CD2-CE1 4.26Å; L221-Y1199 HydrophobicContact CD2-CE2 4.15Å; L221-Y1199 HydrophobicContact CD2-CG 4.14Å; E1188-Y1199 HydrophobicContact CG-CD2 4.4Å; E1188-Y1199 HydrophobicContact CG-CE2 3.76Å; E1188-Y1199 VanDerWaalsContact OE1-CE2 3.23Å; E1188-Y1199 WeakPolarHBondContact OE1-CE2 3.47Å; E1188-Y1199 WeakPolarHBondContact OE2-CE2 3.35Å; E1188-Y1199 PolarHBondContact OE2-OH 2.95Å; Q1190-Y1199 HydrophobicContact CG-CD2 4.3Å; Y1199-K1201 HydrophobicContact CE1-CB 3.77Å; Y1199-K1201 VanDerWaalsContact OH-CD 3.3Å; Y1199-K1201 WeakPolarHBondContact OH-CD 3.22Å; Y1199-R1300 HydrophobicContact CD1-CG 4.48Å; Y1199-R1300 HydrophobicContact CE1-CB 4.37Å; Y1199-R1300 HydrophobicContact CE1-CG 3.91Å; Y1199-I1301 VanDerWaalsContact O-CA 3.26Å; Y1199-I1301 WeakPolarHBondContact O-CA 3.39Å; Y1199-G1302 PolarHBondContact N-O 3.46Å; Y1199-G1302 PolarHBondContact O-N 3.44Å
1200	C	96.6	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	112.2	170.8	-171.9	0	0	0	0	111.4	A1139 V1189 R1300 I1301	A1139-C1200 HydrophobicContact CB-CB 3.52Å; V1189-C1200 PolarHBondContact N-O 3.32Å; V1189-C1200 PolarHBondContact O-N 2.85Å; C1200-R1300 CarbonylContact C-O 3.6Å; C1200-R1300 WeakPolarHBondContact CA-O 3.38Å; C1200-I1301 HydrophobicContact CB-CG2 4.31Å
1201	K	95.5	Very high	92.2	Very high	14 Å²	14	19.8 Å²	19.8	6%	0.061	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.6	173.5	-173.4	165.2	-164.8	148.7	0	110.6	D215 P1186 L1187 E1188 Y1199 Y1299 R1300	D215-K1201 IonicContact OD2-NZ 3.61Å; D215-K1201 PolarHBondContact OD2-NZ 3.24Å; P1186-K1201 HydrophobicContact CB-CD 4.35Å; P1186-K1201 HydrophobicContact CB-CG 3.92Å; L1187-K1201 CarbonylContact O-C 3.57Å; L1187-K1201 WeakPolarHBondContact O-CA 3.47Å; E1188-K1201 HydrophobicContact CB-CB 4.46Å; E1188-K1201 HydrophobicContact CB-CG 4.35Å; E1188-K1201 HydrophobicContact CG-CB 4.25Å; E1188-K1201 WeakPolarHBondContact OE2-CD 3.43Å; E1188-K1201 IonicContact OE2-NZ 2.81Å; E1188-K1201 PolarHBondContact OE2-NZ 3.39Å; Y1199-K1201 HydrophobicContact CE1-CB 3.77Å; Y1199-K1201 VanDerWaalsContact OH-CD 3.3Å; Y1199-K1201 WeakPolarHBondContact OH-CD 3.22Å; K1201-Y1299 CarbonylContact O-C 3.58Å; K1201-Y1299 VanDerWaalsContact O-CA 3.3Å; K1201-Y1299 WeakPolarHBondContact O-CA 3.35Å; K1201-R1300 HydrophobicContact CB-CB 4.38Å; K1201-R1300 PolarHBondContact N-O 2.85Å; K1201-R1300 PolarHBondContact O-N 2.83Å
1202	M	96.1	Very high	92	Very high	4 Å²	4	19 Å²	19	2%	0.02	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.7	-176.8	-44.3	-174.7	-168.5	0	0	109.5	A1139 L1140 Y1145 P1186 L1187 V1189 P1205 Y1299	A1139-M1202 HydrophobicContact CB-CE 3.72Å; L1140-M1202 HydrophobicContact CD2-CE 3.86Å; L1140-M1202 HydrophobicContact CD2-SD 3.62Å; L1140-M1202 HydrophobicContact CG-CE 4.21Å; L1140-M1202 HydrophobicContact CG-SD 4.48Å; Y1145-M1202 HydrophobicContact CD2-CE 3.78Å; Y1145-M1202 HydrophobicContact CD2-SD 3.65Å; Y1145-M1202 HydrophobicContact CE2-CE 4.44Å; Y1145-M1202 HydrophobicContact CE2-SD 3.79Å; Y1145-M1202 HydrophobicContact CG-CE 4.39Å; P1186-M1202 VanDerWaalsContact CA-O 3.22Å; P1186-M1202 WeakPolarHBondContact CA-O 3.37Å; P1186-M1202 WeakPolarHBondContact CB-O 3.47Å; L1187-M1202 HydrophobicContact CD2-SD 4.47Å; L1187-M1202 PolarHBondContact N-O 3.3Å; L1187-M1202 VanDerWaalsContact N-O 3.08Å; L1187-M1202 PolarHBondContact O-N 3Å; V1189-M1202 HydrophobicContact CG2-CE 3.94Å; M1202-P1205 HydrophobicContact CB-CB 4.3Å; M1202-Y1299 HydrophobicContact CB-CD1 4.15Å; M1202-Y1299 HydrophobicContact CB-CE1 4.16Å; M1202-Y1299 HydrophobicContact CG-CD1 3.94Å; M1202-Y1299 HydrophobicContact CG-CE1 3.95Å; M1202-Y1299 HydrophobicContact SD-CE1 4.36Å
1203	Y	93.8	Very high	91.7	Very high	26 Å²	26	19.5 Å²	19.5	10%	0.102	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.2	178.2	-64.1	-92.7	0	0	0	110.3	P1186 F1208 L1262 V1266 A1298 R1300	P1186-Y1203 HydrophobicContact CG-CD1 4.27Å; Y1203-F1208 WeakPolarHBondContact O-CD2 3.42Å; Y1203-F1208 WeakPolarHBondContact O-CE2 3.31Å; Y1203-L1262 HydrophobicContact CD2-CD1 4.39Å; Y1203-L1262 HydrophobicContact CD2-CD2 4.45Å; Y1203-L1262 HydrophobicContact CE2-CD1 4.47Å; Y1203-L1262 HydrophobicContact CE2-CD2 3.75Å; Y1203-V1266 HydrophobicContact CD1-CG2 4.14Å; Y1203-A1298 PolarHBondContact N-O 3.36Å; Y1203-R1300 HydrophobicContact CE2-CB 4.06Å
1204	F	92.6	Very high	91.3	Very high	13 Å²	13	20 Å²	20	6%	0.057	11%	0.109	C	C	.	.	S	Bend	trans	49.5	48.6	-177	-50.8	-84	0	0	0	114.8	T1184 K1206 L1207 F1208 V1266 A1269 F1273	T1184-F1204 HydrophobicContact CG2-CE1 4.18Å; F1204-K1206 VanDerWaalsContact C-N 3.31Å; F1204-K1206 PolarHBondContact O-N 3Å; F1204-L1207 HydrophobicContact CB-CB 4.28Å; F1204-L1207 HydrophobicContact CB-CD1 4.46Å; F1204-L1207 HydrophobicContact CD1-CD1 4.16Å; F1204-L1207 PolarHBondContact O-N 3.39Å; F1204-L1207 VanDerWaalsContact O-N 3.11Å; F1204-F1208 HydrophobicContact CB-CD2 4.16Å; F1204-F1208 HydrophobicContact CB-CE2 4.32Å; F1204-F1208 PolarHBondContact O-N 2.87Å; F1204-V1266 HydrophobicContact CE2-CB 4.26Å; F1204-V1266 HydrophobicContact CE2-CG1 4.1Å; F1204-V1266 HydrophobicContact CE2-CG2 4.11Å; F1204-V1266 HydrophobicContact CZ-CG1 3.96Å; F1204-A1269 HydrophobicContact CD2-CB 4Å; F1204-A1269 HydrophobicContact CE1-CB 4.35Å; F1204-A1269 HydrophobicContact CE2-CB 3.5Å; F1204-A1269 VanDerWaalsContact CE2-CB 3.5Å; F1204-A1269 HydrophobicContact CZ-CB 3.69Å; F1204-F1273 HydrophobicContact CB-CE2 4.06Å; F1204-F1273 HydrophobicContact CB-CZ 4.19Å; F1204-F1273 HydrophobicContact CG-CE2 4.21Å
1205	P	92.5	Very high	91.3	Very high	7 Å²	7	17 Å²	17	5%	0.045	9%	0.087	C	C	.	.	H	α-helix	trans	-57.8	-42.2	-170	25	-34.5	0	0	0	112.3	F1148 I1185 L1187 M1202 L1207 F1208 L1209	F1148-P1205 HydrophobicContact CE1-CB 3.87Å; F1148-P1205 HydrophobicContact CE1-CG 4.31Å; F1148-P1205 HydrophobicContact CE2-CG 4.34Å; F1148-P1205 HydrophobicContact CZ-CB 3.83Å; F1148-P1205 HydrophobicContact CZ-CG 3.77Å; I1185-P1205 WeakPolarHBondContact O-CD 3.49Å; L1187-P1205 HydrophobicContact CB-CB 4.26Å; L1187-P1205 HydrophobicContact CB-CG 3.87Å; M1202-P1205 HydrophobicContact CB-CB 4.3Å; P1205-L1207 PolarHBondContact O-N 3.06Å; P1205-F1208 PolarHBondContact O-N 3.16Å; P1205-L1209 VanDerWaalsContact O-CB 3.32Å; P1205-L1209 WeakPolarHBondContact O-CB 3.49Å; P1205-L1209 PolarHBondContact O-N 3.29Å
1206	K	90.5	Very high	91.1	Very high	41 Å²	41	17.2 Å²	17.2	18%	0.178	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-42.8	177.8	-171.4	178	-179.8	164.4	0	113.2	F1148 L1152 M1154 L1162 F1204 A1210	F1148-K1206 HydrophobicContact CZ-CB 4.19Å; L1152-K1206 HydrophobicContact CD1-CB 4.42Å; L1152-K1206 HydrophobicContact CD1-CG 3.99Å; L1152-K1206 HydrophobicContact CD2-CD 3.65Å; L1152-K1206 HydrophobicContact CD2-CG 3.92Å; M1154-K1206 VanDerWaalsContact SD-CE 3.58Å; M1154-K1206 HydrophobicContact SD-CG 4.19Å; L1162-K1206 HydrophobicContact CD2-CD 4.1Å; L1162-K1206 HydrophobicContact CD2-CG 3.84Å; F1204-K1206 VanDerWaalsContact C-N 3.31Å; F1204-K1206 PolarHBondContact O-N 3Å; K1206-A1210 WeakPolarHBondContact O-CB 3.21Å; K1206-A1210 PolarHBondContact O-N 3.36Å
1207	L	91	Very high	90.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-74.8	-35.9	-179.1	-68.4	172.8	0	0	0	112	L1162 L1163 A1166 L1179 T1183 F1204 P1205 L1211 F1273	L1162-L1207 HydrophobicContact CD2-CD2 3.82Å; L1162-L1207 HydrophobicContact CG-CD2 3.87Å; L1163-L1207 HydrophobicContact CD2-CD2 4.47Å; A1166-L1207 HydrophobicContact CB-CD2 4.48Å; L1179-L1207 HydrophobicContact CD1-CD1 4.31Å; T1183-L1207 HydrophobicContact CG2-CD1 3.89Å; T1183-L1207 HydrophobicContact CG2-CD2 3.81Å; T1183-L1207 HydrophobicContact CG2-CG 3.65Å; F1204-L1207 HydrophobicContact CB-CB 4.28Å; F1204-L1207 HydrophobicContact CB-CD1 4.46Å; F1204-L1207 HydrophobicContact CD1-CD1 4.16Å; F1204-L1207 PolarHBondContact O-N 3.39Å; F1204-L1207 VanDerWaalsContact O-N 3.11Å; P1205-L1207 PolarHBondContact O-N 3.06Å; L1207-L1211 VanDerWaalsContact O-CB 3.3Å; L1207-L1211 WeakPolarHBondContact O-CB 3.5Å; L1207-L1211 PolarHBondContact O-N 3.07Å; L1207-F1273 HydrophobicContact CB-CD1 4.12Å; L1207-F1273 HydrophobicContact CB-CD2 3.94Å; L1207-F1273 HydrophobicContact CB-CE1 3.82Å; L1207-F1273 HydrophobicContact CB-CE2 3.63Å; L1207-F1273 HydrophobicContact CB-CG 4.2Å; L1207-F1273 HydrophobicContact CB-CZ 3.56Å; L1207-F1273 HydrophobicContact CD1-CD2 3.65Å; L1207-F1273 HydrophobicContact CD1-CE2 3.74Å; L1207-F1273 HydrophobicContact CD1-CG 4.4Å; L1207-F1273 HydrophobicContact CG-CD2 4.35Å; L1207-F1273 HydrophobicContact CG-CE2 4.32Å
1208	F	93.4	Very high	89.6	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-70.6	-38.3	173.1	-79.3	-62.9	0	0	0	112.7	Y1203 F1204 P1205 L1211 R1212 F1265 Y1272 F1273 I1295 F1296 A1298	Y1203-F1208 WeakPolarHBondContact O-CD2 3.42Å; Y1203-F1208 WeakPolarHBondContact O-CE2 3.31Å; F1204-F1208 HydrophobicContact CB-CD2 4.16Å; F1204-F1208 HydrophobicContact CB-CE2 4.32Å; F1204-F1208 PolarHBondContact O-N 2.87Å; P1205-F1208 PolarHBondContact O-N 3.16Å; F1208-L1211 HydrophobicContact CD1-CD2 4.36Å; F1208-L1211 PolarHBondContact O-N 3.31Å; F1208-R1212 WeakPolarHBondContact O-CB 3.37Å; F1208-R1212 VanDerWaalsContact O-CG 3.3Å; F1208-R1212 WeakPolarHBondContact O-CG 3.47Å; F1208-R1212 PolarHBondContact O-N 3.44Å; F1208-F1265 HydrophobicContact CE2-CE1 4.24Å; F1208-F1265 HydrophobicContact CE2-CZ 4.48Å; F1208-F1265 AromaticContact CZ-CE1 3.81Å; F1208-F1265 HydrophobicContact CZ-CE1 3.81Å; F1208-F1265 AromaticContact CZ-CZ 3.69Å; F1208-F1265 HydrophobicContact CZ-CZ 3.69Å; F1208-Y1272 HydrophobicContact CE1-CE1 4.5Å; F1208-F1273 AromaticContact CD1-CE1 3.73Å; F1208-F1273 HydrophobicContact CD1-CE1 3.73Å; F1208-F1273 AromaticContact CD1-CZ 3.84Å; F1208-F1273 HydrophobicContact CD1-CZ 3.84Å; F1208-F1273 AromaticContact CD2-CZ 3.95Å; F1208-F1273 HydrophobicContact CD2-CZ 3.95Å; F1208-F1273 AromaticContact CE1-CE1 3.9Å; F1208-F1273 HydrophobicContact CE1-CE1 3.9Å; F1208-F1273 AromaticContact CE1-CZ 3.81Å; F1208-F1273 HydrophobicContact CE1-CZ 3.81Å; F1208-F1273 AromaticContact CE2-CZ 3.94Å; F1208-F1273 HydrophobicContact CE2-CZ 3.94Å; F1208-F1273 HydrophobicContact CG-CE1 4.12Å; F1208-F1273 AromaticContact CG-CZ 3.92Å; F1208-F1273 HydrophobicContact CG-CZ 3.92Å; F1208-F1273 HydrophobicContact CZ-CE1 4.44Å; F1208-F1273 AromaticContact CZ-CZ 3.89Å; F1208-F1273 HydrophobicContact CZ-CZ 3.89Å; F1208-I1295 HydrophobicContact CE1-CB 4.43Å; F1208-I1295 HydrophobicContact CE1-CG2 3.85Å; F1208-I1295 HydrophobicContact CZ-CG2 3.98Å; F1208-F1296 WeakPolarHBondContact CD1-O 3.21Å; F1208-A1298 HydrophobicContact CE2-CB 4.04Å; F1208-A1298 HydrophobicContact CZ-CB 4.24Å
1209	L	91.7	Very high	89	Confident	17 Å²	17	22 Å²	22	9%	0.089	12%	0.117	C	C	.	.	H	α-helix	trans	-55.9	-53.8	170	173.5	64.7	0	0	0	110.7	V1149 L1152 P1205 L1211 R1212 T1213 E1220	V1149-L1209 HydrophobicContact CG1-CD2 4.39Å; V1149-L1209 HydrophobicContact CG2-CD2 4.09Å; L1152-L1209 HydrophobicContact CD1-CD2 3.57Å; P1205-L1209 VanDerWaalsContact O-CB 3.32Å; P1205-L1209 WeakPolarHBondContact O-CB 3.49Å; P1205-L1209 PolarHBondContact O-N 3.29Å; L1209-L1211 VanDerWaalsContact C-N 3.26Å; L1209-L1211 PolarHBondContact O-N 2.85Å; L1209-R1212 PolarHBondContact O-N 3.05Å; L1209-R1212 VanDerWaalsContact O-N 3.11Å; L1209-T1213 PolarHBondContact O-N 3.34Å; L1209-T1213 PolarHBondContact O-OG1 3.11Å; L1209-T1213 VanDerWaalsContact O-OG1 3.11Å; L1209-E1220 WeakPolarHBondContact CD1-OE1 3.17Å; L1209-E1220 VanDerWaalsContact CD1-OE2 3.31Å; L1209-E1220 WeakPolarHBondContact CD1-OE2 3.34Å
1210	A	89.2	Confident	88.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.1	-39.2	177.4	0	0	0	0	0	112.5	M1154 I1159 L1162 L1163 K1206 L1214	M1154-A1210 HydrophobicContact CE-CB 4.02Å; I1159-A1210 HydrophobicContact CG1-CB 4.43Å; I1159-A1210 HydrophobicContact CG2-CB 4.22Å; I1159-A1210 WeakPolarHBondContact CG2-O 3.3Å; L1162-A1210 HydrophobicContact CD2-CB 4.13Å; L1163-A1210 HydrophobicContact CD1-CB 4.46Å; L1163-A1210 HydrophobicContact CG-CB 4.41Å; K1206-A1210 WeakPolarHBondContact O-CB 3.21Å; K1206-A1210 PolarHBondContact O-N 3.36Å; A1210-L1214 VanDerWaalsContact O-CB 3.26Å; A1210-L1214 WeakPolarHBondContact O-CB 3.23Å; A1210-L1214 PolarHBondContact O-N 3.33Å; A1210-L1214 VanDerWaalsContact O-N 3.1Å
1211	L	88.2	Confident	88.2	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-68.8	-39.5	176.1	-171.8	66.9	0	0	0	112.7	L1207 F1208 L1209 L1214 L1215 Y1272 F1273 V1276 I1295	L1207-L1211 VanDerWaalsContact O-CB 3.3Å; L1207-L1211 WeakPolarHBondContact O-CB 3.5Å; L1207-L1211 PolarHBondContact O-N 3.07Å; F1208-L1211 HydrophobicContact CD1-CD2 4.36Å; F1208-L1211 PolarHBondContact O-N 3.31Å; L1209-L1211 VanDerWaalsContact C-N 3.26Å; L1209-L1211 PolarHBondContact O-N 2.85Å; L1211-L1214 PolarHBondContact O-N 3.39Å; L1211-L1215 HydrophobicContact CD1-CD1 3.69Å; L1211-L1215 HydrophobicContact CD1-CG 4.2Å; L1211-L1215 HydrophobicContact CG-CD1 3.9Å; L1211-L1215 WeakPolarHBondContact O-CB 3.3Å; L1211-L1215 WeakPolarHBondContact O-CG 3.41Å; L1211-L1215 PolarHBondContact O-N 3.18Å; L1211-L1215 VanDerWaalsContact O-N 3.12Å; L1211-Y1272 HydrophobicContact CD2-CE1 4.05Å; L1211-F1273 HydrophobicContact CB-CD1 4.42Å; L1211-F1273 HydrophobicContact CB-CE1 4.32Å; L1211-F1273 HydrophobicContact CD2-CD1 4.01Å; L1211-F1273 HydrophobicContact CD2-CE1 3.91Å; L1211-V1276 HydrophobicContact CD1-CB 4.35Å; L1211-V1276 HydrophobicContact CD1-CG1 3.85Å; L1211-I1295 WeakPolarHBondContact CD2-O 3.42Å
1212	R	90.3	Very high	87.8	Confident	5 Å²	5	23.5 Å²	23.5	2%	0.019	13%	0.127	C	C	.	.	H	α-helix	trans	-63.9	-52.1	175.8	-74.4	-172.4	-63.5	-106.1	10.5	110.5	Y1145 F1208 L1209 L1214 L1215 F1216 E1220 F1223 F1296 Y1299	Y1145-R1212 PolarHBondContact OH-NH2 2.75Å; F1208-R1212 WeakPolarHBondContact O-CB 3.37Å; F1208-R1212 VanDerWaalsContact O-CG 3.3Å; F1208-R1212 WeakPolarHBondContact O-CG 3.47Å; F1208-R1212 PolarHBondContact O-N 3.44Å; L1209-R1212 PolarHBondContact O-N 3.05Å; L1209-R1212 VanDerWaalsContact O-N 3.11Å; R1212-L1214 PolarHBondContact O-N 2.97Å; R1212-L1215 PolarHBondContact O-N 3.31Å; R1212-L1215 VanDerWaalsContact O-N 3.17Å; R1212-F1216 HydrophobicContact CB-CD2 3.83Å; R1212-F1216 HydrophobicContact CB-CE2 3.71Å; R1212-F1216 HydrophobicContact CB-CZ 4.41Å; R1212-F1216 HydrophobicContact CG-CD2 4.19Å; R1212-F1216 HydrophobicContact CG-CE2 3.53Å; R1212-F1216 HydrophobicContact CG-CZ 3.92Å; R1212-F1216 VanDerWaalsContact O-CB 3.32Å; R1212-F1216 WeakPolarHBondContact O-CB 3.35Å; R1212-F1216 WeakPolarHBondContact O-CG 3.44Å; R1212-F1216 PolarHBondContact O-N 3.16Å; R1212-E1220 IonicContact CZ-OE1 2.7Å; R1212-E1220 IonicContact NE-OE1 3.21Å; R1212-E1220 PolarHBondContact NE-OE1 3.45Å; R1212-E1220 IonicContact NH2-OE1 3.97Å; R1212-E1220 PolarHBondContact NH2-OE1 3.36Å; R1212-F1223 VanDerWaalsContact CD-CE1 3.5Å; R1212-F1296 HydrophobicContact CG-CB 4.26Å; R1212-F1296 PolarHBondContact NH1-O 3.32Å; R1212-Y1299 PolarHBondContact NH1-OH 2.83Å
1213	T	86.6	Confident	87.5	Confident	79 Å²	79	23.3 Å²	23.3	49%	0.485	13%	0.126	S	C	.	.	H	α-helix	trans	-63.1	-24.6	179.1	-49.4	0	0	0	0	113.2	I1159 L1209	I1159-T1213 HydrophobicContact CD1-CG2 3.47Å; I1159-T1213 VanDerWaalsContact CD1-CG2 3.47Å; L1209-T1213 PolarHBondContact O-N 3.34Å; L1209-T1213 PolarHBondContact O-OG1 3.11Å; L1209-T1213 VanDerWaalsContact O-OG1 3.11Å
1214	L	81.6	Confident	87.5	Confident	46 Å²	46	22.2 Å²	22.2	24%	0.241	12%	0.122	C	C	.	.	H	α-helix	trans	-78.6	-38.6	173.8	173	60.3	0	0	0	113.9	I1159 L1163 A1210 L1211 R1212 A1280 L1282	I1159-L1214 HydrophobicContact CG2-CB 4.13Å; L1163-L1214 HydrophobicContact CD1-CD2 3.54Å; A1210-L1214 VanDerWaalsContact O-CB 3.26Å; A1210-L1214 WeakPolarHBondContact O-CB 3.23Å; A1210-L1214 PolarHBondContact O-N 3.33Å; A1210-L1214 VanDerWaalsContact O-N 3.1Å; L1211-L1214 PolarHBondContact O-N 3.39Å; R1212-L1214 PolarHBondContact O-N 2.97Å; L1214-A1280 HydrophobicContact CD2-CB 3.78Å; L1214-A1280 HydrophobicContact CG-CB 4.25Å; L1214-L1282 HydrophobicContact CD1-CD2 3.35Å; L1214-L1282 HydrophobicContact CD2-CD1 4.29Å; L1214-L1282 HydrophobicContact CD2-CD2 3.73Å; L1214-L1282 HydrophobicContact CD2-CG 4.46Å; L1214-L1282 HydrophobicContact CG-CD2 4.17Å
1215	L	82.5	Confident	87.4	Confident	8 Å²	8	24 Å²	24	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-98.8	-30.4	-170.3	-60.8	179.2	0	0	0	113.1	L916 S917 L1211 R1212 V1276 A1280 K1294 F1296	L916-L1215 HydrophobicContact CB-CD2 4.42Å; L916-L1215 HydrophobicContact CD2-CD2 4.02Å; L916-L1215 VanDerWaalsContact O-CD2 3.28Å; L916-L1215 WeakPolarHBondContact O-CD2 3.48Å; S917-L1215 VanDerWaalsContact CA-O 3.25Å; S917-L1215 WeakPolarHBondContact CA-O 3.46Å; S917-L1215 WeakPolarHBondContact CB-O 3.3Å; S917-L1215 PolarHBondContact OG-O 2.75Å; S917-L1215 VanDerWaalsContact OG-O 3.06Å; L1211-L1215 HydrophobicContact CD1-CD1 3.69Å; L1211-L1215 HydrophobicContact CD1-CG 4.2Å; L1211-L1215 HydrophobicContact CG-CD1 3.9Å; L1211-L1215 WeakPolarHBondContact O-CB 3.3Å; L1211-L1215 WeakPolarHBondContact O-CG 3.41Å; L1211-L1215 PolarHBondContact O-N 3.18Å; L1211-L1215 VanDerWaalsContact O-N 3.12Å; R1212-L1215 PolarHBondContact O-N 3.31Å; R1212-L1215 VanDerWaalsContact O-N 3.17Å; L1215-V1276 HydrophobicContact CD1-CG1 4.06Å; L1215-A1280 HydrophobicContact CD2-CB 4.11Å; L1215-K1294 HydrophobicContact CD1-CG 4.22Å; L1215-F1296 HydrophobicContact CD1-CE1 4.01Å
1216	F	84	Confident	87.2	Confident	14 Å²	14	23.9 Å²	23.9	6%	0.061	13%	0.128	C	C	.	.			trans	-81.6	134.2	179.7	-61	-17	0	0	0	111	L918 R1212 F1218 F1223 F1252 F1296	L918-F1216 HydrophobicContact CD1-CD1 4.21Å; L918-F1216 HydrophobicContact CD1-CE1 3.89Å; R1212-F1216 HydrophobicContact CB-CD2 3.83Å; R1212-F1216 HydrophobicContact CB-CE2 3.71Å; R1212-F1216 HydrophobicContact CB-CZ 4.41Å; R1212-F1216 HydrophobicContact CG-CD2 4.19Å; R1212-F1216 HydrophobicContact CG-CE2 3.53Å; R1212-F1216 HydrophobicContact CG-CZ 3.92Å; R1212-F1216 VanDerWaalsContact O-CB 3.32Å; R1212-F1216 WeakPolarHBondContact O-CB 3.35Å; R1212-F1216 WeakPolarHBondContact O-CG 3.44Å; R1212-F1216 PolarHBondContact O-N 3.16Å; F1216-F1218 HydrophobicContact CB-CD2 3.73Å; F1216-F1218 HydrophobicContact CB-CE2 3.69Å; F1216-F1218 HydrophobicContact CB-CG 4.24Å; F1216-F1218 HydrophobicContact CB-CZ 4.12Å; F1216-F1218 WeakPolarHBondContact CB-O 3.45Å; F1216-F1218 HydrophobicContact CD1-CE2 4.04Å; F1216-F1218 AromaticContact CD1-CZ 3.98Å; F1216-F1218 HydrophobicContact CD1-CZ 3.98Å; F1216-F1218 AromaticContact CD2-CD2 3.98Å; F1216-F1218 HydrophobicContact CD2-CD2 3.98Å; F1216-F1218 AromaticContact CD2-CE2 3.4Å; F1216-F1218 HydrophobicContact CD2-CE2 3.4Å; F1216-F1218 HydrophobicContact CD2-CZ 4.17Å; F1216-F1218 HydrophobicContact CE1-CZ 4.42Å; F1216-F1218 AromaticContact CE2-CE2 3.94Å; F1216-F1218 HydrophobicContact CE2-CE2 3.94Å; F1216-F1218 HydrophobicContact CG-CD2 4Å; F1216-F1218 AromaticContact CG-CE2 3.44Å; F1216-F1218 HydrophobicContact CG-CE2 3.44Å; F1216-F1218 VanDerWaalsContact CG-CE2 3.44Å; F1216-F1218 AromaticContact CG-CZ 3.84Å; F1216-F1218 HydrophobicContact CG-CZ 3.84Å; F1216-F1218 HydrophobicContact CZ-CE2 4.47Å; F1216-F1218 PolarHBondContact O-N 3.49Å; F1216-F1223 HydrophobicContact CD2-CB 4.44Å; F1216-F1223 HydrophobicContact CE2-CB 3.85Å; F1216-F1223 AromaticContact CE2-CD2 3.56Å; F1216-F1223 HydrophobicContact CE2-CD2 3.56Å; F1216-F1223 HydrophobicContact CE2-CE2 4.27Å; F1216-F1223 AromaticContact CE2-CG 3.83Å; F1216-F1223 HydrophobicContact CE2-CG 3.83Å; F1216-F1223 AromaticContact CZ-CD2 3.72Å; F1216-F1223 HydrophobicContact CZ-CD2 3.72Å; F1216-F1223 HydrophobicContact CZ-CE2 4.1Å; F1216-F1223 HydrophobicContact CZ-CG 4.44Å; F1216-F1252 AromaticContact CE1-CE1 3.95Å; F1216-F1252 HydrophobicContact CE1-CE1 3.95Å; F1216-F1252 HydrophobicContact CE1-CZ 4.07Å; F1216-F1252 HydrophobicContact CE2-CZ 4.4Å; F1216-F1252 AromaticContact CZ-CE1 3.74Å; F1216-F1252 HydrophobicContact CZ-CE1 3.74Å; F1216-F1252 AromaticContact CZ-CZ 3.72Å; F1216-F1252 HydrophobicContact CZ-CZ 3.72Å; F1216-F1296 HydrophobicContact CD1-CE1 4.46Å; F1216-F1296 AromaticContact CE1-CD1 3.69Å; F1216-F1296 HydrophobicContact CE1-CD1 3.69Å; F1216-F1296 HydrophobicContact CE1-CD2 4.21Å; F1216-F1296 AromaticContact CE1-CE1 3.56Å; F1216-F1296 HydrophobicContact CE1-CE1 3.56Å; F1216-F1296 HydrophobicContact CE1-CE2 4.07Å; F1216-F1296 HydrophobicContact CE1-CG 4.02Å; F1216-F1296 AromaticContact CE1-CZ 3.76Å; F1216-F1296 HydrophobicContact CE1-CZ 3.76Å; F1216-F1296 HydrophobicContact CZ-CB 4.18Å; F1216-F1296 AromaticContact CZ-CD1 3.78Å; F1216-F1296 HydrophobicContact CZ-CD1 3.78Å; F1216-F1296 HydrophobicContact CZ-CD2 4.12Å; F1216-F1296 HydrophobicContact CZ-CE1 4.15Å; F1216-F1296 HydrophobicContact CZ-CE2 4.44Å; F1216-F1296 AromaticContact CZ-CG 3.77Å; F1216-F1296 HydrophobicContact CZ-CG 3.77Å; F1216-F1296 HydrophobicContact CZ-CZ 4.46Å
1217	P	76.8	Confident	87.4	Confident	82 Å²	82	21.9 Å²	21.9	53%	0.532	12%	0.119	S	C	.	.	S	Bend	trans	-81.9	5.8	168.2	37.1	-34.9	0	0	0	112.1	S917 L918	S917-P1217 WeakPolarHBondContact OG-CD 3.31Å; L918-P1217 VanDerWaalsContact O-CD 3.26Å; L918-P1217 WeakPolarHBondContact O-CD 3.33Å; L918-P1217 WeakPolarHBondContact O-CG 3.47Å
1218	F	79	Confident	87.5	Confident	25 Å²	25	23.2 Å²	23.2	11%	0.11	13%	0.13	C	C	.	.	S	Bend	trans	-127.8	161.8	-177.2	52.2	-113.1	0	0	0	110.3	L918 F1216 T1222 F1252	L918-F1218 HydrophobicContact CB-CE1 4.19Å; L918-F1218 HydrophobicContact CD1-CZ 4.18Å; F1216-F1218 HydrophobicContact CB-CD2 3.73Å; F1216-F1218 HydrophobicContact CB-CE2 3.69Å; F1216-F1218 HydrophobicContact CB-CG 4.24Å; F1216-F1218 HydrophobicContact CB-CZ 4.12Å; F1216-F1218 WeakPolarHBondContact CB-O 3.45Å; F1216-F1218 HydrophobicContact CD1-CE2 4.04Å; F1216-F1218 AromaticContact CD1-CZ 3.98Å; F1216-F1218 HydrophobicContact CD1-CZ 3.98Å; F1216-F1218 AromaticContact CD2-CD2 3.98Å; F1216-F1218 HydrophobicContact CD2-CD2 3.98Å; F1216-F1218 AromaticContact CD2-CE2 3.4Å; F1216-F1218 HydrophobicContact CD2-CE2 3.4Å; F1216-F1218 HydrophobicContact CD2-CZ 4.17Å; F1216-F1218 HydrophobicContact CE1-CZ 4.42Å; F1216-F1218 AromaticContact CE2-CE2 3.94Å; F1216-F1218 HydrophobicContact CE2-CE2 3.94Å; F1216-F1218 HydrophobicContact CG-CD2 4Å; F1216-F1218 AromaticContact CG-CE2 3.44Å; F1216-F1218 HydrophobicContact CG-CE2 3.44Å; F1216-F1218 VanDerWaalsContact CG-CE2 3.44Å; F1216-F1218 AromaticContact CG-CZ 3.84Å; F1216-F1218 HydrophobicContact CG-CZ 3.84Å; F1216-F1218 HydrophobicContact CZ-CE2 4.47Å; F1216-F1218 PolarHBondContact O-N 3.49Å; F1218-T1222 HydrophobicContact CB-CG2 4.05Å; F1218-T1222 HydrophobicContact CD1-CG2 4.26Å; F1218-T1222 VanDerWaalsContact CD2-CB 3.5Å; F1218-T1222 HydrophobicContact CD2-CG2 3.57Å; F1218-T1222 HydrophobicContact CE2-CG2 4Å; F1218-T1222 HydrophobicContact CG-CG2 3.71Å; F1218-F1252 HydrophobicContact CZ-CZ 4.27Å
1219	D	82.5	Confident	87.3	Confident	77 Å²	77	25 Å²	25	41%	0.412	14%	0.143	S	C	.	.			trans	-76.3	167	-175	82.2	-46.3	0	0	0	113.6	R1015 S1221 T1222	R1015-D1219 IonicContact NH1-OD1 2.85Å; D1219-S1221 VanDerWaalsContact C-N 3.26Å; D1219-S1221 PolarHBondContact O-N 3.01Å; D1219-S1221 WeakPolarHBondContact OD2-CB 3.45Å; D1219-S1221 PolarHBondContact OD2-N 2.98Å; D1219-S1221 VanDerWaalsContact OD2-N 3.14Å; D1219-S1221 PolarHBondContact OD2-OG 2.75Å; D1219-T1222 WeakPolarHBondContact O-CB 3.36Å; D1219-T1222 PolarHBondContact O-N 3.15Å; D1219-T1222 PolarHBondContact O-OG1 2.77Å; D1219-T1222 PolarHBondContact OD1-N 3.01Å; D1219-T1222 VanDerWaalsContact OD1-N 3.14Å; D1219-T1222 PolarHBondContact OD1-OG1 3.46Å
1220	E	87.5	Confident	87.3	Confident	28 Å²	28	24.4 Å²	24.4	13%	0.131	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-31	178.4	-175.4	152.3	-107.4	0	0	113.1	Y1145 L1209 R1212 T1222 F1223 V1224	Y1145-E1220 WeakPolarHBondContact CE1-OE2 3.26Å; Y1145-E1220 VanDerWaalsContact OH-CD 3.22Å; Y1145-E1220 PolarHBondContact OH-OE1 3.43Å; Y1145-E1220 VanDerWaalsContact OH-OE1 3.1Å; Y1145-E1220 PolarHBondContact OH-OE2 3.09Å; L1209-E1220 WeakPolarHBondContact CD1-OE1 3.17Å; L1209-E1220 VanDerWaalsContact CD1-OE2 3.31Å; L1209-E1220 WeakPolarHBondContact CD1-OE2 3.34Å; R1212-E1220 IonicContact CZ-OE1 2.7Å; R1212-E1220 IonicContact NE-OE1 3.21Å; R1212-E1220 PolarHBondContact NE-OE1 3.45Å; R1212-E1220 IonicContact NH2-OE1 3.97Å; R1212-E1220 PolarHBondContact NH2-OE1 3.36Å; E1220-T1222 PolarHBondContact O-N 3.14Å; E1220-T1222 VanDerWaalsContact O-N 3.15Å; E1220-F1223 WeakPolarHBondContact O-CA 3.42Å; E1220-F1223 WeakPolarHBondContact O-CB 3.43Å; E1220-F1223 PolarHBondContact O-N 3.2Å; E1220-V1224 WeakPolarHBondContact O-CG2 3.31Å; E1220-V1224 PolarHBondContact O-N 3.09Å
1221	S	87.7	Confident	87.3	Confident	18 Å²	18	28.4 Å²	28.4	13%	0.126	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-19.3	175.1	-27.7	0	0	0	0	112.7	D1219 R1225	D1219-S1221 VanDerWaalsContact C-N 3.26Å; D1219-S1221 PolarHBondContact O-N 3.01Å; D1219-S1221 WeakPolarHBondContact OD2-CB 3.45Å; D1219-S1221 PolarHBondContact OD2-N 2.98Å; D1219-S1221 VanDerWaalsContact OD2-N 3.14Å; D1219-S1221 PolarHBondContact OD2-OG 2.75Å; S1221-R1225 WeakPolarHBondContact O-CG 3.42Å; S1221-R1225 PolarHBondContact O-N 2.61Å; S1221-R1225 PolarHBondContact O-NH1 3.08Å
1222	T	85.6	Confident	87.4	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.012	19%	0.186	C	C	.	.	H	α-helix	trans	-74.4	-41.5	169.8	-55.2	0	0	0	0	111.5	R1015 F1218 D1219 E1220 R1225 S1226 R1251	R1015-T1222 PolarHBondContact NH1-OG1 3.29Å; R1015-T1222 PolarHBondContact NH2-OG1 3.14Å; F1218-T1222 HydrophobicContact CB-CG2 4.05Å; F1218-T1222 HydrophobicContact CD1-CG2 4.26Å; F1218-T1222 VanDerWaalsContact CD2-CB 3.5Å; F1218-T1222 HydrophobicContact CD2-CG2 3.57Å; F1218-T1222 HydrophobicContact CE2-CG2 4Å; F1218-T1222 HydrophobicContact CG-CG2 3.71Å; D1219-T1222 WeakPolarHBondContact O-CB 3.36Å; D1219-T1222 PolarHBondContact O-N 3.15Å; D1219-T1222 PolarHBondContact O-OG1 2.77Å; D1219-T1222 PolarHBondContact OD1-N 3.01Å; D1219-T1222 VanDerWaalsContact OD1-N 3.14Å; D1219-T1222 PolarHBondContact OD1-OG1 3.46Å; E1220-T1222 PolarHBondContact O-N 3.14Å; E1220-T1222 VanDerWaalsContact O-N 3.15Å; T1222-R1225 PolarHBondContact O-N 3.09Å; T1222-S1226 PolarHBondContact O-N 3.15Å; T1222-S1226 PolarHBondContact O-OG 2.89Å; T1222-R1251 VanDerWaalsContact CG2-NH1 3.28Å
1223	F	90.7	Very high	87.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-41	176.2	177	-109.4	0	0	0	111.4	L1140 R1212 F1216 E1220 S1226 L1227 F1252 F1296 V1318	L1140-F1223 HydrophobicContact CD1-CD1 4.18Å; L1140-F1223 HydrophobicContact CD1-CE1 3.87Å; R1212-F1223 VanDerWaalsContact CD-CE1 3.5Å; F1216-F1223 HydrophobicContact CD2-CB 4.44Å; F1216-F1223 HydrophobicContact CE2-CB 3.85Å; F1216-F1223 AromaticContact CE2-CD2 3.56Å; F1216-F1223 HydrophobicContact CE2-CD2 3.56Å; F1216-F1223 HydrophobicContact CE2-CE2 4.27Å; F1216-F1223 AromaticContact CE2-CG 3.83Å; F1216-F1223 HydrophobicContact CE2-CG 3.83Å; F1216-F1223 AromaticContact CZ-CD2 3.72Å; F1216-F1223 HydrophobicContact CZ-CD2 3.72Å; F1216-F1223 HydrophobicContact CZ-CE2 4.1Å; F1216-F1223 HydrophobicContact CZ-CG 4.44Å; E1220-F1223 WeakPolarHBondContact O-CA 3.42Å; E1220-F1223 WeakPolarHBondContact O-CB 3.43Å; E1220-F1223 PolarHBondContact O-N 3.2Å; F1223-S1226 WeakPolarHBondContact O-CB 3.39Å; F1223-S1226 PolarHBondContact O-N 2.75Å; F1223-L1227 HydrophobicContact CD1-CD1 4.17Å; F1223-L1227 HydrophobicContact CE1-CD1 3.68Å; F1223-L1227 HydrophobicContact CE2-CD1 4.27Å; F1223-L1227 HydrophobicContact CZ-CD1 3.74Å; F1223-L1227 PolarHBondContact O-N 2.6Å; F1223-F1252 HydrophobicContact CD2-CD2 4.4Å; F1223-F1252 HydrophobicContact CD2-CE1 4.16Å; F1223-F1252 AromaticContact CD2-CE2 3.79Å; F1223-F1252 HydrophobicContact CD2-CE2 3.79Å; F1223-F1252 AromaticContact CD2-CZ 3.65Å; F1223-F1252 HydrophobicContact CD2-CZ 3.65Å; F1223-F1252 HydrophobicContact CE2-CD1 4.41Å; F1223-F1252 HydrophobicContact CE2-CE1 4.16Å; F1223-F1252 HydrophobicContact CE2-CE2 4.28Å; F1223-F1252 HydrophobicContact CE2-CZ 4.09Å; F1223-F1296 HydrophobicContact CE2-CB 3.99Å; F1223-F1296 HydrophobicContact CZ-CB 4.15Å; F1223-V1318 HydrophobicContact CE2-CG1 3.79Å; F1223-V1318 HydrophobicContact CZ-CB 4.4Å; F1223-V1318 HydrophobicContact CZ-CG1 3.87Å
1224	V	93.8	Very high	86.8	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-57.6	-50.6	173.3	172.8	0	0	0	0	111.6	V1123 V1125 A1137 L1140 A1141 E1220 S1226 L1227 A1228	V1123-V1224 HydrophobicContact CB-CG1 3.92Å; V1123-V1224 HydrophobicContact CG1-CG1 4.05Å; V1123-V1224 HydrophobicContact CG2-CB 4.4Å; V1123-V1224 HydrophobicContact CG2-CG1 4.08Å; V1125-V1224 HydrophobicContact CG2-CG1 3.99Å; A1137-V1224 HydrophobicContact CB-CG1 4.25Å; A1137-V1224 WeakPolarHBondContact CB-O 3.22Å; A1137-V1224 WeakPolarHBondContact O-CG1 3.21Å; L1140-V1224 HydrophobicContact CB-CG2 3.72Å; A1141-V1224 HydrophobicContact CB-CG1 4.16Å; E1220-V1224 WeakPolarHBondContact O-CG2 3.31Å; E1220-V1224 PolarHBondContact O-N 3.09Å; V1224-S1226 VanDerWaalsContact C-N 3.33Å; V1224-S1226 PolarHBondContact O-N 3.41Å; V1224-L1227 PolarHBondContact O-N 2.96Å; V1224-L1227 VanDerWaalsContact O-N 3.14Å; V1224-A1228 PolarHBondContact O-N 2.91Å
1225	R	89.7	Confident	86.3	Confident	49 Å²	49	37.3 Å²	37.3	19%	0.185	19%	0.188	C	C	.	.	H	α-helix	trans	-62.3	-37.4	178	-73.1	-174.6	-172.1	80.1	-7.2	113	D1019 V1123 S1221 T1222 L1227 A1228	D1019-R1225 IonicContact OD1-CZ 2.77Å; D1019-R1225 IonicContact OD1-NE 3.37Å; D1019-R1225 PolarHBondContact OD1-NE 3.02Å; D1019-R1225 IonicContact OD1-NH2 2.65Å; D1019-R1225 PolarHBondContact OD1-NH2 2.75Å; D1019-R1225 IonicContact OD2-CZ 3.8Å; D1019-R1225 IonicContact OD2-NE 3.84Å; D1019-R1225 IonicContact OD2-NH2 2.67Å; D1019-R1225 PolarHBondContact OD2-NH2 2.56Å; V1123-R1225 HydrophobicContact CG1-CG 3.7Å; S1221-R1225 WeakPolarHBondContact O-CG 3.42Å; S1221-R1225 PolarHBondContact O-N 2.61Å; S1221-R1225 PolarHBondContact O-NH1 3.08Å; T1222-R1225 PolarHBondContact O-N 3.09Å; R1225-L1227 VanDerWaalsContact C-N 3.26Å; R1225-L1227 PolarHBondContact O-N 3.13Å; R1225-A1228 WeakPolarHBondContact O-CB 3.42Å; R1225-A1228 PolarHBondContact O-N 2.89Å; R1225-A1228 VanDerWaalsContact O-N 3.12Å
1226	S	89.7	Confident	85.7	Confident	5 Å²	5	39 Å²	39	4%	0.035	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-40.8	174.8	-48.1	0	0	0	0	111.8	T1222 F1223 V1224 T1247 D1249 R1251	T1222-S1226 PolarHBondContact O-N 3.15Å; T1222-S1226 PolarHBondContact O-OG 2.89Å; F1223-S1226 WeakPolarHBondContact O-CB 3.39Å; F1223-S1226 PolarHBondContact O-N 2.75Å; V1224-S1226 VanDerWaalsContact C-N 3.33Å; V1224-S1226 PolarHBondContact O-N 3.41Å; S1226-T1247 WeakPolarHBondContact O-CB 3.02Å; S1226-T1247 WeakPolarHBondContact O-CG2 3.41Å; S1226-D1249 VanDerWaalsContact CB-OD2 3.31Å; S1226-D1249 WeakPolarHBondContact CB-OD2 3.33Å; S1226-D1249 PolarHBondContact OG-OD2 2.83Å; S1226-D1249 VanDerWaalsContact OG-OD2 3.08Å; S1226-R1251 PolarHBondContact OG-NE 3.12Å; S1226-R1251 PolarHBondContact OG-NH2 2.58Å
1227	L	94.3	Very high	84.4	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-77	-21.8	179	-67.3	175.6	0	0	0	113.3	G1133 T1134 I1136 A1137 L1140 F1223 V1224 R1225 S1229 T1247 L1254 V1318	G1133-L1227 CarbonylContact C-O 3.5Å; G1133-L1227 VanDerWaalsContact CA-O 3.3Å; G1133-L1227 WeakPolarHBondContact CA-O 3.14Å; T1134-L1227 PolarHBondContact N-O 2.58Å; I1136-L1227 HydrophobicContact CG2-CD1 3.94Å; A1137-L1227 HydrophobicContact CB-CB 3.83Å; L1140-L1227 HydrophobicContact CD1-CD1 4.11Å; F1223-L1227 HydrophobicContact CD1-CD1 4.17Å; F1223-L1227 HydrophobicContact CE1-CD1 3.68Å; F1223-L1227 HydrophobicContact CE2-CD1 4.27Å; F1223-L1227 HydrophobicContact CZ-CD1 3.74Å; F1223-L1227 PolarHBondContact O-N 2.6Å; V1224-L1227 PolarHBondContact O-N 2.96Å; V1224-L1227 VanDerWaalsContact O-N 3.14Å; R1225-L1227 VanDerWaalsContact C-N 3.26Å; R1225-L1227 PolarHBondContact O-N 3.13Å; L1227-S1229 PolarHBondContact O-N 3.16Å; L1227-T1247 HydrophobicContact CD2-CG2 4.18Å; L1227-L1254 HydrophobicContact CD2-CD1 4.29Å; L1227-L1254 HydrophobicContact CD2-CD2 4.05Å; L1227-L1254 HydrophobicContact CD2-CG 4.24Å; L1227-V1318 HydrophobicContact CD1-CG2 4.4Å; L1227-V1318 HydrophobicContact CD2-CG1 3.96Å; L1227-V1318 HydrophobicContact CD2-CG2 3.92Å
1228	A	92.8	Very high	83.5	Confident	27 Å²	27	39 Å²	39	22%	0.223	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-4.6	179.7	0	0	0	0	0	114.5	V1125 T1134 A1137 V1224 R1225	V1125-A1228 HydrophobicContact CG1-CB 4.06Å; V1125-A1228 HydrophobicContact CG2-CB 4.25Å; T1134-A1228 WeakPolarHBondContact CG2-O 3.25Å; A1137-A1228 HydrophobicContact CB-CB 4.01Å; V1224-A1228 PolarHBondContact O-N 2.91Å; R1225-A1228 WeakPolarHBondContact O-CB 3.42Å; R1225-A1228 PolarHBondContact O-N 2.89Å; R1225-A1228 VanDerWaalsContact O-N 3.12Å
1229	S	89.9	Confident	82.6	Confident	40 Å²	40	45.4 Å²	45.4	28%	0.28	25%	0.247	S	C	.	.	S	Bend	trans	-143.5	119.3	168.5	-172.6	0	0	0	0	110.7	L1227 T1247 R1248	L1227-S1229 PolarHBondContact O-N 3.16Å; S1229-T1247 WeakPolarHBondContact O-CA 3.3Å; S1229-R1248 PolarHBondContact O-N 2.87Å
1230	C	91.9	Very high	81.6	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.034	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	129.4	179.3	69.8	0	0	0	0	113.9	Q1131 G1133 F1245 R1246 L1254	Q1131-C1230 PolarHBondContact OE1-O 3.42Å; G1133-C1230 PolarHBondContact N-SG 3.07Å; C1230-F1245 HydrophobicContact CB-CB 4.47Å; C1230-R1246 CarbonylContact C-O 3.58Å; C1230-R1246 WeakPolarHBondContact CA-O 3.33Å; C1230-R1246 WeakPolarHBondContact CB-O 3.46Å; C1230-L1254 HydrophobicContact CB-CD1 4.06Å
1231	E	89	Confident	80.8	Confident	84 Å²	84	47.5 Å²	47.5	39%	0.393	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	148.6	172.7	61.8	178.8	163.2	0	0	111.2	W1233 F1245 R1246	E1231-W1233 PolarHBondContact O-N 2.59Å; E1231-F1245 CarbonylContact O-C 3.56Å; E1231-F1245 WeakPolarHBondContact O-CA 3.47Å; E1231-F1245 WeakPolarHBondContact O-CB 3.49Å; E1231-R1246 HydrophobicContact CG-CB 4.12Å; E1231-R1246 PolarHBondContact N-O 2.9Å; E1231-R1246 PolarHBondContact O-N 2.77Å; E1231-R1246 IonicContact OE1-CZ 3.51Å; E1231-R1246 IonicContact OE1-NE 2.64Å; E1231-R1246 PolarHBondContact OE1-NE 3.01Å; E1231-R1246 IonicContact OE1-NH2 3.37Å; E1231-R1246 PolarHBondContact OE1-NH2 3.32Å; E1231-R1246 IonicContact OE2-NH2 2.71Å
1232	R	89.2	Confident	80.3	Confident	152 Å²	152	47.6 Å²	47.6	57%	0.574	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.4	167.4	179.1	177.2	168.9	169.4	-5.4	109.1	F1245	R1232-F1245 HydrophobicContact CB-CD1 3.97Å; R1232-F1245 HydrophobicContact CB-CE1 3.99Å; R1232-F1245 HydrophobicContact CG-CD1 4.42Å; R1232-F1245 HydrophobicContact CG-CE1 4.22Å
1233	W	85.4	Confident	80.4	Confident	31 Å²	31	51 Å²	51	12%	0.117	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.4	-179.9	-179.9	58	0	0	0	109.5	E1231 P1235 F1244 R1246 I1253 Y1321 D1354	E1231-W1233 PolarHBondContact O-N 2.59Å; W1233-P1235 HydrophobicContact CE3-CG 4.36Å; W1233-P1235 HydrophobicContact CH2-CB 4.06Å; W1233-P1235 HydrophobicContact CH2-CG 3.92Å; W1233-P1235 HydrophobicContact CZ2-CB 3.81Å; W1233-P1235 HydrophobicContact CZ2-CG 4.08Å; W1233-P1235 HydrophobicContact CZ3-CG 4.06Å; W1233-F1244 HydrophobicContact CE3-CB 4.23Å; W1233-F1244 PolarHBondContact N-O 2.77Å; W1233-F1244 CarbonylContact O-C 3.49Å; W1233-F1244 WeakPolarHBondContact O-CB 3.12Å; W1233-R1246 HydrophobicContact CB-CB 4.01Å; W1233-R1246 HydrophobicContact CG-CB 4.42Å; W1233-I1253 HydrophobicContact CE3-CG1 4.41Å; W1233-I1253 HydrophobicContact CH2-CD1 4.44Å; W1233-I1253 HydrophobicContact CZ3-CD1 3.77Å; W1233-I1253 HydrophobicContact CZ3-CG1 3.99Å; W1233-Y1321 HydrophobicContact CH2-CE2 4.2Å; W1233-D1354 PolarHBondContact NE1-OD1 3.11Å
1234	Q	79.6	Confident	80.3	Confident	105 Å²	105	52.7 Å²	52.7	49%	0.491	30%	0.304	S	S	.	.			trans	-143.7	84.2	-177.4	-164.7	152.6	-5.4	0	0	111
1235	P	72	Confident	80.3	Confident	28 Å²	28	53.4 Å²	53.4	18%	0.182	31%	0.307	C	S	.	.			trans	-64.1	138.3	-175.9	25.1	-33.6	0	0	0	111.9	W1233 V1356	W1233-P1235 HydrophobicContact CE3-CG 4.36Å; W1233-P1235 HydrophobicContact CH2-CB 4.06Å; W1233-P1235 HydrophobicContact CH2-CG 3.92Å; W1233-P1235 HydrophobicContact CZ2-CB 3.81Å; W1233-P1235 HydrophobicContact CZ2-CG 4.08Å; W1233-P1235 HydrophobicContact CZ3-CG 4.06Å; P1235-V1356 HydrophobicContact CB-CG2 4.21Å
1236	T	69	Low	80.4	Confident	43 Å²	43	51.7 Å²	51.7	26%	0.264	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-79.5	126.7	-175.1	65.2	0	0	0	0	111.1	D1354 L1355 V1356	T1236-D1354 PolarHBondContact N-O 2.9Å; T1236-D1354 PolarHBondContact OG1-O 3.22Å; T1236-L1355 WeakPolarHBondContact OG1-CA 3.2Å; T1236-V1356 WeakPolarHBondContact O-CB 3.48Å; T1236-V1356 PolarHBondContact O-N 3.44Å
1237	G	57.7	Low	80.5	Confident	35 Å²	35	51.4 Å²	51.4	36%	0.361	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	126.4	-20.5	179.8	0	0	0	0	0	114.9	K1239	G1237-K1239 PolarHBondContact O-N 2.79Å
1238	G	57.2	Low	80.1	Confident	63 Å²	63	54.6 Å²	54.6	65%	0.649	31%	0.311	S	S	*	.			trans	-69.7	125.2	179	0	0	0	0	0	113.5
1239	K	59.5	Low	79.5	Confident	159 Å²	159	54.2 Å²	54.2	69%	0.691	31%	0.305	S	S	*	.			trans	-92.1	-6.7	-179.4	-63.1	-177.1	-173	174.4	0	115.1	G1237 N1340	G1237-K1239 PolarHBondContact O-N 2.79Å; K1239-N1340 PolarHBondContact NZ-O 3.09Å
1240	S	62.6	Low	79.2	Confident	87 Å²	87	58.5 Å²	58.5	61%	0.608	32%	0.315	S	S	*	.	S	Bend	trans	-81.4	-14.4	-171.6	50.9	0	0	0	0	114.6	A1242	S1240-A1242 PolarHBondContact O-N 3.25Å; S1240-A1242 VanDerWaalsContact O-N 3.09Å
1241	G	68.8	Low	78.9	Confident	61 Å²	61	59.5 Å²	59.5	63%	0.629	32%	0.318	S	S	*	.			trans	69.1	-3.2	-174.5	0	0	0	0	0	115.2	K1243	G1241-K1243 PolarHBondContact O-N 3.19Å
1242	A	77.5	Confident	79	Confident	21 Å²	21	55.5 Å²	55.5	17%	0.174	30%	0.299	C	S	.	.			trans	-58.9	135	179.7	0	0	0	0	0	111.5	S1240 F1244	S1240-A1242 PolarHBondContact O-N 3.25Å; S1240-A1242 VanDerWaalsContact O-N 3.09Å; A1242-F1244 HydrophobicContact CB-CE2 4.29Å; A1242-F1244 WeakPolarHBondContact O-CD2 3.26Å
1243	K	87.4	Confident	79.2	Confident	73 Å²	73	49.2 Å²	49.2	32%	0.317	28%	0.277	S	S	.	.			trans	-73.2	137.5	173.3	-59.2	171.4	-167.1	172.1	0	109.4	G1241 F1245 Q1256	G1241-K1243 PolarHBondContact O-N 3.19Å; K1243-F1245 HydrophobicContact CB-CE2 3.96Å; K1243-F1245 HydrophobicContact CB-CZ 4.36Å; K1243-Q1256 HydrophobicContact CB-CB 4.15Å; K1243-Q1256 VanDerWaalsContact CG-OE1 3.27Å; K1243-Q1256 WeakPolarHBondContact O-CB 3.38Å; K1243-Q1256 PolarHBondContact O-N 2.67Å
1244	F	90.4	Very high	79.7	Confident	36 Å²	36	47.7 Å²	47.7	16%	0.158	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	153.9	168.7	-65.9	-106.1	0	0	0	109	W1233 A1242 I1253 L1254 K1255	W1233-F1244 HydrophobicContact CE3-CB 4.23Å; W1233-F1244 PolarHBondContact N-O 2.77Å; W1233-F1244 CarbonylContact O-C 3.49Å; W1233-F1244 WeakPolarHBondContact O-CB 3.12Å; A1242-F1244 HydrophobicContact CB-CE2 4.29Å; A1242-F1244 WeakPolarHBondContact O-CD2 3.26Å; F1244-I1253 HydrophobicContact CD1-CG2 3.79Å; F1244-L1254 CarbonylContact C-O 3.6Å; F1244-L1254 WeakPolarHBondContact CA-O 3.45Å; F1244-K1255 HydrophobicContact CD1-CB 3.97Å; F1244-K1255 HydrophobicContact CD1-CG 3.95Å; F1244-K1255 HydrophobicContact CE1-CB 3.95Å; F1244-K1255 HydrophobicContact CE1-CD 3.68Å; F1244-K1255 HydrophobicContact CE1-CG 3.54Å; F1244-K1255 HydrophobicContact CZ-CD 3.96Å; F1244-K1255 HydrophobicContact CZ-CG 3.95Å
1245	F	93.6	Very high	80.4	Confident	17 Å²	17	43.1 Å²	43.1	8%	0.075	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	154.8	170.5	-52.9	-101.5	0	0	0	107.9	P1132 C1230 E1231 R1232 K1243 I1253 L1254	P1132-F1245 HydrophobicContact CG-CD1 3.9Å; P1132-F1245 HydrophobicContact CG-CD2 3.82Å; P1132-F1245 HydrophobicContact CG-CE1 3.68Å; P1132-F1245 HydrophobicContact CG-CE2 3.62Å; P1132-F1245 HydrophobicContact CG-CG 3.98Å; P1132-F1245 HydrophobicContact CG-CZ 3.54Å; C1230-F1245 HydrophobicContact CB-CB 4.47Å; E1231-F1245 CarbonylContact O-C 3.56Å; E1231-F1245 WeakPolarHBondContact O-CA 3.47Å; E1231-F1245 WeakPolarHBondContact O-CB 3.49Å; R1232-F1245 HydrophobicContact CB-CD1 3.97Å; R1232-F1245 HydrophobicContact CB-CE1 3.99Å; R1232-F1245 HydrophobicContact CG-CD1 4.42Å; R1232-F1245 HydrophobicContact CG-CE1 4.22Å; K1243-F1245 HydrophobicContact CB-CE2 3.96Å; K1243-F1245 HydrophobicContact CB-CZ 4.36Å; F1245-I1253 CarbonylContact O-C 3.58Å; F1245-I1253 WeakPolarHBondContact O-CA 3.49Å; F1245-L1254 HydrophobicContact CB-CB 4.18Å; F1245-L1254 HydrophobicContact CB-CD1 4.08Å; F1245-L1254 PolarHBondContact N-O 3.47Å; F1245-L1254 PolarHBondContact O-N 3.08Å
1246	R	91.4	Very high	81.3	Confident	13 Å²	13	43.9 Å²	43.9	5%	0.049	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.4	178.7	-176.6	170.6	64.8	-163.7	-1.6	108.1	C1230 E1231 W1233 R1250 F1252	C1230-R1246 CarbonylContact C-O 3.58Å; C1230-R1246 WeakPolarHBondContact CA-O 3.33Å; C1230-R1246 WeakPolarHBondContact CB-O 3.46Å; E1231-R1246 HydrophobicContact CG-CB 4.12Å; E1231-R1246 PolarHBondContact N-O 2.9Å; E1231-R1246 PolarHBondContact O-N 2.77Å; E1231-R1246 IonicContact OE1-CZ 3.51Å; E1231-R1246 IonicContact OE1-NE 2.64Å; E1231-R1246 PolarHBondContact OE1-NE 3.01Å; E1231-R1246 IonicContact OE1-NH2 3.37Å; E1231-R1246 PolarHBondContact OE1-NH2 3.32Å; E1231-R1246 IonicContact OE2-NH2 2.71Å; W1233-R1246 HydrophobicContact CB-CB 4.01Å; W1233-R1246 HydrophobicContact CG-CB 4.42Å; R1246-R1250 HydrophobicContact CG-CB 4.33Å; R1246-R1250 HydrophobicContact CG-CG 4.26Å; R1246-F1252 WeakPolarHBondContact CA-O 3.4Å
1247	T	91.9	Very high	82.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	150.5	174.4	53.8	0	0	0	0	110.4	S1226 L1227 S1229 D1249 R1250 R1251 F1252 L1254	S1226-T1247 WeakPolarHBondContact O-CB 3.02Å; S1226-T1247 WeakPolarHBondContact O-CG2 3.41Å; L1227-T1247 HydrophobicContact CD2-CG2 4.18Å; S1229-T1247 WeakPolarHBondContact O-CA 3.3Å; T1247-D1249 VanDerWaalsContact C-N 3.25Å; T1247-D1249 VanDerWaalsContact CB-OD1 3.25Å; T1247-D1249 WeakPolarHBondContact CB-OD1 3.34Å; T1247-D1249 PolarHBondContact O-N 3.14Å; T1247-D1249 PolarHBondContact OG1-OD1 3.46Å; T1247-R1250 WeakPolarHBondContact O-CA 3.22Å; T1247-R1250 PolarHBondContact O-N 2.82Å; T1247-R1251 PolarHBondContact OG1-N 3.17Å; T1247-F1252 HydrophobicContact CG2-CB 3.91Å; T1247-F1252 HydrophobicContact CG2-CD2 4.21Å; T1247-F1252 PolarHBondContact N-O 2.99Å; T1247-F1252 PolarHBondContact OG1-N 3.19Å; T1247-F1252 PolarHBondContact OG1-O 2.57Å; T1247-L1254 HydrophobicContact CG2-CD1 4.12Å
1248	R	85.2	Confident	83.7	Confident	67 Å²	67	43.1 Å²	43.1	25%	0.253	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-49	-178	-152.4	-160.1	170	143	-2.3	110.5	E923 E929 E933 S1229 R1250	E923-R1248 WeakPolarHBondContact OE1-CD 3.45Å; E923-R1248 WeakPolarHBondContact OE1-CG 3.32Å; E923-R1248 IonicContact OE1-NE 2.62Å; E923-R1248 VanDerWaalsContact OE2-C 3.3Å; E929-R1248 IonicContact OE2-NH2 2.63Å; E929-R1248 PolarHBondContact OE2-NH2 2.78Å; E933-R1248 IonicContact OE1-CZ 2.73Å; E933-R1248 IonicContact OE1-NH1 3.91Å; E933-R1248 PolarHBondContact OE1-NH1 2.9Å; E933-R1248 IonicContact OE1-NH2 2.94Å; E933-R1248 PolarHBondContact OE1-NH2 2.96Å; S1229-R1248 PolarHBondContact O-N 2.87Å; R1248-R1250 WeakPolarHBondContact O-CG 3.31Å; R1248-R1250 PolarHBondContact O-N 3.49Å; R1248-R1250 VanDerWaalsContact O-N 3.08Å
1249	D	79.8	Confident	84.8	Confident	19 Å²	19	43.6 Å²	43.6	10%	0.102	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-6.2	175.9	68.4	15	0	0	0	116.3	E923 S1226 T1247 R1251	E923-D1249 HydrophobicContact CB-CB 4.1Å; E923-D1249 WeakPolarHBondContact OE2-CA 3.26Å; E923-D1249 WeakPolarHBondContact OE2-CB 3.41Å; E923-D1249 PolarHBondContact OE2-N 2.66Å; S1226-D1249 VanDerWaalsContact CB-OD2 3.31Å; S1226-D1249 WeakPolarHBondContact CB-OD2 3.33Å; S1226-D1249 PolarHBondContact OG-OD2 2.83Å; S1226-D1249 VanDerWaalsContact OG-OD2 3.08Å; T1247-D1249 VanDerWaalsContact C-N 3.25Å; T1247-D1249 VanDerWaalsContact CB-OD1 3.25Å; T1247-D1249 WeakPolarHBondContact CB-OD1 3.34Å; T1247-D1249 PolarHBondContact O-N 3.14Å; T1247-D1249 PolarHBondContact OG1-OD1 3.46Å; D1249-R1251 PolarHBondContact O-N 3.4Å; D1249-R1251 VanDerWaalsContact O-N 3.16Å; D1249-R1251 WeakPolarHBondContact OD1-CB 3.49Å; D1249-R1251 PolarHBondContact OD1-N 3.35Å; D1249-R1251 IonicContact OD1-NE 2.84Å; D1249-R1251 IonicContact OD2-CZ 3.18Å; D1249-R1251 IonicContact OD2-NE 2.72Å; D1249-R1251 PolarHBondContact OD2-NE 3.06Å; D1249-R1251 IonicContact OD2-NH2 3.96Å; D1249-R1251 PolarHBondContact OD2-NH2 3.37Å
1250	R	84.3	Confident	85.9	Confident	130 Å²	130	43.9 Å²	43.9	49%	0.491	23%	0.227	S	C	.	.	S	Bend	trans	56.1	22.7	-177.8	-48.3	-174.3	178.4	163.7	1.1	115.2	R1246 T1247 R1248 Y1321	R1246-R1250 HydrophobicContact CG-CB 4.33Å; R1246-R1250 HydrophobicContact CG-CG 4.26Å; T1247-R1250 WeakPolarHBondContact O-CA 3.22Å; T1247-R1250 PolarHBondContact O-N 2.82Å; R1248-R1250 WeakPolarHBondContact O-CG 3.31Å; R1248-R1250 PolarHBondContact O-N 3.49Å; R1248-R1250 VanDerWaalsContact O-N 3.08Å; R1250-Y1321 HydrophobicContact CB-CD1 4.29Å; R1250-Y1321 HydrophobicContact CB-CE1 4.47Å; R1250-Y1321 VanDerWaalsContact O-CB 3.25Å; R1250-Y1321 WeakPolarHBondContact O-CB 3.5Å; R1250-Y1321 WeakPolarHBondContact O-CD1 3.38Å
1251	R	86	Confident	87.1	Confident	25 Å²	25	41.6 Å²	41.6	9%	0.094	21%	0.207	C	C	.	.	S	Bend	trans	-72.2	-34.7	172.4	-77.1	-173	-73.8	-159.5	-7.9	113	T1222 S1226 T1247 D1249 Y1321 Y1324	T1222-R1251 VanDerWaalsContact CG2-NH1 3.28Å; S1226-R1251 PolarHBondContact OG-NE 3.12Å; S1226-R1251 PolarHBondContact OG-NH2 2.58Å; T1247-R1251 PolarHBondContact OG1-N 3.17Å; D1249-R1251 PolarHBondContact O-N 3.4Å; D1249-R1251 VanDerWaalsContact O-N 3.16Å; D1249-R1251 WeakPolarHBondContact OD1-CB 3.49Å; D1249-R1251 PolarHBondContact OD1-N 3.35Å; D1249-R1251 IonicContact OD1-NE 2.84Å; D1249-R1251 IonicContact OD2-CZ 3.18Å; D1249-R1251 IonicContact OD2-NE 2.72Å; D1249-R1251 PolarHBondContact OD2-NE 3.06Å; D1249-R1251 IonicContact OD2-NH2 3.96Å; D1249-R1251 PolarHBondContact OD2-NH2 3.37Å; R1251-Y1321 WeakPolarHBondContact O-CB 3.34Å; R1251-Y1321 PolarHBondContact O-N 2.91Å; R1251-Y1324 HydrophobicContact CB-CE2 4.5Å; R1251-Y1324 HydrophobicContact CG-CD1 4.27Å; R1251-Y1324 HydrophobicContact CG-CD2 3.74Å; R1251-Y1324 HydrophobicContact CG-CE1 3.87Å; R1251-Y1324 HydrophobicContact CG-CE2 3.33Å; R1251-Y1324 HydrophobicContact CG-CG 4.2Å
1252	F	91.5	Very high	87.9	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.8	-171.3	-49.9	-73.3	0	0	0	113.5	L918 F1216 F1218 F1223 R1246 T1247 F1296 V1318 M1319	L918-F1252 HydrophobicContact CD1-CE1 3.58Å; L918-F1252 HydrophobicContact CD1-CZ 3.76Å; F1216-F1252 AromaticContact CE1-CE1 3.95Å; F1216-F1252 HydrophobicContact CE1-CE1 3.95Å; F1216-F1252 HydrophobicContact CE1-CZ 4.07Å; F1216-F1252 HydrophobicContact CE2-CZ 4.4Å; F1216-F1252 AromaticContact CZ-CE1 3.74Å; F1216-F1252 HydrophobicContact CZ-CE1 3.74Å; F1216-F1252 AromaticContact CZ-CZ 3.72Å; F1216-F1252 HydrophobicContact CZ-CZ 3.72Å; F1218-F1252 HydrophobicContact CZ-CZ 4.27Å; F1223-F1252 HydrophobicContact CD2-CD2 4.4Å; F1223-F1252 HydrophobicContact CD2-CE1 4.16Å; F1223-F1252 AromaticContact CD2-CE2 3.79Å; F1223-F1252 HydrophobicContact CD2-CE2 3.79Å; F1223-F1252 AromaticContact CD2-CZ 3.65Å; F1223-F1252 HydrophobicContact CD2-CZ 3.65Å; F1223-F1252 HydrophobicContact CE2-CD1 4.41Å; F1223-F1252 HydrophobicContact CE2-CE1 4.16Å; F1223-F1252 HydrophobicContact CE2-CE2 4.28Å; F1223-F1252 HydrophobicContact CE2-CZ 4.09Å; R1246-F1252 WeakPolarHBondContact CA-O 3.4Å; T1247-F1252 HydrophobicContact CG2-CB 3.91Å; T1247-F1252 HydrophobicContact CG2-CD2 4.21Å; T1247-F1252 PolarHBondContact N-O 2.99Å; T1247-F1252 PolarHBondContact OG1-N 3.19Å; T1247-F1252 PolarHBondContact OG1-O 2.57Å; F1252-F1296 AromaticContact CD1-CD2 3.61Å; F1252-F1296 HydrophobicContact CD1-CD2 3.61Å; F1252-F1296 AromaticContact CD1-CE2 3.83Å; F1252-F1296 HydrophobicContact CD1-CE2 3.83Å; F1252-F1296 AromaticContact CE1-CD2 3.49Å; F1252-F1296 HydrophobicContact CE1-CD2 3.49Å; F1252-F1296 VanDerWaalsContact CE1-CD2 3.49Å; F1252-F1296 AromaticContact CE1-CE2 3.58Å; F1252-F1296 HydrophobicContact CE1-CE2 3.58Å; F1252-F1296 HydrophobicContact CE1-CG 4.38Å; F1252-V1318 HydrophobicContact CB-CG1 4Å; F1252-V1318 HydrophobicContact CD1-CG1 4.35Å; F1252-V1318 HydrophobicContact CG-CG1 4.22Å; F1252-M1319 CarbonylContact C-O 3.58Å; F1252-M1319 VanDerWaalsContact CA-O 3.31Å; F1252-M1319 WeakPolarHBondContact CA-O 3.25Å
1253	I	92.9	Very high	88.3	Confident	20 Å²	20	42 Å²	42	10%	0.103	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.2	162.8	-69.3	164.9	0	0	0	107.9	W1233 F1244 F1245 K1255 V1318 M1319 Y1321	W1233-I1253 HydrophobicContact CE3-CG1 4.41Å; W1233-I1253 HydrophobicContact CH2-CD1 4.44Å; W1233-I1253 HydrophobicContact CZ3-CD1 3.77Å; W1233-I1253 HydrophobicContact CZ3-CG1 3.99Å; F1244-I1253 HydrophobicContact CD1-CG2 3.79Å; F1245-I1253 CarbonylContact O-C 3.58Å; F1245-I1253 WeakPolarHBondContact O-CA 3.49Å; I1253-K1255 HydrophobicContact CG2-CB 4.36Å; I1253-V1318 WeakPolarHBondContact O-CA 3.25Å; I1253-M1319 HydrophobicContact CB-CG 3.94Å; I1253-M1319 HydrophobicContact CG2-CG 4.23Å; I1253-M1319 PolarHBondContact N-O 3.14Å; I1253-M1319 PolarHBondContact O-N 2.86Å; I1253-Y1321 HydrophobicContact CD1-CD2 3.8Å; I1253-Y1321 HydrophobicContact CG1-CD2 3.91Å
1254	L	95.6	Very high	88.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119	159.2	-50.5	85.8	0	0	0	108.2	I1136 L1227 C1230 F1244 F1245 T1247 L1316 I1317 V1318	I1136-L1254 HydrophobicContact CD1-CD2 4.12Å; L1227-L1254 HydrophobicContact CD2-CD1 4.29Å; L1227-L1254 HydrophobicContact CD2-CD2 4.05Å; L1227-L1254 HydrophobicContact CD2-CG 4.24Å; C1230-L1254 HydrophobicContact CB-CD1 4.06Å; F1244-L1254 CarbonylContact C-O 3.6Å; F1244-L1254 WeakPolarHBondContact CA-O 3.45Å; F1245-L1254 HydrophobicContact CB-CB 4.18Å; F1245-L1254 HydrophobicContact CB-CD1 4.08Å; F1245-L1254 PolarHBondContact N-O 3.47Å; F1245-L1254 PolarHBondContact O-N 3.08Å; T1247-L1254 HydrophobicContact CG2-CD1 4.12Å; L1254-L1316 HydrophobicContact CB-CD2 4.43Å; L1254-I1317 CarbonylContact C-O 3.55Å; L1254-I1317 VanDerWaalsContact CA-O 3.3Å; L1254-I1317 WeakPolarHBondContact CA-O 3.36Å; L1254-V1318 HydrophobicContact CD2-CG2 4.28Å; L1254-V1318 HydrophobicContact CG-CG2 4.22Å
1255	K	93.2	Very high	88.1	Confident	8 Å²	8	37.7 Å²	37.7	4%	0.035	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.8	179.3	179	-177.1	174	-171.5	0	109.9	F1244 I1253 M1257 L1316 I1317 M1319 D1419	F1244-K1255 HydrophobicContact CD1-CB 3.97Å; F1244-K1255 HydrophobicContact CD1-CG 3.95Å; F1244-K1255 HydrophobicContact CE1-CB 3.95Å; F1244-K1255 HydrophobicContact CE1-CD 3.68Å; F1244-K1255 HydrophobicContact CE1-CG 3.54Å; F1244-K1255 HydrophobicContact CZ-CD 3.96Å; F1244-K1255 HydrophobicContact CZ-CG 3.95Å; I1253-K1255 HydrophobicContact CG2-CB 4.36Å; K1255-M1257 HydrophobicContact CB-SD 4.35Å; K1255-M1257 HydrophobicContact CD-SD 3.68Å; K1255-M1257 HydrophobicContact CG-SD 3.78Å; K1255-M1257 PolarHBondContact O-N 3.1Å; K1255-L1316 WeakPolarHBondContact O-CA 3.1Å; K1255-I1317 HydrophobicContact CB-CD1 4.48Å; K1255-I1317 HydrophobicContact CB-CG1 3.97Å; K1255-I1317 PolarHBondContact N-O 3.13Å; K1255-I1317 PolarHBondContact O-N 3.28Å; K1255-M1319 HydrophobicContact CB-SD 4.49Å; K1255-D1419 IonicContact NZ-OD1 3.32Å; K1255-D1419 PolarHBondContact NZ-OD1 2.95Å
1256	Q	92.7	Very high	87.7	Confident	44 Å²	44	38.6 Å²	38.6	21%	0.206	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	129.5	168.6	-178.7	170.5	31.5	0	0	110	K1243 T1314 L1316	K1243-Q1256 HydrophobicContact CB-CB 4.15Å; K1243-Q1256 VanDerWaalsContact CG-OE1 3.27Å; K1243-Q1256 WeakPolarHBondContact O-CB 3.38Å; K1243-Q1256 PolarHBondContact O-N 2.67Å; Q1256-T1314 WeakPolarHBondContact CG-OG1 3.13Å; Q1256-T1314 PolarHBondContact NE2-OG1 2.89Å; Q1256-L1316 HydrophobicContact CB-CD2 4.4Å
1257	M	89	Confident	87.3	Confident	11 Å²	11	48.4 Å²	48.4	5%	0.054	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	148.7	178.7	-58.7	-50.2	-54.2	0	0	110.7	K1255 E1261 D1315 I1317 L1421	K1255-M1257 HydrophobicContact CB-SD 4.35Å; K1255-M1257 HydrophobicContact CD-SD 3.68Å; K1255-M1257 HydrophobicContact CG-SD 3.78Å; K1255-M1257 PolarHBondContact O-N 3.1Å; M1257-E1261 HydrophobicContact CE-CB 3.36Å; M1257-E1261 HydrophobicContact CE-CG 3.98Å; M1257-D1315 HydrophobicContact CB-CB 4.35Å; M1257-D1315 PolarHBondContact N-O 2.98Å; M1257-I1317 HydrophobicContact CG-CG1 4.05Å; M1257-I1317 HydrophobicContact CG-CG2 3.99Å; M1257-I1317 HydrophobicContact SD-CD1 4.08Å; M1257-I1317 HydrophobicContact SD-CG1 3.85Å; M1257-L1421 HydrophobicContact CE-CB 3.99Å; M1257-L1421 HydrophobicContact CE-CD1 3.54Å; M1257-L1421 HydrophobicContact CE-CG 4.36Å; M1257-L1421 HydrophobicContact SD-CD1 3.93Å
1258	S	86.5	Confident	87.1	Confident	52 Å²	52	48.8 Å²	48.8	36%	0.364	22%	0.218	S	C	.	.			trans	-76.7	153.6	162.1	64.8	0	0	0	0	110.6	F1260 E1261 L1262	S1258-F1260 PolarHBondContact O-N 3.39Å; S1258-E1261 WeakPolarHBondContact CB-OE2 3.38Å; S1258-E1261 PolarHBondContact N-OE2 3.08Å; S1258-E1261 PolarHBondContact O-N 3.43Å; S1258-E1261 VanDerWaalsContact OG-CD 3.32Å; S1258-E1261 VanDerWaalsContact OG-CG 3.32Å; S1258-E1261 WeakPolarHBondContact OG-CG 3.44Å; S1258-E1261 PolarHBondContact OG-N 3.33Å; S1258-E1261 PolarHBondContact OG-OE2 2.73Å; S1258-L1262 PolarHBondContact O-N 3.11Å
1259	H	81.6	Confident	87.2	Confident	72 Å²	72	45.6 Å²	45.6	33%	0.333	21%	0.206	S	C	.	.	H	α-helix	trans	-53.2	-39.8	178.8	-173.4	79.7	0	0	0	112.6	E1261 L1262 Q1263 R1300 D1315	H1259-E1261 PolarHBondContact O-N 2.94Å; H1259-L1262 PolarHBondContact O-N 2.96Å; H1259-Q1263 PolarHBondContact CD2-NE2 2.97Å; H1259-Q1263 PolarHBondContact NE2-NE2 3.48Å; H1259-Q1263 PolarHBondContact O-N 3.33Å; H1259-R1300 PolarHBondContact ND1-NH2 3.14Å; H1259-D1315 IonicContact ND1-OD2 3.25Å
1260	F	81.9	Confident	87.4	Confident	166 Å²	166	45.7 Å²	45.7	73%	0.728	21%	0.208	S	C	*	.	H	α-helix	trans	-65.1	-35.9	176.3	-63.2	-70.8	0	0	0	113.4	S1258 S1264	S1258-F1260 PolarHBondContact O-N 3.39Å; F1260-S1264 WeakPolarHBondContact O-CB 3.48Å; F1260-S1264 PolarHBondContact O-N 3.07Å
1261	E	87	Confident	87.6	Confident	38 Å²	38	42.1 Å²	42.1	18%	0.178	20%	0.196	C	C	.	.	H	α-helix	trans	-73.7	-33.1	175.5	-68.8	165.4	119.6	0	0	111.7	M1257 S1258 H1259 F1265 R1422	M1257-E1261 HydrophobicContact CE-CB 3.36Å; M1257-E1261 HydrophobicContact CE-CG 3.98Å; S1258-E1261 WeakPolarHBondContact CB-OE2 3.38Å; S1258-E1261 PolarHBondContact N-OE2 3.08Å; S1258-E1261 PolarHBondContact O-N 3.43Å; S1258-E1261 VanDerWaalsContact OG-CD 3.32Å; S1258-E1261 VanDerWaalsContact OG-CG 3.32Å; S1258-E1261 WeakPolarHBondContact OG-CG 3.44Å; S1258-E1261 PolarHBondContact OG-N 3.33Å; S1258-E1261 PolarHBondContact OG-OE2 2.73Å; H1259-E1261 PolarHBondContact O-N 2.94Å; E1261-F1265 PolarHBondContact O-N 2.86Å; E1261-R1422 HydrophobicContact CG-CB 4.44Å
1262	L	87.4	Confident	87.8	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-49.8	172.2	179.6	63.6	0	0	0	111.3	Y1203 S1258 H1259 S1264 F1265 V1266 A1298 D1315	Y1203-L1262 HydrophobicContact CD2-CD1 4.39Å; Y1203-L1262 HydrophobicContact CD2-CD2 4.45Å; Y1203-L1262 HydrophobicContact CE2-CD1 4.47Å; Y1203-L1262 HydrophobicContact CE2-CD2 3.75Å; S1258-L1262 PolarHBondContact O-N 3.11Å; H1259-L1262 PolarHBondContact O-N 2.96Å; L1262-S1264 VanDerWaalsContact C-N 3.27Å; L1262-S1264 PolarHBondContact O-N 3.31Å; L1262-F1265 PolarHBondContact O-N 2.99Å; L1262-F1265 VanDerWaalsContact O-N 3.15Å; L1262-V1266 HydrophobicContact CD1-CG2 4.24Å; L1262-V1266 HydrophobicContact CG-CG2 4.41Å; L1262-V1266 WeakPolarHBondContact O-CG2 3.49Å; L1262-V1266 PolarHBondContact O-N 2.83Å; L1262-A1298 HydrophobicContact CD1-CB 4.29Å; L1262-D1315 HydrophobicContact CB-CB 4.41Å; L1262-D1315 HydrophobicContact CD2-CB 3.86Å; L1262-D1315 WeakPolarHBondContact CD2-OD1 3.44Å; L1262-D1315 WeakPolarHBondContact CD2-OD2 3.46Å
1263	Q	84.3	Confident	87.7	Confident	84 Å²	84	40.9 Å²	40.9	39%	0.393	19%	0.192	S	C	.	.	H	α-helix	trans	-56.3	-43.6	174.1	-74.5	-167.8	0.4	0	0	111.7	H1259 V1266 R1267	H1259-Q1263 PolarHBondContact CD2-NE2 2.97Å; H1259-Q1263 PolarHBondContact NE2-NE2 3.48Å; H1259-Q1263 PolarHBondContact O-N 3.33Å; Q1263-V1266 PolarHBondContact O-N 2.85Å; Q1263-R1267 WeakPolarHBondContact O-CB 3.2Å; Q1263-R1267 PolarHBondContact O-N 3.23Å
1264	S	84.7	Confident	87.2	Confident	17 Å²	17	40.4 Å²	40.4	12%	0.119	19%	0.19	C	C	.	.	H	α-helix	trans	-57.9	-47.6	175.6	173.6	0	0	0	0	111.3	F1260 L1262 R1267 F1268 L1421 A1423	F1260-S1264 WeakPolarHBondContact O-CB 3.48Å; F1260-S1264 PolarHBondContact O-N 3.07Å; L1262-S1264 VanDerWaalsContact C-N 3.27Å; L1262-S1264 PolarHBondContact O-N 3.31Å; S1264-R1267 PolarHBondContact O-N 2.88Å; S1264-F1268 WeakPolarHBondContact O-CD1 3.32Å; S1264-F1268 PolarHBondContact O-N 2.83Å; S1264-L1421 VanDerWaalsContact CB-O 3.22Å; S1264-L1421 WeakPolarHBondContact CB-O 3.29Å; S1264-L1421 PolarHBondContact OG-O 3.11Å; S1264-A1423 WeakPolarHBondContact OG-CB 3.49Å; S1264-A1423 PolarHBondContact OG-N 3.45Å; S1264-A1423 VanDerWaalsContact OG-N 3.12Å
1265	F	88.7	Confident	86.8	Confident	2 Å²	2	42 Å²	42	1%	0.009	20%	0.198	C	C	.	.	H	α-helix	trans	-60.4	-50.1	173.8	176.2	-106.8	0	0	0	112.7	F1208 E1261 L1262 R1267 F1268 A1269 Y1272 I1295 A1298 L1421	F1208-F1265 HydrophobicContact CE2-CE1 4.24Å; F1208-F1265 HydrophobicContact CE2-CZ 4.48Å; F1208-F1265 AromaticContact CZ-CE1 3.81Å; F1208-F1265 HydrophobicContact CZ-CE1 3.81Å; F1208-F1265 AromaticContact CZ-CZ 3.69Å; F1208-F1265 HydrophobicContact CZ-CZ 3.69Å; E1261-F1265 PolarHBondContact O-N 2.86Å; L1262-F1265 PolarHBondContact O-N 2.99Å; L1262-F1265 VanDerWaalsContact O-N 3.15Å; F1265-R1267 PolarHBondContact O-N 3.1Å; F1265-R1267 VanDerWaalsContact O-N 3.14Å; F1265-F1268 HydrophobicContact CD2-CE1 4.42Å; F1265-F1268 HydrophobicContact CD2-CE2 4.23Å; F1265-F1268 AromaticContact CD2-CZ 3.97Å; F1265-F1268 HydrophobicContact CD2-CZ 3.97Å; F1265-F1268 CarbonylContact O-C 3.51Å; F1265-F1268 PolarHBondContact O-N 3.33Å; F1265-A1269 HydrophobicContact CE1-CB 4.05Å; F1265-A1269 HydrophobicContact CE2-CB 4.37Å; F1265-A1269 HydrophobicContact CZ-CB 3.95Å; F1265-A1269 WeakPolarHBondContact O-CB 3.11Å; F1265-A1269 PolarHBondContact O-N 2.82Å; F1265-Y1272 HydrophobicContact CE2-CD1 4.08Å; F1265-Y1272 HydrophobicContact CE2-CG 4.23Å; F1265-Y1272 HydrophobicContact CZ-CD1 4.24Å; F1265-I1295 HydrophobicContact CD2-CD1 4.31Å; F1265-I1295 HydrophobicContact CE2-CD1 4.02Å; F1265-A1298 HydrophobicContact CD1-CB 4.2Å; F1265-A1298 HydrophobicContact CE1-CB 3.98Å; F1265-L1421 HydrophobicContact CB-CD2 3.83Å; F1265-L1421 HydrophobicContact CD2-CD2 3.6Å; F1265-L1421 HydrophobicContact CG-CD2 3.96Å
1266	V	86.3	Confident	86.5	Confident	37 Å²	37	41.6 Å²	41.6	22%	0.224	20%	0.196	C	C	.	.	H	α-helix	trans	-54	-37.2	179.9	170.3	0	0	0	0	111.2	Y1203 F1204 L1262 Q1263 F1268	Y1203-V1266 HydrophobicContact CD1-CG2 4.14Å; F1204-V1266 HydrophobicContact CE2-CB 4.26Å; F1204-V1266 HydrophobicContact CE2-CG1 4.1Å; F1204-V1266 HydrophobicContact CE2-CG2 4.11Å; F1204-V1266 HydrophobicContact CZ-CG1 3.96Å; L1262-V1266 HydrophobicContact CD1-CG2 4.24Å; L1262-V1266 HydrophobicContact CG-CG2 4.41Å; L1262-V1266 WeakPolarHBondContact O-CG2 3.49Å; L1262-V1266 PolarHBondContact O-N 2.83Å; Q1263-V1266 PolarHBondContact O-N 2.85Å; V1266-F1268 PolarHBondContact O-N 2.96Å
1267	R	83.1	Confident	85.9	Confident	218 Å²	218	39.8 Å²	39.8	82%	0.823	19%	0.189	S	C	*	.	H	α-helix	trans	-69	-27.2	178.2	-171	174.6	-178.3	159.4	5.3	115.1	Q1263 S1264 F1265	Q1263-R1267 WeakPolarHBondContact O-CB 3.2Å; Q1263-R1267 PolarHBondContact O-N 3.23Å; S1264-R1267 PolarHBondContact O-N 2.88Å; F1265-R1267 PolarHBondContact O-N 3.1Å; F1265-R1267 VanDerWaalsContact O-N 3.14Å
1268	F	86.8	Confident	85.3	Confident	8 Å²	8	42.4 Å²	42.4	4%	0.035	21%	0.212	C	C	.	.	H	α-helix	trans	-113.6	3.4	177.2	79.5	-99.5	0	0	0	114.6	S1264 F1265 V1266 P1270 Q1271 Y1272 F1391 N1395 I1397 Y1420 L1421	S1264-F1268 WeakPolarHBondContact O-CD1 3.32Å; S1264-F1268 PolarHBondContact O-N 2.83Å; F1265-F1268 HydrophobicContact CD2-CE1 4.42Å; F1265-F1268 HydrophobicContact CD2-CE2 4.23Å; F1265-F1268 AromaticContact CD2-CZ 3.97Å; F1265-F1268 HydrophobicContact CD2-CZ 3.97Å; F1265-F1268 CarbonylContact O-C 3.51Å; F1265-F1268 PolarHBondContact O-N 3.33Å; V1266-F1268 PolarHBondContact O-N 2.96Å; F1268-P1270 VanDerWaalsContact C-CD 3.48Å; F1268-Q1271 VanDerWaalsContact C-OE1 3.25Å; F1268-Q1271 VanDerWaalsContact CA-OE1 3.31Å; F1268-Q1271 PolarHBondContact O-N 2.77Å; F1268-Q1271 VanDerWaalsContact O-N 3.08Å; F1268-Q1271 PolarHBondContact O-OE1 3Å; F1268-Q1271 VanDerWaalsContact O-OE1 3.09Å; F1268-Y1272 PolarHBondContact O-N 3.45Å; F1268-F1391 HydrophobicContact CD2-CZ 4.18Å; F1268-F1391 HydrophobicContact CE2-CZ 4.35Å; F1268-N1395 HydrophobicContact CB-CB 4.31Å; F1268-I1397 HydrophobicContact CD1-CD1 3.83Å; F1268-I1397 HydrophobicContact CD1-CG1 4.34Å; F1268-I1397 HydrophobicContact CD2-CD1 3.93Å; F1268-I1397 HydrophobicContact CE1-CD1 3.63Å; F1268-I1397 HydrophobicContact CE1-CG1 4.19Å; F1268-I1397 HydrophobicContact CE2-CD1 3.74Å; F1268-I1397 HydrophobicContact CG-CD1 4Å; F1268-I1397 HydrophobicContact CZ-CD1 3.6Å; F1268-Y1420 HydrophobicContact CE2-CD2 4.39Å; F1268-Y1420 HydrophobicContact CZ-CD2 4.15Å; F1268-Y1420 WeakPolarHBondContact CZ-O 3.48Å; F1268-L1421 HydrophobicContact CZ-CD2 4.25Å
1269	A	88.6	Confident	84.9	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-53.5	-43.1	-178	0	0	0	0	0	113.8	F1204 F1265 Q1271 Y1272 F1273	F1204-A1269 HydrophobicContact CD2-CB 4Å; F1204-A1269 HydrophobicContact CE1-CB 4.35Å; F1204-A1269 HydrophobicContact CE2-CB 3.5Å; F1204-A1269 VanDerWaalsContact CE2-CB 3.5Å; F1204-A1269 HydrophobicContact CZ-CB 3.69Å; F1265-A1269 HydrophobicContact CE1-CB 4.05Å; F1265-A1269 HydrophobicContact CE2-CB 4.37Å; F1265-A1269 HydrophobicContact CZ-CB 3.95Å; F1265-A1269 WeakPolarHBondContact O-CB 3.11Å; F1265-A1269 PolarHBondContact O-N 2.82Å; A1269-Q1271 VanDerWaalsContact C-N 3.32Å; A1269-Q1271 PolarHBondContact O-N 3.4Å; A1269-Y1272 WeakPolarHBondContact O-CB 3.12Å; A1269-Y1272 PolarHBondContact O-N 3.1Å; A1269-Y1272 VanDerWaalsContact O-N 3.11Å; A1269-F1273 HydrophobicContact CB-CD2 4.49Å; A1269-F1273 HydrophobicContact CB-CE2 4.14Å; A1269-F1273 WeakPolarHBondContact O-CD2 3.46Å; A1269-F1273 PolarHBondContact O-N 3.49Å
1270	P	84.4	Confident	84.4	Confident	22 Å²	22	37.3 Å²	37.3	14%	0.143	19%	0.186	C	C	.	.	H	α-helix	trans	-57.3	-42.6	175.7	-25.7	35.7	0	0	0	113.2	L1179 F1268 F1273 A1274	L1179-P1270 HydrophobicContact CD1-CB 4.06Å; L1179-P1270 HydrophobicContact CD1-CG 3.83Å; F1268-P1270 VanDerWaalsContact C-CD 3.48Å; P1270-F1273 PolarHBondContact O-N 2.89Å; P1270-A1274 WeakPolarHBondContact O-CB 3.46Å; P1270-A1274 PolarHBondContact O-N 2.97Å
1271	Q	86.6	Confident	83.5	Confident	54 Å²	54	31.7 Å²	31.7	25%	0.252	16%	0.163	S	C	.	.	H	α-helix	trans	-69.8	-33.5	177.6	-60.5	81.8	-10.4	0	0	111.5	F1268 A1269 A1274 H1275 F1391	F1268-Q1271 VanDerWaalsContact C-OE1 3.25Å; F1268-Q1271 VanDerWaalsContact CA-OE1 3.31Å; F1268-Q1271 PolarHBondContact O-N 2.77Å; F1268-Q1271 VanDerWaalsContact O-N 3.08Å; F1268-Q1271 PolarHBondContact O-OE1 3Å; F1268-Q1271 VanDerWaalsContact O-OE1 3.09Å; A1269-Q1271 VanDerWaalsContact C-N 3.32Å; A1269-Q1271 PolarHBondContact O-N 3.4Å; Q1271-A1274 WeakPolarHBondContact O-CB 3.41Å; Q1271-H1275 WeakPolarHBondContact O-CB 3.4Å; Q1271-H1275 PolarHBondContact O-N 3.1Å; Q1271-F1391 HydrophobicContact CB-CE2 3.93Å; Q1271-F1391 VanDerWaalsContact O-CE2 3.31Å; Q1271-F1391 WeakPolarHBondContact O-CE2 3.38Å
1272	Y	90.6	Very high	82.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.3	-50.6	172.2	162.3	-96.4	0	0	0	111.8	F1208 L1211 F1265 F1268 A1269 A1274 H1275 V1276 L1292 I1295 Y1420	F1208-Y1272 HydrophobicContact CE1-CE1 4.5Å; L1211-Y1272 HydrophobicContact CD2-CE1 4.05Å; F1265-Y1272 HydrophobicContact CE2-CD1 4.08Å; F1265-Y1272 HydrophobicContact CE2-CG 4.23Å; F1265-Y1272 HydrophobicContact CZ-CD1 4.24Å; F1268-Y1272 PolarHBondContact O-N 3.45Å; A1269-Y1272 WeakPolarHBondContact O-CB 3.12Å; A1269-Y1272 PolarHBondContact O-N 3.1Å; A1269-Y1272 VanDerWaalsContact O-N 3.11Å; Y1272-A1274 VanDerWaalsContact C-N 3.27Å; Y1272-A1274 PolarHBondContact O-N 2.87Å; Y1272-H1275 PolarHBondContact O-N 3.45Å; Y1272-H1275 VanDerWaalsContact O-N 3.15Å; Y1272-V1276 HydrophobicContact CD2-CG2 4.06Å; Y1272-V1276 HydrophobicContact CE1-CG2 4.49Å; Y1272-V1276 HydrophobicContact CE2-CG2 3.56Å; Y1272-V1276 PolarHBondContact O-N 3.11Å; Y1272-L1292 HydrophobicContact CD2-CD2 3.95Å; Y1272-L1292 HydrophobicContact CE2-CD2 3.98Å; Y1272-I1295 HydrophobicContact CE1-CB 4.5Å; Y1272-I1295 PolarHBondContact OH-N 2.99Å; Y1272-I1295 PolarHBondContact OH-O 3.03Å; Y1272-Y1420 HydrophobicContact CD2-CE2 4.29Å; Y1272-Y1420 HydrophobicContact CE2-CE2 4.42Å
1273	F	89.4	Confident	80.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.1	-42.2	177.1	-70.3	-65.6	0	0	0	111.2	L1163 F1204 L1207 F1208 L1211 A1269 P1270 H1275 A1277	L1163-F1273 HydrophobicContact CD2-CB 4.23Å; L1163-F1273 HydrophobicContact CD2-CD1 4.43Å; F1204-F1273 HydrophobicContact CB-CE2 4.06Å; F1204-F1273 HydrophobicContact CB-CZ 4.19Å; F1204-F1273 HydrophobicContact CG-CE2 4.21Å; L1207-F1273 HydrophobicContact CB-CD1 4.12Å; L1207-F1273 HydrophobicContact CB-CD2 3.94Å; L1207-F1273 HydrophobicContact CB-CE1 3.82Å; L1207-F1273 HydrophobicContact CB-CE2 3.63Å; L1207-F1273 HydrophobicContact CB-CG 4.2Å; L1207-F1273 HydrophobicContact CB-CZ 3.56Å; L1207-F1273 HydrophobicContact CD1-CD2 3.65Å; L1207-F1273 HydrophobicContact CD1-CE2 3.74Å; L1207-F1273 HydrophobicContact CD1-CG 4.4Å; L1207-F1273 HydrophobicContact CG-CD2 4.35Å; L1207-F1273 HydrophobicContact CG-CE2 4.32Å; F1208-F1273 AromaticContact CD1-CE1 3.73Å; F1208-F1273 HydrophobicContact CD1-CE1 3.73Å; F1208-F1273 AromaticContact CD1-CZ 3.84Å; F1208-F1273 HydrophobicContact CD1-CZ 3.84Å; F1208-F1273 AromaticContact CD2-CZ 3.95Å; F1208-F1273 HydrophobicContact CD2-CZ 3.95Å; F1208-F1273 AromaticContact CE1-CE1 3.9Å; F1208-F1273 HydrophobicContact CE1-CE1 3.9Å; F1208-F1273 AromaticContact CE1-CZ 3.81Å; F1208-F1273 HydrophobicContact CE1-CZ 3.81Å; F1208-F1273 AromaticContact CE2-CZ 3.94Å; F1208-F1273 HydrophobicContact CE2-CZ 3.94Å; F1208-F1273 HydrophobicContact CG-CE1 4.12Å; F1208-F1273 AromaticContact CG-CZ 3.92Å; F1208-F1273 HydrophobicContact CG-CZ 3.92Å; F1208-F1273 HydrophobicContact CZ-CE1 4.44Å; F1208-F1273 AromaticContact CZ-CZ 3.89Å; F1208-F1273 HydrophobicContact CZ-CZ 3.89Å; L1211-F1273 HydrophobicContact CB-CD1 4.42Å; L1211-F1273 HydrophobicContact CB-CE1 4.32Å; L1211-F1273 HydrophobicContact CD2-CD1 4.01Å; L1211-F1273 HydrophobicContact CD2-CE1 3.91Å; A1269-F1273 HydrophobicContact CB-CD2 4.49Å; A1269-F1273 HydrophobicContact CB-CE2 4.14Å; A1269-F1273 WeakPolarHBondContact O-CD2 3.46Å; A1269-F1273 PolarHBondContact O-N 3.49Å; P1270-F1273 PolarHBondContact O-N 2.89Å; F1273-H1275 PolarHBondContact O-N 3.33Å; F1273-A1277 WeakPolarHBondContact O-CB 3.45Å; F1273-A1277 PolarHBondContact O-N 3.2Å
1274	A	83.3	Confident	78.9	Confident	9 Å²	9	35.4 Å²	35.4	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-56.7	-47.7	174.2	0	0	0	0	0	113.5	A1167 P1270 Q1271 Y1272 A1278	A1167-A1274 VanDerWaalsContact CA-CB 3.44Å; A1167-A1274 HydrophobicContact CB-CB 3.64Å; P1270-A1274 WeakPolarHBondContact O-CB 3.46Å; P1270-A1274 PolarHBondContact O-N 2.97Å; Q1271-A1274 WeakPolarHBondContact O-CB 3.41Å; Y1272-A1274 VanDerWaalsContact C-N 3.27Å; Y1272-A1274 PolarHBondContact O-N 2.87Å; A1274-A1278 WeakPolarHBondContact O-CB 3.41Å; A1274-A1278 PolarHBondContact O-N 2.88Å
1275	H	86.7	Confident	77.1	Confident	33 Å²	33	37.9 Å²	37.9	15%	0.153	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-42.4	-177.4	-172.9	80.6	0	0	0	112	Q1271 Y1272 F1273 A1278 S1279 D1388 F1391	Q1271-H1275 WeakPolarHBondContact O-CB 3.4Å; Q1271-H1275 PolarHBondContact O-N 3.1Å; Y1272-H1275 PolarHBondContact O-N 3.45Å; Y1272-H1275 VanDerWaalsContact O-N 3.15Å; F1273-H1275 PolarHBondContact O-N 3.33Å; H1275-A1278 PolarHBondContact O-N 2.96Å; H1275-S1279 PolarHBondContact O-N 3.04Å; H1275-D1388 IonicContact CD2-OD1 3.4Å; H1275-D1388 IonicContact CE1-OD1 2.73Å; H1275-D1388 IonicContact NE2-OD1 3.16Å; H1275-D1388 PolarHBondContact NE2-OD1 3.41Å; H1275-F1391 HydrophobicContact CB-CD2 3.92Å; H1275-F1391 HydrophobicContact CB-CE2 3.99Å; H1275-F1391 HydrophobicContact CB-CG 4.24Å; H1275-F1391 HydrophobicContact CB-CZ 4.34Å; H1275-F1391 AromaticContact CG-CD2 3.99Å; H1275-F1391 AromaticContact CG-CG 3.81Å; H1275-F1391 AromaticContact ND1-CG 3.69Å
1276	V	86.1	Confident	75.4	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-68.5	-43.6	176.7	-177	0	0	0	0	110.9	L1211 L1215 Y1272 A1278 S1279 A1280 K1294	L1211-V1276 HydrophobicContact CD1-CB 4.35Å; L1211-V1276 HydrophobicContact CD1-CG1 3.85Å; L1215-V1276 HydrophobicContact CD1-CG1 4.06Å; Y1272-V1276 HydrophobicContact CD2-CG2 4.06Å; Y1272-V1276 HydrophobicContact CE1-CG2 4.49Å; Y1272-V1276 HydrophobicContact CE2-CG2 3.56Å; Y1272-V1276 PolarHBondContact O-N 3.11Å; V1276-A1278 VanDerWaalsContact C-N 3.33Å; V1276-A1278 PolarHBondContact O-N 3.19Å; V1276-S1279 PolarHBondContact O-N 2.78Å; V1276-S1279 PolarHBondContact O-OG 2.92Å; V1276-A1280 PolarHBondContact O-N 3.37Å; V1276-K1294 HydrophobicContact CG1-CG 4.16Å
1277	A	80.2	Confident	74.3	Confident	6 Å²	6	47.1 Å²	47.1	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-39	176.3	0	0	0	0	0	113.1	L1163 F1273 S1279 A1280 L1282	L1163-A1277 HydrophobicContact CB-CB 3.83Å; L1163-A1277 HydrophobicContact CD1-CB 4.49Å; F1273-A1277 WeakPolarHBondContact O-CB 3.45Å; F1273-A1277 PolarHBondContact O-N 3.2Å; A1277-S1279 PolarHBondContact O-N 2.69Å; A1277-A1280 PolarHBondContact O-N 2.8Å; A1277-L1282 HydrophobicContact CB-CD1 4.01Å
1278	A	77.8	Confident	73.6	Confident	65 Å²	65	39 Å²	39	54%	0.537	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-26.2	175	0	0	0	0	0	113.4	A1274 H1275 V1276 S1288	A1274-A1278 WeakPolarHBondContact O-CB 3.41Å; A1274-A1278 PolarHBondContact O-N 2.88Å; H1275-A1278 PolarHBondContact O-N 2.96Å; V1276-A1278 VanDerWaalsContact C-N 3.33Å; V1276-A1278 PolarHBondContact O-N 3.19Å; A1278-S1288 PolarHBondContact O-OG 3.35Å
1279	S	77.8	Confident	73.2	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-88.5	-23.8	175	65	0	0	0	0	113.8	L916 H1275 V1276 A1277 N1281 S1288	L916-S1279 WeakPolarHBondContact CD1-O 3.49Å; H1275-S1279 PolarHBondContact O-N 3.04Å; V1276-S1279 PolarHBondContact O-N 2.78Å; V1276-S1279 PolarHBondContact O-OG 2.92Å; A1277-S1279 PolarHBondContact O-N 2.69Å; S1279-N1281 PolarHBondContact O-N 3.39Å; S1279-S1288 WeakPolarHBondContact CA-O 3.49Å; S1279-S1288 WeakPolarHBondContact CA-OG 3.37Å; S1279-S1288 WeakPolarHBondContact CB-O 3.45Å
1280	A	71	Confident	73.1	Confident	17 Å²	17	41 Å²	41	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-11.4	179.4	0	0	0	0	0	115.5	L916 L1214 L1215 V1276 A1277 L1282	L916-A1280 HydrophobicContact CD2-CB 4.48Å; L1214-A1280 HydrophobicContact CD2-CB 3.78Å; L1214-A1280 HydrophobicContact CG-CB 4.25Å; L1215-A1280 HydrophobicContact CD2-CB 4.11Å; V1276-A1280 PolarHBondContact O-N 3.37Å; A1277-A1280 PolarHBondContact O-N 2.8Å; A1280-L1282 HydrophobicContact CB-CD2 4.18Å; A1280-L1282 HydrophobicContact CB-CG 4.5Å
1281	N	63.4	Low	73.4	Confident	47 Å²	47	40 Å²	40	25%	0.251	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	29.5	173	-138.3	65.6	0	0	0	118.2	S1279 N1283 G1284 E1285 K1287	S1279-N1281 PolarHBondContact O-N 3.39Å; N1281-N1283 PolarHBondContact O-N 3.33Å; N1281-G1284 PolarHBondContact O-N 3.37Å; N1281-E1285 PolarHBondContact ND2-O 3.13Å; N1281-E1285 PolarHBondContact OD1-O 2.88Å; N1281-K1287 HydrophobicContact CB-CD 4.35Å; N1281-K1287 HydrophobicContact CB-CG 3.66Å; N1281-K1287 VanDerWaalsContact CG-CG 3.46Å; N1281-K1287 WeakPolarHBondContact OD1-CA 3.39Å; N1281-K1287 WeakPolarHBondContact OD1-CG 3.19Å; N1281-K1287 PolarHBondContact OD1-N 3.26Å
1282	L	57.3	Low	73.7	Confident	22 Å²	22	37.4 Å²	37.4	12%	0.115	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	3.7	-173.8	-52	-172.2	0	0	0	117.7	Q1160 L1163 K1164 L1214 A1277 A1280	Q1160-L1282 HydrophobicContact CB-CD1 4.35Å; Q1160-L1282 HydrophobicContact CG-CB 4.33Å; Q1160-L1282 HydrophobicContact CG-CD1 4.21Å; Q1160-L1282 HydrophobicContact CG-CD2 3.95Å; Q1160-L1282 HydrophobicContact CG-CG 4.39Å; Q1160-L1282 PolarHBondContact OE1-O 3.34Å; L1163-L1282 HydrophobicContact CB-CD1 4.39Å; K1164-L1282 VanDerWaalsContact CE-CB 3.46Å; K1164-L1282 PolarHBondContact NZ-O 3.37Å; L1214-L1282 HydrophobicContact CD1-CD2 3.35Å; L1214-L1282 HydrophobicContact CD2-CD1 4.29Å; L1214-L1282 HydrophobicContact CD2-CD2 3.73Å; L1214-L1282 HydrophobicContact CD2-CG 4.46Å; L1214-L1282 HydrophobicContact CG-CD2 4.17Å; A1277-L1282 HydrophobicContact CB-CD1 4.01Å; A1280-L1282 HydrophobicContact CB-CD2 4.18Å; A1280-L1282 HydrophobicContact CB-CG 4.5Å
1283	N	53.3	Low	73.8	Confident	118 Å²	118	37.5 Å²	37.5	63%	0.631	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.4	3.9	-171.8	-67.4	-25	0	0	0	113.8	K1164 N1281 E1285	K1164-N1283 WeakPolarHBondContact CE-OD1 3.43Å; K1164-N1283 PolarHBondContact NZ-OD1 3.02Å; N1281-N1283 PolarHBondContact O-N 3.33Å; N1283-E1285 PolarHBondContact O-N 3.39Å
1284	G	49.9	Very low	73.9	Confident	66 Å²	66	37.6 Å²	37.6	68%	0.68	22%	0.223	S	C	*	.	S	Bend	trans	68.3	-1.8	-174.8	0	0	0	0	0	115.4	N1281	N1281-G1284 PolarHBondContact O-N 3.37Å
1285	E	48.4	Very low	74.3	Confident	69 Å²	69	37.1 Å²	37.1	32%	0.322	22%	0.22	S	C	.	.	S	Bend	trans	-68.2	-174.6	165.2	-80.8	-166.4	-150.1	0	0	111.1	L676 N1281 N1283	L676-E1285 HydrophobicContact CD2-CB 3.58Å; L676-E1285 HydrophobicContact CD2-CG 3.93Å; L676-E1285 WeakPolarHBondContact CD2-OE2 3.3Å; N1281-E1285 PolarHBondContact ND2-O 3.13Å; N1281-E1285 PolarHBondContact OD1-O 2.88Å; N1283-E1285 PolarHBondContact O-N 3.39Å
1286	E	53.4	Low	74.7	Confident	112 Å²	112	35.8 Å²	35.8	52%	0.523	21%	0.213	S	C	.	.			trans	-85.5	138.4	-173.6	-144	157.3	133.9	0	0	111.8	L676 R680 S1288	L676-E1286 HydrophobicContact CD1-CB 3.79Å; L676-E1286 HydrophobicContact CD2-CB 3.63Å; L676-E1286 HydrophobicContact CG-CB 4.32Å; R680-E1286 IonicContact CZ-OE2 3.9Å; R680-E1286 IonicContact NE-OE2 3.19Å; R680-E1286 PolarHBondContact NE-OE2 3.28Å; R680-E1286 VanDerWaalsContact NH2-CB 3.35Å; R680-E1286 IonicContact NH2-OE2 3.52Å; R680-E1286 PolarHBondContact NH2-OE2 2.88Å; E1286-S1288 PolarHBondContact O-N 3.19Å
1287	K	61.8	Low	75.1	Confident	122 Å²	122	35.7 Å²	35.7	53%	0.53	21%	0.213	S	C	.	.			trans	-57.6	109.6	-178.7	-81.1	-171	174.9	-172.5	0	110.6	L916 N1281 V1289	L916-K1287 HydrophobicContact CD1-CD 4.36Å; N1281-K1287 HydrophobicContact CB-CD 4.35Å; N1281-K1287 HydrophobicContact CB-CG 3.66Å; N1281-K1287 VanDerWaalsContact CG-CG 3.46Å; N1281-K1287 WeakPolarHBondContact OD1-CA 3.39Å; N1281-K1287 WeakPolarHBondContact OD1-CG 3.19Å; N1281-K1287 PolarHBondContact OD1-N 3.26Å; K1287-V1289 PolarHBondContact O-N 3.08Å; K1287-V1289 VanDerWaalsContact O-N 3.11Å
1288	S	68	Low	75.9	Confident	46 Å²	46	35.5 Å²	35.5	32%	0.322	21%	0.211	S	C	.	.			trans	-65.5	111.2	164.2	68.9	0	0	0	0	107.5	A1278 S1279 E1286 S1290	A1278-S1288 PolarHBondContact O-OG 3.35Å; S1279-S1288 WeakPolarHBondContact CA-O 3.49Å; S1279-S1288 WeakPolarHBondContact CA-OG 3.37Å; S1279-S1288 WeakPolarHBondContact CB-O 3.45Å; E1286-S1288 PolarHBondContact O-N 3.19Å; S1288-S1290 PolarHBondContact O-N 3.12Å
1289	V	78.8	Confident	76.8	Confident	40 Å²	40	32.6 Å²	32.6	24%	0.242	19%	0.186	C	C	.	.			trans	-68	133.9	-176.6	-166	0	0	0	0	108.6	F913 K1287 A1384 N1387	F913-V1289 HydrophobicContact CD2-CG1 3.79Å; F913-V1289 HydrophobicContact CE2-CG1 3.96Å; F913-V1289 HydrophobicContact CG-CG1 4.36Å; K1287-V1289 PolarHBondContact O-N 3.08Å; K1287-V1289 VanDerWaalsContact O-N 3.11Å; V1289-A1384 HydrophobicContact CB-CB 4.14Å; V1289-A1384 HydrophobicContact CG1-CB 3.8Å; V1289-A1384 WeakPolarHBondContact O-CA 3.42Å; V1289-N1387 PolarHBondContact O-ND2 3.44Å
1290	S	87.1	Confident	77.6	Confident	11 Å²	11	33.4 Å²	33.4	8%	0.077	19%	0.189	C	C	.	.			trans	-129.3	137.4	170.5	175.7	0	0	0	0	108.8	S1288 L1292 D1388	S1288-S1290 PolarHBondContact O-N 3.12Å; S1290-L1292 WeakPolarHBondContact OG-CB 3.3Å; S1290-L1292 PolarHBondContact OG-N 3.24Å; S1290-L1292 VanDerWaalsContact OG-N 3.14Å; S1290-D1388 WeakPolarHBondContact CB-OD1 3.47Å; S1290-D1388 PolarHBondContact OG-OD1 3.47Å; S1290-D1388 PolarHBondContact OG-OD2 3.36Å
1291	S	90.7	Very high	78.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.182	C	C	.	.			trans	-96.1	-0.8	171.4	62.4	0	0	0	0	112.5	V1293 D1388 G1416 I1417	S1291-V1293 PolarHBondContact O-N 2.94Å; S1291-D1388 VanDerWaalsContact CA-OD2 3.31Å; S1291-D1388 WeakPolarHBondContact CA-OD2 3.28Å; S1291-D1388 WeakPolarHBondContact CB-OD2 3.49Å; S1291-D1388 PolarHBondContact N-OD2 2.97Å; S1291-D1388 PolarHBondContact OG-OD2 3.49Å; S1291-G1416 CarbonylContact O-C 3.58Å; S1291-G1416 WeakPolarHBondContact O-CA 3.15Å; S1291-I1417 PolarHBondContact O-N 3.36Å; S1291-I1417 WeakPolarHBondContact OG-CD1 3.32Å; S1291-I1417 WeakPolarHBondContact OG-CG1 3.32Å
1292	L	92.2	Very high	80.2	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-61.8	128.8	179.6	-156.5	70.1	0	0	0	110.6	Y1272 S1290 K1294 D1388 F1391 I1417 Y1420	Y1272-L1292 HydrophobicContact CD2-CD2 3.95Å; Y1272-L1292 HydrophobicContact CE2-CD2 3.98Å; S1290-L1292 WeakPolarHBondContact OG-CB 3.3Å; S1290-L1292 PolarHBondContact OG-N 3.24Å; S1290-L1292 VanDerWaalsContact OG-N 3.14Å; L1292-K1294 WeakPolarHBondContact O-CD 3.39Å; L1292-K1294 VanDerWaalsContact O-CE 3.28Å; L1292-K1294 WeakPolarHBondContact O-CE 3.39Å; L1292-K1294 PolarHBondContact O-NZ 3.02Å; L1292-D1388 PolarHBondContact N-OD2 2.99Å; L1292-F1391 HydrophobicContact CD2-CE1 4.13Å; L1292-I1417 HydrophobicContact CD1-CB 4.24Å; L1292-I1417 HydrophobicContact CD1-CG2 4.07Å; L1292-Y1420 HydrophobicContact CD1-CD1 3.48Å; L1292-Y1420 VanDerWaalsContact CD1-CD1 3.48Å; L1292-Y1420 HydrophobicContact CD1-CD2 4.1Å; L1292-Y1420 HydrophobicContact CD1-CE1 3.48Å; L1292-Y1420 VanDerWaalsContact CD1-CE1 3.48Å; L1292-Y1420 HydrophobicContact CD1-CE2 4.1Å; L1292-Y1420 HydrophobicContact CD1-CG 3.81Å; L1292-Y1420 HydrophobicContact CD2-CE1 4.45Å; L1292-Y1420 HydrophobicContact CD2-CE2 4.06Å; L1292-Y1420 HydrophobicContact CG-CD1 4.24Å; L1292-Y1420 HydrophobicContact CG-CE1 3.7Å; L1292-Y1420 HydrophobicContact CG-CE2 4.2Å
1293	V	92.4	Very high	82	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.012	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-76.7	127.6	174.5	178.2	0	0	0	0	108.7	A914 S1291 M1319 E1320 L1322 I1417 I1418 Y1420	A914-V1293 HydrophobicContact CB-CG2 4.33Å; S1291-V1293 PolarHBondContact O-N 2.94Å; V1293-M1319 HydrophobicContact CB-CE 4.31Å; V1293-M1319 HydrophobicContact CG1-CE 3.78Å; V1293-E1320 HydrophobicContact CG1-CB 3.85Å; V1293-E1320 HydrophobicContact CG1-CG 4.4Å; V1293-E1320 VanDerWaalsContact CG1-O 3.26Å; V1293-E1320 WeakPolarHBondContact CG1-O 3.03Å; V1293-L1322 HydrophobicContact CG2-CD1 4.49Å; V1293-I1417 WeakPolarHBondContact CG2-O 3.23Å; V1293-I1417 PolarHBondContact N-O 3.34Å; V1293-I1417 VanDerWaalsContact N-O 3.11Å; V1293-I1418 HydrophobicContact CB-CG2 4.12Å; V1293-I1418 HydrophobicContact CG2-CG2 3.71Å; V1293-Y1420 PolarHBondContact O-OH 3.29Å
1294	K	91.4	Very high	83.9	Confident	1 Å²	1	27 Å²	27	0%	0.004	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-82.9	139.3	-163.8	-69.3	81.8	-174.1	157.9	0	111.9	A914 L1215 V1276 L1292 F1296 M1319 E1320	A914-K1294 PolarHBondContact O-NZ 3.35Å; L1215-K1294 HydrophobicContact CD1-CG 4.22Å; V1276-K1294 HydrophobicContact CG1-CG 4.16Å; L1292-K1294 WeakPolarHBondContact O-CD 3.39Å; L1292-K1294 VanDerWaalsContact O-CE 3.28Å; L1292-K1294 WeakPolarHBondContact O-CE 3.39Å; L1292-K1294 PolarHBondContact O-NZ 3.02Å; K1294-F1296 HydrophobicContact CB-CE1 3.8Å; K1294-F1296 HydrophobicContact CB-CE2 4.46Å; K1294-F1296 HydrophobicContact CB-CZ 3.76Å; K1294-M1319 CarbonylContact O-C 3.57Å; K1294-M1319 WeakPolarHBondContact O-CA 3.21Å; K1294-M1319 VanDerWaalsContact O-CB 3.31Å; K1294-M1319 WeakPolarHBondContact O-CB 3.25Å; K1294-E1320 WeakPolarHBondContact CD-OE2 3.49Å; K1294-E1320 PolarHBondContact N-OE2 3.15Å; K1294-E1320 IonicContact NZ-OE2 3.59Å; K1294-E1320 PolarHBondContact O-N 2.89Å
1295	I	93.7	Very high	86	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.6	168.5	-59.4	167.6	0	0	0	108	F1208 L1211 F1265 Y1272 I1317 V1318 M1319 Y1420 L1421	F1208-I1295 HydrophobicContact CE1-CB 4.43Å; F1208-I1295 HydrophobicContact CE1-CG2 3.85Å; F1208-I1295 HydrophobicContact CZ-CG2 3.98Å; L1211-I1295 WeakPolarHBondContact CD2-O 3.42Å; F1265-I1295 HydrophobicContact CD2-CD1 4.31Å; F1265-I1295 HydrophobicContact CE2-CD1 4.02Å; Y1272-I1295 HydrophobicContact CE1-CB 4.5Å; Y1272-I1295 PolarHBondContact OH-N 2.99Å; Y1272-I1295 PolarHBondContact OH-O 3.03Å; I1295-I1317 HydrophobicContact CD1-CD1 4.04Å; I1295-I1317 HydrophobicContact CG1-CD1 4.12Å; I1295-I1317 HydrophobicContact CG2-CB 4.22Å; I1295-I1317 HydrophobicContact CG2-CG2 4.45Å; I1295-V1318 WeakPolarHBondContact CA-O 3.37Å; I1295-M1319 HydrophobicContact CG1-CB 4.25Å; I1295-Y1420 HydrophobicContact CD1-CE2 4.08Å; I1295-L1421 HydrophobicContact CD1-CD2 3.8Å
1296	F	94	Very high	87.9	Confident	4 Å²	4	25.1 Å²	25.1	2%	0.018	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-4	-177.5	-56.6	-62.4	0	0	0	113.7	L918 F1208 R1212 L1215 F1216 F1223 F1252 K1294 V1318 E1320	L918-F1296 HydrophobicContact CD1-CE2 4.47Å; F1208-F1296 WeakPolarHBondContact CD1-O 3.21Å; R1212-F1296 HydrophobicContact CG-CB 4.26Å; R1212-F1296 PolarHBondContact NH1-O 3.32Å; L1215-F1296 HydrophobicContact CD1-CE1 4.01Å; F1216-F1296 HydrophobicContact CD1-CE1 4.46Å; F1216-F1296 AromaticContact CE1-CD1 3.69Å; F1216-F1296 HydrophobicContact CE1-CD1 3.69Å; F1216-F1296 HydrophobicContact CE1-CD2 4.21Å; F1216-F1296 AromaticContact CE1-CE1 3.56Å; F1216-F1296 HydrophobicContact CE1-CE1 3.56Å; F1216-F1296 HydrophobicContact CE1-CE2 4.07Å; F1216-F1296 HydrophobicContact CE1-CG 4.02Å; F1216-F1296 AromaticContact CE1-CZ 3.76Å; F1216-F1296 HydrophobicContact CE1-CZ 3.76Å; F1216-F1296 HydrophobicContact CZ-CB 4.18Å; F1216-F1296 AromaticContact CZ-CD1 3.78Å; F1216-F1296 HydrophobicContact CZ-CD1 3.78Å; F1216-F1296 HydrophobicContact CZ-CD2 4.12Å; F1216-F1296 HydrophobicContact CZ-CE1 4.15Å; F1216-F1296 HydrophobicContact CZ-CE2 4.44Å; F1216-F1296 AromaticContact CZ-CG 3.77Å; F1216-F1296 HydrophobicContact CZ-CG 3.77Å; F1216-F1296 HydrophobicContact CZ-CZ 4.46Å; F1223-F1296 HydrophobicContact CE2-CB 3.99Å; F1223-F1296 HydrophobicContact CZ-CB 4.15Å; F1252-F1296 AromaticContact CD1-CD2 3.61Å; F1252-F1296 HydrophobicContact CD1-CD2 3.61Å; F1252-F1296 AromaticContact CD1-CE2 3.83Å; F1252-F1296 HydrophobicContact CD1-CE2 3.83Å; F1252-F1296 AromaticContact CE1-CD2 3.49Å; F1252-F1296 HydrophobicContact CE1-CD2 3.49Å; F1252-F1296 VanDerWaalsContact CE1-CD2 3.49Å; F1252-F1296 AromaticContact CE1-CE2 3.58Å; F1252-F1296 HydrophobicContact CE1-CE2 3.58Å; F1252-F1296 HydrophobicContact CE1-CG 4.38Å; K1294-F1296 HydrophobicContact CB-CE1 3.8Å; K1294-F1296 HydrophobicContact CB-CE2 4.46Å; K1294-F1296 HydrophobicContact CB-CZ 3.76Å; F1296-V1318 PolarHBondContact N-O 3.14Å; F1296-E1320 HydrophobicContact CE2-CB 3.69Å; F1296-E1320 HydrophobicContact CZ-CB 4.08Å
1297	G	95.5	Very high	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.9	154.4	169.2	0	0	0	0	0	112.4	I1317 V1318	G1297-I1317 WeakPolarHBondContact O-CA 3.3Å; G1297-V1318 PolarHBondContact N-O 3.05Å; G1297-V1318 PolarHBondContact O-N 3.03Å
1298	A	96.1	Very high	90.9	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.008	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.5	171.4	0	0	0	0	0	108.9	Y1203 F1208 L1262 F1265 I1317	Y1203-A1298 PolarHBondContact N-O 3.36Å; F1208-A1298 HydrophobicContact CE2-CB 4.04Å; F1208-A1298 HydrophobicContact CZ-CB 4.24Å; L1262-A1298 HydrophobicContact CD1-CB 4.29Å; F1265-A1298 HydrophobicContact CD1-CB 4.2Å; F1265-A1298 HydrophobicContact CE1-CB 3.98Å; A1298-I1317 HydrophobicContact CB-CG2 4.01Å
1299	Y	96.2	Very high	91.9	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.016	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.6	-166.4	-54.5	-84.4	0	0	0	111	I1136 K1201 M1202 R1212 L1316 V1318	I1136-Y1299 HydrophobicContact CD1-CD2 3.88Å; I1136-Y1299 HydrophobicContact CD1-CG 4.03Å; I1136-Y1299 HydrophobicContact CG1-CD2 4.5Å; I1136-Y1299 HydrophobicContact CG1-CG 4.24Å; I1136-Y1299 HydrophobicContact CG2-CD1 3.84Å; I1136-Y1299 HydrophobicContact CG2-CD2 4.04Å; I1136-Y1299 HydrophobicContact CG2-CE1 3.68Å; I1136-Y1299 HydrophobicContact CG2-CE2 3.87Å; I1136-Y1299 HydrophobicContact CG2-CG 4.02Å; K1201-Y1299 CarbonylContact O-C 3.58Å; K1201-Y1299 VanDerWaalsContact O-CA 3.3Å; K1201-Y1299 WeakPolarHBondContact O-CA 3.35Å; M1202-Y1299 HydrophobicContact CB-CD1 4.15Å; M1202-Y1299 HydrophobicContact CB-CE1 4.16Å; M1202-Y1299 HydrophobicContact CG-CD1 3.94Å; M1202-Y1299 HydrophobicContact CG-CE1 3.95Å; M1202-Y1299 HydrophobicContact SD-CE1 4.36Å; R1212-Y1299 PolarHBondContact NH1-OH 2.83Å; Y1299-L1316 PolarHBondContact N-O 3.44Å; Y1299-L1316 PolarHBondContact O-N 2.95Å; Y1299-V1318 HydrophobicContact CD2-CG2 4.02Å; Y1299-V1318 HydrophobicContact CE2-CB 4.25Å; Y1299-V1318 HydrophobicContact CE2-CG2 3.63Å
1300	R	95.4	Very high	92.4	Very high	18 Å²	18	26.1 Å²	26.1	7%	0.068	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.7	157.2	174.7	171	-70	155.6	17.9	107.8	E217 Y1199 C1200 K1201 Y1203 H1259 T1314 D1315	E217-R1300 IonicContact OE1-CZ 2.63Å; E217-R1300 IonicContact OE1-NH1 2.66Å; E217-R1300 PolarHBondContact OE1-NH1 3.4Å; Y1199-R1300 HydrophobicContact CD1-CG 4.48Å; Y1199-R1300 HydrophobicContact CE1-CB 4.37Å; Y1199-R1300 HydrophobicContact CE1-CG 3.91Å; C1200-R1300 CarbonylContact C-O 3.6Å; C1200-R1300 WeakPolarHBondContact CA-O 3.38Å; K1201-R1300 HydrophobicContact CB-CB 4.38Å; K1201-R1300 PolarHBondContact N-O 2.85Å; K1201-R1300 PolarHBondContact O-N 2.83Å; Y1203-R1300 HydrophobicContact CE2-CB 4.06Å; H1259-R1300 PolarHBondContact ND1-NH2 3.14Å; R1300-T1314 WeakPolarHBondContact CA-O 3.33Å; R1300-D1315 WeakPolarHBondContact CB-OD1 3.38Å; R1300-D1315 WeakPolarHBondContact CG-OD1 3.42Å; R1300-D1315 IonicContact CZ-OD1 3.23Å; R1300-D1315 IonicContact CZ-OD2 3.49Å; R1300-D1315 IonicContact NE-OD1 3.38Å; R1300-D1315 PolarHBondContact NE-OD1 3.37Å; R1300-D1315 IonicContact NE-OD2 3.58Å; R1300-D1315 IonicContact NH2-OD1 2.67Å; R1300-D1315 PolarHBondContact NH2-OD1 3.13Å; R1300-D1315 IonicContact NH2-OD2 3.27Å; R1300-D1315 PolarHBondContact NH2-OD2 3.38Å
1301	I	95.7	Very high	92.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	156.6	173.4	64.5	171.5	0	0	0	111.2	P1132 I1135 I1136 Y1199 C1200 F1312 K1313 T1314 L1316	P1132-I1301 HydrophobicContact CB-CD1 3.48Å; P1132-I1301 VanDerWaalsContact CB-CD1 3.48Å; I1135-I1301 HydrophobicContact CB-CD1 4.4Å; I1135-I1301 HydrophobicContact CD1-CD1 4.26Å; I1135-I1301 HydrophobicContact CG2-CB 4.03Å; I1135-I1301 HydrophobicContact CG2-CG2 3.96Å; I1136-I1301 HydrophobicContact CD1-CG2 4.4Å; I1136-I1301 HydrophobicContact CG1-CG2 3.7Å; Y1199-I1301 VanDerWaalsContact O-CA 3.26Å; Y1199-I1301 WeakPolarHBondContact O-CA 3.39Å; C1200-I1301 HydrophobicContact CB-CG2 4.31Å; I1301-F1312 HydrophobicContact CD1-CE1 4.35Å; I1301-K1313 WeakPolarHBondContact O-CA 3.22Å; I1301-T1314 HydrophobicContact CD1-CG2 4.06Å; I1301-T1314 HydrophobicContact CG1-CG2 3.62Å; I1301-T1314 PolarHBondContact N-O 3.24Å; I1301-T1314 PolarHBondContact O-N 2.72Å; I1301-L1316 HydrophobicContact CD1-CD1 3.51Å; I1301-L1316 HydrophobicContact CG1-CD1 3.91Å
1302	G	93.5	Very high	92.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	163.9	168.5	0	0	0	0	0	112.6	Y1199 F1312	Y1199-G1302 PolarHBondContact N-O 3.46Å; Y1199-G1302 PolarHBondContact O-N 3.44Å; G1302-F1312 CarbonylContact C-O 3.55Å; G1302-F1312 WeakPolarHBondContact CA-O 3.19Å
1303	F	94.9	Very high	92.5	Very high	13 Å²	13	32.4 Å²	32.4	6%	0.057	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.9	172	67.5	-101.9	0	0	0	112	E1129 I1135 Q1197 F1198 A1310 A1311 F1312	E1129-F1303 HydrophobicContact CB-CD1 4.44Å; E1129-F1303 HydrophobicContact CB-CE1 3.76Å; E1129-F1303 HydrophobicContact CB-CE2 4.07Å; E1129-F1303 HydrophobicContact CB-CZ 3.57Å; E1129-F1303 HydrophobicContact CG-CD1 4.38Å; E1129-F1303 HydrophobicContact CG-CD2 4.15Å; E1129-F1303 HydrophobicContact CG-CE1 4.13Å; E1129-F1303 HydrophobicContact CG-CE2 3.91Å; E1129-F1303 HydrophobicContact CG-CG 4.4Å; E1129-F1303 HydrophobicContact CG-CZ 3.92Å; E1129-F1303 WeakPolarHBondContact OE1-CD2 3.45Å; E1129-F1303 WeakPolarHBondContact OE2-CE2 3.44Å; I1135-F1303 HydrophobicContact CD1-CD1 3.81Å; I1135-F1303 HydrophobicContact CD1-CE1 4.44Å; Q1197-F1303 CarbonylContact O-C 3.46Å; Q1197-F1303 WeakPolarHBondContact O-CA 3.29Å; Q1197-F1303 WeakPolarHBondContact O-CB 3.39Å; F1198-F1303 HydrophobicContact CD1-CB 3.51Å; F1198-F1303 HydrophobicContact CD1-CG 4.41Å; F1198-F1303 HydrophobicContact CE1-CB 3.63Å; F1198-F1303 HydrophobicContact CE1-CD1 4.47Å; F1198-F1303 HydrophobicContact CE1-CG 4.14Å; F1198-F1303 HydrophobicContact CG-CB 4.32Å; F1303-A1310 HydrophobicContact CE2-CB 4.03Å; F1303-A1311 WeakPolarHBondContact O-CA 3.16Å; F1303-F1312 HydrophobicContact CD1-CB 3.78Å; F1303-F1312 AromaticContact CD1-CD1 3.89Å; F1303-F1312 HydrophobicContact CD1-CD1 3.89Å; F1303-F1312 HydrophobicContact CD1-CG 4.31Å; F1303-F1312 HydrophobicContact CD2-CB 4.37Å; F1303-F1312 HydrophobicContact CE1-CB 3.39Å; F1303-F1312 AromaticContact CE1-CD1 3.52Å; F1303-F1312 HydrophobicContact CE1-CD1 3.52Å; F1303-F1312 AromaticContact CE1-CG 3.78Å; F1303-F1312 HydrophobicContact CE1-CG 3.78Å; F1303-F1312 HydrophobicContact CE2-CB 4.02Å; F1303-F1312 HydrophobicContact CG-CB 4.25Å; F1303-F1312 HydrophobicContact CZ-CB 3.5Å; F1303-F1312 HydrophobicContact CZ-CD1 4.38Å; F1303-F1312 HydrophobicContact CZ-CG 4.21Å; F1303-F1312 PolarHBondContact N-O 3.45Å; F1303-F1312 PolarHBondContact O-N 3.22Å
1304	K	93.9	Very high	92.5	Very high	58 Å²	58	32.8 Å²	32.8	25%	0.252	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	111.9	173.4	-174.9	176.7	-175.9	180	0	108.8	W220 E223 I224 A1196 Q1197	W220-K1304 HydrophobicContact CB-CD 4.33Å; W220-K1304 HydrophobicContact CE3-CB 3.61Å; W220-K1304 HydrophobicContact CE3-CD 3.8Å; W220-K1304 HydrophobicContact CE3-CG 4.39Å; W220-K1304 HydrophobicContact CZ3-CB 3.51Å; E223-K1304 IonicContact OE2-NZ 3.08Å; E223-K1304 PolarHBondContact OE2-NZ 3.18Å; I224-K1304 HydrophobicContact CD1-CB 4.5Å; A1196-K1304 WeakPolarHBondContact CA-O 3.44Å; Q1197-K1304 PolarHBondContact N-O 3.04Å; Q1197-K1304 PolarHBondContact O-N 2.81Å
1305	N	92.7	Very high	92.6	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.011	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.3	-176.1	-174.1	-41.2	0	0	0	110.1	P1112 E1129 A1196 Q1307 T1308 N1309 A1310	P1112-N1305 PolarHBondContact O-ND2 3.42Å; P1112-N1305 VanDerWaalsContact O-ND2 3.14Å; E1129-N1305 VanDerWaalsContact OE1-CB 3.22Å; E1129-N1305 WeakPolarHBondContact OE1-CB 3.31Å; E1129-N1305 PolarHBondContact OE1-ND2 3.04Å; A1196-N1305 HydrophobicContact CB-CB 3.9Å; N1305-Q1307 VanDerWaalsContact C-N 3.33Å; N1305-Q1307 WeakPolarHBondContact OD1-CA 3.49Å; N1305-Q1307 WeakPolarHBondContact OD1-CB 3.21Å; N1305-Q1307 PolarHBondContact OD1-N 3.44Å; N1305-T1308 VanDerWaalsContact CB-OG1 3.29Å; N1305-T1308 WeakPolarHBondContact CB-OG1 3.3Å; N1305-T1308 PolarHBondContact OD1-N 3.35Å; N1305-T1308 PolarHBondContact OD1-OG1 3.09Å; N1305-N1309 WeakPolarHBondContact O-CA 3.5Å; N1305-N1309 PolarHBondContact O-N 2.87Å; N1305-A1310 PolarHBondContact N-O 2.99Å
1306	S	89.2	Confident	92.7	Very high	93 Å²	93	33.4 Å²	33.4	65%	0.65	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12	-175.4	-57	0	0	0	0	113.1	A1195	A1195-S1306 PolarHBondContact O-N 3Å
1307	Q	86.8	Confident	92.8	Very high	118 Å²	118	33.3 Å²	33.3	55%	0.551	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-42.8	176.1	-58	-171.6	6.5	0	0	111.5	A1195 N1305	A1195-Q1307 HydrophobicContact CB-CG 3.98Å; N1305-Q1307 VanDerWaalsContact C-N 3.33Å; N1305-Q1307 WeakPolarHBondContact OD1-CA 3.49Å; N1305-Q1307 WeakPolarHBondContact OD1-CB 3.21Å; N1305-Q1307 PolarHBondContact OD1-N 3.44Å
1308	T	90.3	Very high	92.8	Very high	47 Å²	47	33.3 Å²	33.3	29%	0.288	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-16.7	178.5	61.7	0	0	0	0	113.4	P1112 N1305 A1310	P1112-T1308 HydrophobicContact CB-CG2 3.53Å; P1112-T1308 HydrophobicContact CG-CG2 4.38Å; N1305-T1308 VanDerWaalsContact CB-OG1 3.29Å; N1305-T1308 WeakPolarHBondContact CB-OG1 3.3Å; N1305-T1308 PolarHBondContact OD1-N 3.35Å; N1305-T1308 PolarHBondContact OD1-OG1 3.09Å; T1308-A1310 PolarHBondContact O-N 3.24Å; T1308-A1310 WeakPolarHBondContact OG1-CB 2.98Å; T1308-A1310 PolarHBondContact OG1-N 3.47Å; T1308-A1310 VanDerWaalsContact OG1-N 3.1Å
1309	N	89.1	Confident	92.7	Very high	139 Å²	139	33.9 Å²	33.9	74%	0.743	19%	0.19	S	C	*	.			trans	59.5	17	-163.6	-58.3	-90	0	0	0	113.6	N1305	N1305-N1309 WeakPolarHBondContact O-CA 3.5Å; N1305-N1309 PolarHBondContact O-N 2.87Å
1310	A	89.4	Confident	92.4	Very high	36 Å²	36	34 Å²	34	30%	0.298	19%	0.19	S	C	.	.			trans	-73.3	137.6	175	0	0	0	0	0	110.9	F1303 N1305 T1308	F1303-A1310 HydrophobicContact CE2-CB 4.03Å; N1305-A1310 PolarHBondContact N-O 2.99Å; T1308-A1310 PolarHBondContact O-N 3.24Å; T1308-A1310 WeakPolarHBondContact OG1-CB 2.98Å; T1308-A1310 PolarHBondContact OG1-N 3.47Å; T1308-A1310 VanDerWaalsContact OG1-N 3.1Å
1311	A	89.1	Confident	92.1	Very high	54 Å²	54	33.9 Å²	33.9	45%	0.446	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	137	174.2	0	0	0	0	0	108.9	I224 F1303	I224-A1311 HydrophobicContact CD1-CB 4.02Å; I224-A1311 HydrophobicContact CG1-CB 4.04Å; I224-A1311 HydrophobicContact CG2-CB 3.97Å; F1303-A1311 WeakPolarHBondContact O-CA 3.16Å
1312	F	91.2	Very high	91.8	Very high	51 Å²	51	34.5 Å²	34.5	22%	0.224	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143.7	-176.5	-177.6	-118.2	0	0	0	111.2	I1301 G1302 F1303 T1314	I1301-F1312 HydrophobicContact CD1-CE1 4.35Å; G1302-F1312 CarbonylContact C-O 3.55Å; G1302-F1312 WeakPolarHBondContact CA-O 3.19Å; F1303-F1312 HydrophobicContact CD1-CB 3.78Å; F1303-F1312 AromaticContact CD1-CD1 3.89Å; F1303-F1312 HydrophobicContact CD1-CD1 3.89Å; F1303-F1312 HydrophobicContact CD1-CG 4.31Å; F1303-F1312 HydrophobicContact CD2-CB 4.37Å; F1303-F1312 HydrophobicContact CE1-CB 3.39Å; F1303-F1312 AromaticContact CE1-CD1 3.52Å; F1303-F1312 HydrophobicContact CE1-CD1 3.52Å; F1303-F1312 AromaticContact CE1-CG 3.78Å; F1303-F1312 HydrophobicContact CE1-CG 3.78Å; F1303-F1312 HydrophobicContact CE2-CB 4.02Å; F1303-F1312 HydrophobicContact CG-CB 4.25Å; F1303-F1312 HydrophobicContact CZ-CB 3.5Å; F1303-F1312 HydrophobicContact CZ-CD1 4.38Å; F1303-F1312 HydrophobicContact CZ-CG 4.21Å; F1303-F1312 PolarHBondContact N-O 3.45Å; F1303-F1312 PolarHBondContact O-N 3.22Å; F1312-T1314 HydrophobicContact CE1-CG2 3.51Å; F1312-T1314 HydrophobicContact CE2-CG2 4.44Å; F1312-T1314 HydrophobicContact CZ-CG2 3.44Å; F1312-T1314 VanDerWaalsContact CZ-CG2 3.44Å
1313	K	91.5	Very high	91.5	Very high	40 Å²	40	35 Å²	35	17%	0.174	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	132.7	175	-171.3	179.3	-179.2	-177.5	0	108.8	E217 L221 Q225 I1301	E217-K1313 WeakPolarHBondContact OE1-CE 3.36Å; E217-K1313 IonicContact OE1-NZ 3.67Å; E217-K1313 PolarHBondContact OE1-NZ 3.35Å; E217-K1313 IonicContact OE2-NZ 2.74Å; E217-K1313 PolarHBondContact OE2-NZ 3Å; L221-K1313 HydrophobicContact CD2-CD 4.33Å; L221-K1313 HydrophobicContact CG-CD 4.29Å; Q225-K1313 HydrophobicContact CG-CD 4.35Å; Q225-K1313 VanDerWaalsContact NE2-NZ 3.18Å; I1301-K1313 WeakPolarHBondContact O-CA 3.22Å
1314	T	92.9	Very high	90.9	Very high	9 Å²	9	35.9 Å²	35.9	6%	0.055	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	149.4	175.7	-169	0	0	0	0	113	Q1256 R1300 I1301 F1312 L1316	Q1256-T1314 WeakPolarHBondContact CG-OG1 3.13Å; Q1256-T1314 PolarHBondContact NE2-OG1 2.89Å; R1300-T1314 WeakPolarHBondContact CA-O 3.33Å; I1301-T1314 HydrophobicContact CD1-CG2 4.06Å; I1301-T1314 HydrophobicContact CG1-CG2 3.62Å; I1301-T1314 PolarHBondContact N-O 3.24Å; I1301-T1314 PolarHBondContact O-N 2.72Å; F1312-T1314 HydrophobicContact CE1-CG2 3.51Å; F1312-T1314 HydrophobicContact CE2-CG2 4.44Å; F1312-T1314 HydrophobicContact CZ-CG2 3.44Å; F1312-T1314 VanDerWaalsContact CZ-CG2 3.44Å; T1314-L1316 HydrophobicContact CG2-CD1 3.83Å; T1314-L1316 HydrophobicContact CG2-CG 3.88Å
1315	D	94.4	Very high	90.1	Very high	13 Å²	13	34.9 Å²	34.9	7%	0.07	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	137.2	163.9	-66	-30	0	0	0	109.2	M1257 H1259 L1262 R1300	M1257-D1315 HydrophobicContact CB-CB 4.35Å; M1257-D1315 PolarHBondContact N-O 2.98Å; H1259-D1315 IonicContact ND1-OD2 3.25Å; L1262-D1315 HydrophobicContact CB-CB 4.41Å; L1262-D1315 HydrophobicContact CD2-CB 3.86Å; L1262-D1315 WeakPolarHBondContact CD2-OD1 3.44Å; L1262-D1315 WeakPolarHBondContact CD2-OD2 3.46Å; R1300-D1315 WeakPolarHBondContact CB-OD1 3.38Å; R1300-D1315 WeakPolarHBondContact CG-OD1 3.42Å; R1300-D1315 IonicContact CZ-OD1 3.23Å; R1300-D1315 IonicContact CZ-OD2 3.49Å; R1300-D1315 IonicContact NE-OD1 3.38Å; R1300-D1315 PolarHBondContact NE-OD1 3.37Å; R1300-D1315 IonicContact NE-OD2 3.58Å; R1300-D1315 IonicContact NH2-OD1 2.67Å; R1300-D1315 PolarHBondContact NH2-OD1 3.13Å; R1300-D1315 IonicContact NH2-OD2 3.27Å; R1300-D1315 PolarHBondContact NH2-OD2 3.38Å
1316	L	95.3	Very high	89.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	146.9	-176.2	-76.2	164.4	0	0	0	110.9	P1132 I1136 L1254 K1255 Q1256 Y1299 I1301 T1314	P1132-L1316 HydrophobicContact CB-CD1 3.95Å; I1136-L1316 HydrophobicContact CD1-CD1 4.06Å; L1254-L1316 HydrophobicContact CB-CD2 4.43Å; K1255-L1316 WeakPolarHBondContact O-CA 3.1Å; Q1256-L1316 HydrophobicContact CB-CD2 4.4Å; Y1299-L1316 PolarHBondContact N-O 3.44Å; Y1299-L1316 PolarHBondContact O-N 2.95Å; I1301-L1316 HydrophobicContact CD1-CD1 3.51Å; I1301-L1316 HydrophobicContact CG1-CD1 3.91Å; T1314-L1316 HydrophobicContact CG2-CD1 3.83Å; T1314-L1316 HydrophobicContact CG2-CG 3.88Å
1317	I	95.5	Very high	89.1	Confident	2 Å²	2	40 Å²	40	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	146.7	159.9	59.1	161.5	0	0	0	110.7	L1254 K1255 M1257 I1295 G1297 A1298 M1319 L1421	L1254-I1317 CarbonylContact C-O 3.55Å; L1254-I1317 VanDerWaalsContact CA-O 3.3Å; L1254-I1317 WeakPolarHBondContact CA-O 3.36Å; K1255-I1317 HydrophobicContact CB-CD1 4.48Å; K1255-I1317 HydrophobicContact CB-CG1 3.97Å; K1255-I1317 PolarHBondContact N-O 3.13Å; K1255-I1317 PolarHBondContact O-N 3.28Å; M1257-I1317 HydrophobicContact CG-CG1 4.05Å; M1257-I1317 HydrophobicContact CG-CG2 3.99Å; M1257-I1317 HydrophobicContact SD-CD1 4.08Å; M1257-I1317 HydrophobicContact SD-CG1 3.85Å; I1295-I1317 HydrophobicContact CD1-CD1 4.04Å; I1295-I1317 HydrophobicContact CG1-CD1 4.12Å; I1295-I1317 HydrophobicContact CG2-CB 4.22Å; I1295-I1317 HydrophobicContact CG2-CG2 4.45Å; G1297-I1317 WeakPolarHBondContact O-CA 3.3Å; A1298-I1317 HydrophobicContact CB-CG2 4.01Å; I1317-M1319 HydrophobicContact CD1-SD 3.79Å; I1317-L1421 HydrophobicContact CD1-CD1 3.46Å; I1317-L1421 VanDerWaalsContact CD1-CD1 3.46Å
1318	V	96.1	Very high	89	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.9	169.2	179.3	0	0	0	0	108	I1136 F1223 L1227 F1252 I1253 L1254 I1295 F1296 G1297 Y1299	I1136-V1318 HydrophobicContact CD1-CG2 4.49Å; F1223-V1318 HydrophobicContact CE2-CG1 3.79Å; F1223-V1318 HydrophobicContact CZ-CB 4.4Å; F1223-V1318 HydrophobicContact CZ-CG1 3.87Å; L1227-V1318 HydrophobicContact CD1-CG2 4.4Å; L1227-V1318 HydrophobicContact CD2-CG1 3.96Å; L1227-V1318 HydrophobicContact CD2-CG2 3.92Å; F1252-V1318 HydrophobicContact CB-CG1 4Å; F1252-V1318 HydrophobicContact CD1-CG1 4.35Å; F1252-V1318 HydrophobicContact CG-CG1 4.22Å; I1253-V1318 WeakPolarHBondContact O-CA 3.25Å; L1254-V1318 HydrophobicContact CD2-CG2 4.28Å; L1254-V1318 HydrophobicContact CG-CG2 4.22Å; I1295-V1318 WeakPolarHBondContact CA-O 3.37Å; F1296-V1318 PolarHBondContact N-O 3.14Å; G1297-V1318 PolarHBondContact N-O 3.05Å; G1297-V1318 PolarHBondContact O-N 3.03Å; Y1299-V1318 HydrophobicContact CD2-CG2 4.02Å; Y1299-V1318 HydrophobicContact CE2-CB 4.25Å; Y1299-V1318 HydrophobicContact CE2-CG2 3.63Å
1319	M	93.3	Very high	88.6	Confident	14 Å²	14	38.9 Å²	38.9	7%	0.069	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	158.8	-175.1	66.1	-173.1	-60.8	0	0	113.3	F1252 I1253 K1255 V1293 K1294 I1295 I1317	F1252-M1319 CarbonylContact C-O 3.58Å; F1252-M1319 VanDerWaalsContact CA-O 3.31Å; F1252-M1319 WeakPolarHBondContact CA-O 3.25Å; I1253-M1319 HydrophobicContact CB-CG 3.94Å; I1253-M1319 HydrophobicContact CG2-CG 4.23Å; I1253-M1319 PolarHBondContact N-O 3.14Å; I1253-M1319 PolarHBondContact O-N 2.86Å; K1255-M1319 HydrophobicContact CB-SD 4.49Å; V1293-M1319 HydrophobicContact CB-CE 4.31Å; V1293-M1319 HydrophobicContact CG1-CE 3.78Å; K1294-M1319 CarbonylContact O-C 3.57Å; K1294-M1319 WeakPolarHBondContact O-CA 3.21Å; K1294-M1319 VanDerWaalsContact O-CB 3.31Å; K1294-M1319 WeakPolarHBondContact O-CB 3.25Å; I1295-M1319 HydrophobicContact CG1-CB 4.25Å; I1317-M1319 HydrophobicContact CD1-SD 3.79Å
1320	E	90.7	Very high	88.5	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.028	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	130.2	178.1	177.4	-172.4	-176.1	0	0	113.1	A914 S915 L918 V1293 K1294 F1296 L1322	A914-E1320 WeakPolarHBondContact CA-OE1 3.5Å; A914-E1320 VanDerWaalsContact CB-OE1 3.3Å; A914-E1320 WeakPolarHBondContact CB-OE1 3.42Å; A914-E1320 WeakPolarHBondContact CB-OE2 3.33Å; S915-E1320 PolarHBondContact N-OE1 3.12Å; L918-E1320 HydrophobicContact CD2-CG 4.43Å; V1293-E1320 HydrophobicContact CG1-CB 3.85Å; V1293-E1320 HydrophobicContact CG1-CG 4.4Å; V1293-E1320 VanDerWaalsContact CG1-O 3.26Å; V1293-E1320 WeakPolarHBondContact CG1-O 3.03Å; K1294-E1320 WeakPolarHBondContact CD-OE2 3.49Å; K1294-E1320 PolarHBondContact N-OE2 3.15Å; K1294-E1320 IonicContact NZ-OE2 3.59Å; K1294-E1320 PolarHBondContact O-N 2.89Å; F1296-E1320 HydrophobicContact CE2-CB 3.69Å; F1296-E1320 HydrophobicContact CZ-CB 4.08Å; E1320-L1322 PolarHBondContact O-N 3.04Å
1321	Y	89.7	Confident	88.6	Confident	16 Å²	16	33.2 Å²	33.2	6%	0.063	16%	0.164	C	C	.	.			trans	-82.1	102.5	165.2	-174.9	-117.5	0	0	0	110.1	W1233 R1250 R1251 I1253 F1323 Y1324	W1233-Y1321 HydrophobicContact CH2-CE2 4.2Å; R1250-Y1321 HydrophobicContact CB-CD1 4.29Å; R1250-Y1321 HydrophobicContact CB-CE1 4.47Å; R1250-Y1321 VanDerWaalsContact O-CB 3.25Å; R1250-Y1321 WeakPolarHBondContact O-CB 3.5Å; R1250-Y1321 WeakPolarHBondContact O-CD1 3.38Å; R1251-Y1321 WeakPolarHBondContact O-CB 3.34Å; R1251-Y1321 PolarHBondContact O-N 2.91Å; I1253-Y1321 HydrophobicContact CD1-CD2 3.8Å; I1253-Y1321 HydrophobicContact CG1-CD2 3.91Å; Y1321-F1323 HydrophobicContact CD1-CB 4.36Å; Y1321-F1323 HydrophobicContact CE1-CB 3.75Å; Y1321-F1323 HydrophobicContact CE2-CD2 4.39Å; Y1321-F1323 PolarHBondContact O-N 2.88Å; Y1321-Y1324 VanDerWaalsContact CD1-N 3.31Å; Y1321-Y1324 WeakPolarHBondContact O-CB 3.16Å; Y1321-Y1324 PolarHBondContact O-N 3.42Å
1322	L	88.3	Confident	88.8	Confident	13 Å²	13	30.7 Å²	30.7	7%	0.068	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-24.2	-176.2	179.9	63.6	0	0	0	115.1	A914 V1293 E1320 L1403	A914-L1322 HydrophobicContact CB-CD1 3.8Å; V1293-L1322 HydrophobicContact CG2-CD1 4.49Å; E1320-L1322 PolarHBondContact O-N 3.04Å; L1322-L1403 HydrophobicContact CD2-CB 4.03Å; L1322-L1403 HydrophobicContact CD2-CD2 3.91Å; L1322-L1403 HydrophobicContact CD2-CG 4.1Å
1323	F	87.6	Confident	88.8	Confident	11 Å²	11	29.3 Å²	29.3	5%	0.048	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	12.6	-175.2	-49.1	-39.4	0	0	0	113.9	Y1321 G1325 R1326 V1328 V1331 L1403 G1405 L1414	Y1321-F1323 HydrophobicContact CD1-CB 4.36Å; Y1321-F1323 HydrophobicContact CE1-CB 3.75Å; Y1321-F1323 HydrophobicContact CE2-CD2 4.39Å; Y1321-F1323 PolarHBondContact O-N 2.88Å; F1323-G1325 PolarHBondContact O-N 2.98Å; F1323-R1326 PolarHBondContact O-N 2.84Å; F1323-V1328 HydrophobicContact CB-CB 4.45Å; F1323-V1328 HydrophobicContact CB-CG2 3.85Å; F1323-V1328 HydrophobicContact CD1-CG2 3.87Å; F1323-V1328 HydrophobicContact CD2-CG1 4.4Å; F1323-V1328 HydrophobicContact CG-CB 4.37Å; F1323-V1328 HydrophobicContact CG-CG1 4.39Å; F1323-V1328 HydrophobicContact CG-CG2 3.88Å; F1323-V1331 HydrophobicContact CD2-CG2 4.32Å; F1323-V1331 HydrophobicContact CE2-CB 4.39Å; F1323-V1331 HydrophobicContact CE2-CG1 3.74Å; F1323-V1331 HydrophobicContact CE2-CG2 3.68Å; F1323-V1331 HydrophobicContact CZ-CG1 3.94Å; F1323-V1331 HydrophobicContact CZ-CG2 4.23Å; F1323-L1403 HydrophobicContact CE2-CD2 4.07Å; F1323-L1403 HydrophobicContact CE2-CG 4.4Å; F1323-L1403 HydrophobicContact CZ-CD2 3.88Å; F1323-L1403 HydrophobicContact CZ-CG 3.87Å; F1323-G1405 VanDerWaalsContact CE1-N 3.27Å; F1323-L1414 HydrophobicContact CD1-CB 4.1Å; F1323-L1414 HydrophobicContact CD1-CD1 4.44Å; F1323-L1414 HydrophobicContact CE1-CB 4.14Å
1324	Y	82.4	Confident	88.9	Confident	30 Å²	30	27.4 Å²	27.4	12%	0.118	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	131.7	172.6	172.4	-111.6	0	0	0	110.8	L918 A919 E921 R1251 Y1321	L918-Y1324 HydrophobicContact CD2-CD1 3.92Å; L918-Y1324 HydrophobicContact CD2-CE1 4.4Å; A919-Y1324 WeakPolarHBondContact O-CE1 3.38Å; A919-Y1324 PolarHBondContact O-OH 2.75Å; A919-Y1324 VanDerWaalsContact O-OH 3.09Å; E921-Y1324 WeakPolarHBondContact CA-OH 3.23Å; E921-Y1324 PolarHBondContact N-OH 3.16Å; E921-Y1324 VanDerWaalsContact N-OH 3.09Å; E921-Y1324 PolarHBondContact O-OH 2.93Å; R1251-Y1324 HydrophobicContact CB-CE2 4.5Å; R1251-Y1324 HydrophobicContact CG-CD1 4.27Å; R1251-Y1324 HydrophobicContact CG-CD2 3.74Å; R1251-Y1324 HydrophobicContact CG-CE1 3.87Å; R1251-Y1324 HydrophobicContact CG-CE2 3.33Å; R1251-Y1324 HydrophobicContact CG-CG 4.2Å; Y1321-Y1324 VanDerWaalsContact CD1-N 3.31Å; Y1321-Y1324 WeakPolarHBondContact O-CB 3.16Å; Y1321-Y1324 PolarHBondContact O-N 3.42Å
1325	G	75.7	Confident	88.8	Confident	37 Å²	37	28.4 Å²	28.4	38%	0.381	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	20.5	-176.7	0	0	0	0	0	116.2	E921 F1323	E921-G1325 WeakPolarHBondContact OE2-CA 3.23Å; F1323-G1325 PolarHBondContact O-N 2.98Å
1326	R	80	Confident	88.5	Confident	128 Å²	128	28 Å²	28	48%	0.483	13%	0.132	S	C	.	.			trans	-135.7	138.2	-170.4	-54.7	-67.4	171.2	-174.2	-5.1	114.6	F1323 V1328 L1414	F1323-R1326 PolarHBondContact O-N 2.84Å; R1326-V1328 HydrophobicContact CB-CG2 3.86Å; R1326-V1328 PolarHBondContact O-N 3.45Å; R1326-V1328 VanDerWaalsContact O-N 3.11Å; R1326-L1414 HydrophobicContact CB-CD1 3.6Å; R1326-L1414 HydrophobicContact CG-CD1 3.55Å; R1326-L1414 HydrophobicContact CG-CD2 3.86Å; R1326-L1414 HydrophobicContact CG-CG 4.36Å
1327	D	81.4	Confident	87.9	Confident	75 Å²	75	28.7 Å²	28.7	40%	0.401	14%	0.137	S	C	.	.			trans	-80.4	83.1	169.1	179.2	11.2	0	0	0	110.5	R1329	D1327-R1329 VanDerWaalsContact OD1-CG 3.22Å; D1327-R1329 WeakPolarHBondContact OD1-CG 3.5Å; D1327-R1329 IonicContact OD1-NE 3.04Å; D1327-R1329 PolarHBondContact OD1-NE 3.48Å; D1327-R1329 VanDerWaalsContact OD1-NE 3.1Å; D1327-R1329 IonicContact OD2-CZ 2.72Å; D1327-R1329 IonicContact OD2-NE 2.81Å; D1327-R1329 PolarHBondContact OD2-NE 3.38Å; D1327-R1329 IonicContact OD2-NH2 3.43Å; D1327-R1329 PolarHBondContact OD2-NH2 3.01Å
1328	V	85.5	Confident	86.9	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.024	15%	0.154	C	C	.	.			trans	-94.4	107.9	179.6	178.2	0	0	0	0	110.4	F1323 R1326 Q1330 V1331 S1352 T1353 L1414	F1323-V1328 HydrophobicContact CB-CB 4.45Å; F1323-V1328 HydrophobicContact CB-CG2 3.85Å; F1323-V1328 HydrophobicContact CD1-CG2 3.87Å; F1323-V1328 HydrophobicContact CD2-CG1 4.4Å; F1323-V1328 HydrophobicContact CG-CB 4.37Å; F1323-V1328 HydrophobicContact CG-CG1 4.39Å; F1323-V1328 HydrophobicContact CG-CG2 3.88Å; R1326-V1328 HydrophobicContact CB-CG2 3.86Å; R1326-V1328 PolarHBondContact O-N 3.45Å; R1326-V1328 VanDerWaalsContact O-N 3.11Å; V1328-Q1330 WeakPolarHBondContact CG1-O 3.32Å; V1328-V1331 HydrophobicContact CG1-CG2 3.68Å; V1328-S1352 PolarHBondContact O-OG 2.92Å; V1328-T1353 HydrophobicContact CB-CG2 4.1Å; V1328-T1353 HydrophobicContact CG1-CG2 4.37Å; V1328-T1353 WeakPolarHBondContact O-CG2 3.32Å; V1328-L1414 HydrophobicContact CG2-CD1 3.54Å
1329	R	81.6	Confident	85.6	Confident	137 Å²	137	36.7 Å²	36.7	52%	0.517	17%	0.171	S	C	.	.			trans	-97.2	-5.8	-175.5	-58	-171.8	-176.1	-166.8	2.4	114.3	D1327 V1406	D1327-R1329 VanDerWaalsContact OD1-CG 3.22Å; D1327-R1329 WeakPolarHBondContact OD1-CG 3.5Å; D1327-R1329 IonicContact OD1-NE 3.04Å; D1327-R1329 PolarHBondContact OD1-NE 3.48Å; D1327-R1329 VanDerWaalsContact OD1-NE 3.1Å; D1327-R1329 IonicContact OD2-CZ 2.72Å; D1327-R1329 IonicContact OD2-NE 2.81Å; D1327-R1329 PolarHBondContact OD2-NE 3.38Å; D1327-R1329 IonicContact OD2-NH2 3.43Å; D1327-R1329 PolarHBondContact OD2-NH2 3.01Å; R1329-V1406 PolarHBondContact N-O 2.95Å
1330	Q	87.6	Confident	84.5	Confident	54 Å²	54	41.9 Å²	41.9	25%	0.252	20%	0.199	S	C	.	.			trans	-155.9	135.1	175.7	-165.8	173.7	55.4	0	0	109.8	V1328 Y1332 L1357 V1406	V1328-Q1330 WeakPolarHBondContact CG1-O 3.32Å; Q1330-Y1332 HydrophobicContact CB-CE2 4.49Å; Q1330-Y1332 VanDerWaalsContact CD-CE2 3.49Å; Q1330-Y1332 HydrophobicContact CG-CD2 4.31Å; Q1330-Y1332 HydrophobicContact CG-CE2 3.62Å; Q1330-Y1332 PolarHBondContact NE2-OH 2.9Å; Q1330-Y1332 PolarHBondContact OE1-OH 3.45Å; Q1330-L1357 HydrophobicContact CG-CD1 3.86Å; Q1330-V1406 HydrophobicContact CB-CB 4.31Å; Q1330-V1406 HydrophobicContact CB-CG2 4.37Å; Q1330-V1406 PolarHBondContact O-N 3.41Å
1331	V	91.5	Very high	84	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.6	-180	-177.8	0	0	0	0	110.1	F1323 V1328 V1356 L1357 L1403 M1404	F1323-V1331 HydrophobicContact CD2-CG2 4.32Å; F1323-V1331 HydrophobicContact CE2-CB 4.39Å; F1323-V1331 HydrophobicContact CE2-CG1 3.74Å; F1323-V1331 HydrophobicContact CE2-CG2 3.68Å; F1323-V1331 HydrophobicContact CZ-CG1 3.94Å; F1323-V1331 HydrophobicContact CZ-CG2 4.23Å; V1328-V1331 HydrophobicContact CG1-CG2 3.68Å; V1331-V1356 HydrophobicContact CG1-CG1 4.26Å; V1331-V1356 HydrophobicContact CG1-CG2 4.11Å; V1331-L1357 WeakPolarHBondContact O-CB 3.42Å; V1331-L1357 PolarHBondContact O-N 3.44Å; V1331-L1403 HydrophobicContact CG1-CD1 3.85Å; V1331-M1404 CarbonylContact C-O 3.46Å; V1331-M1404 VanDerWaalsContact CA-O 3.31Å; V1331-M1404 WeakPolarHBondContact CA-O 3.44Å
1332	Y	92	Very high	83.7	Confident	2 Å²	2	46 Å²	46	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.4	172.3	-61.6	-102.9	0	0	0	111.8	Q1330 L1357 L1362 F1371 L1403 M1404 V1406	Q1330-Y1332 HydrophobicContact CB-CE2 4.49Å; Q1330-Y1332 VanDerWaalsContact CD-CE2 3.49Å; Q1330-Y1332 HydrophobicContact CG-CD2 4.31Å; Q1330-Y1332 HydrophobicContact CG-CE2 3.62Å; Q1330-Y1332 PolarHBondContact NE2-OH 2.9Å; Q1330-Y1332 PolarHBondContact OE1-OH 3.45Å; Y1332-L1357 CarbonylContact C-O 3.53Å; Y1332-L1357 WeakPolarHBondContact CA-O 3.38Å; Y1332-L1357 HydrophobicContact CD1-CB 3.51Å; Y1332-L1357 HydrophobicContact CD1-CD1 4.4Å; Y1332-L1357 HydrophobicContact CE1-CB 3.71Å; Y1332-L1357 HydrophobicContact CE1-CD1 3.81Å; Y1332-L1357 HydrophobicContact CE1-CG 4.42Å; Y1332-L1357 HydrophobicContact CG-CB 4.11Å; Y1332-L1362 HydrophobicContact CD1-CB 3.91Å; Y1332-L1362 HydrophobicContact CE1-CB 3.82Å; Y1332-L1362 HydrophobicContact CE1-CD1 4.07Å; Y1332-F1371 HydrophobicContact CE2-CE2 4.18Å; Y1332-F1371 HydrophobicContact CE2-CZ 4.19Å; Y1332-L1403 CarbonylContact O-C 3.02Å; Y1332-L1403 WeakPolarHBondContact O-CA 3.48Å; Y1332-M1404 HydrophobicContact CD2-CE 3.29Å; Y1332-M1404 HydrophobicContact CE2-CE 3.71Å; Y1332-M1404 HydrophobicContact CG-CE 3.87Å; Y1332-M1404 PolarHBondContact N-O 2.87Å; Y1332-M1404 PolarHBondContact O-N 3.3Å; Y1332-V1406 HydrophobicContact CD2-CG2 4.46Å; Y1332-V1406 HydrophobicContact CE2-CG2 4.17Å
1333	D	92.4	Very high	83.3	Confident	22 Å²	22	46.1 Å²	46.1	12%	0.118	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123	163.6	157.4	17.2	0	0	0	108	R1341 V1356 L1357 L1358 S1401 L1403	D1333-R1341 VanDerWaalsContact CG-NH1 3.29Å; D1333-R1341 PolarHBondContact O-NH2 3.18Å; D1333-R1341 IonicContact OD1-CZ 2.79Å; D1333-R1341 IonicContact OD1-NH1 3.17Å; D1333-R1341 PolarHBondContact OD1-NH1 3.45Å; D1333-R1341 IonicContact OD1-NH2 3.79Å; D1333-R1341 PolarHBondContact OD1-NH2 3.23Å; D1333-R1341 IonicContact OD2-CZ 2.79Å; D1333-R1341 IonicContact OD2-NH1 2.75Å; D1333-R1341 PolarHBondContact OD2-NH1 3.14Å; D1333-R1341 IonicContact OD2-NH2 3.65Å; D1333-R1341 PolarHBondContact OD2-NH2 3.3Å; D1333-V1356 HydrophobicContact CB-CG1 3.56Å; D1333-L1357 PolarHBondContact N-O 3.01Å; D1333-L1358 HydrophobicContact CB-CD2 3.85Å; D1333-L1358 WeakPolarHBondContact O-CA 3.42Å; D1333-S1401 WeakPolarHBondContact OD1-CB 3.29Å; D1333-S1401 PolarHBondContact OD1-OG 3.16Å; D1333-L1403 HydrophobicContact CB-CD1 4.45Å
1334	L	93.1	Very high	82.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.5	-171.9	-55.7	173	0	0	0	111.3	L1362 S1401 L1402 M1460 Y1463 F1464	L1334-L1362 HydrophobicContact CD1-CD2 3.71Å; L1334-L1362 HydrophobicContact CD2-CB 4.15Å; L1334-L1362 HydrophobicContact CD2-CD2 3.61Å; L1334-L1362 HydrophobicContact CG-CD2 4.33Å; L1334-S1401 CarbonylContact O-C 3.54Å; L1334-S1401 VanDerWaalsContact O-CA 3.3Å; L1334-S1401 WeakPolarHBondContact O-CA 3.19Å; L1334-L1402 PolarHBondContact N-O 3.04Å; L1334-L1402 PolarHBondContact O-N 3.22Å; L1334-M1460 HydrophobicContact CB-CE 3.88Å; L1334-M1460 HydrophobicContact CB-SD 4.39Å; L1334-Y1463 HydrophobicContact CB-CD2 4.5Å; L1334-Y1463 HydrophobicContact CB-CE2 4.23Å; L1334-Y1463 HydrophobicContact CD1-CD2 3.98Å; L1334-Y1463 HydrophobicContact CD1-CE2 4.45Å; L1334-Y1463 HydrophobicContact CD2-CE2 4.3Å; L1334-F1464 HydrophobicContact CD1-CE2 4.32Å; L1334-F1464 HydrophobicContact CD1-CZ 3.83Å
1335	K	91.6	Very high	81.9	Confident	29 Å²	29	52 Å²	52	13%	0.126	26%	0.256	C	S	.	.			trans	-113.5	1.2	179.6	-74.7	-171.4	-175.7	-164.7	0	113.6	D1359 D1399 S1401 D1419 Y1452 R1455	K1335-D1359 PolarHBondContact N-OD1 3.04Å; K1335-D1359 PolarHBondContact N-OD2 3.16Å; K1335-D1399 WeakPolarHBondContact CE-O 3.38Å; K1335-D1399 PolarHBondContact NZ-O 3.45Å; K1335-S1401 WeakPolarHBondContact CE-OG 3.41Å; K1335-S1401 WeakPolarHBondContact CG-OG 3.45Å; K1335-D1419 IonicContact NZ-OD2 3.04Å; K1335-Y1452 WeakPolarHBondContact CB-OH 3.45Å; K1335-Y1452 WeakPolarHBondContact CG-OH 3.29Å; K1335-R1455 PolarHBondContact O-NH2 3.44Å
1336	G	87.7	Confident	80.9	Confident	4 Å²	4	61.3 Å²	61.3	4%	0.041	28%	0.279	C	S	.	.	S	Bend	trans	66.1	40.1	-170.3	0	0	0	0	0	112	D1359 R1455 S1459	G1336-D1359 WeakPolarHBondContact CA-OD1 3.39Å; G1336-D1359 PolarHBondContact N-OD1 3.24Å; G1336-R1455 VanDerWaalsContact O-CD 3.29Å; G1336-R1455 WeakPolarHBondContact O-CD 3.38Å; G1336-R1455 WeakPolarHBondContact O-CG 3.16Å; G1336-R1455 PolarHBondContact O-NE 3.34Å; G1336-S1459 WeakPolarHBondContact CA-OG 3.22Å
1337	S	83.2	Confident	79.7	Confident	16 Å²	16	59.5 Å²	59.5	11%	0.112	28%	0.278	C	S	.	.			trans	-155.1	129.8	-178.7	66.5	0	0	0	0	112.3	R1341 D1359	S1337-R1341 WeakPolarHBondContact O-CB 3.35Å; S1337-R1341 WeakPolarHBondContact O-CG 3.48Å; S1337-D1359 PolarHBondContact N-OD1 2.99Å; S1337-D1359 WeakPolarHBondContact O-CB 3.21Å
1338	Q	72.5	Confident	78.2	Confident	79 Å²	79	65.2 Å²	65.2	37%	0.369	30%	0.3	S	S	.	.			trans	-87.5	-26.7	-176.5	-65.8	171.3	-17	0	0	113.7	N1340 R1341 M1363	Q1338-N1340 PolarHBondContact O-N 3.15Å; Q1338-N1340 VanDerWaalsContact O-N 3.15Å; Q1338-R1341 PolarHBondContact O-N 3.41Å; Q1338-R1341 VanDerWaalsContact O-N 3.14Å; Q1338-M1363 HydrophobicContact CG-CG 4.48Å
1339	R	69.7	Low	76.5	Confident	92 Å²	92	74.7 Å²	74.7	35%	0.347	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	116.9	-172.1	-170.8	173.8	-178.4	170.8	1.3	111.3	R1341	R1339-R1341 VanDerWaalsContact C-N 3.3Å; R1339-R1341 PolarHBondContact O-N 3.22Å
1340	N	69.4	Low	75.1	Confident	122 Å²	122	70.1 Å²	70.1	65%	0.652	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	33.5	-178	-54.7	-9.8	0	0	0	113.8	K1239 Q1338	K1239-N1340 PolarHBondContact NZ-O 3.09Å; Q1338-N1340 PolarHBondContact O-N 3.15Å; Q1338-N1340 VanDerWaalsContact O-N 3.15Å
1341	R	82	Confident	73.6	Confident	26 Å²	26	71.4 Å²	71.4	10%	0.098	35%	0.345	C	S	.	.			trans	-122.3	61.4	-176.5	-70.9	-77.5	-71.3	-172.3	-6	111.8	D1333 S1337 Q1338 R1339 L1358 D1359 Q1360	D1333-R1341 VanDerWaalsContact CG-NH1 3.29Å; D1333-R1341 PolarHBondContact O-NH2 3.18Å; D1333-R1341 IonicContact OD1-CZ 2.79Å; D1333-R1341 IonicContact OD1-NH1 3.17Å; D1333-R1341 PolarHBondContact OD1-NH1 3.45Å; D1333-R1341 IonicContact OD1-NH2 3.79Å; D1333-R1341 PolarHBondContact OD1-NH2 3.23Å; D1333-R1341 IonicContact OD2-CZ 2.79Å; D1333-R1341 IonicContact OD2-NH1 2.75Å; D1333-R1341 PolarHBondContact OD2-NH1 3.14Å; D1333-R1341 IonicContact OD2-NH2 3.65Å; D1333-R1341 PolarHBondContact OD2-NH2 3.3Å; S1337-R1341 WeakPolarHBondContact O-CB 3.35Å; S1337-R1341 WeakPolarHBondContact O-CG 3.48Å; Q1338-R1341 PolarHBondContact O-N 3.41Å; Q1338-R1341 VanDerWaalsContact O-N 3.14Å; R1339-R1341 VanDerWaalsContact C-N 3.3Å; R1339-R1341 PolarHBondContact O-N 3.22Å; R1341-L1358 VanDerWaalsContact C-CB 3.42Å; R1341-L1358 HydrophobicContact CB-CB 4.18Å; R1341-L1358 WeakPolarHBondContact O-CB 3.41Å; R1341-D1359 HydrophobicContact CB-CB 4.15Å; R1341-D1359 IonicContact CZ-OD2 3.4Å; R1341-D1359 IonicContact NE-OD2 3.53Å; R1341-D1359 PolarHBondContact NE-OD2 2.91Å; R1341-D1359 IonicContact NH2-OD2 3.61Å; R1341-D1359 PolarHBondContact NH2-OD2 3.22Å; R1341-Q1360 WeakPolarHBondContact O-CA 3.42Å; R1341-Q1360 WeakPolarHBondContact O-CB 3.28Å; R1341-Q1360 PolarHBondContact O-N 3.21Å
1342	H	83.1	Confident	72.3	Confident	83 Å²	83	74.3 Å²	74.3	38%	0.384	37%	0.365	S	S	.	.			trans	-136.5	138.9	175.4	-166.5	-86.7	0	0	0	110.7	Q1360 N1361 E1364	H1342-Q1360 HydrophobicContact CB-CB 4.1Å; H1342-Q1360 PolarHBondContact CD2-NE2 2.82Å; H1342-N1361 WeakPolarHBondContact CA-OD1 3.45Å; H1342-N1361 PolarHBondContact CE1-ND2 3.45Å; H1342-N1361 PolarHBondContact NE2-ND2 3.25Å; H1342-E1364 IonicContact CD2-OE1 3.69Å; H1342-E1364 PolarHBondContact CD2-OE1 2.99Å; H1342-E1364 IonicContact CD2-OE2 3.86Å; H1342-E1364 PolarHBondContact CD2-OE2 2.99Å; H1342-E1364 IonicContact CE1-OE2 2.69Å; H1342-E1364 VanDerWaalsContact NE2-CD 3.33Å; H1342-E1364 IonicContact NE2-OE1 2.8Å; H1342-E1364 PolarHBondContact NE2-OE1 3.44Å; H1342-E1364 VanDerWaalsContact NE2-OE1 3.14Å; H1342-E1364 IonicContact NE2-OE2 2.59Å; H1342-E1364 PolarHBondContact NE2-OE2 3.41Å
1343	T	79.6	Confident	71.1	Confident	16 Å²	16	75.4 Å²	75.4	10%	0.098	37%	0.372	C	S	.	.			trans	-117.7	139.1	174.4	-57.3	0	0	0	0	109.8	L1355 V1356 L1358 N1361	T1343-L1355 HydrophobicContact CG2-CD1 3.84Å; T1343-V1356 PolarHBondContact OG1-O 3.49Å; T1343-L1358 WeakPolarHBondContact OG1-CD1 3.42Å; T1343-L1358 WeakPolarHBondContact OG1-CG 3.25Å; T1343-N1361 PolarHBondContact N-OD1 3.24Å; T1343-N1361 PolarHBondContact O-ND2 2.94Å
1344	S	72.7	Confident	70.1	Confident	75 Å²	75	75.7 Å²	75.7	52%	0.524	37%	0.373	S	S	.	.			trans	-83.6	117	180	59.4	0	0	0	0	113.1	R1346	S1344-R1346 PolarHBondContact O-N 3.4Å
1345	E	66.7	Low	69.6	Low	90 Å²	90	77.3 Å²	77.3	42%	0.421	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	9.8	-179.7	-58.9	-172.8	156.1	0	0	115.7	L1347 L1357 K1365	E1345-L1347 VanDerWaalsContact C-N 3.27Å; E1345-L1347 PolarHBondContact O-N 3Å; E1345-L1357 HydrophobicContact CG-CD2 4.04Å; E1345-K1365 IonicContact OE1-NZ 3.58Å; E1345-K1365 PolarHBondContact OE1-NZ 3.33Å; E1345-K1365 IonicContact OE2-NZ 2.79Å
1346	R	56.5	Low	69.3	Low	232 Å²	232	76.8 Å²	76.8	88%	0.875	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-10.8	179.8	-74.4	-171.5	174.8	-171.7	-1.4	114	S1344 K1348	S1344-R1346 PolarHBondContact O-N 3.4Å; R1346-K1348 PolarHBondContact O-N 3.09Å
1347	L	54.2	Low	69.4	Low	89 Å²	89	76.7 Å²	76.7	47%	0.466	38%	0.38	S	S	.	.			trans	-75	64	176.4	-71.3	165.1	0	0	0	111.9	E1345 Q1349 S1350	E1345-L1347 VanDerWaalsContact C-N 3.27Å; E1345-L1347 PolarHBondContact O-N 3Å; L1347-Q1349 PolarHBondContact O-N 3.25Å; L1347-Q1349 VanDerWaalsContact O-N 3.16Å; L1347-S1350 PolarHBondContact O-OG 3.37Å; L1347-S1350 VanDerWaalsContact O-OG 3.13Å
1348	K	50.2	Low	69.7	Low	196 Å²	196	76.1 Å²	76.1	85%	0.852	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	5.8	-178.4	-73.2	-167.2	173.1	-171.8	0	115.5	R1346	R1346-K1348 PolarHBondContact O-N 3.09Å
1349	Q	49.6	Very low	70.5	Confident	202 Å²	202	72.3 Å²	72.3	94%	0.944	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-12.5	-178.7	-73.7	179.1	-32.6	0	0	114	L1347	L1347-Q1349 PolarHBondContact O-N 3.25Å; L1347-Q1349 VanDerWaalsContact O-N 3.16Å
1350	S	51.8	Low	71.2	Confident	42 Å²	42	71.2 Å²	71.2	29%	0.294	36%	0.356	S	S	.	.	S	Bend	trans	-82.1	152.8	172.4	53.2	0	0	0	0	111.2	L1347	L1347-S1350 PolarHBondContact O-OG 3.37Å; L1347-S1350 VanDerWaalsContact O-OG 3.13Å
1351	T	57	Low	72.1	Confident	81 Å²	81	65.5 Å²	65.5	50%	0.497	33%	0.326	S	S	.	.			trans	-66.5	158.7	176.1	83.7	0	0	0	0	110.9	T1353 D1354	T1351-T1353 PolarHBondContact O-N 2.57Å; T1351-T1353 VanDerWaalsContact O-N 3.09Å; T1351-T1353 PolarHBondContact OG1-OG1 2.86Å; T1351-D1354 WeakPolarHBondContact CB-OD2 3.39Å; T1351-D1354 PolarHBondContact N-OD2 3.05Å; T1351-D1354 PolarHBondContact O-N 3.41Å; T1351-D1354 VanDerWaalsContact OG1-CG 3.3Å; T1351-D1354 PolarHBondContact OG1-OD2 3.42Å
1352	S	63.5	Low	72.3	Confident	63 Å²	63	64.3 Å²	64.3	44%	0.441	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.8	-172.1	55	0	0	0	0	114.8	V1328	V1328-S1352 PolarHBondContact O-OG 2.92Å
1353	T	67.2	Low	72.3	Confident	25 Å²	25	61.7 Å²	61.7	15%	0.153	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-18.8	175.3	45.8	0	0	0	0	113.5	V1328 T1351	V1328-T1353 HydrophobicContact CB-CG2 4.1Å; V1328-T1353 HydrophobicContact CG1-CG2 4.37Å; V1328-T1353 WeakPolarHBondContact O-CG2 3.32Å; T1351-T1353 PolarHBondContact O-N 2.57Å; T1351-T1353 VanDerWaalsContact O-N 3.09Å; T1351-T1353 PolarHBondContact OG1-OG1 2.86Å
1354	D	71.4	Confident	72.4	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.144	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-15.1	-176.9	-55.3	-45.7	0	0	0	113.1	W1233 T1236 T1351	W1233-D1354 PolarHBondContact NE1-OD1 3.11Å; T1236-D1354 PolarHBondContact N-O 2.9Å; T1236-D1354 PolarHBondContact OG1-O 3.22Å; T1351-D1354 WeakPolarHBondContact CB-OD2 3.39Å; T1351-D1354 PolarHBondContact N-OD2 3.05Å; T1351-D1354 PolarHBondContact O-N 3.41Å; T1351-D1354 VanDerWaalsContact OG1-CG 3.3Å; T1351-D1354 PolarHBondContact OG1-OD2 3.42Å
1355	L	81.8	Confident	72.8	Confident	34 Å²	34	63.3 Å²	63.3	18%	0.178	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-89.2	98.5	173.3	-179	61.7	0	0	0	110.7	T1236 T1343 L1357	T1236-L1355 WeakPolarHBondContact OG1-CA 3.2Å; T1343-L1355 HydrophobicContact CG2-CD1 3.84Å; L1355-L1357 HydrophobicContact CD2-CD2 4.49Å; L1355-L1357 HydrophobicContact CG-CD2 4.3Å
1356	V	86.1	Confident	73.5	Confident	18 Å²	18	59 Å²	59	11%	0.109	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	112.4	177.8	-173.2	0	0	0	0	110.3	P1235 T1236 V1331 D1333 T1343	P1235-V1356 HydrophobicContact CB-CG2 4.21Å; T1236-V1356 WeakPolarHBondContact O-CB 3.48Å; T1236-V1356 PolarHBondContact O-N 3.44Å; V1331-V1356 HydrophobicContact CG1-CG1 4.26Å; V1331-V1356 HydrophobicContact CG1-CG2 4.11Å; D1333-V1356 HydrophobicContact CB-CG1 3.56Å; T1343-V1356 PolarHBondContact OG1-O 3.49Å
1357	L	89.1	Confident	74.5	Confident	2 Å²	2	48 Å²	48	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	157.7	172.7	-60.1	-178.2	0	0	0	110.7	Q1330 V1331 Y1332 D1333 E1345 L1355 N1361	Q1330-L1357 HydrophobicContact CG-CD1 3.86Å; V1331-L1357 WeakPolarHBondContact O-CB 3.42Å; V1331-L1357 PolarHBondContact O-N 3.44Å; Y1332-L1357 CarbonylContact C-O 3.53Å; Y1332-L1357 WeakPolarHBondContact CA-O 3.38Å; Y1332-L1357 HydrophobicContact CD1-CB 3.51Å; Y1332-L1357 HydrophobicContact CD1-CD1 4.4Å; Y1332-L1357 HydrophobicContact CE1-CB 3.71Å; Y1332-L1357 HydrophobicContact CE1-CD1 3.81Å; Y1332-L1357 HydrophobicContact CE1-CG 4.42Å; Y1332-L1357 HydrophobicContact CG-CB 4.11Å; D1333-L1357 PolarHBondContact N-O 3.01Å; E1345-L1357 HydrophobicContact CG-CD2 4.04Å; L1355-L1357 HydrophobicContact CD2-CD2 4.49Å; L1355-L1357 HydrophobicContact CG-CD2 4.3Å; L1357-N1361 HydrophobicContact CB-CB 3.97Å; L1357-N1361 HydrophobicContact CD2-CB 4.36Å
1358	L	90	Very high	75.8	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	174.3	-171.9	-60	178.8	0	0	0	112.3	D1333 R1341 T1343 Q1360 N1361 L1362	D1333-L1358 HydrophobicContact CB-CD2 3.85Å; D1333-L1358 WeakPolarHBondContact O-CA 3.42Å; R1341-L1358 VanDerWaalsContact C-CB 3.42Å; R1341-L1358 HydrophobicContact CB-CB 4.18Å; R1341-L1358 WeakPolarHBondContact O-CB 3.41Å; T1343-L1358 WeakPolarHBondContact OG1-CD1 3.42Å; T1343-L1358 WeakPolarHBondContact OG1-CG 3.25Å; L1358-Q1360 PolarHBondContact O-N 3.15Å; L1358-N1361 PolarHBondContact N-OD1 3.12Å; L1358-N1361 WeakPolarHBondContact O-CA 3.24Å; L1358-N1361 WeakPolarHBondContact O-CB 3.44Å; L1358-N1361 PolarHBondContact O-N 3.16Å; L1358-L1362 PolarHBondContact O-N 2.8Å
1359	D	89.7	Confident	77.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-46.3	-39.3	-176.7	-57	-122.6	0	0	0	114.2	K1335 G1336 S1337 R1341 M1363 Y1463	K1335-D1359 PolarHBondContact N-OD1 3.04Å; K1335-D1359 PolarHBondContact N-OD2 3.16Å; G1336-D1359 WeakPolarHBondContact CA-OD1 3.39Å; G1336-D1359 PolarHBondContact N-OD1 3.24Å; S1337-D1359 PolarHBondContact N-OD1 2.99Å; S1337-D1359 WeakPolarHBondContact O-CB 3.21Å; R1341-D1359 HydrophobicContact CB-CB 4.15Å; R1341-D1359 IonicContact CZ-OD2 3.4Å; R1341-D1359 IonicContact NE-OD2 3.53Å; R1341-D1359 PolarHBondContact NE-OD2 2.91Å; R1341-D1359 IonicContact NH2-OD2 3.61Å; R1341-D1359 PolarHBondContact NH2-OD2 3.22Å; D1359-M1363 VanDerWaalsContact O-CB 3.32Å; D1359-M1363 WeakPolarHBondContact O-CB 3.45Å; D1359-M1363 WeakPolarHBondContact O-CG 3.47Å; D1359-M1363 PolarHBondContact O-N 2.97Å; D1359-Y1463 PolarHBondContact OD1-OH 3.41Å
1360	Q	84.1	Confident	78.9	Confident	68 Å²	68	35.7 Å²	35.7	32%	0.318	19%	0.192	S	C	.	.	H	α-helix	trans	-75.1	-38.2	179.6	-163.1	-170	-53.9	0	0	111.9	R1341 H1342 L1358 L1362 M1363 E1364	R1341-Q1360 WeakPolarHBondContact O-CA 3.42Å; R1341-Q1360 WeakPolarHBondContact O-CB 3.28Å; R1341-Q1360 PolarHBondContact O-N 3.21Å; H1342-Q1360 HydrophobicContact CB-CB 4.1Å; H1342-Q1360 PolarHBondContact CD2-NE2 2.82Å; L1358-Q1360 PolarHBondContact O-N 3.15Å; Q1360-L1362 VanDerWaalsContact C-N 3.27Å; Q1360-L1362 PolarHBondContact O-N 3.03Å; Q1360-M1363 PolarHBondContact O-N 3.43Å; Q1360-E1364 WeakPolarHBondContact CG-OE1 3.5Å; Q1360-E1364 PolarHBondContact NE2-OE1 2.84Å; Q1360-E1364 WeakPolarHBondContact O-CB 3.36Å; Q1360-E1364 VanDerWaalsContact O-CG 3.3Å; Q1360-E1364 WeakPolarHBondContact O-CG 3.37Å; Q1360-E1364 PolarHBondContact O-N 3.39Å
1361	N	87.1	Confident	80.7	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-39.7	173.5	-61	102.7	0	0	0	111.3	H1342 T1343 L1357 L1358	H1342-N1361 WeakPolarHBondContact CA-OD1 3.45Å; H1342-N1361 PolarHBondContact CE1-ND2 3.45Å; H1342-N1361 PolarHBondContact NE2-ND2 3.25Å; T1343-N1361 PolarHBondContact N-OD1 3.24Å; T1343-N1361 PolarHBondContact O-ND2 2.94Å; L1357-N1361 HydrophobicContact CB-CB 3.97Å; L1357-N1361 HydrophobicContact CD2-CB 4.36Å; L1358-N1361 PolarHBondContact N-OD1 3.12Å; L1358-N1361 WeakPolarHBondContact O-CA 3.24Å; L1358-N1361 WeakPolarHBondContact O-CB 3.44Å; L1358-N1361 PolarHBondContact O-N 3.16Å
1362	L	87.9	Confident	82.3	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.9	-47.9	173.3	-179.7	58	0	0	0	110.9	Y1332 L1334 L1358 Q1360 E1364 K1365 V1366 F1371 Y1463	Y1332-L1362 HydrophobicContact CD1-CB 3.91Å; Y1332-L1362 HydrophobicContact CE1-CB 3.82Å; Y1332-L1362 HydrophobicContact CE1-CD1 4.07Å; L1334-L1362 HydrophobicContact CD1-CD2 3.71Å; L1334-L1362 HydrophobicContact CD2-CB 4.15Å; L1334-L1362 HydrophobicContact CD2-CD2 3.61Å; L1334-L1362 HydrophobicContact CG-CD2 4.33Å; L1358-L1362 PolarHBondContact O-N 2.8Å; Q1360-L1362 VanDerWaalsContact C-N 3.27Å; Q1360-L1362 PolarHBondContact O-N 3.03Å; L1362-E1364 VanDerWaalsContact C-N 3.3Å; L1362-E1364 PolarHBondContact O-N 2.99Å; L1362-K1365 CarbonylContact O-C 3.55Å; L1362-K1365 PolarHBondContact O-N 3.26Å; L1362-V1366 WeakPolarHBondContact O-CB 3.38Å; L1362-V1366 PolarHBondContact O-N 3.38Å; L1362-F1371 HydrophobicContact CD1-CD2 3.83Å; L1362-F1371 HydrophobicContact CD1-CE2 3.64Å; L1362-Y1463 HydrophobicContact CD2-CD1 4.14Å; L1362-Y1463 HydrophobicContact CD2-CD2 3.9Å; L1362-Y1463 HydrophobicContact CD2-CE2 4.48Å; L1362-Y1463 HydrophobicContact CD2-CG 3.72Å
1363	M	82.7	Confident	83.6	Confident	29 Å²	29	28 Å²	28	14%	0.143	14%	0.138	C	C	.	.	H	α-helix	trans	-65.4	-27.6	-178.1	-79.2	-68.5	-41.1	0	0	114.6	Q1338 D1359 Q1360 K1365 V1366 I1462 Y1463	Q1338-M1363 HydrophobicContact CG-CG 4.48Å; D1359-M1363 VanDerWaalsContact O-CB 3.32Å; D1359-M1363 WeakPolarHBondContact O-CB 3.45Å; D1359-M1363 WeakPolarHBondContact O-CG 3.47Å; D1359-M1363 PolarHBondContact O-N 2.97Å; Q1360-M1363 PolarHBondContact O-N 3.43Å; M1363-K1365 VanDerWaalsContact C-N 3.28Å; M1363-V1366 HydrophobicContact CE-CG1 3.99Å; M1363-V1366 HydrophobicContact SD-CG1 3.85Å; M1363-I1462 HydrophobicContact SD-CG2 4.46Å; M1363-Y1463 HydrophobicContact CG-CE1 3.93Å; M1363-Y1463 HydrophobicContact SD-CD1 4.1Å; M1363-Y1463 HydrophobicContact SD-CE1 3.6Å; M1363-Y1463 VanDerWaalsContact SD-CE1 3.6Å
1364	E	80.8	Confident	84.4	Confident	78 Å²	78	29 Å²	29	36%	0.364	14%	0.143	S	C	.	.	H	α-helix	trans	-66.6	-30.7	171.6	-77.3	162.5	-167	0	0	112	H1342 Q1360 L1362	H1342-E1364 IonicContact CD2-OE1 3.69Å; H1342-E1364 PolarHBondContact CD2-OE1 2.99Å; H1342-E1364 IonicContact CD2-OE2 3.86Å; H1342-E1364 PolarHBondContact CD2-OE2 2.99Å; H1342-E1364 IonicContact CE1-OE2 2.69Å; H1342-E1364 VanDerWaalsContact NE2-CD 3.33Å; H1342-E1364 IonicContact NE2-OE1 2.8Å; H1342-E1364 PolarHBondContact NE2-OE1 3.44Å; H1342-E1364 VanDerWaalsContact NE2-OE1 3.14Å; H1342-E1364 IonicContact NE2-OE2 2.59Å; H1342-E1364 PolarHBondContact NE2-OE2 3.41Å; Q1360-E1364 WeakPolarHBondContact CG-OE1 3.5Å; Q1360-E1364 PolarHBondContact NE2-OE1 2.84Å; Q1360-E1364 WeakPolarHBondContact O-CB 3.36Å; Q1360-E1364 VanDerWaalsContact O-CG 3.3Å; Q1360-E1364 WeakPolarHBondContact O-CG 3.37Å; Q1360-E1364 PolarHBondContact O-N 3.39Å; L1362-E1364 VanDerWaalsContact C-N 3.3Å; L1362-E1364 PolarHBondContact O-N 2.99Å
1365	K	81.5	Confident	84.7	Confident	47 Å²	47	28.2 Å²	28.2	20%	0.204	14%	0.14	C	C	.	.	H	α-helix	trans	-97.6	-32.9	-178.6	-62.5	-177.3	-172.6	178.5	0	113.6	E1345 L1362 M1363 C1367 L1368 E1369	E1345-K1365 IonicContact OE1-NZ 3.58Å; E1345-K1365 PolarHBondContact OE1-NZ 3.33Å; E1345-K1365 IonicContact OE2-NZ 2.79Å; L1362-K1365 CarbonylContact O-C 3.55Å; L1362-K1365 PolarHBondContact O-N 3.26Å; M1363-K1365 VanDerWaalsContact C-N 3.28Å; K1365-C1367 PolarHBondContact O-N 2.91Å; K1365-L1368 PolarHBondContact O-N 2.96Å; K1365-E1369 HydrophobicContact CB-CB 4.47Å; K1365-E1369 PolarHBondContact O-N 3.12Å
1366	V	82.4	Confident	84.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.1	-169	76	0	0	0	0	114.6	Y750 L1362 M1363 L1368 S1370	Y750-V1366 HydrophobicContact CD2-CG1 4.26Å; Y750-V1366 HydrophobicContact CE2-CG1 3.86Å; Y750-V1366 HydrophobicContact CE2-CG2 4.31Å; Y750-V1366 PolarHBondContact OH-O 3.26Å; Y750-V1366 VanDerWaalsContact OH-O 3.1Å; L1362-V1366 WeakPolarHBondContact O-CB 3.38Å; L1362-V1366 PolarHBondContact O-N 3.38Å; M1363-V1366 HydrophobicContact CE-CG1 3.99Å; M1363-V1366 HydrophobicContact SD-CG1 3.85Å; V1366-L1368 VanDerWaalsContact C-N 3.31Å; V1366-L1368 PolarHBondContact O-N 2.94Å; V1366-S1370 WeakPolarHBondContact O-CB 3.36Å; V1366-S1370 PolarHBondContact O-OG 2.93Å
1367	C	77.5	Confident	84.6	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25.5	176.2	-59.9	0	0	0	0	113.1	Y740 R749 Y750 R799 K1365	Y740-C1367 HydrophobicContact CD2-CB 4.1Å; Y740-C1367 HydrophobicContact CG-CB 4.05Å; R749-C1367 VanDerWaalsContact C-SG 3.57Å; R749-C1367 VanDerWaalsContact CA-SG 3.6Å; Y750-C1367 PolarHBondContact N-SG 3.2Å; R799-C1367 PolarHBondContact NH1-O 3.48Å; R799-C1367 PolarHBondContact NH2-O 3.25Å; K1365-C1367 PolarHBondContact O-N 2.91Å
1368	L	80.3	Confident	84.6	Confident	88 Å²	88	29.6 Å²	29.6	46%	0.461	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-43.3	-177	-57	178.1	0	0	0	111.3	Y740 L742 K1365 V1366	Y740-L1368 HydrophobicContact CE2-CD2 3.88Å; L742-L1368 HydrophobicContact CD1-CD2 4.32Å; K1365-L1368 PolarHBondContact O-N 2.96Å; V1366-L1368 VanDerWaalsContact C-N 3.31Å; V1366-L1368 PolarHBondContact O-N 2.94Å
1369	E	81	Confident	84.3	Confident	128 Å²	128	31 Å²	31	60%	0.598	17%	0.167	S	C	*	.	S	Bend	trans	-120.3	72.5	-176.4	-63.1	173.4	-177.3	0	0	109	K1365	K1365-E1369 HydrophobicContact CB-CB 4.47Å; K1365-E1369 PolarHBondContact O-N 3.12Å
1370	S	84.4	Confident	84.2	Confident	12 Å²	12	36.5 Å²	36.5	8%	0.084	19%	0.19	C	C	.	.			trans	-82.1	136.3	179.5	-30.1	0	0	0	0	111.5	Y750 V1366 Y1372	Y750-S1370 PolarHBondContact OH-OG 3.39Å; V1366-S1370 WeakPolarHBondContact O-CB 3.36Å; V1366-S1370 PolarHBondContact O-OG 2.93Å; S1370-Y1372 VanDerWaalsContact C-N 3.26Å; S1370-Y1372 VanDerWaalsContact CB-CE2 3.48Å; S1370-Y1372 WeakPolarHBondContact O-CD2 3.41Å; S1370-Y1372 PolarHBondContact O-N 3.03Å; S1370-Y1372 PolarHBondContact OG-OH 3.09Å
1371	F	89.6	Confident	84.5	Confident	18 Å²	18	33.2 Å²	33.2	8%	0.079	18%	0.175	C	C	.	.			trans	-78.9	72.1	173	-67.6	-71.6	0	0	0	111.2	F909 Y1332 L1362 L1373 M1404 V1406 L1413 F1464	F909-F1371 HydrophobicContact CD2-CD1 4.15Å; F909-F1371 HydrophobicContact CE1-CD1 4.26Å; F909-F1371 HydrophobicContact CE1-CE1 4.44Å; F909-F1371 AromaticContact CE2-CD1 3.76Å; F909-F1371 HydrophobicContact CE2-CD1 3.76Å; F909-F1371 HydrophobicContact CE2-CE1 4.38Å; F909-F1371 AromaticContact CZ-CD1 3.82Å; F909-F1371 HydrophobicContact CZ-CD1 3.82Å; F909-F1371 HydrophobicContact CZ-CE1 4.03Å; Y1332-F1371 HydrophobicContact CE2-CE2 4.18Å; Y1332-F1371 HydrophobicContact CE2-CZ 4.19Å; L1362-F1371 HydrophobicContact CD1-CD2 3.83Å; L1362-F1371 HydrophobicContact CD1-CE2 3.64Å; F1371-L1373 PolarHBondContact O-N 3.38Å; F1371-M1404 HydrophobicContact CD2-CE 3.97Å; F1371-M1404 HydrophobicContact CE2-CE 3.75Å; F1371-M1404 HydrophobicContact CZ-CE 4.23Å; F1371-V1406 HydrophobicContact CE1-CG1 3.96Å; F1371-V1406 HydrophobicContact CE1-CG2 3.87Å; F1371-V1406 HydrophobicContact CZ-CG2 3.85Å; F1371-L1413 HydrophobicContact CB-CD1 4.07Å; F1371-L1413 HydrophobicContact CD1-CD2 3.82Å; F1371-L1413 HydrophobicContact CE1-CD2 4.24Å; F1371-L1413 HydrophobicContact CG-CD1 4.49Å; F1371-L1413 HydrophobicContact CG-CD2 4.41Å; F1371-F1464 HydrophobicContact CB-CD1 4.15Å; F1371-F1464 HydrophobicContact CB-CE1 4.36Å
1372	Y	91.3	Very high	84.7	Confident	6 Å²	6	35.8 Å²	35.8	2%	0.024	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-63.8	128.2	178.4	-68.3	-70.8	0	0	0	111.5	L736 R799 V801 I906 F909 S1370 P1465	L736-Y1372 HydrophobicContact CD2-CE1 4.11Å; R799-Y1372 WeakPolarHBondContact CD-OH 3.47Å; R799-Y1372 PolarHBondContact NH1-OH 3.33Å; V801-Y1372 HydrophobicContact CB-CE1 4.35Å; V801-Y1372 HydrophobicContact CG1-CD1 4.19Å; V801-Y1372 HydrophobicContact CG1-CE1 4.11Å; V801-Y1372 HydrophobicContact CG2-CE1 3.91Å; V801-Y1372 HydrophobicContact CG2-CE2 4.48Å; I906-Y1372 HydrophobicContact CB-CD2 4.22Å; I906-Y1372 HydrophobicContact CD1-CD1 4.39Å; I906-Y1372 HydrophobicContact CD1-CD2 3.48Å; I906-Y1372 VanDerWaalsContact CD1-CD2 3.48Å; I906-Y1372 HydrophobicContact CD1-CE2 4.12Å; I906-Y1372 HydrophobicContact CD1-CG 3.65Å; I906-Y1372 HydrophobicContact CG1-CD2 4.47Å; I906-Y1372 HydrophobicContact CG2-CD2 4.28Å; I906-Y1372 HydrophobicContact CG2-CE2 4.22Å; F909-Y1372 PolarHBondContact N-O 3.29Å; S1370-Y1372 VanDerWaalsContact C-N 3.26Å; S1370-Y1372 VanDerWaalsContact CB-CE2 3.48Å; S1370-Y1372 WeakPolarHBondContact O-CD2 3.41Å; S1370-Y1372 PolarHBondContact O-N 3.03Å; S1370-Y1372 PolarHBondContact OG-OH 3.09Å; Y1372-P1465 WeakPolarHBondContact CA-O 3.36Å; Y1372-P1465 HydrophobicContact CD1-CB 4Å; Y1372-P1465 HydrophobicContact CD1-CG 3.56Å; Y1372-P1465 HydrophobicContact CE1-CB 4.1Å; Y1372-P1465 HydrophobicContact CE1-CG 3.67Å; Y1372-P1465 HydrophobicContact CG-CG 4.43Å
1373	L	90.6	Very high	84.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	152.1	173.8	-63.7	-172.9	0	0	0	111.1	F909 T911 F1371 K1378 L1381 L1413 F1464 P1465 A1466 S1467	F909-L1373 HydrophobicContact CB-CD2 3.98Å; T911-L1373 HydrophobicContact CG2-CD1 3.61Å; T911-L1373 HydrophobicContact CG2-CD2 3.77Å; T911-L1373 HydrophobicContact CG2-CG 4.36Å; F1371-L1373 PolarHBondContact O-N 3.38Å; L1373-K1378 HydrophobicContact CB-CB 4.13Å; L1373-K1378 HydrophobicContact CD1-CB 4.13Å; L1373-K1378 HydrophobicContact CD1-CD 4.28Å; L1373-L1381 HydrophobicContact CD1-CD2 3.69Å; L1373-L1413 HydrophobicContact CD2-CD1 3.93Å; L1373-F1464 HydrophobicContact CD1-CB 3.86Å; L1373-F1464 HydrophobicContact CG-CB 4.24Å; L1373-P1465 PolarHBondContact N-O 3.45Å; L1373-A1466 CarbonylContact O-C 3.59Å; L1373-A1466 WeakPolarHBondContact O-CA 3.31Å; L1373-S1467 PolarHBondContact O-N 2.83Å
1374	N	83.5	Confident	85.1	Confident	48 Å²	48	37 Å²	37	26%	0.257	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	149.9	160.5	59.9	79.6	0	0	0	110.6	F909 A1376 S1377 K1378	F909-N1374 PolarHBondContact O-ND2 3.19Å; N1374-A1376 PolarHBondContact O-N 2.69Å; N1374-A1376 VanDerWaalsContact O-N 3.09Å; N1374-S1377 VanDerWaalsContact CG-OG 3.25Å; N1374-S1377 PolarHBondContact ND2-OG 3.04Å; N1374-S1377 PolarHBondContact O-N 3.14Å; N1374-S1377 WeakPolarHBondContact OD1-CB 3.17Å; N1374-S1377 PolarHBondContact OD1-N 3.12Å; N1374-S1377 PolarHBondContact OD1-OG 3.35Å; N1374-K1378 PolarHBondContact O-N 3.35Å
1375	S	77.6	Confident	85.6	Confident	10 Å²	10	33.5 Å²	33.5	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-48.4	-40.9	-177.6	-62.6	0	0	0	0	114	A1379 N1473	S1375-A1379 WeakPolarHBondContact O-CB 3.32Å; S1375-A1379 PolarHBondContact O-N 3.47Å; S1375-N1473 WeakPolarHBondContact CB-O 3.38Å; S1375-N1473 PolarHBondContact OG-O 3.43Å
1376	A	79.5	Confident	86.1	Confident	56 Å²	56	36.3 Å²	36.3	46%	0.463	19%	0.187	S	C	.	.	H	α-helix	trans	-70.4	-31.2	-178.6	0	0	0	0	0	113.3	N1374 K1380	N1374-A1376 PolarHBondContact O-N 2.69Å; N1374-A1376 VanDerWaalsContact O-N 3.09Å; A1376-K1380 WeakPolarHBondContact O-CG 3.27Å; A1376-K1380 PolarHBondContact O-N 3.06Å
1377	S	86.4	Confident	86.4	Confident	10 Å²	10	38 Å²	38	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-77.8	-41.4	175.7	-60	0	0	0	0	111.2	T911 N1374 A1379 K1380 L1381	T911-S1377 WeakPolarHBondContact OG1-CB 3.4Å; T911-S1377 PolarHBondContact OG1-O 3.21Å; N1374-S1377 VanDerWaalsContact CG-OG 3.25Å; N1374-S1377 PolarHBondContact ND2-OG 3.04Å; N1374-S1377 PolarHBondContact O-N 3.14Å; N1374-S1377 WeakPolarHBondContact OD1-CB 3.17Å; N1374-S1377 PolarHBondContact OD1-N 3.12Å; N1374-S1377 PolarHBondContact OD1-OG 3.35Å; S1377-A1379 PolarHBondContact O-N 3.25Å; S1377-K1380 PolarHBondContact O-N 3.02Å; S1377-L1381 PolarHBondContact O-N 3.06Å
1378	K	88.6	Confident	87.2	Confident	17 Å²	17	38 Å²	38	7%	0.074	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-46.7	172.3	-180	55.7	169.3	159.4	0	111.6	L1373 N1374 K1380 L1381 D1382 D1461 F1464 A1466	L1373-K1378 HydrophobicContact CB-CB 4.13Å; L1373-K1378 HydrophobicContact CD1-CB 4.13Å; L1373-K1378 HydrophobicContact CD1-CD 4.28Å; N1374-K1378 PolarHBondContact O-N 3.35Å; K1378-K1380 VanDerWaalsContact C-N 3.28Å; K1378-K1380 PolarHBondContact O-N 2.96Å; K1378-L1381 WeakPolarHBondContact O-CB 3.43Å; K1378-L1381 PolarHBondContact O-N 3.05Å; K1378-L1381 VanDerWaalsContact O-N 3.09Å; K1378-D1382 WeakPolarHBondContact CD-OD1 3.44Å; K1378-D1382 VanDerWaalsContact CD-OD2 3.26Å; K1378-D1382 WeakPolarHBondContact CD-OD2 3.42Å; K1378-D1382 VanDerWaalsContact CE-OD1 3.25Å; K1378-D1382 WeakPolarHBondContact CE-OD1 3.35Å; K1378-D1382 WeakPolarHBondContact CE-OD2 3.48Å; K1378-D1382 WeakPolarHBondContact CG-OD2 3.48Å; K1378-D1382 IonicContact NZ-OD1 2.71Å; K1378-D1382 PolarHBondContact NZ-OD1 3.35Å; K1378-D1382 IonicContact NZ-OD2 2.75Å; K1378-D1382 PolarHBondContact NZ-OD2 3.16Å; K1378-D1382 PolarHBondContact O-N 3.2Å; K1378-D1461 IonicContact NZ-OD1 3.98Å; K1378-D1461 PolarHBondContact NZ-OD1 3.37Å; K1378-F1464 WeakPolarHBondContact CD-O 3.47Å; K1378-F1464 WeakPolarHBondContact CE-O 3.37Å; K1378-A1466 HydrophobicContact CB-CB 3.85Å; K1378-A1466 HydrophobicContact CG-CB 3.85Å
1379	A	84.7	Confident	87.9	Confident	33 Å²	33	33.8 Å²	33.8	27%	0.273	17%	0.174	S	C	.	.	H	α-helix	trans	-58.4	-36.7	177	0	0	0	0	0	113.5	S1375 S1377 E1383 Y1475	S1375-A1379 WeakPolarHBondContact O-CB 3.32Å; S1375-A1379 PolarHBondContact O-N 3.47Å; S1377-A1379 PolarHBondContact O-N 3.25Å; A1379-E1383 WeakPolarHBondContact O-CB 3.25Å; A1379-E1383 PolarHBondContact O-N 2.62Å; A1379-Y1475 HydrophobicContact CB-CG 4.47Å
1380	K	86.8	Confident	88.4	Confident	115 Å²	115	30.8 Å²	30.8	50%	0.5	16%	0.164	S	C	.	.	H	α-helix	trans	-69.4	-43.3	173.6	-73.5	173	-179.9	-179.9	0	112.3	F913 A1376 S1377 K1378 D1382 E1383 A1384	F913-K1380 HydrophobicContact CE2-CB 4.06Å; F913-K1380 HydrophobicContact CZ-CB 4.36Å; A1376-K1380 WeakPolarHBondContact O-CG 3.27Å; A1376-K1380 PolarHBondContact O-N 3.06Å; S1377-K1380 PolarHBondContact O-N 3.02Å; K1378-K1380 VanDerWaalsContact C-N 3.28Å; K1378-K1380 PolarHBondContact O-N 2.96Å; K1380-D1382 VanDerWaalsContact C-N 3.31Å; K1380-D1382 PolarHBondContact O-N 2.96Å; K1380-E1383 PolarHBondContact O-N 2.91Å; K1380-A1384 VanDerWaalsContact O-CB 3.3Å; K1380-A1384 WeakPolarHBondContact O-CB 3.38Å; K1380-A1384 PolarHBondContact O-N 3.42Å
1381	L	90.9	Very high	88.7	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-43.6	176.1	179	59.6	0	0	0	111.4	T911 F913 L1373 S1377 K1378 A1384 I1385 L1415 F1464	T911-L1381 HydrophobicContact CG2-CB 4.29Å; T911-L1381 HydrophobicContact CG2-CD2 4.47Å; F913-L1381 HydrophobicContact CE1-CD1 3.79Å; F913-L1381 HydrophobicContact CZ-CB 4.2Å; F913-L1381 HydrophobicContact CZ-CD1 4.26Å; L1373-L1381 HydrophobicContact CD1-CD2 3.69Å; S1377-L1381 PolarHBondContact O-N 3.06Å; K1378-L1381 WeakPolarHBondContact O-CB 3.43Å; K1378-L1381 PolarHBondContact O-N 3.05Å; K1378-L1381 VanDerWaalsContact O-N 3.09Å; L1381-A1384 PolarHBondContact O-N 3.25Å; L1381-I1385 HydrophobicContact CD1-CD1 3.52Å; L1381-I1385 HydrophobicContact CD1-CG1 3.97Å; L1381-I1385 HydrophobicContact CG-CD1 3.85Å; L1381-I1385 WeakPolarHBondContact O-CB 3.34Å; L1381-I1385 WeakPolarHBondContact O-CG1 3.32Å; L1381-I1385 PolarHBondContact O-N 2.89Å; L1381-L1415 HydrophobicContact CD1-CD1 3.6Å; L1381-L1415 HydrophobicContact CD2-CD1 4.19Å; L1381-L1415 HydrophobicContact CG-CD1 4.49Å; L1381-F1464 HydrophobicContact CD2-CB 3.77Å; L1381-F1464 HydrophobicContact CD2-CD2 3.8Å; L1381-F1464 HydrophobicContact CD2-CG 3.91Å
1382	D	90.2	Very high	88.9	Confident	56 Å²	56	30.2 Å²	30.2	30%	0.299	16%	0.16	S	C	.	.	H	α-helix	trans	-73.6	-37.5	-178.3	-61.6	-17.4	0	0	0	111.6	K1378 K1380 R1386	K1378-D1382 WeakPolarHBondContact CD-OD1 3.44Å; K1378-D1382 VanDerWaalsContact CD-OD2 3.26Å; K1378-D1382 WeakPolarHBondContact CD-OD2 3.42Å; K1378-D1382 VanDerWaalsContact CE-OD1 3.25Å; K1378-D1382 WeakPolarHBondContact CE-OD1 3.35Å; K1378-D1382 WeakPolarHBondContact CE-OD2 3.48Å; K1378-D1382 WeakPolarHBondContact CG-OD2 3.48Å; K1378-D1382 IonicContact NZ-OD1 2.71Å; K1378-D1382 PolarHBondContact NZ-OD1 3.35Å; K1378-D1382 IonicContact NZ-OD2 2.75Å; K1378-D1382 PolarHBondContact NZ-OD2 3.16Å; K1378-D1382 PolarHBondContact O-N 3.2Å; K1380-D1382 VanDerWaalsContact C-N 3.31Å; K1380-D1382 PolarHBondContact O-N 2.96Å; D1382-R1386 WeakPolarHBondContact O-CB 3.32Å; D1382-R1386 PolarHBondContact O-N 3.41Å
1383	E	88.4	Confident	88.9	Confident	55 Å²	55	30.5 Å²	30.5	26%	0.257	16%	0.163	S	C	.	.	H	α-helix	trans	-62.5	-42.9	170.6	-172.1	114.8	-106.7	0	0	110.8	R679 A1379 K1380 R1386 N1387	R679-E1383 IonicContact CZ-OE1 2.58Å; R679-E1383 IonicContact CZ-OE2 2.75Å; R679-E1383 IonicContact NH1-OE1 2.95Å; R679-E1383 PolarHBondContact NH1-OE1 3.44Å; R679-E1383 IonicContact NH1-OE2 2.69Å; R679-E1383 IonicContact NH2-OE1 2.78Å; R679-E1383 PolarHBondContact NH2-OE1 3.23Å; R679-E1383 IonicContact NH2-OE2 3.82Å; R679-E1383 PolarHBondContact NH2-OE2 3.36Å; A1379-E1383 WeakPolarHBondContact O-CB 3.25Å; A1379-E1383 PolarHBondContact O-N 2.62Å; K1380-E1383 PolarHBondContact O-N 2.91Å; E1383-R1386 IonicContact OE1-CZ 2.65Å; E1383-R1386 IonicContact OE1-NH2 3.86Å; E1383-R1386 PolarHBondContact OE1-NH2 2.88Å; E1383-N1387 WeakPolarHBondContact O-CB 3.41Å; E1383-N1387 PolarHBondContact O-N 3.07Å; E1383-N1387 PolarHBondContact O-ND2 3.46Å; E1383-N1387 VanDerWaalsContact O-ND2 3.14Å; E1383-N1387 PolarHBondContact O-OD1 2.82Å
1384	A	90.4	Very high	88.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.1	-57	178.5	0	0	0	0	0	113.1	F913 V1289 K1380 L1381 R1386 N1387 D1388	F913-A1384 HydrophobicContact CD1-CB 4.49Å; F913-A1384 HydrophobicContact CE1-CB 4.12Å; F913-A1384 HydrophobicContact CZ-CB 4.34Å; V1289-A1384 HydrophobicContact CB-CB 4.14Å; V1289-A1384 HydrophobicContact CG1-CB 3.8Å; V1289-A1384 WeakPolarHBondContact O-CA 3.42Å; K1380-A1384 VanDerWaalsContact O-CB 3.3Å; K1380-A1384 WeakPolarHBondContact O-CB 3.38Å; K1380-A1384 PolarHBondContact O-N 3.42Å; L1381-A1384 PolarHBondContact O-N 3.25Å; A1384-R1386 VanDerWaalsContact C-N 3.28Å; A1384-R1386 PolarHBondContact O-N 2.91Å; A1384-N1387 WeakPolarHBondContact O-CB 3.36Å; A1384-N1387 PolarHBondContact O-N 3.13Å; A1384-N1387 VanDerWaalsContact O-N 3.09Å; A1384-D1388 PolarHBondContact O-N 3.1Å
1385	I	92.8	Very high	89	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-41.6	178	-70.3	175.2	0	0	0	110.2	L1381 T1389 L1402 F1456 V1457 M1460	L1381-I1385 HydrophobicContact CD1-CD1 3.52Å; L1381-I1385 HydrophobicContact CD1-CG1 3.97Å; L1381-I1385 HydrophobicContact CG-CD1 3.85Å; L1381-I1385 WeakPolarHBondContact O-CB 3.34Å; L1381-I1385 WeakPolarHBondContact O-CG1 3.32Å; L1381-I1385 PolarHBondContact O-N 2.89Å; I1385-T1389 HydrophobicContact CG2-CG2 3.92Å; I1385-T1389 VanDerWaalsContact O-CB 3.28Å; I1385-T1389 WeakPolarHBondContact O-CB 3.26Å; I1385-T1389 VanDerWaalsContact O-CG2 3.28Å; I1385-T1389 WeakPolarHBondContact O-CG2 3.13Å; I1385-T1389 PolarHBondContact O-N 2.81Å; I1385-T1389 PolarHBondContact O-OG1 3.46Å; I1385-L1402 HydrophobicContact CD1-CD2 4.39Å; I1385-F1456 HydrophobicContact CG2-CD1 4.24Å; I1385-F1456 HydrophobicContact CG2-CE1 4.14Å; I1385-V1457 HydrophobicContact CG2-CG2 3.9Å; I1385-M1460 HydrophobicContact CD1-CB 3.9Å; I1385-M1460 HydrophobicContact CD1-CG 3.91Å
1386	R	91.8	Very high	89.5	Confident	107 Å²	107	38.5 Å²	38.5	40%	0.404	21%	0.211	S	C	.	.	H	α-helix	trans	-67.2	-34.7	177.5	-173.5	-160.6	52.7	46	2.7	112.2	D1382 E1383 A1384 V1390	D1382-R1386 WeakPolarHBondContact O-CB 3.32Å; D1382-R1386 PolarHBondContact O-N 3.41Å; E1383-R1386 IonicContact OE1-CZ 2.65Å; E1383-R1386 IonicContact OE1-NH2 3.86Å; E1383-R1386 PolarHBondContact OE1-NH2 2.88Å; A1384-R1386 VanDerWaalsContact C-N 3.28Å; A1384-R1386 PolarHBondContact O-N 2.91Å; R1386-V1390 VanDerWaalsContact O-CB 3.3Å; R1386-V1390 WeakPolarHBondContact O-CB 3.33Å; R1386-V1390 WeakPolarHBondContact O-CG2 3.46Å; R1386-V1390 PolarHBondContact O-N 2.85Å
1387	N	89	Confident	89.9	Confident	34 Å²	34	35.8 Å²	35.8	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-66	-55.6	174.1	-71.4	-21.7	0	0	0	110.3	V1289 E1383 A1384 F1391	V1289-N1387 PolarHBondContact O-ND2 3.44Å; E1383-N1387 WeakPolarHBondContact O-CB 3.41Å; E1383-N1387 PolarHBondContact O-N 3.07Å; E1383-N1387 PolarHBondContact O-ND2 3.46Å; E1383-N1387 VanDerWaalsContact O-ND2 3.14Å; E1383-N1387 PolarHBondContact O-OD1 2.82Å; A1384-N1387 WeakPolarHBondContact O-CB 3.36Å; A1384-N1387 PolarHBondContact O-N 3.13Å; A1384-N1387 VanDerWaalsContact O-N 3.09Å; N1387-F1391 PolarHBondContact O-N 2.99Å
1388	D	93.4	Very high	89.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-48.5	-173.9	-60.2	-32.1	0	0	0	112.1	H1275 S1290 S1291 L1292 A1384 V1390 F1391 L1392 I1417	H1275-D1388 IonicContact CD2-OD1 3.4Å; H1275-D1388 IonicContact CE1-OD1 2.73Å; H1275-D1388 IonicContact NE2-OD1 3.16Å; H1275-D1388 PolarHBondContact NE2-OD1 3.41Å; S1290-D1388 WeakPolarHBondContact CB-OD1 3.47Å; S1290-D1388 PolarHBondContact OG-OD1 3.47Å; S1290-D1388 PolarHBondContact OG-OD2 3.36Å; S1291-D1388 VanDerWaalsContact CA-OD2 3.31Å; S1291-D1388 WeakPolarHBondContact CA-OD2 3.28Å; S1291-D1388 WeakPolarHBondContact CB-OD2 3.49Å; S1291-D1388 PolarHBondContact N-OD2 2.97Å; S1291-D1388 PolarHBondContact OG-OD2 3.49Å; L1292-D1388 PolarHBondContact N-OD2 2.99Å; A1384-D1388 PolarHBondContact O-N 3.1Å; D1388-V1390 VanDerWaalsContact C-N 3.28Å; D1388-V1390 PolarHBondContact O-N 3.11Å; D1388-F1391 CarbonylContact O-C 3.57Å; D1388-F1391 WeakPolarHBondContact O-CA 3.45Å; D1388-F1391 VanDerWaalsContact O-CB 3.31Å; D1388-F1391 WeakPolarHBondContact O-CB 3.45Å; D1388-F1391 PolarHBondContact O-N 3.36Å; D1388-L1392 WeakPolarHBondContact O-CG 3.32Å; D1388-L1392 PolarHBondContact O-N 2.91Å; D1388-I1417 HydrophobicContact CB-CD1 3.89Å
1389	T	94.1	Very high	89.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.7	-20.2	-175.6	63.5	0	0	0	0	113.5	I1385 S1393 Y1400 I1417 R1453 F1456	I1385-T1389 HydrophobicContact CG2-CG2 3.92Å; I1385-T1389 VanDerWaalsContact O-CB 3.28Å; I1385-T1389 WeakPolarHBondContact O-CB 3.26Å; I1385-T1389 VanDerWaalsContact O-CG2 3.28Å; I1385-T1389 WeakPolarHBondContact O-CG2 3.13Å; I1385-T1389 PolarHBondContact O-N 2.81Å; I1385-T1389 PolarHBondContact O-OG1 3.46Å; T1389-S1393 VanDerWaalsContact O-CB 3.28Å; T1389-S1393 WeakPolarHBondContact O-CB 3.18Å; T1389-S1393 PolarHBondContact O-N 3.17Å; T1389-Y1400 HydrophobicContact CG2-CE2 3.75Å; T1389-I1417 HydrophobicContact CG2-CD1 4.25Å; T1389-R1453 VanDerWaalsContact C-CD 3.44Å; T1389-R1453 WeakPolarHBondContact O-CD 3.33Å; T1389-R1453 WeakPolarHBondContact OG1-CD 3.5Å; T1389-R1453 WeakPolarHBondContact OG1-CG 3.49Å; T1389-F1456 HydrophobicContact CG2-CD1 3.93Å; T1389-F1456 HydrophobicContact CG2-CE1 3.95Å
1390	V	92.2	Very high	89.9	Confident	65 Å²	65	34.1 Å²	34.1	39%	0.394	18%	0.175	S	C	.	.	H	α-helix	trans	-69.1	-45.3	166	166.3	0	0	0	0	110.2	R1386 D1388 A1394	R1386-V1390 VanDerWaalsContact O-CB 3.3Å; R1386-V1390 WeakPolarHBondContact O-CB 3.33Å; R1386-V1390 WeakPolarHBondContact O-CG2 3.46Å; R1386-V1390 PolarHBondContact O-N 2.85Å; D1388-V1390 VanDerWaalsContact C-N 3.28Å; D1388-V1390 PolarHBondContact O-N 3.11Å; V1390-A1394 VanDerWaalsContact O-CB 3.29Å; V1390-A1394 WeakPolarHBondContact O-CB 3.24Å; V1390-A1394 PolarHBondContact O-N 2.98Å
1391	F	91.6	Very high	90.2	Very high	19 Å²	19	28.6 Å²	28.6	8%	0.083	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-45.6	173.2	156.9	-100.3	0	0	0	112	F1268 Q1271 H1275 L1292 N1387 D1388 A1394 N1395	F1268-F1391 HydrophobicContact CD2-CZ 4.18Å; F1268-F1391 HydrophobicContact CE2-CZ 4.35Å; Q1271-F1391 HydrophobicContact CB-CE2 3.93Å; Q1271-F1391 VanDerWaalsContact O-CE2 3.31Å; Q1271-F1391 WeakPolarHBondContact O-CE2 3.38Å; H1275-F1391 HydrophobicContact CB-CD2 3.92Å; H1275-F1391 HydrophobicContact CB-CE2 3.99Å; H1275-F1391 HydrophobicContact CB-CG 4.24Å; H1275-F1391 HydrophobicContact CB-CZ 4.34Å; H1275-F1391 AromaticContact CG-CD2 3.99Å; H1275-F1391 AromaticContact CG-CG 3.81Å; H1275-F1391 AromaticContact ND1-CG 3.69Å; L1292-F1391 HydrophobicContact CD2-CE1 4.13Å; N1387-F1391 PolarHBondContact O-N 2.99Å; D1388-F1391 CarbonylContact O-C 3.57Å; D1388-F1391 WeakPolarHBondContact O-CA 3.45Å; D1388-F1391 VanDerWaalsContact O-CB 3.31Å; D1388-F1391 WeakPolarHBondContact O-CB 3.45Å; D1388-F1391 PolarHBondContact O-N 3.36Å; F1391-A1394 PolarHBondContact O-N 3.11Å; F1391-N1395 VanDerWaalsContact CD2-ND2 3.33Å; F1391-N1395 WeakPolarHBondContact CD2-ND2 3.18Å; F1391-N1395 VanDerWaalsContact CE2-ND2 3.29Å; F1391-N1395 WeakPolarHBondContact CE2-ND2 3.35Å; F1391-N1395 PolarHBondContact O-N 3.08Å; F1391-N1395 VanDerWaalsContact O-N 3.12Å; F1391-N1395 PolarHBondContact O-ND2 3.08Å
1392	L	93.3	Very high	90.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.1	-44.8	178.8	-62.9	179.7	0	0	0	112.3	D1388 A1394 N1395 H1396 I1397 Y1400 I1417 Y1420	D1388-L1392 WeakPolarHBondContact O-CG 3.32Å; D1388-L1392 PolarHBondContact O-N 2.91Å; L1392-A1394 VanDerWaalsContact C-N 3.32Å; L1392-A1394 PolarHBondContact O-N 3Å; L1392-N1395 PolarHBondContact O-N 2.92Å; L1392-H1396 PolarHBondContact O-N 3.38Å; L1392-I1397 HydrophobicContact CB-CB 4.19Å; L1392-I1397 HydrophobicContact CD2-CB 4.19Å; L1392-I1397 HydrophobicContact CD2-CD1 3.66Å; L1392-I1397 HydrophobicContact CD2-CG2 4.07Å; L1392-I1397 PolarHBondContact O-N 3.34Å; L1392-Y1400 HydrophobicContact CB-CD1 4.3Å; L1392-Y1400 HydrophobicContact CB-CE1 3.9Å; L1392-Y1400 HydrophobicContact CD1-CD1 3.67Å; L1392-Y1400 HydrophobicContact CD1-CD2 3.96Å; L1392-Y1400 HydrophobicContact CD1-CE1 3.85Å; L1392-Y1400 HydrophobicContact CD1-CE2 4.14Å; L1392-Y1400 HydrophobicContact CD1-CG 3.73Å; L1392-I1417 HydrophobicContact CD1-CG2 4.01Å; L1392-Y1420 HydrophobicContact CD2-CD2 4.33Å; L1392-Y1420 HydrophobicContact CD2-CG 4.3Å
1393	S	91	Very high	90.6	Very high	11 Å²	11	27.2 Å²	27.2	8%	0.077	14%	0.144	C	C	.	.	H	α-helix	trans	-60.9	-40.6	175.7	-173.6	0	0	0	0	111.8	T1389 N1395 H1396 E1450	T1389-S1393 VanDerWaalsContact O-CB 3.28Å; T1389-S1393 WeakPolarHBondContact O-CB 3.18Å; T1389-S1393 PolarHBondContact O-N 3.17Å; S1393-N1395 PolarHBondContact O-N 3.43Å; S1393-H1396 PolarHBondContact O-N 3.12Å; S1393-H1396 VanDerWaalsContact O-N 3.12Å; S1393-E1450 WeakPolarHBondContact OG-CA 3.39Å; S1393-E1450 PolarHBondContact OG-N 2.97Å; S1393-E1450 PolarHBondContact OG-OE2 3.27Å
1394	A	88.4	Confident	90.9	Very high	71 Å²	71	24.6 Å²	24.6	59%	0.587	13%	0.131	S	C	*	.	H	α-helix	trans	-65.8	-33.8	179.1	0	0	0	0	0	113.5	V1390 F1391 L1392 H1396	V1390-A1394 VanDerWaalsContact O-CB 3.29Å; V1390-A1394 WeakPolarHBondContact O-CB 3.24Å; V1390-A1394 PolarHBondContact O-N 2.98Å; F1391-A1394 PolarHBondContact O-N 3.11Å; L1392-A1394 VanDerWaalsContact C-N 3.32Å; L1392-A1394 PolarHBondContact O-N 3Å; A1394-H1396 VanDerWaalsContact C-N 3.26Å; A1394-H1396 PolarHBondContact O-N 3.11Å
1395	N	88.2	Confident	91	Very high	35 Å²	35	24.6 Å²	24.6	19%	0.187	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	13.7	174.4	-68	-80.5	0	0	0	113	F1268 F1391 L1392 S1393 I1397	F1268-N1395 HydrophobicContact CB-CB 4.31Å; F1391-N1395 VanDerWaalsContact CD2-ND2 3.33Å; F1391-N1395 WeakPolarHBondContact CD2-ND2 3.18Å; F1391-N1395 VanDerWaalsContact CE2-ND2 3.29Å; F1391-N1395 WeakPolarHBondContact CE2-ND2 3.35Å; F1391-N1395 PolarHBondContact O-N 3.08Å; F1391-N1395 VanDerWaalsContact O-N 3.12Å; F1391-N1395 PolarHBondContact O-ND2 3.08Å; L1392-N1395 PolarHBondContact O-N 2.92Å; S1393-N1395 PolarHBondContact O-N 3.43Å; N1395-I1397 HydrophobicContact CB-CD1 3.81Å; N1395-I1397 HydrophobicContact CB-CG1 4.12Å; N1395-I1397 PolarHBondContact O-N 3.38Å
1396	H	87.8	Confident	90.9	Very high	120 Å²	120	24.7 Å²	24.7	56%	0.556	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	25.1	-177.8	-55.3	-56.9	0	0	0	115.4	L1392 S1393 A1394 Y1424 P1449	L1392-H1396 PolarHBondContact O-N 3.38Å; S1393-H1396 PolarHBondContact O-N 3.12Å; S1393-H1396 VanDerWaalsContact O-N 3.12Å; A1394-H1396 VanDerWaalsContact C-N 3.26Å; A1394-H1396 PolarHBondContact O-N 3.11Å; H1396-Y1424 WeakPolarHBondContact O-CB 3.47Å; H1396-Y1424 PolarHBondContact O-N 3.35Å; H1396-P1449 HydrophobicContact CB-CG 4.25Å
1397	I	88.9	Confident	90.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-83.2	141.9	179.1	-60.8	162.5	0	0	0	110.1	F1268 L1392 N1395 Y1400 Y1420	F1268-I1397 HydrophobicContact CD1-CD1 3.83Å; F1268-I1397 HydrophobicContact CD1-CG1 4.34Å; F1268-I1397 HydrophobicContact CD2-CD1 3.93Å; F1268-I1397 HydrophobicContact CE1-CD1 3.63Å; F1268-I1397 HydrophobicContact CE1-CG1 4.19Å; F1268-I1397 HydrophobicContact CE2-CD1 3.74Å; F1268-I1397 HydrophobicContact CG-CD1 4Å; F1268-I1397 HydrophobicContact CZ-CD1 3.6Å; L1392-I1397 HydrophobicContact CB-CB 4.19Å; L1392-I1397 HydrophobicContact CD2-CB 4.19Å; L1392-I1397 HydrophobicContact CD2-CD1 3.66Å; L1392-I1397 HydrophobicContact CD2-CG2 4.07Å; L1392-I1397 PolarHBondContact O-N 3.34Å; N1395-I1397 HydrophobicContact CB-CD1 3.81Å; N1395-I1397 HydrophobicContact CB-CG1 4.12Å; N1395-I1397 PolarHBondContact O-N 3.38Å; I1397-Y1400 HydrophobicContact CG2-CD1 4.25Å; I1397-Y1420 WeakPolarHBondContact CG2-O 3.39Å
1398	M	84.8	Confident	90.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.			trans	-152.8	180	179.2	64.4	173.7	-69.3	0	0	111.8	Y1400 R1422 Y1424 V1446 V1447 Y1452	M1398-Y1400 PolarHBondContact O-N 2.8Å; M1398-Y1400 VanDerWaalsContact O-N 3.16Å; M1398-R1422 PolarHBondContact N-O 3.36Å; M1398-Y1424 HydrophobicContact SD-CD2 3.28Å; M1398-Y1424 WeakPolarHBondContact SD-CD2 3.25Å; M1398-Y1424 HydrophobicContact SD-CE2 4.01Å; M1398-Y1424 HydrophobicContact SD-CG 3.84Å; M1398-V1446 HydrophobicContact CE-CB 4.08Å; M1398-V1446 HydrophobicContact CE-CG1 3.7Å; M1398-V1446 HydrophobicContact CE-CG2 4.39Å; M1398-V1446 HydrophobicContact SD-CG1 4.44Å; M1398-V1447 WeakPolarHBondContact CE-O 3.39Å; M1398-Y1452 HydrophobicContact CB-CD2 4.2Å; M1398-Y1452 HydrophobicContact CB-CG 4.14Å; M1398-Y1452 HydrophobicContact CE-CD2 4.16Å
1399	D	82.4	Confident	89.6	Confident	24 Å²	24	26.9 Å²	26.9	13%	0.128	16%	0.162	C	C	.	.	S	Bend	trans	59.7	15.4	-173.8	-65.9	-41.6	0	0	0	115.1	K1335 K1428 Y1452	K1335-D1399 WeakPolarHBondContact CE-O 3.38Å; K1335-D1399 PolarHBondContact NZ-O 3.45Å; D1399-K1428 IonicContact OD2-NZ 3.1Å; D1399-K1428 PolarHBondContact OD2-NZ 2.93Å; D1399-Y1452 VanDerWaalsContact CA-CE2 3.49Å; D1399-Y1452 VanDerWaalsContact CA-CZ 3.41Å; D1399-Y1452 VanDerWaalsContact CA-OH 3.29Å; D1399-Y1452 WeakPolarHBondContact CA-OH 3.48Å; D1399-Y1452 HydrophobicContact CB-CE2 4.44Å; D1399-Y1452 VanDerWaalsContact N-CE2 3.31Å; D1399-Y1452 WeakPolarHBondContact OD1-CE2 3.32Å
1400	Y	92.5	Very high	89.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.			trans	-70.7	153.9	170.3	55.9	-97.7	0	0	0	112.4	T1389 L1392 I1397 M1398 I1417 I1418 Y1452 R1453 F1456	T1389-Y1400 HydrophobicContact CG2-CE2 3.75Å; L1392-Y1400 HydrophobicContact CB-CD1 4.3Å; L1392-Y1400 HydrophobicContact CB-CE1 3.9Å; L1392-Y1400 HydrophobicContact CD1-CD1 3.67Å; L1392-Y1400 HydrophobicContact CD1-CD2 3.96Å; L1392-Y1400 HydrophobicContact CD1-CE1 3.85Å; L1392-Y1400 HydrophobicContact CD1-CE2 4.14Å; L1392-Y1400 HydrophobicContact CD1-CG 3.73Å; I1397-Y1400 HydrophobicContact CG2-CD1 4.25Å; M1398-Y1400 PolarHBondContact O-N 2.8Å; M1398-Y1400 VanDerWaalsContact O-N 3.16Å; Y1400-I1417 HydrophobicContact CD2-CG2 4.2Å; Y1400-I1418 WeakPolarHBondContact CA-O 3.4Å; Y1400-I1418 WeakPolarHBondContact CB-O 3.39Å; Y1400-Y1452 HydrophobicContact CD1-CD1 4.25Å; Y1400-Y1452 HydrophobicContact CD1-CE1 4.02Å; Y1400-Y1452 AromaticContact CD2-CE1 3.98Å; Y1400-Y1452 HydrophobicContact CD2-CE1 3.98Å; Y1400-Y1452 AromaticContact CE1-CD1 3.68Å; Y1400-Y1452 HydrophobicContact CE1-CD1 3.68Å; Y1400-Y1452 AromaticContact CE1-CE1 3.87Å; Y1400-Y1452 HydrophobicContact CE1-CE1 3.87Å; Y1400-Y1452 HydrophobicContact CE2-CD1 4.09Å; Y1400-Y1452 AromaticContact CE2-CE1 3.81Å; Y1400-Y1452 HydrophobicContact CE2-CE1 3.81Å; Y1400-Y1452 HydrophobicContact CG-CE1 4.09Å; Y1400-Y1452 AromaticContact CZ-CD1 3.6Å; Y1400-Y1452 AromaticContact CZ-CE1 3.77Å; Y1400-Y1452 PolarHBondContact O-OH 2.87Å; Y1400-R1453 WeakPolarHBondContact OH-CA 3.18Å; Y1400-F1456 AromaticContact CD2-CD2 3.99Å; Y1400-F1456 HydrophobicContact CD2-CD2 3.99Å; Y1400-F1456 HydrophobicContact CD2-CE1 4.46Å; Y1400-F1456 AromaticContact CD2-CE2 3.62Å; Y1400-F1456 HydrophobicContact CD2-CE2 3.62Å; Y1400-F1456 AromaticContact CD2-CZ 3.86Å; Y1400-F1456 HydrophobicContact CD2-CZ 3.86Å; Y1400-F1456 HydrophobicContact CE2-CB 4.43Å; Y1400-F1456 AromaticContact CE2-CD1 3.97Å; Y1400-F1456 HydrophobicContact CE2-CD1 3.97Å; Y1400-F1456 AromaticContact CE2-CD2 3.67Å; Y1400-F1456 HydrophobicContact CE2-CD2 3.67Å; Y1400-F1456 AromaticContact CE2-CE1 3.99Å; Y1400-F1456 HydrophobicContact CE2-CE1 3.99Å; Y1400-F1456 AromaticContact CE2-CE2 3.69Å; Y1400-F1456 HydrophobicContact CE2-CE2 3.69Å; Y1400-F1456 AromaticContact CE2-CG 3.79Å; Y1400-F1456 HydrophobicContact CE2-CG 3.79Å; Y1400-F1456 AromaticContact CE2-CZ 3.84Å; Y1400-F1456 HydrophobicContact CE2-CZ 3.84Å
1401	S	92.6	Very high	88.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	155.9	177.8	-58.9	0	0	0	0	112.4	D1333 L1334 K1335 I1417 I1418	D1333-S1401 WeakPolarHBondContact OD1-CB 3.29Å; D1333-S1401 PolarHBondContact OD1-OG 3.16Å; L1334-S1401 CarbonylContact O-C 3.54Å; L1334-S1401 VanDerWaalsContact O-CA 3.3Å; L1334-S1401 WeakPolarHBondContact O-CA 3.19Å; K1335-S1401 WeakPolarHBondContact CE-OG 3.41Å; K1335-S1401 WeakPolarHBondContact CG-OG 3.45Å; S1401-I1417 CarbonylContact O-C 3.52Å; S1401-I1417 WeakPolarHBondContact O-CA 3.24Å; S1401-I1418 PolarHBondContact N-O 3.41Å; S1401-I1418 PolarHBondContact O-N 3.49Å
1402	L	95.3	Very high	88.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	117.3	150.1	-169.1	69.6	0	0	0	108.4	L1334 I1385 L1415 I1417 F1456 M1460 F1464	L1334-L1402 PolarHBondContact N-O 3.04Å; L1334-L1402 PolarHBondContact O-N 3.22Å; I1385-L1402 HydrophobicContact CD1-CD2 4.39Å; L1402-L1415 HydrophobicContact CD1-CB 4.36Å; L1402-L1415 HydrophobicContact CD2-CD2 4.21Å; L1402-I1417 HydrophobicContact CD1-CG1 3.8Å; L1402-F1456 HydrophobicContact CB-CE2 4.47Å; L1402-F1456 HydrophobicContact CB-CZ 3.85Å; L1402-M1460 HydrophobicContact CB-CE 3.76Å; L1402-M1460 HydrophobicContact CB-SD 4.29Å; L1402-M1460 HydrophobicContact CD2-CE 4.4Å; L1402-M1460 HydrophobicContact CD2-CG 4.37Å; L1402-M1460 HydrophobicContact CD2-SD 3.85Å; L1402-F1464 HydrophobicContact CD2-CE2 3.74Å; L1402-F1464 HydrophobicContact CD2-CZ 4.35Å
1403	L	94.2	Very high	88.7	Confident	27 Å²	27	31.2 Å²	31.2	14%	0.141	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	132	166.5	-169.9	71	0	0	0	108.3	L1322 F1323 V1331 Y1332 D1333 G1416 I1418	L1322-L1403 HydrophobicContact CD2-CB 4.03Å; L1322-L1403 HydrophobicContact CD2-CD2 3.91Å; L1322-L1403 HydrophobicContact CD2-CG 4.1Å; F1323-L1403 HydrophobicContact CE2-CD2 4.07Å; F1323-L1403 HydrophobicContact CE2-CG 4.4Å; F1323-L1403 HydrophobicContact CZ-CD2 3.88Å; F1323-L1403 HydrophobicContact CZ-CG 3.87Å; V1331-L1403 HydrophobicContact CG1-CD1 3.85Å; Y1332-L1403 CarbonylContact O-C 3.02Å; Y1332-L1403 WeakPolarHBondContact O-CA 3.48Å; D1333-L1403 HydrophobicContact CB-CD1 4.45Å; L1403-G1416 WeakPolarHBondContact CB-O 3.49Å; L1403-G1416 PolarHBondContact N-O 2.94Å; L1403-G1416 PolarHBondContact O-N 2.68Å; L1403-I1418 HydrophobicContact CB-CD1 3.98Å; L1403-I1418 HydrophobicContact CB-CG1 4.15Å; L1403-I1418 HydrophobicContact CB-CG2 4.14Å; L1403-I1418 HydrophobicContact CD1-CD1 4.13Å; L1403-I1418 HydrophobicContact CD2-CD1 4.34Å; L1403-I1418 HydrophobicContact CD2-CG2 4.37Å; L1403-I1418 HydrophobicContact CG-CD1 4.37Å
1404	M	94.1	Very high	88.8	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.7	178.5	174.6	172	77.2	0	0	110.9	V1331 Y1332 F1371 V1406 L1413 L1414 L1415 F1464	V1331-M1404 CarbonylContact C-O 3.46Å; V1331-M1404 VanDerWaalsContact CA-O 3.31Å; V1331-M1404 WeakPolarHBondContact CA-O 3.44Å; Y1332-M1404 HydrophobicContact CD2-CE 3.29Å; Y1332-M1404 HydrophobicContact CE2-CE 3.71Å; Y1332-M1404 HydrophobicContact CG-CE 3.87Å; Y1332-M1404 PolarHBondContact N-O 2.87Å; Y1332-M1404 PolarHBondContact O-N 3.3Å; F1371-M1404 HydrophobicContact CD2-CE 3.97Å; F1371-M1404 HydrophobicContact CE2-CE 3.75Å; F1371-M1404 HydrophobicContact CZ-CE 4.23Å; M1404-V1406 HydrophobicContact CE-CG2 4.12Å; M1404-V1406 HydrophobicContact CG-CG2 4.45Å; M1404-L1413 HydrophobicContact SD-CB 4.45Å; M1404-L1413 HydrophobicContact SD-CD1 3.98Å; M1404-L1413 HydrophobicContact SD-CD2 3.96Å; M1404-L1413 HydrophobicContact SD-CG 4.34Å; M1404-L1414 CarbonylContact C-O 3.34Å; M1404-L1414 WeakPolarHBondContact CA-O 3.39Å; M1404-L1415 HydrophobicContact CB-CD2 3.61Å; M1404-L1415 HydrophobicContact CG-CD2 3.55Å; M1404-L1415 HydrophobicContact SD-CD2 3.98Å; M1404-F1464 HydrophobicContact CE-CE1 4.2Å; M1404-F1464 HydrophobicContact CE-CZ 4.41Å; M1404-F1464 HydrophobicContact SD-CE1 3.43Å; M1404-F1464 WeakPolarHBondContact SD-CE1 3.47Å; M1404-F1464 HydrophobicContact SD-CZ 3.67Å
1405	G	92.6	Very high	89.1	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.1	164.6	0	0	0	0	0	110.6	F1323 L1414	F1323-G1405 VanDerWaalsContact CE1-N 3.27Å; G1405-L1414 PolarHBondContact N-O 2.99Å; G1405-L1414 PolarHBondContact O-N 3.22Å
1406	V	91.2	Very high	89.4	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.03	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	110.4	177.1	-172.3	0	0	0	0	109.9	F909 R1329 Q1330 Y1332 F1371 M1404 Q1408 L1413	F909-V1406 HydrophobicContact CE1-CG1 4.03Å; R1329-V1406 PolarHBondContact N-O 2.95Å; Q1330-V1406 HydrophobicContact CB-CB 4.31Å; Q1330-V1406 HydrophobicContact CB-CG2 4.37Å; Q1330-V1406 PolarHBondContact O-N 3.41Å; Y1332-V1406 HydrophobicContact CD2-CG2 4.46Å; Y1332-V1406 HydrophobicContact CE2-CG2 4.17Å; F1371-V1406 HydrophobicContact CE1-CG1 3.96Å; F1371-V1406 HydrophobicContact CE1-CG2 3.87Å; F1371-V1406 HydrophobicContact CZ-CG2 3.85Å; M1404-V1406 HydrophobicContact CE-CG2 4.12Å; M1404-V1406 HydrophobicContact CG-CG2 4.45Å; V1406-Q1408 HydrophobicContact CG1-CB 4.38Å; V1406-L1413 HydrophobicContact CG1-CD2 4.3Å; V1406-L1413 HydrophobicContact CG2-CD2 4.17Å
1407	D	88.4	Confident	89.7	Confident	4 Å²	4	20.2 Å²	20.2	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	97.5	162	177.3	-16.9	0	0	0	107.7	G1409 N1410 S1411 V1412	D1407-G1409 VanDerWaalsContact C-N 3.33Å; D1407-G1409 PolarHBondContact OD1-N 3.45Å; D1407-N1410 PolarHBondContact OD1-N 2.94Å; D1407-N1410 PolarHBondContact OD1-ND2 2.92Å; D1407-N1410 PolarHBondContact OD2-ND2 3.23Å; D1407-S1411 WeakPolarHBondContact O-CA 3.27Å; D1407-S1411 PolarHBondContact O-N 2.88Å; D1407-S1411 VanDerWaalsContact O-N 3.08Å; D1407-V1412 HydrophobicContact CB-CB 4.26Å; D1407-V1412 PolarHBondContact N-O 3.34Å; D1407-V1412 PolarHBondContact O-N 3.38Å
1408	Q	79.5	Confident	89.9	Confident	123 Å²	123	21.7 Å²	21.7	58%	0.575	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-15.2	-177.8	-162	171	28.8	0	0	112.8	V1406	V1406-Q1408 HydrophobicContact CG1-CB 4.38Å
1409	G	79.5	Confident	90	Very high	61 Å²	61	24.1 Å²	24.1	63%	0.629	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-46.8	176.3	0	0	0	0	0	111.4	D1407	D1407-G1409 VanDerWaalsContact C-N 3.33Å; D1407-G1409 PolarHBondContact OD1-N 3.45Å
1410	N	82.3	Confident	90.4	Very high	118 Å²	118	23.1 Å²	23.1	63%	0.631	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.4	179.5	-60.8	-64.2	0	0	0	113.6	D1407 V1412	D1407-N1410 PolarHBondContact OD1-N 2.94Å; D1407-N1410 PolarHBondContact OD1-ND2 2.92Å; D1407-N1410 PolarHBondContact OD2-ND2 3.23Å; N1410-V1412 HydrophobicContact CB-CG2 3.83Å
1411	S	87.4	Confident	90.1	Very high	36 Å²	36	23.3 Å²	23.3	25%	0.252	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	50.9	-172.7	-59.2	0	0	0	0	112.7	F909 S910 D1407	F909-S1411 WeakPolarHBondContact CA-O 3.25Å; S910-S1411 PolarHBondContact N-O 2.88Å; D1407-S1411 WeakPolarHBondContact O-CA 3.27Å; D1407-S1411 PolarHBondContact O-N 2.88Å; D1407-S1411 VanDerWaalsContact O-N 3.08Å
1412	V	90	Very high	89.2	Confident	21 Å²	21	28.6 Å²	28.6	13%	0.127	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.3	179.1	-175	0	0	0	0	110.1	S910 D1407 N1410 L1414	S910-V1412 WeakPolarHBondContact O-CA 3.04Å; D1407-V1412 HydrophobicContact CB-CB 4.26Å; D1407-V1412 PolarHBondContact N-O 3.34Å; D1407-V1412 PolarHBondContact O-N 3.38Å; N1410-V1412 HydrophobicContact CB-CG2 3.83Å; V1412-L1414 HydrophobicContact CG1-CG 4.49Å
1413	L	92.7	Very high	88	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125	163.6	-53.9	-178.1	0	0	0	109	F909 S910 S912 F1371 L1373 M1404 V1406 L1415 F1464	F909-L1413 HydrophobicContact CB-CD1 4.3Å; F909-L1413 HydrophobicContact CB-CD2 4.44Å; F909-L1413 HydrophobicContact CB-CG 3.94Å; F909-L1413 HydrophobicContact CD1-CD2 3.61Å; F909-L1413 HydrophobicContact CD1-CG 4Å; F909-L1413 HydrophobicContact CE1-CD2 4.06Å; F909-L1413 HydrophobicContact CG-CD2 4.09Å; F909-L1413 HydrophobicContact CG-CG 4.14Å; S910-L1413 PolarHBondContact O-N 2.82Å; S912-L1413 PolarHBondContact N-O 3.31Å; S912-L1413 VanDerWaalsContact O-O 3.09Å; F1371-L1413 HydrophobicContact CB-CD1 4.07Å; F1371-L1413 HydrophobicContact CD1-CD2 3.82Å; F1371-L1413 HydrophobicContact CE1-CD2 4.24Å; F1371-L1413 HydrophobicContact CG-CD1 4.49Å; F1371-L1413 HydrophobicContact CG-CD2 4.41Å; L1373-L1413 HydrophobicContact CD2-CD1 3.93Å; M1404-L1413 HydrophobicContact SD-CB 4.45Å; M1404-L1413 HydrophobicContact SD-CD1 3.98Å; M1404-L1413 HydrophobicContact SD-CD2 3.96Å; M1404-L1413 HydrophobicContact SD-CG 4.34Å; V1406-L1413 HydrophobicContact CG1-CD2 4.3Å; V1406-L1413 HydrophobicContact CG2-CD2 4.17Å; L1413-L1415 HydrophobicContact CB-CD1 4.25Å; L1413-L1415 HydrophobicContact CB-CD2 4.13Å; L1413-L1415 HydrophobicContact CB-CG 4.04Å; L1413-F1464 HydrophobicContact CD1-CD1 3.91Å; L1413-F1464 HydrophobicContact CD1-CE1 3.96Å
1414	L	92.4	Very high	86.5	Confident	5 Å²	5	31.3 Å²	31.3	3%	0.026	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.2	176	-70.1	150.1	0	0	0	108.2	S912 F1323 R1326 V1328 M1404 G1405 V1412	S912-L1414 WeakPolarHBondContact O-CA 3.36Å; F1323-L1414 HydrophobicContact CD1-CB 4.1Å; F1323-L1414 HydrophobicContact CD1-CD1 4.44Å; F1323-L1414 HydrophobicContact CE1-CB 4.14Å; R1326-L1414 HydrophobicContact CB-CD1 3.6Å; R1326-L1414 HydrophobicContact CG-CD1 3.55Å; R1326-L1414 HydrophobicContact CG-CD2 3.86Å; R1326-L1414 HydrophobicContact CG-CG 4.36Å; V1328-L1414 HydrophobicContact CG2-CD1 3.54Å; M1404-L1414 CarbonylContact C-O 3.34Å; M1404-L1414 WeakPolarHBondContact CA-O 3.39Å; G1405-L1414 PolarHBondContact N-O 2.99Å; G1405-L1414 PolarHBondContact O-N 3.22Å; V1412-L1414 HydrophobicContact CG1-CG 4.49Å
1415	L	94.2	Very high	85.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.2	-165	-61.2	177.8	0	0	0	111.8	T911 S912 F913 A914 L1381 L1402 M1404 L1413	T911-L1415 HydrophobicContact CG2-CD1 3.9Å; S912-L1415 PolarHBondContact O-N 2.87Å; F913-L1415 WeakPolarHBondContact CA-O 3.29Å; F913-L1415 HydrophobicContact CD1-CB 4.13Å; F913-L1415 HydrophobicContact CE1-CB 4.23Å; F913-L1415 HydrophobicContact CE1-CD1 4.42Å; A914-L1415 PolarHBondContact N-O 3.43Å; L1381-L1415 HydrophobicContact CD1-CD1 3.6Å; L1381-L1415 HydrophobicContact CD2-CD1 4.19Å; L1381-L1415 HydrophobicContact CG-CD1 4.49Å; L1402-L1415 HydrophobicContact CD1-CB 4.36Å; L1402-L1415 HydrophobicContact CD2-CD2 4.21Å; M1404-L1415 HydrophobicContact CB-CD2 3.61Å; M1404-L1415 HydrophobicContact CG-CD2 3.55Å; M1404-L1415 HydrophobicContact SD-CD2 3.98Å; L1413-L1415 HydrophobicContact CB-CD1 4.25Å; L1413-L1415 HydrophobicContact CB-CD2 4.13Å; L1413-L1415 HydrophobicContact CB-CG 4.04Å
1416	G	93.7	Very high	82.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	135.7	179.6	0	0	0	0	0	114.1	S1291 L1403	S1291-G1416 CarbonylContact O-C 3.58Å; S1291-G1416 WeakPolarHBondContact O-CA 3.15Å; L1403-G1416 WeakPolarHBondContact CB-O 3.49Å; L1403-G1416 PolarHBondContact N-O 2.94Å; L1403-G1416 PolarHBondContact O-N 2.68Å
1417	I	95	Very high	81.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	128.2	176.2	-66	177.1	0	0	0	110.6	S1291 L1292 V1293 D1388 T1389 L1392 Y1400 S1401 L1402 Y1420 F1456	S1291-I1417 PolarHBondContact O-N 3.36Å; S1291-I1417 WeakPolarHBondContact OG-CD1 3.32Å; S1291-I1417 WeakPolarHBondContact OG-CG1 3.32Å; L1292-I1417 HydrophobicContact CD1-CB 4.24Å; L1292-I1417 HydrophobicContact CD1-CG2 4.07Å; V1293-I1417 WeakPolarHBondContact CG2-O 3.23Å; V1293-I1417 PolarHBondContact N-O 3.34Å; V1293-I1417 VanDerWaalsContact N-O 3.11Å; D1388-I1417 HydrophobicContact CB-CD1 3.89Å; T1389-I1417 HydrophobicContact CG2-CD1 4.25Å; L1392-I1417 HydrophobicContact CD1-CG2 4.01Å; Y1400-I1417 HydrophobicContact CD2-CG2 4.2Å; S1401-I1417 CarbonylContact O-C 3.52Å; S1401-I1417 WeakPolarHBondContact O-CA 3.24Å; L1402-I1417 HydrophobicContact CD1-CG1 3.8Å; I1417-Y1420 HydrophobicContact CG2-CD1 4.35Å; I1417-Y1420 WeakPolarHBondContact O-CE1 3.5Å; I1417-F1456 HydrophobicContact CD1-CE1 4.32Å; I1417-F1456 HydrophobicContact CD1-CZ 4.36Å; I1417-F1456 HydrophobicContact CG1-CZ 4.4Å
1418	I	92.4	Very high	79.5	Confident	31 Å²	31	47.6 Å²	47.6	16%	0.159	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	174.7	-177.1	65.6	165	0	0	0	111.8	V1293 Y1400 S1401 L1403 Y1420	V1293-I1418 HydrophobicContact CB-CG2 4.12Å; V1293-I1418 HydrophobicContact CG2-CG2 3.71Å; Y1400-I1418 WeakPolarHBondContact CA-O 3.4Å; Y1400-I1418 WeakPolarHBondContact CB-O 3.39Å; S1401-I1418 PolarHBondContact N-O 3.41Å; S1401-I1418 PolarHBondContact O-N 3.49Å; L1403-I1418 HydrophobicContact CB-CD1 3.98Å; L1403-I1418 HydrophobicContact CB-CG1 4.15Å; L1403-I1418 HydrophobicContact CB-CG2 4.14Å; L1403-I1418 HydrophobicContact CD1-CD1 4.13Å; L1403-I1418 HydrophobicContact CD2-CD1 4.34Å; L1403-I1418 HydrophobicContact CD2-CG2 4.37Å; L1403-I1418 HydrophobicContact CG-CD1 4.37Å; I1418-Y1420 PolarHBondContact O-N 2.88Å; I1418-Y1420 VanDerWaalsContact O-N 3.12Å
1419	D	88	Confident	78	Confident	52 Å²	52	47.3 Å²	47.3	28%	0.278	24%	0.241	S	C	.	.			trans	59.4	18.7	176.9	-89.4	2.5	0	0	0	115.6	K1255 K1335 L1421	K1255-D1419 IonicContact NZ-OD1 3.32Å; K1255-D1419 PolarHBondContact NZ-OD1 2.95Å; K1335-D1419 IonicContact NZ-OD2 3.04Å; D1419-L1421 PolarHBondContact O-N 3.02Å
1420	Y	90.7	Very high	76.6	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.008	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	26.1	-178	61.8	-96.1	0	0	0	114.8	F1268 Y1272 L1292 V1293 I1295 L1392 I1397 I1417 I1418	F1268-Y1420 HydrophobicContact CE2-CD2 4.39Å; F1268-Y1420 HydrophobicContact CZ-CD2 4.15Å; F1268-Y1420 WeakPolarHBondContact CZ-O 3.48Å; Y1272-Y1420 HydrophobicContact CD2-CE2 4.29Å; Y1272-Y1420 HydrophobicContact CE2-CE2 4.42Å; L1292-Y1420 HydrophobicContact CD1-CD1 3.48Å; L1292-Y1420 VanDerWaalsContact CD1-CD1 3.48Å; L1292-Y1420 HydrophobicContact CD1-CD2 4.1Å; L1292-Y1420 HydrophobicContact CD1-CE1 3.48Å; L1292-Y1420 VanDerWaalsContact CD1-CE1 3.48Å; L1292-Y1420 HydrophobicContact CD1-CE2 4.1Å; L1292-Y1420 HydrophobicContact CD1-CG 3.81Å; L1292-Y1420 HydrophobicContact CD2-CE1 4.45Å; L1292-Y1420 HydrophobicContact CD2-CE2 4.06Å; L1292-Y1420 HydrophobicContact CG-CD1 4.24Å; L1292-Y1420 HydrophobicContact CG-CE1 3.7Å; L1292-Y1420 HydrophobicContact CG-CE2 4.2Å; V1293-Y1420 PolarHBondContact O-OH 3.29Å; I1295-Y1420 HydrophobicContact CD1-CE2 4.08Å; L1392-Y1420 HydrophobicContact CD2-CD2 4.33Å; L1392-Y1420 HydrophobicContact CD2-CG 4.3Å; I1397-Y1420 WeakPolarHBondContact CG2-O 3.39Å; I1417-Y1420 HydrophobicContact CG2-CD1 4.35Å; I1417-Y1420 WeakPolarHBondContact O-CE1 3.5Å; I1418-Y1420 PolarHBondContact O-N 2.88Å; I1418-Y1420 VanDerWaalsContact O-N 3.12Å
1421	L	85.4	Confident	75.1	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-7.4	-171.4	-66.5	158.3	0	0	0	113.7	M1257 S1264 F1265 F1268 I1295 I1317 D1419	M1257-L1421 HydrophobicContact CE-CB 3.99Å; M1257-L1421 HydrophobicContact CE-CD1 3.54Å; M1257-L1421 HydrophobicContact CE-CG 4.36Å; M1257-L1421 HydrophobicContact SD-CD1 3.93Å; S1264-L1421 VanDerWaalsContact CB-O 3.22Å; S1264-L1421 WeakPolarHBondContact CB-O 3.29Å; S1264-L1421 PolarHBondContact OG-O 3.11Å; F1265-L1421 HydrophobicContact CB-CD2 3.83Å; F1265-L1421 HydrophobicContact CD2-CD2 3.6Å; F1265-L1421 HydrophobicContact CG-CD2 3.96Å; F1268-L1421 HydrophobicContact CZ-CD2 4.25Å; I1295-L1421 HydrophobicContact CD1-CD2 3.8Å; I1317-L1421 HydrophobicContact CD1-CD1 3.46Å; I1317-L1421 VanDerWaalsContact CD1-CD1 3.46Å; D1419-L1421 PolarHBondContact O-N 3.02Å
1422	R	74.7	Confident	73.2	Confident	110 Å²	110	47 Å²	47	42%	0.415	22%	0.22	S	C	.	.			trans	-108.6	105.1	-174.1	-167.1	164.1	176	-177	-1.4	112	E1261 M1398 D1427	E1261-R1422 HydrophobicContact CG-CB 4.44Å; M1398-R1422 PolarHBondContact N-O 3.36Å; R1422-D1427 IonicContact NH2-OD2 2.89Å
1423	A	69.7	Low	71	Confident	26 Å²	26	54.9 Å²	54.9	22%	0.215	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-65.5	164	173.9	0	0	0	0	0	113.2	S1264 T1425	S1264-A1423 WeakPolarHBondContact OG-CB 3.49Å; S1264-A1423 PolarHBondContact OG-N 3.45Å; S1264-A1423 VanDerWaalsContact OG-N 3.12Å; A1423-T1425 PolarHBondContact O-N 2.97Å
1424	Y	62.5	Low	69	Low	58 Å²	58	59.3 Å²	59.3	23%	0.227	28%	0.275	C	S	.	.			trans	-86.4	89.8	177.1	-178.7	-126.1	0	0	0	112.2	H1396 M1398 K1428 R1429 V1446 P1449	H1396-Y1424 WeakPolarHBondContact O-CB 3.47Å; H1396-Y1424 PolarHBondContact O-N 3.35Å; M1398-Y1424 HydrophobicContact SD-CD2 3.28Å; M1398-Y1424 WeakPolarHBondContact SD-CD2 3.25Å; M1398-Y1424 HydrophobicContact SD-CE2 4.01Å; M1398-Y1424 HydrophobicContact SD-CG 3.84Å; Y1424-K1428 HydrophobicContact CD2-CB 4.21Å; Y1424-K1428 HydrophobicContact CE2-CB 4.29Å; Y1424-R1429 HydrophobicContact CE1-CG 4.38Å; Y1424-R1429 HydrophobicContact CE2-CG 4.22Å; Y1424-R1429 VanDerWaalsContact OH-CG 3.25Å; Y1424-R1429 WeakPolarHBondContact OH-CG 3.37Å; Y1424-V1446 HydrophobicContact CE2-CG1 4.36Å; Y1424-P1449 HydrophobicContact CD1-CG 4.18Å; Y1424-P1449 HydrophobicContact CG-CG 4.19Å
1425	T	64.3	Low	66.8	Low	75 Å²	75	64.4 Å²	64.4	46%	0.46	30%	0.297	S	S	.	.			trans	-90.8	167.9	176.9	39.3	0	0	0	0	113	A1423 D1427 K1428	A1423-T1425 PolarHBondContact O-N 2.97Å; T1425-D1427 VanDerWaalsContact C-N 3.33Å; T1425-D1427 VanDerWaalsContact C-OD1 3.26Å; T1425-D1427 WeakPolarHBondContact CB-OD1 3.37Å; T1425-D1427 PolarHBondContact O-N 3.2Å; T1425-D1427 PolarHBondContact OG1-OD1 2.84Å; T1425-K1428 PolarHBondContact O-N 3.1Å
1426	W	48.2	Very low	64.5	Low	196 Å²	196	67.7 Å²	67.7	74%	0.742	32%	0.32	S	S	*	.	H	α-helix	trans	-68.1	-25.8	-173.6	-80.3	91.3	0	0	0	114.2	K1428 R1429 I1430	W1426-K1428 VanDerWaalsContact C-N 3.29Å; W1426-K1428 PolarHBondContact O-N 3.14Å; W1426-R1429 VanDerWaalsContact CZ3-NH1 3.32Å; W1426-R1429 WeakPolarHBondContact O-CB 3.17Å; W1426-R1429 PolarHBondContact O-N 3.27Å; W1426-R1429 VanDerWaalsContact O-N 3.14Å; W1426-I1430 PolarHBondContact O-N 3.17Å
1427	D	52.2	Low	62.2	Low	77 Å²	77	72.9 Å²	72.9	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-52.1	-46.6	170.6	65.7	-43.4	0	0	0	111.6	R1422 T1425 R1429 I1430 E1431	R1422-D1427 IonicContact NH2-OD2 2.89Å; T1425-D1427 VanDerWaalsContact C-N 3.33Å; T1425-D1427 VanDerWaalsContact C-OD1 3.26Å; T1425-D1427 WeakPolarHBondContact CB-OD1 3.37Å; T1425-D1427 PolarHBondContact O-N 3.2Å; T1425-D1427 PolarHBondContact OG1-OD1 2.84Å; D1427-R1429 VanDerWaalsContact C-N 3.3Å; D1427-R1429 PolarHBondContact O-N 2.93Å; D1427-I1430 WeakPolarHBondContact O-CB 3.4Å; D1427-I1430 PolarHBondContact O-N 2.98Å; D1427-I1430 VanDerWaalsContact O-N 3.1Å; D1427-E1431 PolarHBondContact O-N 3.17Å
1428	K	54.3	Low	59.3	Low	4 Å²	4	76.5 Å²	76.5	2%	0.017	38%	0.376	C	S	.	.	H	α-helix	trans	-69.4	-23.2	-179.6	-85.8	-170.8	175.1	-175.9	0	113.8	D1399 Y1424 T1425 W1426 S1432 V1446	D1399-K1428 IonicContact OD2-NZ 3.1Å; D1399-K1428 PolarHBondContact OD2-NZ 2.93Å; Y1424-K1428 HydrophobicContact CD2-CB 4.21Å; Y1424-K1428 HydrophobicContact CE2-CB 4.29Å; T1425-K1428 PolarHBondContact O-N 3.1Å; W1426-K1428 VanDerWaalsContact C-N 3.29Å; W1426-K1428 PolarHBondContact O-N 3.14Å; K1428-S1432 VanDerWaalsContact O-CB 3.27Å; K1428-S1432 WeakPolarHBondContact O-CB 3.48Å; K1428-S1432 PolarHBondContact O-N 3.39Å; K1428-V1446 HydrophobicContact CB-CG1 3.88Å; K1428-V1446 HydrophobicContact CD-CG1 4.28Å; K1428-V1446 HydrophobicContact CG-CG1 4.31Å; K1428-V1446 WeakPolarHBondContact O-CG1 3.44Å
1429	R	49.1	Very low	56.5	Low	116 Å²	116	80.8 Å²	80.8	44%	0.438	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-43.8	169.3	-80.7	178.1	156.2	-174.9	-6	110.9	Y1424 W1426 D1427 W1433	Y1424-R1429 HydrophobicContact CE1-CG 4.38Å; Y1424-R1429 HydrophobicContact CE2-CG 4.22Å; Y1424-R1429 VanDerWaalsContact OH-CG 3.25Å; Y1424-R1429 WeakPolarHBondContact OH-CG 3.37Å; W1426-R1429 VanDerWaalsContact CZ3-NH1 3.32Å; W1426-R1429 WeakPolarHBondContact O-CB 3.17Å; W1426-R1429 PolarHBondContact O-N 3.27Å; W1426-R1429 VanDerWaalsContact O-N 3.14Å; D1427-R1429 VanDerWaalsContact C-N 3.3Å; D1427-R1429 PolarHBondContact O-N 2.93Å; R1429-W1433 WeakPolarHBondContact O-CB 3.43Å; R1429-W1433 PolarHBondContact O-N 3.36Å
1430	I	49.1	Very low	54.1	Low	116 Å²	116	83.3 Å²	83.3	60%	0.595	43%	0.426	S	S	*	.	H	α-helix	trans	-67.7	-45.4	178.3	-56.9	172.8	0	0	0	109.9	W1426 D1427 S1432 W1433 V1434	W1426-I1430 PolarHBondContact O-N 3.17Å; D1427-I1430 WeakPolarHBondContact O-CB 3.4Å; D1427-I1430 PolarHBondContact O-N 2.98Å; D1427-I1430 VanDerWaalsContact O-N 3.1Å; I1430-S1432 VanDerWaalsContact C-N 3.33Å; I1430-S1432 PolarHBondContact O-N 3.42Å; I1430-W1433 PolarHBondContact O-N 2.96Å; I1430-V1434 HydrophobicContact CG2-CG2 4.47Å; I1430-V1434 WeakPolarHBondContact O-CG2 3.25Å; I1430-V1434 PolarHBondContact O-N 2.93Å
1431	E	51.9	Low	51.9	Low	71 Å²	71	87.6 Å²	87.6	33%	0.332	47%	0.471	S	S	.	.	H	α-helix	trans	-57.6	-43.6	176.5	-162.9	-161.7	172.1	0	0	112.3	D1427 K1435	D1427-E1431 PolarHBondContact O-N 3.17Å; E1431-K1435 HydrophobicContact CG-CD 4.21Å; E1431-K1435 WeakPolarHBondContact O-CB 3.29Å; E1431-K1435 VanDerWaalsContact O-CG 3.31Å; E1431-K1435 WeakPolarHBondContact O-CG 3.16Å; E1431-K1435 PolarHBondContact O-N 3.15Å; E1431-K1435 VanDerWaalsContact O-N 3.14Å; E1431-K1435 IonicContact OE1-NZ 3.49Å; E1431-K1435 PolarHBondContact OE1-NZ 3.12Å
1432	S	46.8	Very low	50	Low	21 Å²	21	92.4 Å²	92.4	15%	0.147	49%	0.493	C	S	.	.	H	α-helix	trans	-66.5	-43	176.2	-173	0	0	0	0	112.1	K1428 I1430 K1435 S1436 V1446	K1428-S1432 VanDerWaalsContact O-CB 3.27Å; K1428-S1432 WeakPolarHBondContact O-CB 3.48Å; K1428-S1432 PolarHBondContact O-N 3.39Å; I1430-S1432 VanDerWaalsContact C-N 3.33Å; I1430-S1432 PolarHBondContact O-N 3.42Å; S1432-K1435 PolarHBondContact O-N 3.46Å; S1432-S1436 WeakPolarHBondContact O-CB 3.33Å; S1432-S1436 PolarHBondContact O-N 3.07Å; S1432-V1446 WeakPolarHBondContact CB-O 3.42Å; S1432-V1446 PolarHBondContact OG-O 2.97Å
1433	W	43	Very low	48.7	Very low	188 Å²	188	93.3 Å²	93.3	71%	0.712	51%	0.505	S	S	*	.	H	α-helix	trans	-60.9	-50.8	179.5	-162.1	72.2	0	0	0	111.3	R1429 I1430 K1435 S1436	R1429-W1433 WeakPolarHBondContact O-CB 3.43Å; R1429-W1433 PolarHBondContact O-N 3.36Å; I1430-W1433 PolarHBondContact O-N 2.96Å; W1433-K1435 VanDerWaalsContact C-N 3.31Å; W1433-K1435 PolarHBondContact O-N 3.28Å; W1433-S1436 PolarHBondContact O-N 3.12Å; W1433-S1436 PolarHBondContact O-OG 2.88Å
1434	V	50.6	Low	48	Very low	93 Å²	93	93.3 Å²	93.3	56%	0.564	50%	0.503	S	S	*	.	H	α-helix	trans	-59.3	-40.3	177.3	174	0	0	0	0	111.7	I1430 S1436	I1430-V1434 HydrophobicContact CG2-CG2 4.47Å; I1430-V1434 WeakPolarHBondContact O-CG2 3.25Å; I1430-V1434 PolarHBondContact O-N 2.93Å; V1434-S1436 VanDerWaalsContact C-N 3.31Å; V1434-S1436 PolarHBondContact O-N 2.76Å
1435	K	48	Very low	47.7	Very low	111 Å²	111	93 Å²	93	48%	0.483	51%	0.507	S	S	.	.	H	α-helix	trans	-76.6	-13	178.3	-70.1	175.8	-179.3	179.7	0	114.3	E1431 S1432 W1433	E1431-K1435 HydrophobicContact CG-CD 4.21Å; E1431-K1435 WeakPolarHBondContact O-CB 3.29Å; E1431-K1435 VanDerWaalsContact O-CG 3.31Å; E1431-K1435 WeakPolarHBondContact O-CG 3.16Å; E1431-K1435 PolarHBondContact O-N 3.15Å; E1431-K1435 VanDerWaalsContact O-N 3.14Å; E1431-K1435 IonicContact OE1-NZ 3.49Å; E1431-K1435 PolarHBondContact OE1-NZ 3.12Å; S1432-K1435 PolarHBondContact O-N 3.46Å; W1433-K1435 VanDerWaalsContact C-N 3.31Å; W1433-K1435 PolarHBondContact O-N 3.28Å
1436	S	45	Very low	47.5	Very low	69 Å²	69	90 Å²	90	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-84	-23.7	-179.7	75.5	0	0	0	0	114.3	S1432 W1433 V1434 S1438	S1432-S1436 WeakPolarHBondContact O-CB 3.33Å; S1432-S1436 PolarHBondContact O-N 3.07Å; W1433-S1436 PolarHBondContact O-N 3.12Å; W1433-S1436 PolarHBondContact O-OG 2.88Å; V1434-S1436 VanDerWaalsContact C-N 3.31Å; V1434-S1436 PolarHBondContact O-N 2.76Å; S1436-S1438 VanDerWaalsContact C-N 3.31Å; S1436-S1438 PolarHBondContact O-N 3.01Å
1437	V	44.5	Very low	48.5	Very low	109 Å²	109	81.5 Å²	81.5	66%	0.661	46%	0.458	S	S	*	.	S	Bend	trans	-73.8	-20.2	-175.8	-179.5	0	0	0	0	112.9
1438	S	34.6	Very low	49.8	Very low	76 Å²	76	80 Å²	80	53%	0.531	45%	0.454	S	S	.	.	S	Bend	trans	-113.2	102.9	-173.3	-67.9	0	0	0	0	114.3	S1436	S1436-S1438 VanDerWaalsContact C-N 3.31Å; S1436-S1438 PolarHBondContact O-N 3.01Å
1439	V	34.4	Very low	51.2	Low	122 Å²	122	80.1 Å²	80.1	74%	0.739	46%	0.455	S	S	*	.	S	Bend	trans	78.6	117.8	154.2	-173.9	0	0	0	0	118.6
1440	S	36.3	Very low	53	Low	105 Å²	105	78.5 Å²	78.5	73%	0.734	45%	0.452	S	S	*	.	S	Bend	trans	47.5	84.5	149.5	-56.7	0	0	0	0	120.7	Q1442	S1440-Q1442 VanDerWaalsContact C-N 3.27Å; S1440-Q1442 PolarHBondContact O-N 3.01Å
1441	G	45.7	Very low	54.6	Low	92 Å²	92	76.8 Å²	76.8	95%	0.948	44%	0.444	S	S	*	.	S	Bend	trans	75.3	-16.9	132.6	0	0	0	0	0	119.5
1442	Q	45.2	Very low	56.4	Low	106 Å²	106	73.4 Å²	73.4	50%	0.495	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-89.4	133.5	170.8	-67.7	-172.5	-11.1	0	0	110.5	S1440	S1440-Q1442 VanDerWaalsContact C-N 3.27Å; S1440-Q1442 PolarHBondContact O-N 3.01Å
1443	L	46.9	Very low	58.6	Low	128 Å²	128	74.8 Å²	74.8	67%	0.67	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-58.9	140	174.6	-75.8	166.2	0	0	0	110.7
1444	P	55	Low	60.8	Low	27 Å²	27	69.4 Å²	69.4	18%	0.175	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-64.1	153.3	174.9	27.9	-34	0	0	0	110.8	V1446 V1447	P1444-V1446 VanDerWaalsContact C-N 3.26Å; P1444-V1446 PolarHBondContact O-N 3.17Å; P1444-V1447 HydrophobicContact CG-CG1 4.11Å
1445	T	56	Low	62.6	Low	51 Å²	51	66.3 Å²	66.3	31%	0.313	39%	0.393	S	S	.	.	S	Bend	trans	-58.1	-43	177.3	-44	0	0	0	0	111.1	R1455	T1445-R1455 PolarHBondContact O-NH1 3.26Å
1446	V	61.6	Low	64.8	Low	12 Å²	12	61 Å²	61	7%	0.073	37%	0.37	C	S	.	.			trans	-88.8	105.5	179.8	-178.5	0	0	0	0	110.2	M1398 Y1424 K1428 S1432 P1444	M1398-V1446 HydrophobicContact CE-CB 4.08Å; M1398-V1446 HydrophobicContact CE-CG1 3.7Å; M1398-V1446 HydrophobicContact CE-CG2 4.39Å; M1398-V1446 HydrophobicContact SD-CG1 4.44Å; Y1424-V1446 HydrophobicContact CE2-CG1 4.36Å; K1428-V1446 HydrophobicContact CB-CG1 3.88Å; K1428-V1446 HydrophobicContact CD-CG1 4.28Å; K1428-V1446 HydrophobicContact CG-CG1 4.31Å; K1428-V1446 WeakPolarHBondContact O-CG1 3.44Å; S1432-V1446 WeakPolarHBondContact CB-O 3.42Å; S1432-V1446 PolarHBondContact OG-O 2.97Å; P1444-V1446 VanDerWaalsContact C-N 3.26Å; P1444-V1446 PolarHBondContact O-N 3.17Å
1447	V	68	Low	67	Low	17 Å²	17	59.9 Å²	59.9	10%	0.103	36%	0.361	C	S	.	.			trans	-128.7	170.9	171.5	-69.2	0	0	0	0	109.1	M1398 P1444 L1451 Y1452	M1398-V1447 WeakPolarHBondContact CE-O 3.39Å; P1444-V1447 HydrophobicContact CG-CG1 4.11Å; V1447-L1451 HydrophobicContact CB-CB 4.04Å; V1447-L1451 HydrophobicContact CG2-CB 3.88Å; V1447-Y1452 HydrophobicContact CG2-CD2 4.49Å
1448	S	79.6	Confident	69.1	Low	45 Å²	45	60.5 Å²	60.5	32%	0.315	36%	0.356	S	S	.	.			trans	-57.2	147.5	175.6	58.1	0	0	0	0	111.7	E1450 L1451 Y1452	S1448-E1450 PolarHBondContact O-N 3.41Å; S1448-L1451 WeakPolarHBondContact O-CA 3.29Å; S1448-L1451 PolarHBondContact O-N 3.1Å; S1448-L1451 WeakPolarHBondContact OG-CD1 3.36Å; S1448-L1451 WeakPolarHBondContact OG-CG 3.48Å; S1448-Y1452 PolarHBondContact O-N 3.4Å
1449	P	84	Confident	71.7	Confident	7 Å²	7	57.7 Å²	57.7	5%	0.045	34%	0.336	C	S	.	.	H	α-helix	trans	-50.5	-37.7	-175	-32.4	36.4	0	0	0	115.1	H1396 Y1424 Y1452 R1453	H1396-P1449 HydrophobicContact CB-CG 4.25Å; Y1424-P1449 HydrophobicContact CD1-CG 4.18Å; Y1424-P1449 HydrophobicContact CG-CG 4.19Å; P1449-Y1452 WeakPolarHBondContact O-CB 3.49Å; P1449-Y1452 PolarHBondContact O-N 2.97Å; P1449-R1453 PolarHBondContact O-N 3.1Å
1450	E	86	Confident	74.5	Confident	82 Å²	82	51.9 Å²	51.9	38%	0.383	30%	0.301	S	S	.	.	H	α-helix	trans	-68.1	-39.6	177.1	-173.1	67	179.2	0	0	113.1	S1393 S1448 R1453 L1454	S1393-E1450 WeakPolarHBondContact OG-CA 3.39Å; S1393-E1450 PolarHBondContact OG-N 2.97Å; S1393-E1450 PolarHBondContact OG-OE2 3.27Å; S1448-E1450 PolarHBondContact O-N 3.41Å; E1450-R1453 PolarHBondContact O-N 3.49Å; E1450-R1453 IonicContact OE1-CZ 3.55Å; E1450-R1453 VanDerWaalsContact OE1-CZ 3.27Å; E1450-R1453 IonicContact OE1-NH1 2.68Å; E1450-R1453 PolarHBondContact OE1-NH1 3.43Å; E1450-R1453 IonicContact OE1-NH2 3.14Å; E1450-R1453 PolarHBondContact OE1-NH2 2.86Å; E1450-R1453 IonicContact OE2-CZ 2.74Å; E1450-R1453 VanDerWaalsContact OE2-CZ 3.23Å; E1450-R1453 IonicContact OE2-NH1 2.81Å; E1450-R1453 PolarHBondContact OE2-NH1 3.02Å; E1450-R1453 IonicContact OE2-NH2 3.94Å; E1450-R1453 PolarHBondContact OE2-NH2 2.88Å; E1450-L1454 WeakPolarHBondContact O-CG 3.45Å; E1450-L1454 PolarHBondContact O-N 3.24Å
1451	L	84.4	Confident	76.9	Confident	81 Å²	81	50.2 Å²	50.2	42%	0.424	28%	0.284	S	S	.	.	H	α-helix	trans	-71.2	-32.7	172.9	-69	177.3	0	0	0	111.5	V1447 S1448 L1454 R1455	V1447-L1451 HydrophobicContact CB-CB 4.04Å; V1447-L1451 HydrophobicContact CG2-CB 3.88Å; S1448-L1451 WeakPolarHBondContact O-CA 3.29Å; S1448-L1451 PolarHBondContact O-N 3.1Å; S1448-L1451 WeakPolarHBondContact OG-CD1 3.36Å; S1448-L1451 WeakPolarHBondContact OG-CG 3.48Å; L1451-L1454 PolarHBondContact O-N 2.94Å; L1451-R1455 VanDerWaalsContact O-CB 3.3Å; L1451-R1455 WeakPolarHBondContact O-CB 3.48Å; L1451-R1455 PolarHBondContact O-N 3.02Å
1452	Y	88.5	Confident	78.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-47.2	172.6	-167.1	-76.5	0	0	0	110	K1335 M1398 D1399 Y1400 V1447 S1448 P1449 L1454 R1455 F1456	K1335-Y1452 WeakPolarHBondContact CB-OH 3.45Å; K1335-Y1452 WeakPolarHBondContact CG-OH 3.29Å; M1398-Y1452 HydrophobicContact CB-CD2 4.2Å; M1398-Y1452 HydrophobicContact CB-CG 4.14Å; M1398-Y1452 HydrophobicContact CE-CD2 4.16Å; D1399-Y1452 VanDerWaalsContact CA-CE2 3.49Å; D1399-Y1452 VanDerWaalsContact CA-CZ 3.41Å; D1399-Y1452 VanDerWaalsContact CA-OH 3.29Å; D1399-Y1452 WeakPolarHBondContact CA-OH 3.48Å; D1399-Y1452 HydrophobicContact CB-CE2 4.44Å; D1399-Y1452 VanDerWaalsContact N-CE2 3.31Å; D1399-Y1452 WeakPolarHBondContact OD1-CE2 3.32Å; Y1400-Y1452 HydrophobicContact CD1-CD1 4.25Å; Y1400-Y1452 HydrophobicContact CD1-CE1 4.02Å; Y1400-Y1452 AromaticContact CD2-CE1 3.98Å; Y1400-Y1452 HydrophobicContact CD2-CE1 3.98Å; Y1400-Y1452 AromaticContact CE1-CD1 3.68Å; Y1400-Y1452 HydrophobicContact CE1-CD1 3.68Å; Y1400-Y1452 AromaticContact CE1-CE1 3.87Å; Y1400-Y1452 HydrophobicContact CE1-CE1 3.87Å; Y1400-Y1452 HydrophobicContact CE2-CD1 4.09Å; Y1400-Y1452 AromaticContact CE2-CE1 3.81Å; Y1400-Y1452 HydrophobicContact CE2-CE1 3.81Å; Y1400-Y1452 HydrophobicContact CG-CE1 4.09Å; Y1400-Y1452 AromaticContact CZ-CD1 3.6Å; Y1400-Y1452 AromaticContact CZ-CE1 3.77Å; Y1400-Y1452 PolarHBondContact O-OH 2.87Å; V1447-Y1452 HydrophobicContact CG2-CD2 4.49Å; S1448-Y1452 PolarHBondContact O-N 3.4Å; P1449-Y1452 WeakPolarHBondContact O-CB 3.49Å; P1449-Y1452 PolarHBondContact O-N 2.97Å; Y1452-L1454 PolarHBondContact O-N 3.06Å; Y1452-R1455 VanDerWaalsContact CZ-NH2 3.34Å; Y1452-R1455 PolarHBondContact O-N 2.91Å; Y1452-F1456 HydrophobicContact CD1-CB 4.49Å; Y1452-F1456 HydrophobicContact CE1-CB 4.46Å; Y1452-F1456 HydrophobicContact CE1-CD2 4.04Å; Y1452-F1456 WeakPolarHBondContact O-CB 3.33Å; Y1452-F1456 PolarHBondContact O-N 3.09Å
1453	R	92.7	Very high	81.1	Confident	49 Å²	49	42.9 Å²	42.9	19%	0.185	23%	0.226	C	C	.	.	H	α-helix	trans	-55.6	-52.3	174.4	176.1	174	105.1	-127.5	-16.3	111.7	T1389 Y1400 P1449 E1450 R1455 F1456 V1457	T1389-R1453 VanDerWaalsContact C-CD 3.44Å; T1389-R1453 WeakPolarHBondContact O-CD 3.33Å; T1389-R1453 WeakPolarHBondContact OG1-CD 3.5Å; T1389-R1453 WeakPolarHBondContact OG1-CG 3.49Å; Y1400-R1453 WeakPolarHBondContact OH-CA 3.18Å; P1449-R1453 PolarHBondContact O-N 3.1Å; E1450-R1453 PolarHBondContact O-N 3.49Å; E1450-R1453 IonicContact OE1-CZ 3.55Å; E1450-R1453 VanDerWaalsContact OE1-CZ 3.27Å; E1450-R1453 IonicContact OE1-NH1 2.68Å; E1450-R1453 PolarHBondContact OE1-NH1 3.43Å; E1450-R1453 IonicContact OE1-NH2 3.14Å; E1450-R1453 PolarHBondContact OE1-NH2 2.86Å; E1450-R1453 IonicContact OE2-CZ 2.74Å; E1450-R1453 VanDerWaalsContact OE2-CZ 3.23Å; E1450-R1453 IonicContact OE2-NH1 2.81Å; E1450-R1453 PolarHBondContact OE2-NH1 3.02Å; E1450-R1453 IonicContact OE2-NH2 3.94Å; E1450-R1453 PolarHBondContact OE2-NH2 2.88Å; R1453-R1455 PolarHBondContact O-N 3.2Å; R1453-F1456 PolarHBondContact O-N 2.89Å; R1453-V1457 HydrophobicContact CG-CG2 4.16Å; R1453-V1457 VanDerWaalsContact O-CG2 3.3Å; R1453-V1457 WeakPolarHBondContact O-CG2 3.3Å; R1453-V1457 PolarHBondContact O-N 3.43Å
1454	L	89.6	Confident	83.2	Confident	75 Å²	75	36.8 Å²	36.8	39%	0.393	19%	0.194	S	C	.	.	H	α-helix	trans	-60.3	-48.6	-177.4	-69.9	169.6	0	0	0	111.2	E1450 L1451 Y1452 F1456 V1457 E1458	E1450-L1454 WeakPolarHBondContact O-CG 3.45Å; E1450-L1454 PolarHBondContact O-N 3.24Å; L1451-L1454 PolarHBondContact O-N 2.94Å; Y1452-L1454 PolarHBondContact O-N 3.06Å; L1454-F1456 VanDerWaalsContact C-N 3.3Å; L1454-F1456 PolarHBondContact O-N 3.26Å; L1454-V1457 PolarHBondContact O-N 3.41Å; L1454-E1458 WeakPolarHBondContact O-CB 3.28Å; L1454-E1458 WeakPolarHBondContact O-CG 3.22Å; L1454-E1458 PolarHBondContact O-N 3.09Å
1455	R	89.5	Confident	84.9	Confident	28 Å²	28	35.8 Å²	35.8	11%	0.106	19%	0.187	C	C	.	.	H	α-helix	trans	-57.9	-41.2	175.9	-168.3	-164.1	78	-145.2	-3.2	112.5	K1335 G1336 T1445 L1451 Y1452 R1453 S1459	K1335-R1455 PolarHBondContact O-NH2 3.44Å; G1336-R1455 VanDerWaalsContact O-CD 3.29Å; G1336-R1455 WeakPolarHBondContact O-CD 3.38Å; G1336-R1455 WeakPolarHBondContact O-CG 3.16Å; G1336-R1455 PolarHBondContact O-NE 3.34Å; T1445-R1455 PolarHBondContact O-NH1 3.26Å; L1451-R1455 VanDerWaalsContact O-CB 3.3Å; L1451-R1455 WeakPolarHBondContact O-CB 3.48Å; L1451-R1455 PolarHBondContact O-N 3.02Å; Y1452-R1455 VanDerWaalsContact CZ-NH2 3.34Å; Y1452-R1455 PolarHBondContact O-N 2.91Å; R1453-R1455 PolarHBondContact O-N 3.2Å; R1455-S1459 WeakPolarHBondContact O-CB 3.45Å; R1455-S1459 PolarHBondContact O-N 3.18Å; R1455-S1459 VanDerWaalsContact O-N 3.14Å; R1455-S1459 PolarHBondContact O-OG 3.37Å
1456	F	93.1	Very high	86.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-53.1	178.5	-174.5	-86.7	0	0	0	110.9	I1385 T1389 Y1400 L1402 I1417 Y1452 R1453 L1454 S1459 M1460	I1385-F1456 HydrophobicContact CG2-CD1 4.24Å; I1385-F1456 HydrophobicContact CG2-CE1 4.14Å; T1389-F1456 HydrophobicContact CG2-CD1 3.93Å; T1389-F1456 HydrophobicContact CG2-CE1 3.95Å; Y1400-F1456 AromaticContact CD2-CD2 3.99Å; Y1400-F1456 HydrophobicContact CD2-CD2 3.99Å; Y1400-F1456 HydrophobicContact CD2-CE1 4.46Å; Y1400-F1456 AromaticContact CD2-CE2 3.62Å; Y1400-F1456 HydrophobicContact CD2-CE2 3.62Å; Y1400-F1456 AromaticContact CD2-CZ 3.86Å; Y1400-F1456 HydrophobicContact CD2-CZ 3.86Å; Y1400-F1456 HydrophobicContact CE2-CB 4.43Å; Y1400-F1456 AromaticContact CE2-CD1 3.97Å; Y1400-F1456 HydrophobicContact CE2-CD1 3.97Å; Y1400-F1456 AromaticContact CE2-CD2 3.67Å; Y1400-F1456 HydrophobicContact CE2-CD2 3.67Å; Y1400-F1456 AromaticContact CE2-CE1 3.99Å; Y1400-F1456 HydrophobicContact CE2-CE1 3.99Å; Y1400-F1456 AromaticContact CE2-CE2 3.69Å; Y1400-F1456 HydrophobicContact CE2-CE2 3.69Å; Y1400-F1456 AromaticContact CE2-CG 3.79Å; Y1400-F1456 HydrophobicContact CE2-CG 3.79Å; Y1400-F1456 AromaticContact CE2-CZ 3.84Å; Y1400-F1456 HydrophobicContact CE2-CZ 3.84Å; L1402-F1456 HydrophobicContact CB-CE2 4.47Å; L1402-F1456 HydrophobicContact CB-CZ 3.85Å; I1417-F1456 HydrophobicContact CD1-CE1 4.32Å; I1417-F1456 HydrophobicContact CD1-CZ 4.36Å; I1417-F1456 HydrophobicContact CG1-CZ 4.4Å; Y1452-F1456 HydrophobicContact CD1-CB 4.49Å; Y1452-F1456 HydrophobicContact CE1-CB 4.46Å; Y1452-F1456 HydrophobicContact CE1-CD2 4.04Å; Y1452-F1456 WeakPolarHBondContact O-CB 3.33Å; Y1452-F1456 PolarHBondContact O-N 3.09Å; R1453-F1456 PolarHBondContact O-N 2.89Å; L1454-F1456 VanDerWaalsContact C-N 3.3Å; L1454-F1456 PolarHBondContact O-N 3.26Å; F1456-S1459 WeakPolarHBondContact O-CB 3.46Å; F1456-S1459 PolarHBondContact O-N 2.86Å; F1456-S1459 VanDerWaalsContact O-N 3.16Å; F1456-M1460 HydrophobicContact CD1-CE 4.17Å; F1456-M1460 HydrophobicContact CD1-CG 4.23Å; F1456-M1460 HydrophobicContact CD2-CE 3.83Å; F1456-M1460 HydrophobicContact CE1-CE 3.93Å; F1456-M1460 HydrophobicContact CE1-CG 4.18Å; F1456-M1460 HydrophobicContact CE2-CE 3.57Å; F1456-M1460 HydrophobicContact CG-CE 4.14Å; F1456-M1460 HydrophobicContact CZ-CE 3.64Å; F1456-M1460 WeakPolarHBondContact O-CG 3.29Å; F1456-M1460 PolarHBondContact O-N 3.3Å
1457	V	92.1	Very high	87.6	Confident	46 Å²	46	33.6 Å²	33.6	28%	0.279	18%	0.176	S	C	.	.	H	α-helix	trans	-57.6	-52.7	178.6	174	0	0	0	0	111.3	I1385 R1453 L1454 S1459 M1460 D1461	I1385-V1457 HydrophobicContact CG2-CG2 3.9Å; R1453-V1457 HydrophobicContact CG-CG2 4.16Å; R1453-V1457 VanDerWaalsContact O-CG2 3.3Å; R1453-V1457 WeakPolarHBondContact O-CG2 3.3Å; R1453-V1457 PolarHBondContact O-N 3.43Å; L1454-V1457 PolarHBondContact O-N 3.41Å; V1457-S1459 PolarHBondContact O-N 2.89Å; V1457-S1459 VanDerWaalsContact O-N 3.16Å; V1457-M1460 PolarHBondContact O-N 2.98Å; V1457-D1461 PolarHBondContact O-N 3.14Å
1458	E	88	Confident	88	Confident	122 Å²	122	32.9 Å²	32.9	57%	0.57	17%	0.171	S	C	*	.	H	α-helix	trans	-57.9	-31.1	178.6	-72.3	175.7	-176.1	0	0	112.6	L1454 I1462	L1454-E1458 WeakPolarHBondContact O-CB 3.28Å; L1454-E1458 WeakPolarHBondContact O-CG 3.22Å; L1454-E1458 PolarHBondContact O-N 3.09Å; E1458-I1462 WeakPolarHBondContact O-CD1 3.48Å; E1458-I1462 WeakPolarHBondContact O-CG1 3.34Å; E1458-I1462 PolarHBondContact O-N 3.31Å
1459	S	90	Very high	87.6	Confident	16 Å²	16	33.6 Å²	33.6	11%	0.112	17%	0.172	C	C	.	.	H	α-helix	trans	-74.6	-41.5	175.9	-59.9	0	0	0	0	112.2	G1336 R1455 F1456 V1457 D1461 I1462 Y1463	G1336-S1459 WeakPolarHBondContact CA-OG 3.22Å; R1455-S1459 WeakPolarHBondContact O-CB 3.45Å; R1455-S1459 PolarHBondContact O-N 3.18Å; R1455-S1459 VanDerWaalsContact O-N 3.14Å; R1455-S1459 PolarHBondContact O-OG 3.37Å; F1456-S1459 WeakPolarHBondContact O-CB 3.46Å; F1456-S1459 PolarHBondContact O-N 2.86Å; F1456-S1459 VanDerWaalsContact O-N 3.16Å; V1457-S1459 PolarHBondContact O-N 2.89Å; V1457-S1459 VanDerWaalsContact O-N 3.16Å; S1459-D1461 VanDerWaalsContact C-N 3.25Å; S1459-D1461 PolarHBondContact O-N 3.47Å; S1459-I1462 WeakPolarHBondContact O-CB 3.38Å; S1459-I1462 PolarHBondContact O-N 3.01Å; S1459-Y1463 VanDerWaalsContact O-CD1 3.28Å; S1459-Y1463 WeakPolarHBondContact O-CD1 3.44Å; S1459-Y1463 WeakPolarHBondContact O-CD2 3.49Å; S1459-Y1463 PolarHBondContact O-N 3.34Å
1460	M	92.5	Very high	86.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-67.6	-26.2	176.8	-56.4	-47.7	164.9	0	0	112.2	L1334 I1385 L1402 F1456 V1457 I1462 Y1463 F1464	L1334-M1460 HydrophobicContact CB-CE 3.88Å; L1334-M1460 HydrophobicContact CB-SD 4.39Å; I1385-M1460 HydrophobicContact CD1-CB 3.9Å; I1385-M1460 HydrophobicContact CD1-CG 3.91Å; L1402-M1460 HydrophobicContact CB-CE 3.76Å; L1402-M1460 HydrophobicContact CB-SD 4.29Å; L1402-M1460 HydrophobicContact CD2-CE 4.4Å; L1402-M1460 HydrophobicContact CD2-CG 4.37Å; L1402-M1460 HydrophobicContact CD2-SD 3.85Å; F1456-M1460 HydrophobicContact CD1-CE 4.17Å; F1456-M1460 HydrophobicContact CD1-CG 4.23Å; F1456-M1460 HydrophobicContact CD2-CE 3.83Å; F1456-M1460 HydrophobicContact CE1-CE 3.93Å; F1456-M1460 HydrophobicContact CE1-CG 4.18Å; F1456-M1460 HydrophobicContact CE2-CE 3.57Å; F1456-M1460 HydrophobicContact CG-CE 4.14Å; F1456-M1460 HydrophobicContact CZ-CE 3.64Å; F1456-M1460 WeakPolarHBondContact O-CG 3.29Å; F1456-M1460 PolarHBondContact O-N 3.3Å; V1457-M1460 PolarHBondContact O-N 2.98Å; M1460-I1462 VanDerWaalsContact C-N 3.35Å; M1460-Y1463 HydrophobicContact CE-CE2 4.46Å; M1460-Y1463 HydrophobicContact SD-CD2 3.59Å; M1460-Y1463 VanDerWaalsContact SD-CD2 3.59Å; M1460-Y1463 HydrophobicContact SD-CE2 4.04Å; M1460-F1464 HydrophobicContact CB-CD2 4.11Å; M1460-F1464 HydrophobicContact CB-CE2 4.42Å; M1460-F1464 WeakPolarHBondContact O-CB 3.38Å; M1460-F1464 WeakPolarHBondContact O-CD2 3.5Å; M1460-F1464 PolarHBondContact O-N 3.02Å; M1460-F1464 HydrophobicContact SD-CD2 4.49Å; M1460-F1464 HydrophobicContact SD-CE2 3.86Å
1461	D	87	Confident	85	Confident	70 Å²	70	35.4 Å²	35.4	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-64.5	-36.4	168.3	-72.9	-25.6	0	0	0	113	K1378 V1457 S1459	K1378-D1461 IonicContact NZ-OD1 3.98Å; K1378-D1461 PolarHBondContact NZ-OD1 3.37Å; V1457-D1461 PolarHBondContact O-N 3.14Å; S1459-D1461 VanDerWaalsContact C-N 3.25Å; S1459-D1461 PolarHBondContact O-N 3.47Å
1462	I	86.7	Confident	83.2	Confident	39 Å²	39	33 Å²	33	20%	0.2	18%	0.176	C	C	.	.	H	α-helix	trans	-77.2	-36.4	177.5	-62.1	160.9	0	0	0	111.2	N753 M1363 E1458 S1459 M1460	N753-I1462 HydrophobicContact CB-CG1 4.45Å; N753-I1462 WeakPolarHBondContact ND2-CD1 3.43Å; M1363-I1462 HydrophobicContact SD-CG2 4.46Å; E1458-I1462 WeakPolarHBondContact O-CD1 3.48Å; E1458-I1462 WeakPolarHBondContact O-CG1 3.34Å; E1458-I1462 PolarHBondContact O-N 3.31Å; S1459-I1462 WeakPolarHBondContact O-CB 3.38Å; S1459-I1462 PolarHBondContact O-N 3.01Å; M1460-I1462 VanDerWaalsContact C-N 3.35Å
1463	Y	91.1	Very high	80.9	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.02	19%	0.193	C	C	.	.	H	α-helix	trans	-76.3	-34.1	-178.1	-59	-13.5	0	0	0	112.7	L1334 D1359 L1362 M1363 S1459 M1460 P1465	L1334-Y1463 HydrophobicContact CB-CD2 4.5Å; L1334-Y1463 HydrophobicContact CB-CE2 4.23Å; L1334-Y1463 HydrophobicContact CD1-CD2 3.98Å; L1334-Y1463 HydrophobicContact CD1-CE2 4.45Å; L1334-Y1463 HydrophobicContact CD2-CE2 4.3Å; D1359-Y1463 PolarHBondContact OD1-OH 3.41Å; L1362-Y1463 HydrophobicContact CD2-CD1 4.14Å; L1362-Y1463 HydrophobicContact CD2-CD2 3.9Å; L1362-Y1463 HydrophobicContact CD2-CE2 4.48Å; L1362-Y1463 HydrophobicContact CD2-CG 3.72Å; M1363-Y1463 HydrophobicContact CG-CE1 3.93Å; M1363-Y1463 HydrophobicContact SD-CD1 4.1Å; M1363-Y1463 HydrophobicContact SD-CE1 3.6Å; M1363-Y1463 VanDerWaalsContact SD-CE1 3.6Å; S1459-Y1463 VanDerWaalsContact O-CD1 3.28Å; S1459-Y1463 WeakPolarHBondContact O-CD1 3.44Å; S1459-Y1463 WeakPolarHBondContact O-CD2 3.49Å; S1459-Y1463 PolarHBondContact O-N 3.34Å; M1460-Y1463 HydrophobicContact CE-CE2 4.46Å; M1460-Y1463 HydrophobicContact SD-CD2 3.59Å; M1460-Y1463 VanDerWaalsContact SD-CD2 3.59Å; M1460-Y1463 HydrophobicContact SD-CE2 4.04Å; Y1463-P1465 VanDerWaalsContact O-CD 3.26Å; Y1463-P1465 WeakPolarHBondContact O-CD 3.35Å
1464	F	92.1	Very high	78.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-122.8	65.8	-174.5	-51.7	-59.4	0	0	0	112.2	L1334 F1371 L1373 K1378 L1381 L1402 M1404 L1413 M1460 A1466	L1334-F1464 HydrophobicContact CD1-CE2 4.32Å; L1334-F1464 HydrophobicContact CD1-CZ 3.83Å; F1371-F1464 HydrophobicContact CB-CD1 4.15Å; F1371-F1464 HydrophobicContact CB-CE1 4.36Å; L1373-F1464 HydrophobicContact CD1-CB 3.86Å; L1373-F1464 HydrophobicContact CG-CB 4.24Å; K1378-F1464 WeakPolarHBondContact CD-O 3.47Å; K1378-F1464 WeakPolarHBondContact CE-O 3.37Å; L1381-F1464 HydrophobicContact CD2-CB 3.77Å; L1381-F1464 HydrophobicContact CD2-CD2 3.8Å; L1381-F1464 HydrophobicContact CD2-CG 3.91Å; L1402-F1464 HydrophobicContact CD2-CE2 3.74Å; L1402-F1464 HydrophobicContact CD2-CZ 4.35Å; M1404-F1464 HydrophobicContact CE-CE1 4.2Å; M1404-F1464 HydrophobicContact CE-CZ 4.41Å; M1404-F1464 HydrophobicContact SD-CE1 3.43Å; M1404-F1464 WeakPolarHBondContact SD-CE1 3.47Å; M1404-F1464 HydrophobicContact SD-CZ 3.67Å; L1413-F1464 HydrophobicContact CD1-CD1 3.91Å; L1413-F1464 HydrophobicContact CD1-CE1 3.96Å; M1460-F1464 HydrophobicContact CB-CD2 4.11Å; M1460-F1464 HydrophobicContact CB-CE2 4.42Å; M1460-F1464 WeakPolarHBondContact O-CB 3.38Å; M1460-F1464 WeakPolarHBondContact O-CD2 3.5Å; M1460-F1464 PolarHBondContact O-N 3.02Å; M1460-F1464 HydrophobicContact SD-CD2 4.49Å; M1460-F1464 HydrophobicContact SD-CE2 3.86Å; F1464-A1466 PolarHBondContact O-N 3.42Å
1465	P	90.2	Very high	75.6	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.032	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-63.6	132.8	178.4	23.6	-32.2	0	0	0	112.3	L736 P754 Y1372 L1373 Y1463	L736-P1465 HydrophobicContact CD2-CB 3.52Å; P754-P1465 HydrophobicContact CB-CB 4.01Å; P754-P1465 HydrophobicContact CG-CB 4.43Å; Y1372-P1465 WeakPolarHBondContact CA-O 3.36Å; Y1372-P1465 HydrophobicContact CD1-CB 4Å; Y1372-P1465 HydrophobicContact CD1-CG 3.56Å; Y1372-P1465 HydrophobicContact CE1-CB 4.1Å; Y1372-P1465 HydrophobicContact CE1-CG 3.67Å; Y1372-P1465 HydrophobicContact CG-CG 4.43Å; L1373-P1465 PolarHBondContact N-O 3.45Å; Y1463-P1465 VanDerWaalsContact O-CD 3.26Å; Y1463-P1465 WeakPolarHBondContact O-CD 3.35Å
1466	A	87.1	Confident	74.9	Confident	15 Å²	15	43.7 Å²	43.7	12%	0.124	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	127.2	165.2	0	0	0	0	0	111	L1373 K1378 F1464	L1373-A1466 CarbonylContact O-C 3.59Å; L1373-A1466 WeakPolarHBondContact O-CA 3.31Å; K1378-A1466 HydrophobicContact CB-CB 3.85Å; K1378-A1466 HydrophobicContact CG-CB 3.85Å; F1464-A1466 PolarHBondContact O-N 3.42Å
1467	S	86.8	Confident	74	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	124.5	156	-169.7	0	0	0	0	108.7	G803 L1373	G803-S1467 PolarHBondContact N-OG 2.76Å; G803-S1467 VanDerWaalsContact N-OG 3.09Å; G803-S1467 WeakPolarHBondContact O-CB 3.43Å; G803-S1467 PolarHBondContact O-OG 3.36Å; L1373-S1467 PolarHBondContact O-N 2.83Å
1468	P	77.9	Confident	73	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.013	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-63.8	158.1	174.9	-19.8	32.7	0	0	0	111.7	L802 G803 V1474	L802-P1468 HydrophobicContact CD1-CB 4.01Å; L802-P1468 WeakPolarHBondContact CD1-O 3.49Å; G803-P1468 PolarHBondContact N-O 3.03Å; P1468-V1474 HydrophobicContact CB-CG2 3.94Å; P1468-V1474 HydrophobicContact CG-CG2 3.93Å
1469	D	70.8	Confident	72.1	Confident	60 Å²	60	41.5 Å²	41.5	32%	0.321	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-90.2	166.6	168.2	74	34.2	0	0	0	112.4	S1471 G1472 N1473	D1469-S1471 VanDerWaalsContact CG-OG 3.3Å; D1469-S1471 PolarHBondContact O-N 3.13Å; D1469-S1471 VanDerWaalsContact OD1-CA 3.28Å; D1469-S1471 WeakPolarHBondContact OD1-CA 3.24Å; D1469-S1471 WeakPolarHBondContact OD1-CB 3.24Å; D1469-S1471 PolarHBondContact OD1-N 2.89Å; D1469-S1471 PolarHBondContact OD1-OG 3.29Å; D1469-S1471 PolarHBondContact OD2-OG 2.79Å; D1469-G1472 PolarHBondContact O-N 2.97Å; D1469-G1472 PolarHBondContact OD1-N 3.5Å; D1469-N1473 PolarHBondContact OD1-N 2.96Å
1470	R	60.2	Low	71	Confident	86 Å²	86	43.1 Å²	43.1	33%	0.325	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.9	-179.6	-169.4	167.2	-163.4	-145.2	-7.7	114.3	K618 H867	K618-R1470 VanDerWaalsContact O-CZ 3.27Å; K618-R1470 PolarHBondContact O-NH1 3.12Å; K618-R1470 PolarHBondContact O-NH2 3.41Å; H867-R1470 PolarHBondContact CD2-NE 3.5Å; H867-R1470 PolarHBondContact CE1-NE 3.09Å; H867-R1470 VanDerWaalsContact CE1-NE 3.33Å; H867-R1470 PolarHBondContact ND1-NE 2.74Å; H867-R1470 VanDerWaalsContact NE2-CD 3.32Å; H867-R1470 WeakPolarHBondContact NE2-CD 3.38Å; H867-R1470 PolarHBondContact NE2-NE 3.27Å
1471	S	55.4	Low	69.5	Low	40 Å²	40	45.9 Å²	45.9	28%	0.28	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.2	172	69.7	0	0	0	0	113.1	D1469 N1473	D1469-S1471 VanDerWaalsContact CG-OG 3.3Å; D1469-S1471 PolarHBondContact O-N 3.13Å; D1469-S1471 VanDerWaalsContact OD1-CA 3.28Å; D1469-S1471 WeakPolarHBondContact OD1-CA 3.24Å; D1469-S1471 WeakPolarHBondContact OD1-CB 3.24Å; D1469-S1471 PolarHBondContact OD1-N 2.89Å; D1469-S1471 PolarHBondContact OD1-OG 3.29Å; D1469-S1471 PolarHBondContact OD2-OG 2.79Å; S1471-N1473 VanDerWaalsContact C-N 3.27Å; S1471-N1473 PolarHBondContact OG-ND2 3.07Å
1472	G	46.4	Very low	68.3	Low	32 Å²	32	44.1 Å²	44.1	33%	0.33	23%	0.228	S	C	.	.			trans	76.9	11.6	-178.7	0	0	0	0	0	113.5	D1469 V1474	D1469-G1472 PolarHBondContact O-N 2.97Å; D1469-G1472 PolarHBondContact OD1-N 3.5Å; G1472-V1474 PolarHBondContact O-N 3.03Å
1473	N	39.5	Very low	66.9	Low	70 Å²	70	44.5 Å²	44.5	37%	0.374	23%	0.23	S	C	.	.			trans	-80.1	87	-178.9	-77.8	-56.1	0	0	0	111	S1375 D1469 S1471	S1375-N1473 WeakPolarHBondContact CB-O 3.38Å; S1375-N1473 PolarHBondContact OG-O 3.43Å; D1469-N1473 PolarHBondContact OD1-N 2.96Å; S1471-N1473 VanDerWaalsContact C-N 3.27Å; S1471-N1473 PolarHBondContact OG-ND2 3.07Å
1474	V	33.6	Very low	64.9	Low	60 Å²	60	47.8 Å²	47.8	36%	0.364	25%	0.248	S	C	.	.			trans	-80.3	121.6	149.5	-171.9	0	0	0	0	106.7	T734 T756 P1468 G1472	T734-V1474 HydrophobicContact CG2-CG2 4.1Å; T756-V1474 HydrophobicContact CG2-CG2 4Å; P1468-V1474 HydrophobicContact CB-CG2 3.94Å; P1468-V1474 HydrophobicContact CG-CG2 3.93Å; G1472-V1474 PolarHBondContact O-N 3.03Å
1475	Y	38.4	Very low	62.4	Low	201 Å²	201	52.2 Å²	52.2	79%	0.788	27%	0.27	S	S	*	.			trans	-83.9	0	-168.6	-114.9	-82.9	0	0	0	114.6	A1379	A1379-Y1475 HydrophobicContact CB-CG 4.47Å

Retrieved 1,475 of 1,475 residues in 422.4 ms (Link to these results)

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