A0A087Y492_POEFO Loading...

Matrilin 2

AlphaFold DB , UniProt , Accession A0A087Y492, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 943 aa.

						>A0A087Y492_POEFO|A0A087Y492
VSSLVMRSMVLAFFCLLCCSAARPERRRPKLVLVKRRNDTIIQNNTPENPCKATALDFVFVIDSSRSIRPEDYDKVKTFIINLLQFLDVGLNSTRVGLLQYGSVVQPEFSLNTHTSKAQVEEAVRNMQHLATGTMTGLAIQYTMEVAFTEEQGARPKSLQIPRIAMIVTDGRPQDTVEEIAAEAREAGIQIFAIGVGRVEMKTLKAIGSQPHSEHVHLVANFSQIETLISVFKSKLCGGSDMCKVVEHQCQHICVSSPASYRCRCRKGFTLNPDGKTCKAEDMCAAADHGCDHICVNLADGYECRCRPGYELTIDLKTCNRIDYCDLGNHGCEHNCVSLPGSYICSCKKGFVLNADGKTCSQIDHCAAGSHGCEQEFMNTETSCVCKCTNGYTLRSDGKTCQKVDPCADGSHGCEQEFVSAGDSCVCRCRKGFTLRPDGKTCKKVDPCADGSHGCEQEFVSAGDSCVCRCRKGFTLRPDGKTCKKIEHCLDGNDGCEQEFINTENSCVCKCREGYTLRKDGKTCQTVVEITLSLGVTIYSKAECKLFEKHYDIRHCYRKPLAVQVVYSLPFACGILASSVVTFAQTGFKPGSPGGRLQSVDLCQTLDHGCQHLCFSTTDSYICKCNEGFLLAEDGKSCEKPGCHDGVMDLVFVIDGSKSLGPANFELVKQFVNSIVDSLNVSRMVTRVGLIQFSTKVRTEFSLGQHAAAQDVKRAVNQMQYMGRGSMTGSALRHMFQFSFSEKEGARLNVPRVCIVFTDGRSQDDVSEWASKAKTAGVTMYALGVGKAIEQELREIASEPAEMHLYYAEDFEKMGEITKKLKSRMCKVLIKSNGYTGRLFHFFVKISPIIFNILKILSTGNYSIKTRFYFFLKSYFNRNQKYFVRTKTSYTSADKPADESLCRCESVIVFQNQVTEKLKNLAQRILEAMSKKLETLENQVVNK
					

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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	V	35.4	Very low	28.4	Very low	187 Å²	187	147.2 Å²	147.2	100%	1.133	81%	0.811	S	S	*	*				0	77.9	0	-163.8	0	0	0	0	106.8
2	S	26.4	Very low	28.4	Very low	117 Å²	117	143.2 Å²	143.2	82%	0.818	81%	0.812	S	S	*	*			cis	73.6	85.7	40.7	-41.3	0	0	0	0	112.7
3	S	28.7	Very low	28.1	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	80%	0.802	S	S	*	*			trans	-162.3	112.7	142.2	-169.8	0	0	0	0	110.9
4	L	30.9	Very low	28	Very low	152 Å²	152	145.9 Å²	145.9	80%	0.796	80%	0.797	S	S	*	*			trans	40.1	116	153	-79.6	56	0	0	0	119.4
5	V	30.5	Very low	27.8	Very low	113 Å²	113	143.5 Å²	143.5	69%	0.685	79%	0.794	S	S	*	*			cis	74.7	123.4	29.5	-168.5	0	0	0	0	115.5
6	M	26.6	Very low	27.6	Very low	165 Å²	165	142.9 Å²	142.9	81%	0.813	79%	0.788	S	S	*	*			trans	62.9	127.4	165.2	-78.1	-175.4	-82.9	0	0	117.7
7	R	28.5	Very low	27.6	Very low	249 Å²	249	143.2 Å²	143.2	94%	0.94	79%	0.788	S	S	*	*				-131.8	132.1	57.3	-77.4	173.9	169.3	170.1	-4.3	115
8	S	29.1	Very low	27.5	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	79%	0.791	S	S	*	*			trans	-101.2	-172.5	161.9	-54	0	0	0	0	109.9
9	M	25.4	Very low	27.3	Very low	169 Å²	169	140 Å²	140	83%	0.833	79%	0.785	S	S	*	*			trans	90.9	118.2	178.7	-55.5	-163.1	81.9	0	0	113.8
10	V	26	Very low	27.3	Very low	116 Å²	116	138.5 Å²	138.5	70%	0.703	78%	0.784	S	S	*	*				92.6	113.9	51	163.7	0	0	0	0	111.5
11	L	24.6	Very low	27.2	Very low	142 Å²	142	136.7 Å²	136.7	74%	0.743	79%	0.786	S	S	*	*			trans	48.4	108.9	160.5	-81.9	84.3	0	0	0	120.4	F13	L11-F13 HydrophobicContact CD2-CD2 4.2Å; L11-F13 HydrophobicContact CD2-CE2 4.34Å
12	A	28.2	Very low	26.6	Very low	99 Å²	99	132.3 Å²	132.3	82%	0.818	77%	0.77	S	S	*	*				-150.3	109.8	122.5	0	0	0	0	0	107.4
13	F	25.2	Very low	26.6	Very low	156 Å²	156	138 Å²	138	68%	0.684	77%	0.773	S	S	*	*				63.1	129.8	70.6	-111.5	-80.2	0	0	0	114.8	L11	L11-F13 HydrophobicContact CD2-CD2 4.2Å; L11-F13 HydrophobicContact CD2-CE2 4.34Å
14	F	26.3	Very low	27	Very low	168 Å²	168	137.8 Å²	137.8	74%	0.737	77%	0.77	S	S	*	*			trans	69.1	132.2	175.5	-61.5	-74.5	0	0	0	116.7
15	C	24.8	Very low	26.7	Very low	110 Å²	110	137 Å²	137	74%	0.743	76%	0.762	S	S	*	*			cis	-132.4	142.6	-5.3	-81.9	0	0	0	0	108.9
16	L	24.6	Very low	26.4	Very low	134 Å²	134	141.4 Å²	141.4	70%	0.702	77%	0.766	S	S	*	*				66.9	131.8	56.7	-90.9	167	0	0	0	115.5
17	L	27.2	Very low	26.5	Very low	149 Å²	149	145 Å²	145	78%	0.78	77%	0.77	S	S	*	*			trans	94.5	120.7	173	-54.8	166.9	0	0	0	114.4
18	C	26.4	Very low	26.3	Very low	126 Å²	126	144.8 Å²	144.8	85%	0.851	77%	0.77	S	S	*	*			cis	-117.6	149	21.1	-69.9	0	0	0	0	116
19	C	24	Very low	26.5	Very low	99 Å²	99	144.9 Å²	144.9	67%	0.669	77%	0.768	S	S	*	*			trans	-70.2	171.7	164.3	-54	0	0	0	0	110.4
20	S	27.6	Very low	26.6	Very low	109 Å²	109	146 Å²	146	76%	0.762	77%	0.768	S	S	*	*			cis	-159.5	157.8	28.1	-53.5	0	0	0	0	113
21	A	24.9	Very low	26.5	Very low	102 Å²	102	148.5 Å²	148.5	84%	0.843	78%	0.777	S	S	*	*			trans	36.2	141.4	142.6	0	0	0	0	0	121.6
22	A	23.4	Very low	26.7	Very low	95 Å²	95	147.1 Å²	147.1	79%	0.785	77%	0.774	S	S	*	*			cis	-158.5	155.9	4.5	0	0	0	0	0	112.3
23	R	26.3	Very low	26.5	Very low	236 Å²	236	149.6 Å²	149.6	89%	0.891	77%	0.773	S	S	*	*			trans	-101.7	173.6	151.2	-81.3	-172.5	174.8	-179.6	0.6	106.6
24	P	35.9	Very low	26.8	Very low	102 Å²	102	148 Å²	148	66%	0.662	78%	0.775	S	S	*	*			cis	-156.9	-162	29.5	43.6	-19.3	0	0	0	117.8
25	E	24.5	Very low	26.8	Very low	136 Å²	136	148.7 Å²	148.7	64%	0.636	78%	0.778	S	S	*	*			trans	77.7	150.3	151.6	-71	-176.5	145.3	0	0	119.9
26	R	24.1	Very low	26.9	Very low	204 Å²	204	154.2 Å²	154.2	77%	0.77	78%	0.783	S	S	*	*			cis	-153.2	139.2	0.9	-124.4	159.9	-155	171.9	18.4	110.4
27	R	29.1	Very low	27	Very low	240 Å²	240	158.5 Å²	158.5	91%	0.906	79%	0.79	S	S	*	*			trans	-96.1	136.9	148.4	-81.2	-174.1	177.9	-176	0.2	107.6
28	R	24.6	Very low	27.3	Very low	245 Å²	245	158.5 Å²	158.5	93%	0.925	79%	0.791	S	S	*	*			trans	177.2	164.2	141.6	-97.6	175.2	-167.3	-141.7	4	111.1
29	P	34.2	Very low	27.5	Very low	106 Å²	106	159 Å²	159	69%	0.688	79%	0.785	S	S	*	*			trans	-133.6	-169.1	-139.7	41.4	-23	0	0	0	115.7
30	K	26.8	Very low	28.2	Very low	191 Å²	191	161.4 Å²	161.4	83%	0.83	80%	0.797	S	S	*	*			trans	77.4	122.4	166	-63.2	176.8	177	-176.6	0	117.3
31	L	23.4	Very low	28.4	Very low	169 Å²	169	163.1 Å²	163.1	89%	0.885	80%	0.796	S	S	*	*				-147.1	147.8	106.7	-142	76.6	0	0	0	111.5
32	V	28.3	Very low	28.9	Very low	114 Å²	114	164.6 Å²	164.6	69%	0.691	79%	0.788	S	S	*	*			trans	-85.1	134.8	172.8	171.3	0	0	0	0	108.5	V34	V32-V34 HydrophobicContact CG1-CG2 4.16Å
33	L	25.3	Very low	29.3	Very low	150 Å²	150	168.6 Å²	168.6	79%	0.785	79%	0.791	S	S	*	*			trans	-140.2	95.3	151.6	-143.3	93.3	0	0	0	110.5	K35	L33-K35 PolarHBondContact O-N 3.38Å
34	V	30.2	Very low	29.5	Very low	122 Å²	122	163.9 Å²	163.9	74%	0.739	78%	0.783	S	S	*	*			trans	-70.7	119.2	166	173.7	0	0	0	0	107.6	V32	V32-V34 HydrophobicContact CG1-CG2 4.16Å
35	K	25.9	Very low	29.6	Very low	184 Å²	184	166.2 Å²	166.2	80%	0.8	79%	0.79	S	S	*	*			trans	-127.9	89.1	166.8	-144.5	173.6	-170.7	177.7	0	109.5	L33 R37	L33-K35 PolarHBondContact O-N 3.38Å; K35-R37 PolarHBondContact O-N 3.4Å
36	R	27	Very low	30.1	Very low	226 Å²	226	165.1 Å²	165.1	85%	0.853	79%	0.793	S	S	*	*			trans	-63.4	125	163.6	-87.9	-177.1	169.3	176.1	-3.3	108.3
37	R	28.5	Very low	30.7	Very low	224 Å²	224	161.5 Å²	161.5	85%	0.845	80%	0.796	S	S	*	*			trans	-135.4	118.4	146.8	-106.9	-175.4	177	169.8	-2.9	107.4	K35	K35-R37 PolarHBondContact O-N 3.4Å
38	N	33.2	Very low	31.2	Very low	148 Å²	148	156.7 Å²	156.7	79%	0.791	78%	0.784	S	S	*	*			trans	-74.1	131.2	160.4	-70.1	-5.7	0	0	0	106.3
39	D	29.3	Very low	32.3	Very low	138 Å²	138	149.7 Å²	149.7	74%	0.738	77%	0.765	S	S	*	*			trans	-147.2	116.6	151.6	-84.2	-51.2	0	0	0	107.6	I41	D39-I41 PolarHBondContact O-N 3.39Å
40	T	39	Very low	33.1	Very low	148 Å²	148	148.9 Å²	148.9	91%	0.908	76%	0.76	S	S	*	*			trans	-77.9	107.6	177.5	36.1	0	0	0	0	110.1
41	I	31.4	Very low	34.5	Very low	145 Å²	145	140.5 Å²	140.5	74%	0.744	73%	0.725	S	S	*	*			trans	-132.9	107.9	168.2	-57.8	-177.7	0	0	0	110.3	D39	D39-I41 PolarHBondContact O-N 3.39Å
42	I	35.3	Very low	35.8	Very low	133 Å²	133	139.2 Å²	139.2	68%	0.682	71%	0.712	S	S	*	*			trans	30.5	105	142.9	-48.3	177.4	0	0	0	116.3	N44	I42-N44 VanDerWaalsContact C-N 3.34Å; I42-N44 WeakPolarHBondContact CG2-OD1 3.42Å; I42-N44 PolarHBondContact O-N 2.98Å
43	Q	31.9	Very low	37.1	Very low	180 Å²	180	137.6 Å²	137.6	84%	0.841	71%	0.71	S	S	*	*			trans	-69	92.2	158	-76.2	-171.9	-19.7	0	0	109.6	N45	Q43-N45 PolarHBondContact O-N 3.36Å; Q43-N45 VanDerWaalsContact O-N 3.11Å
44	N	31.5	Very low	38.9	Very low	136 Å²	136	132.8 Å²	132.8	73%	0.727	69%	0.687	S	S	*	*			trans	-68.6	103.9	163.1	-87.4	-12.3	0	0	0	108.6	I42 T46	I42-N44 VanDerWaalsContact C-N 3.34Å; I42-N44 WeakPolarHBondContact CG2-OD1 3.42Å; I42-N44 PolarHBondContact O-N 2.98Å; N44-T46 VanDerWaalsContact C-N 3.33Å; N44-T46 PolarHBondContact O-N 2.97Å
45	N	38.8	Very low	41.3	Very low	152 Å²	152	128.2 Å²	128.2	81%	0.813	66%	0.662	S	S	*	*			trans	-62.9	92	169.4	-77.6	-33.2	0	0	0	110	Q43	Q43-N45 PolarHBondContact O-N 3.36Å; Q43-N45 VanDerWaalsContact O-N 3.11Å
46	T	34.4	Very low	44.2	Very low	113 Å²	113	119.7 Å²	119.7	69%	0.693	63%	0.625	S	S	*	*			trans	-81.9	126	151.5	47.2	0	0	0	0	107	N44 E48	N44-T46 VanDerWaalsContact C-N 3.33Å; N44-T46 PolarHBondContact O-N 2.97Å; T46-E48 PolarHBondContact O-N 3.44Å
47	P	35.6	Very low	47.3	Very low	128 Å²	128	108.9 Å²	108.9	83%	0.831	59%	0.585	S	S	*	*			trans	-66	112	177	26.2	-32.2	0	0	0	108.5	N49	P47-N49 PolarHBondContact O-N 3.05Å
48	E	40.7	Very low	50.4	Low	138 Å²	138	98.2 Å²	98.2	65%	0.645	55%	0.545	S	S	*	.			trans	-61.4	122.5	175.6	-67.3	-159	109.7	0	0	109.5	T46 P50 K52	T46-E48 PolarHBondContact O-N 3.44Å; E48-P50 WeakPolarHBondContact O-CD 3.48Å; E48-K52 IonicContact OE1-NZ 2.61Å; E48-K52 PolarHBondContact OE1-NZ 3.43Å
49	N	48.3	Very low	53.4	Low	98 Å²	98	91.3 Å²	91.3	52%	0.524	51%	0.507	S	S	.	.			trans	-61.7	121.3	176.4	-174.4	-0.5	0	0	0	109.1	P47 C51	P47-N49 PolarHBondContact O-N 3.05Å; N49-C51 PolarHBondContact O-N 2.8Å
50	P	49.9	Very low	56.7	Low	90 Å²	90	84.8 Å²	84.8	58%	0.584	47%	0.472	S	S	*	.	S	Bend	trans	-58.3	-24.1	-175.4	-27.6	35.8	0	0	0	114.5	E48 K52	E48-P50 WeakPolarHBondContact O-CD 3.48Å; P50-K52 PolarHBondContact O-N 2.98Å
51	C	57.2	Low	59.4	Low	15 Å²	15	77.7 Å²	77.7	10%	0.101	43%	0.429	C	S	.	.			trans	-79.7	33.6	-175.8	-47.3	0	0	0	0	113.8	N49 A53 F86 C237	N49-C51 PolarHBondContact O-N 2.8Å; C51-A53 PolarHBondContact O-N 3.38Å; C51-F86 WeakPolarHBondContact CB-O 3.39Å; C51-F86 PolarHBondContact SG-O 3.34Å; C51-C237 HydrophobicContact CB-CB 3.8Å; C51-C237 WeakPolarHBondContact CB-SG 3.5Å; C51-C237 WeakPolarHBondContact SG-CB 3.03Å; C51-C237 CovalentContact SG-SG 2.03Å; C51-C237 PolarHBondContact SG-SG 3.35Å
52	K	50.6	Low	62.5	Low	142 Å²	142	70.9 Å²	70.9	62%	0.617	39%	0.394	S	S	*	.			trans	-71.3	100.2	-178.2	-96.5	-174.8	174.6	-176.7	0	112.2	E48 P50	E48-K52 IonicContact OE1-NZ 2.61Å; E48-K52 PolarHBondContact OE1-NZ 3.43Å; P50-K52 PolarHBondContact O-N 2.98Å
53	A	54.6	Low	65.2	Low	79 Å²	79	64.6 Å²	64.6	65%	0.653	36%	0.362	S	S	*	.			trans	61.7	47.4	152.5	0	0	0	0	0	118.1	C51	C51-A53 PolarHBondContact O-N 3.38Å
54	T	63.3	Low	68.2	Low	49 Å²	49	56 Å²	56	30%	0.301	32%	0.322	S	S	.	.			trans	-89	123	156.3	-27.4	0	0	0	0	109.1	P258	T54-P258 HydrophobicContact CG2-CB 4.33Å
55	A	80.7	Confident	71	Confident	26 Å²	26	49.5 Å²	49.5	22%	0.215	29%	0.287	C	S	.	.			trans	-72.4	125.2	174.3	0	0	0	0	0	110.4	S93 I161 P162	A55-S93 WeakPolarHBondContact CA-O 3.4Å; A55-I161 HydrophobicContact CB-CD1 3.72Å; A55-P162 WeakPolarHBondContact O-CD 3.48Å
56	L	87.8	Confident	73.4	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	128.3	-173.4	-64.7	174.5	0	0	0	113.5	S93 T94 R95 R155 P162 I164 P258	L56-S93 PolarHBondContact N-O 3.05Å; L56-T94 HydrophobicContact CB-CG2 4.06Å; L56-T94 WeakPolarHBondContact O-CA 3.05Å; L56-R95 PolarHBondContact O-N 3.13Å; L56-R155 PolarHBondContact O-NH2 3.46Å; L56-P162 HydrophobicContact CD2-CB 3.78Å; L56-P162 HydrophobicContact CD2-CG 3.72Å; L56-I164 HydrophobicContact CD2-CD1 4.21Å; L56-P258 HydrophobicContact CD2-CB 4.36Å
57	D	92.4	Very high	75.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	89.2	157.9	54.9	-101.5	0	0	0	113.6	R95 L111 F148 A154 R155 P162 R163 I164	D57-R95 HydrophobicContact CB-CB 4.16Å; D57-L111 HydrophobicContact CB-CD1 3.99Å; D57-L111 HydrophobicContact CB-CD2 3.74Å; D57-L111 HydrophobicContact CB-CG 4.48Å; D57-F148 WeakPolarHBondContact O-CE1 3.23Å; D57-A154 WeakPolarHBondContact OD2-CA 3.44Å; D57-R155 IonicContact OD1-CZ 2.7Å; D57-R155 IonicContact OD1-NE 2.71Å; D57-R155 PolarHBondContact OD1-NE 3.2Å; D57-R155 IonicContact OD1-NH2 3.9Å; D57-R155 PolarHBondContact OD1-NH2 2.93Å; D57-R155 PolarHBondContact OD2-N 3.25Å; D57-P162 VanDerWaalsContact CA-O 3.25Å; D57-P162 WeakPolarHBondContact CA-O 2.97Å; D57-P162 PolarHBondContact N-O 2.94Å; D57-R163 CarbonylContact O-C 3.56Å; D57-R163 WeakPolarHBondContact O-CA 3.41Å; D57-I164 PolarHBondContact O-N 3.14Å
58	F	92.9	Very high	78.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.1	-175.9	-160.7	-77	0	0	0	113.5	F60 T94 R95 V96 G97 L111 I164 M166 L236	F58-F60 AromaticContact CD1-CD2 3.96Å; F58-F60 HydrophobicContact CD1-CD2 3.96Å; F58-F60 AromaticContact CD1-CE2 3.77Å; F58-F60 HydrophobicContact CD1-CE2 3.77Å; F58-F60 HydrophobicContact CD1-CZ 4.18Å; F58-F60 AromaticContact CE1-CD1 3.94Å; F58-F60 HydrophobicContact CE1-CD1 3.94Å; F58-F60 AromaticContact CE1-CD2 3.78Å; F58-F60 HydrophobicContact CE1-CD2 3.78Å; F58-F60 AromaticContact CE1-CE1 3.7Å; F58-F60 HydrophobicContact CE1-CE1 3.7Å; F58-F60 AromaticContact CE1-CE2 3.52Å; F58-F60 HydrophobicContact CE1-CE2 3.52Å; F58-F60 AromaticContact CE1-CG 3.99Å; F58-F60 HydrophobicContact CE1-CG 3.99Å; F58-F60 AromaticContact CE1-CZ 3.48Å; F58-F60 HydrophobicContact CE1-CZ 3.48Å; F58-F60 VanDerWaalsContact CE1-CZ 3.48Å; F58-F60 HydrophobicContact CZ-CE1 4.28Å; F58-F60 HydrophobicContact CZ-CZ 4.2Å; F58-T94 HydrophobicContact CB-CG2 4Å; F58-R95 PolarHBondContact N-O 3.13Å; F58-V96 CarbonylContact O-C 2.89Å; F58-V96 VanDerWaalsContact O-CA 3.29Å; F58-V96 WeakPolarHBondContact O-CA 3.32Å; F58-G97 PolarHBondContact O-N 3.24Å; F58-L111 VanDerWaalsContact O-CD2 3.3Å; F58-L111 WeakPolarHBondContact O-CD2 3.37Å; F58-I164 HydrophobicContact CD2-CB 3.92Å; F58-I164 HydrophobicContact CD2-CG2 3.9Å; F58-I164 HydrophobicContact CE2-CB 4.22Å; F58-I164 HydrophobicContact CE2-CG2 3.66Å; F58-I164 HydrophobicContact CZ-CG2 4.44Å; F58-M166 HydrophobicContact CE1-CB 4.02Å; F58-M166 HydrophobicContact CZ-CB 3.77Å; F58-M166 HydrophobicContact CZ-CE 4.1Å; F58-M166 HydrophobicContact CZ-SD 4.37Å; F58-L236 HydrophobicContact CE2-CD1 4.01Å; F58-L236 HydrophobicContact CE2-CD2 4.04Å
59	V	96.7	Very high	80.8	Confident	2 Å²	2	44 Å²	44	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.8	176.6	178.5	0	0	0	0	111	V61 G97 L99 L111 T143 A147 F148 I164 A165 M166	V59-V61 HydrophobicContact CG1-CG2 4.18Å; V59-G97 WeakPolarHBondContact CA-O 3.42Å; V59-L99 HydrophobicContact CG1-CD2 3.79Å; V59-L111 HydrophobicContact CG2-CD1 4.26Å; V59-L111 HydrophobicContact CG2-CD2 3.99Å; V59-L111 HydrophobicContact CG2-CG 4.21Å; V59-T143 HydrophobicContact CG1-CG2 4.4Å; V59-A147 HydrophobicContact CG1-CB 4.32Å; V59-A147 HydrophobicContact CG2-CB 4.35Å; V59-F148 HydrophobicContact CB-CE1 4.48Å; V59-F148 HydrophobicContact CB-CE2 4.18Å; V59-F148 HydrophobicContact CB-CZ 3.83Å; V59-F148 HydrophobicContact CG2-CD1 4.33Å; V59-F148 HydrophobicContact CG2-CE1 3.69Å; V59-F148 HydrophobicContact CG2-CE2 4.03Å; V59-F148 HydrophobicContact CG2-CZ 3.51Å; V59-I164 PolarHBondContact N-O 3Å; V59-A165 WeakPolarHBondContact O-CA 3.27Å; V59-M166 PolarHBondContact O-N 2.92Å
60	F	96.9	Very high	82.8	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.1	167.8	-71.4	-83.5	0	0	0	110.4	F58 I62 I80 L83 L84 V96 G97 L98 L99 M166	F58-F60 AromaticContact CD1-CD2 3.96Å; F58-F60 HydrophobicContact CD1-CD2 3.96Å; F58-F60 AromaticContact CD1-CE2 3.77Å; F58-F60 HydrophobicContact CD1-CE2 3.77Å; F58-F60 HydrophobicContact CD1-CZ 4.18Å; F58-F60 AromaticContact CE1-CD1 3.94Å; F58-F60 HydrophobicContact CE1-CD1 3.94Å; F58-F60 AromaticContact CE1-CD2 3.78Å; F58-F60 HydrophobicContact CE1-CD2 3.78Å; F58-F60 AromaticContact CE1-CE1 3.7Å; F58-F60 HydrophobicContact CE1-CE1 3.7Å; F58-F60 AromaticContact CE1-CE2 3.52Å; F58-F60 HydrophobicContact CE1-CE2 3.52Å; F58-F60 AromaticContact CE1-CG 3.99Å; F58-F60 HydrophobicContact CE1-CG 3.99Å; F58-F60 AromaticContact CE1-CZ 3.48Å; F58-F60 HydrophobicContact CE1-CZ 3.48Å; F58-F60 VanDerWaalsContact CE1-CZ 3.48Å; F58-F60 HydrophobicContact CZ-CE1 4.28Å; F58-F60 HydrophobicContact CZ-CZ 4.2Å; F60-I62 HydrophobicContact CB-CD1 4.24Å; F60-I62 HydrophobicContact CB-CG1 4.27Å; F60-I62 HydrophobicContact CD1-CD1 4.43Å; F60-I80 HydrophobicContact CD1-CG1 4.04Å; F60-I80 HydrophobicContact CD1-CG2 4.44Å; F60-I80 HydrophobicContact CD2-CG2 4.3Å; F60-I80 HydrophobicContact CE1-CB 4.5Å; F60-I80 HydrophobicContact CE1-CG1 4.05Å; F60-I80 HydrophobicContact CE1-CG2 4.17Å; F60-I80 HydrophobicContact CE2-CG2 4.02Å; F60-I80 HydrophobicContact CG-CG2 4.5Å; F60-I80 HydrophobicContact CZ-CG2 3.95Å; F60-L83 HydrophobicContact CE1-CD2 3.97Å; F60-L83 HydrophobicContact CZ-CD2 4Å; F60-L84 HydrophobicContact CE2-CD2 4.42Å; F60-V96 HydrophobicContact CD2-CG1 3.81Å; F60-V96 HydrophobicContact CE2-CG1 3.8Å; F60-G97 PolarHBondContact N-O 2.79Å; F60-L98 HydrophobicContact CB-CB 4.25Å; F60-L98 HydrophobicContact CB-CD1 3.98Å; F60-L98 HydrophobicContact CB-CG 3.81Å; F60-L98 HydrophobicContact CG-CD1 4.48Å; F60-L98 WeakPolarHBondContact O-CA 3.36Å; F60-L99 PolarHBondContact O-N 3.01Å; F60-M166 HydrophobicContact CD1-CB 4.27Å; F60-M166 HydrophobicContact CD1-CG 4.39Å; F60-M166 HydrophobicContact CD1-SD 4.09Å; F60-M166 HydrophobicContact CE1-SD 3.71Å
61	V	96.6	Very high	84.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	101.1	178.5	177.3	0	0	0	0	107.5	V59 L99 Y101 A139 T143 M166 I167 V168	V59-V61 HydrophobicContact CG1-CG2 4.18Å; V61-L99 WeakPolarHBondContact CA-O 3.39Å; V61-L99 HydrophobicContact CB-CD1 4.33Å; V61-L99 HydrophobicContact CG1-CD1 3.91Å; V61-L99 HydrophobicContact CG2-CD1 4.11Å; V61-L99 HydrophobicContact CG2-CD2 4.22Å; V61-L99 HydrophobicContact CG2-CG 4.13Å; V61-Y101 HydrophobicContact CG1-CD1 3.94Å; V61-Y101 HydrophobicContact CG1-CE1 3.93Å; V61-A139 HydrophobicContact CG1-CB 3.96Å; V61-T143 HydrophobicContact CG2-CG2 4.2Å; V61-T143 VanDerWaalsContact CG2-OG1 3.32Å; V61-T143 WeakPolarHBondContact CG2-OG1 3.41Å; V61-M166 PolarHBondContact N-O 3.48Å; V61-I167 HydrophobicContact CB-CB 4.46Å; V61-I167 HydrophobicContact CB-CG1 3.93Å; V61-I167 HydrophobicContact CG1-CG1 4.12Å; V61-I167 HydrophobicContact CG1-CG2 4.37Å; V61-I167 HydrophobicContact CG2-CG1 4.38Å; V61-I167 WeakPolarHBondContact O-CA 3.49Å; V61-V168 PolarHBondContact O-N 3.16Å
62	I	95.9	Very high	86.3	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.5	-166.1	-55.6	-57	0	0	0	110.9	F60 S64 Y73 V76 I80 L99 Q100 Y101 V168	F60-I62 HydrophobicContact CB-CD1 4.24Å; F60-I62 HydrophobicContact CB-CG1 4.27Å; F60-I62 HydrophobicContact CD1-CD1 4.43Å; I62-S64 PolarHBondContact O-N 2.88Å; I62-Y73 HydrophobicContact CG2-CE2 4.27Å; I62-V76 HydrophobicContact CD1-CG1 4.13Å; I62-V76 HydrophobicContact CG2-CG1 3.77Å; I62-I80 HydrophobicContact CD1-CD1 3.75Å; I62-I80 HydrophobicContact CD1-CG1 4.4Å; I62-I80 HydrophobicContact CG1-CD1 3.86Å; I62-L99 PolarHBondContact N-O 3.44Å; I62-Q100 HydrophobicContact CB-CB 4.41Å; I62-Q100 CarbonylContact O-C 3.59Å; I62-Q100 WeakPolarHBondContact O-CA 3.33Å; I62-Q100 WeakPolarHBondContact O-CB 3.46Å; I62-Y101 WeakPolarHBondContact O-CD1 3.46Å; I62-Y101 PolarHBondContact O-N 3.17Å; I62-V168 HydrophobicContact CD1-CB 4.05Å; I62-V168 HydrophobicContact CD1-CG2 3.82Å
63	D	93.6	Very high	88.3	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	128.6	168	-167.6	-25.1	0	0	0	109.4	S65 I68 Y101 T134 V168 T169	D63-S65 WeakPolarHBondContact OD1-CB 3.25Å; D63-S65 PolarHBondContact OD1-N 3.06Å; D63-S65 PolarHBondContact OD1-OG 2.91Å; D63-I68 HydrophobicContact CB-CD1 3.86Å; D63-I68 WeakPolarHBondContact O-CD1 3.36Å; D63-Y101 HydrophobicContact CB-CE1 3.88Å; D63-Y101 HydrophobicContact CB-CE2 4.46Å; D63-T134 WeakPolarHBondContact OD2-CG2 3.47Å; D63-V168 WeakPolarHBondContact CB-O 3.44Å; D63-V168 PolarHBondContact N-O 3.33Å; D63-T169 WeakPolarHBondContact OD2-CA 3.42Å; D63-T169 WeakPolarHBondContact OD2-CB 3.3Å; D63-T169 PolarHBondContact OD2-OG1 3.35Å
64	S	93.5	Very high	90.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.			trans	-128.5	25.4	-178.6	-162.7	0	0	0	0	109.9	I62 Y73 Q100 Y101 H129 L130 A131	I62-S64 PolarHBondContact O-N 2.88Å; S64-Y73 WeakPolarHBondContact OG-CE2 3.29Å; S64-Q100 PolarHBondContact OG-OE1 3.06Å; S64-Y101 WeakPolarHBondContact CA-O 3.18Å; S64-Y101 WeakPolarHBondContact CB-O 3.27Å; S64-Y101 PolarHBondContact N-O 3.04Å; S64-H129 PolarHBondContact O-CD2 2.94Å; S64-H129 PolarHBondContact O-NE2 2.77Å; S64-H129 PolarHBondContact OG-CD2 3.05Å; S64-L130 PolarHBondContact OG-N 2.87Å; S64-A131 PolarHBondContact O-N 2.93Å
65	S	91.6	Very high	91.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-68.8	170.4	-179.9	64.6	0	0	0	0	113.3	D63 S67 I68 H129 T132 G133 T134	D63-S65 WeakPolarHBondContact OD1-CB 3.25Å; D63-S65 PolarHBondContact OD1-N 3.06Å; D63-S65 PolarHBondContact OD1-OG 2.91Å; S65-S67 VanDerWaalsContact C-N 3.29Å; S65-S67 PolarHBondContact O-N 3.25Å; S65-S67 PolarHBondContact OG-OG 2.85Å; S65-I68 PolarHBondContact O-N 3.45Å; S65-H129 PolarHBondContact O-NE2 3.18Å; S65-T132 CarbonylContact C-O 3.54Å; S65-T132 WeakPolarHBondContact CA-O 3.48Å; S65-G133 WeakPolarHBondContact CB-O 3.34Å; S65-T134 WeakPolarHBondContact CB-OG1 3.44Å; S65-T134 PolarHBondContact OG-OG1 2.9Å
66	R	88.4	Confident	92	Very high	197 Å²	197	37.8 Å²	37.8	74%	0.743	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.9	179.9	179.1	171.7	-66.9	-113.9	-7.7	114.7	I68 A131 T132	R66-I68 VanDerWaalsContact C-N 3.29Å; R66-A131 PolarHBondContact NE-O 3.36Å; R66-A131 PolarHBondContact NH2-O 2.83Å; R66-T132 WeakPolarHBondContact CB-O 3.31Å; R66-T132 PolarHBondContact N-O 2.84Å
67	S	86.9	Confident	92.3	Very high	67 Å²	67	39 Å²	39	47%	0.469	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-32	179.2	30.8	0	0	0	0	111.9	S65 D170	S65-S67 VanDerWaalsContact C-N 3.29Å; S65-S67 PolarHBondContact O-N 3.25Å; S65-S67 PolarHBondContact OG-OG 2.85Å; S67-D170 WeakPolarHBondContact CB-OD1 3.46Å; S67-D170 VanDerWaalsContact CB-OD2 3.24Å; S67-D170 WeakPolarHBondContact CB-OD2 3.32Å; S67-D170 PolarHBondContact OG-OD1 3.34Å; S67-D170 PolarHBondContact OG-OD2 3.25Å
68	I	89.3	Confident	92.3	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.015	20%	0.202	C	C	.	.	S	Bend	trans	-77	124.4	175.5	-50.5	-179.6	0	0	0	108.9	D63 S65 R66 D72 Y73 H129 D170 F222	D63-I68 HydrophobicContact CB-CD1 3.86Å; D63-I68 WeakPolarHBondContact O-CD1 3.36Å; S65-I68 PolarHBondContact O-N 3.45Å; R66-I68 VanDerWaalsContact C-N 3.29Å; I68-D72 HydrophobicContact CG2-CB 4.18Å; I68-Y73 HydrophobicContact CG2-CD2 4.42Å; I68-H129 PolarHBondContact O-CE1 2.89Å; I68-H129 PolarHBondContact O-NE2 2.66Å; I68-D170 HydrophobicContact CD1-CB 4.41Å; I68-D170 HydrophobicContact CG1-CB 4.05Å; I68-D170 VanDerWaalsContact CG1-CG 3.41Å; I68-D170 WeakPolarHBondContact CG1-OD2 3.45Å; I68-D170 PolarHBondContact N-OD2 3.28Å; I68-F222 HydrophobicContact CB-CZ 4.39Å; I68-F222 HydrophobicContact CD1-CZ 4.04Å; I68-F222 HydrophobicContact CG1-CE2 4.49Å; I68-F222 HydrophobicContact CG1-CZ 3.85Å; I68-F222 HydrophobicContact CG2-CE1 4.33Å; I68-F222 HydrophobicContact CG2-CE2 4.29Å; I68-F222 HydrophobicContact CG2-CZ 3.85Å
69	R	89.5	Confident	92.3	Very high	149 Å²	149	41.9 Å²	41.9	56%	0.562	20%	0.202	S	C	*	.			trans	-81.1	154.6	175.6	-61.6	-178.8	176.8	-167.1	-2.2	110.6	E71 D72 Y73	R69-E71 VanDerWaalsContact C-N 3.26Å; R69-E71 HydrophobicContact CB-CG 3.78Å; R69-E71 WeakPolarHBondContact CD-OE1 3.42Å; R69-E71 IonicContact CZ-OE1 3.33Å; R69-E71 IonicContact NE-OE1 2.93Å; R69-E71 IonicContact NH1-OE1 3.91Å; R69-E71 PolarHBondContact NH1-OE1 2.99Å; R69-E71 PolarHBondContact O-N 3.16Å; R69-D72 HydrophobicContact CB-CB 4.42Å; R69-D72 CarbonylContact O-C 3.52Å; R69-D72 WeakPolarHBondContact O-CA 3.36Å; R69-D72 PolarHBondContact O-N 3.37Å; R69-Y73 PolarHBondContact O-N 3.15Å
70	P	90	Very high	92.2	Very high	83 Å²	83	41.8 Å²	41.8	54%	0.539	20%	0.201	S	C	.	.	H	α-helix	trans	-53.2	-43.1	175.3	-27.7	35.8	0	0	0	113.1	D72 Y73 D74	P70-D72 PolarHBondContact O-N 2.61Å; P70-Y73 PolarHBondContact O-N 3.11Å; P70-D74 PolarHBondContact O-N 2.72Å
71	E	89.7	Confident	92	Very high	111 Å²	111	43 Å²	43	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-61.6	-23.1	175.5	67.5	-150.9	-159.7	0	0	114.7	R69 K75	R69-E71 VanDerWaalsContact C-N 3.26Å; R69-E71 HydrophobicContact CB-CG 3.78Å; R69-E71 WeakPolarHBondContact CD-OE1 3.42Å; R69-E71 IonicContact CZ-OE1 3.33Å; R69-E71 IonicContact NE-OE1 2.93Å; R69-E71 IonicContact NH1-OE1 3.91Å; R69-E71 PolarHBondContact NH1-OE1 2.99Å; R69-E71 PolarHBondContact O-N 3.16Å; E71-K75 VanDerWaalsContact O-CE 3.28Å; E71-K75 WeakPolarHBondContact O-CE 3.19Å
72	D	90.6	Very high	91.7	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.16	22%	0.222	C	C	.	.	H	α-helix	trans	-94.9	-34.2	175.2	-77.6	-42.4	0	0	0	111.6	I68 R69 P70 D74 K75 V76 F222	I68-D72 HydrophobicContact CG2-CB 4.18Å; R69-D72 HydrophobicContact CB-CB 4.42Å; R69-D72 CarbonylContact O-C 3.52Å; R69-D72 WeakPolarHBondContact O-CA 3.36Å; R69-D72 PolarHBondContact O-N 3.37Å; P70-D72 PolarHBondContact O-N 2.61Å; D72-D74 VanDerWaalsContact C-N 3.34Å; D72-D74 PolarHBondContact O-N 3.09Å; D72-K75 WeakPolarHBondContact O-CA 3.2Å; D72-K75 VanDerWaalsContact O-CB 3.3Å; D72-K75 WeakPolarHBondContact O-CB 3.38Å; D72-K75 PolarHBondContact O-N 3.11Å; D72-K75 IonicContact OD1-NZ 2.86Å; D72-K75 PolarHBondContact OD1-NZ 2.88Å; D72-V76 PolarHBondContact O-N 3.35Å; D72-F222 HydrophobicContact CB-CB 4.12Å; D72-F222 HydrophobicContact CB-CD1 4.4Å; D72-F222 HydrophobicContact CB-CD2 3.47Å; D72-F222 VanDerWaalsContact CB-CD2 3.47Å; D72-F222 HydrophobicContact CB-CE2 3.94Å; D72-F222 HydrophobicContact CB-CG 3.73Å
73	Y	92.7	Very high	91.3	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-38.6	173.6	-171.9	-97.8	0	0	0	111.6	I62 S64 I68 R69 P70 K75 V76 K77 Q100 H129	I62-Y73 HydrophobicContact CG2-CE2 4.27Å; S64-Y73 WeakPolarHBondContact OG-CE2 3.29Å; I68-Y73 HydrophobicContact CG2-CD2 4.42Å; R69-Y73 PolarHBondContact O-N 3.15Å; P70-Y73 PolarHBondContact O-N 3.11Å; Y73-K75 PolarHBondContact O-N 3.26Å; Y73-V76 WeakPolarHBondContact O-CA 3.4Å; Y73-V76 WeakPolarHBondContact O-CB 3.33Å; Y73-V76 PolarHBondContact O-N 3.31Å; Y73-K77 VanDerWaalsContact CE1-CE 3.48Å; Y73-K77 HydrophobicContact CE1-CG 4.41Å; Y73-K77 PolarHBondContact O-N 2.99Å; Y73-Q100 PolarHBondContact OH-OE1 3.23Å; Y73-H129 HydrophobicContact CD1-CB 3.87Å; Y73-H129 HydrophobicContact CD2-CB 4.41Å; Y73-H129 AromaticContact CD2-CD2 3.58Å; Y73-H129 HydrophobicContact CE1-CB 4.01Å; Y73-H129 AromaticContact CE2-CD2 3.93Å; Y73-H129 HydrophobicContact CG-CB 4.08Å; Y73-H129 AromaticContact CG-CD2 3.91Å
74	D	92.6	Very high	91.1	Very high	79 Å²	79	45.6 Å²	45.6	42%	0.422	22%	0.221	S	C	.	.	H	α-helix	trans	-65.9	-24.9	172.9	-73.3	-29.8	0	0	0	113	P70 D72 K77 T78	P70-D74 PolarHBondContact O-N 2.72Å; D72-D74 VanDerWaalsContact C-N 3.34Å; D72-D74 PolarHBondContact O-N 3.09Å; D74-K77 WeakPolarHBondContact OD1-CD 3.3Å; D74-K77 WeakPolarHBondContact OD1-CE 3.5Å; D74-K77 IonicContact OD1-NZ 2.71Å; D74-K77 PolarHBondContact OD1-NZ 3.46Å; D74-K77 VanDerWaalsContact OD1-NZ 3.08Å; D74-T78 WeakPolarHBondContact O-CB 3.36Å; D74-T78 PolarHBondContact O-N 2.65Å; D74-T78 PolarHBondContact O-OG1 3.06Å
75	K	92.1	Very high	90.8	Very high	62 Å²	62	49.4 Å²	49.4	27%	0.27	24%	0.239	S	C	.	.	H	α-helix	trans	-71.1	-34.3	169	-58.2	169.2	-167.5	163.5	0	111.2	E71 D72 Y73 T78 F79 F222 S223	E71-K75 VanDerWaalsContact O-CE 3.28Å; E71-K75 WeakPolarHBondContact O-CE 3.19Å; D72-K75 WeakPolarHBondContact O-CA 3.2Å; D72-K75 VanDerWaalsContact O-CB 3.3Å; D72-K75 WeakPolarHBondContact O-CB 3.38Å; D72-K75 PolarHBondContact O-N 3.11Å; D72-K75 IonicContact OD1-NZ 2.86Å; D72-K75 PolarHBondContact OD1-NZ 2.88Å; Y73-K75 PolarHBondContact O-N 3.26Å; K75-T78 PolarHBondContact O-N 2.71Å; K75-F79 WeakPolarHBondContact O-CB 3.37Å; K75-F79 PolarHBondContact O-N 2.71Å; K75-F222 HydrophobicContact CB-CB 4.3Å; K75-F222 HydrophobicContact CD-CB 3.78Å; K75-S223 PolarHBondContact NZ-OG 2.89Å
76	V	92.8	Very high	90.2	Very high	1 Å²	1	52 Å²	52	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-44.3	172.9	-175.6	0	0	0	0	110.7	I62 D72 Y73 T78 F79 I80 V168 F222	I62-V76 HydrophobicContact CD1-CG1 4.13Å; I62-V76 HydrophobicContact CG2-CG1 3.77Å; D72-V76 PolarHBondContact O-N 3.35Å; Y73-V76 WeakPolarHBondContact O-CA 3.4Å; Y73-V76 WeakPolarHBondContact O-CB 3.33Å; Y73-V76 PolarHBondContact O-N 3.31Å; V76-T78 VanDerWaalsContact C-N 3.33Å; V76-T78 PolarHBondContact O-N 2.97Å; V76-F79 WeakPolarHBondContact O-CB 3.38Å; V76-F79 PolarHBondContact O-N 2.85Å; V76-I80 HydrophobicContact CG1-CD1 4.11Å; V76-I80 VanDerWaalsContact O-CG1 3.31Å; V76-I80 WeakPolarHBondContact O-CG1 3.42Å; V76-I80 PolarHBondContact O-N 2.89Å; V76-V168 HydrophobicContact CG1-CG1 4.44Å; V76-F222 HydrophobicContact CG2-CD1 3.56Å; V76-F222 HydrophobicContact CG2-CE1 3.47Å; V76-F222 VanDerWaalsContact CG2-CE1 3.47Å
77	K	94.2	Very high	89.9	Confident	30 Å²	30	43.2 Å²	43.2	13%	0.13	22%	0.218	C	C	.	.	H	α-helix	trans	-55.9	-47.9	171.3	-63.9	-178.5	-176.6	169.3	0	111.7	Y73 D74 F79 I80 I81 V124 R125 M127	Y73-K77 VanDerWaalsContact CE1-CE 3.48Å; Y73-K77 HydrophobicContact CE1-CG 4.41Å; Y73-K77 PolarHBondContact O-N 2.99Å; D74-K77 WeakPolarHBondContact OD1-CD 3.3Å; D74-K77 WeakPolarHBondContact OD1-CE 3.5Å; D74-K77 IonicContact OD1-NZ 2.71Å; D74-K77 PolarHBondContact OD1-NZ 3.46Å; D74-K77 VanDerWaalsContact OD1-NZ 3.08Å; K77-F79 VanDerWaalsContact C-N 3.35Å; K77-F79 PolarHBondContact O-N 3.04Å; K77-I80 PolarHBondContact O-N 2.88Å; K77-I81 WeakPolarHBondContact O-CG1 3.41Å; K77-I81 PolarHBondContact O-N 3.15Å; K77-V124 HydrophobicContact CB-CG1 4.23Å; K77-R125 PolarHBondContact NZ-O 3.15Å; K77-M127 WeakPolarHBondContact CE-O 3.39Å; K77-M127 HydrophobicContact CG-CE 3.86Å; K77-M127 PolarHBondContact NZ-O 3.04Å
78	T	92.6	Very high	89.8	Confident	60 Å²	60	43.7 Å²	43.7	37%	0.368	22%	0.216	S	C	.	.	H	α-helix	trans	-60.5	-43.3	179.1	-57.9	0	0	0	0	111.4	D74 K75 V76 I80 I81 N82	D74-T78 WeakPolarHBondContact O-CB 3.36Å; D74-T78 PolarHBondContact O-N 2.65Å; D74-T78 PolarHBondContact O-OG1 3.06Å; K75-T78 PolarHBondContact O-N 2.71Å; V76-T78 VanDerWaalsContact C-N 3.33Å; V76-T78 PolarHBondContact O-N 2.97Å; T78-I80 PolarHBondContact O-N 2.83Å; T78-I81 PolarHBondContact O-N 3.17Å; T78-N82 VanDerWaalsContact O-CB 3.3Å; T78-N82 WeakPolarHBondContact O-CB 3.29Å; T78-N82 PolarHBondContact O-N 2.89Å; T78-N82 PolarHBondContact O-ND2 2.96Å
79	F	92.6	Very high	89.7	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-44.9	174	168.8	-102.4	0	0	0	112.7	K75 V76 K77 N82 L83 M166 I194 I225 L228 I229 F232	K75-F79 WeakPolarHBondContact O-CB 3.37Å; K75-F79 PolarHBondContact O-N 2.71Å; V76-F79 WeakPolarHBondContact O-CB 3.38Å; V76-F79 PolarHBondContact O-N 2.85Å; K77-F79 VanDerWaalsContact C-N 3.35Å; K77-F79 PolarHBondContact O-N 3.04Å; F79-N82 PolarHBondContact O-N 2.78Å; F79-L83 HydrophobicContact CZ-CD2 4.5Å; F79-L83 WeakPolarHBondContact O-CB 3.45Å; F79-L83 PolarHBondContact O-N 3.2Å; F79-M166 HydrophobicContact CE1-SD 3.82Å; F79-M166 HydrophobicContact CZ-SD 4.07Å; F79-I194 HydrophobicContact CE1-CD1 4.16Å; F79-I194 HydrophobicContact CZ-CD1 3.92Å; F79-I225 HydrophobicContact CB-CG2 3.78Å; F79-I225 HydrophobicContact CD1-CD1 4.02Å; F79-I225 HydrophobicContact CD1-CG1 4.41Å; F79-I225 HydrophobicContact CD2-CB 4.47Å; F79-I225 HydrophobicContact CD2-CG1 4.08Å; F79-I225 HydrophobicContact CD2-CG2 3.93Å; F79-I225 HydrophobicContact CE1-CD1 4.23Å; F79-I225 HydrophobicContact CE1-CG1 4.48Å; F79-I225 HydrophobicContact CE2-CG1 4.16Å; F79-I225 WeakPolarHBondContact CE2-O 3.18Å; F79-I225 HydrophobicContact CG-CD1 4.19Å; F79-I225 HydrophobicContact CG-CG1 4.22Å; F79-I225 HydrophobicContact CG-CG2 3.91Å; F79-I225 HydrophobicContact CZ-CG1 4.36Å; F79-L228 HydrophobicContact CE2-CB 4.4Å; F79-I229 HydrophobicContact CD2-CD1 4.28Å; F79-I229 HydrophobicContact CD2-CG1 3.81Å; F79-I229 HydrophobicContact CE2-CG1 3.9Å; F79-F232 HydrophobicContact CZ-CD2 4.25Å; F79-F232 HydrophobicContact CZ-CE2 4.29Å
80	I	93.3	Very high	89.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-48.5	176.9	-64.6	162.6	0	0	0	110.4	F60 I62 V76 K77 T78 N82 L83 L84 L98 V124 M127	F60-I80 HydrophobicContact CD1-CG1 4.04Å; F60-I80 HydrophobicContact CD1-CG2 4.44Å; F60-I80 HydrophobicContact CD2-CG2 4.3Å; F60-I80 HydrophobicContact CE1-CB 4.5Å; F60-I80 HydrophobicContact CE1-CG1 4.05Å; F60-I80 HydrophobicContact CE1-CG2 4.17Å; F60-I80 HydrophobicContact CE2-CG2 4.02Å; F60-I80 HydrophobicContact CG-CG2 4.5Å; F60-I80 HydrophobicContact CZ-CG2 3.95Å; I62-I80 HydrophobicContact CD1-CD1 3.75Å; I62-I80 HydrophobicContact CD1-CG1 4.4Å; I62-I80 HydrophobicContact CG1-CD1 3.86Å; V76-I80 HydrophobicContact CG1-CD1 4.11Å; V76-I80 VanDerWaalsContact O-CG1 3.31Å; V76-I80 WeakPolarHBondContact O-CG1 3.42Å; V76-I80 PolarHBondContact O-N 2.89Å; K77-I80 PolarHBondContact O-N 2.88Å; T78-I80 PolarHBondContact O-N 2.83Å; I80-N82 VanDerWaalsContact C-N 3.31Å; I80-N82 PolarHBondContact O-N 2.9Å; I80-L83 PolarHBondContact O-N 3.27Å; I80-L84 HydrophobicContact CG2-CD1 3.92Å; I80-L84 HydrophobicContact CG2-CG 4.4Å; I80-L84 WeakPolarHBondContact O-CB 3.36Å; I80-L84 VanDerWaalsContact O-CG 3.27Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 2.92Å; I80-L98 HydrophobicContact CD1-CD1 4.1Å; I80-L98 HydrophobicContact CG2-CD1 4.49Å; I80-V124 HydrophobicContact CB-CG1 4.06Å; I80-V124 HydrophobicContact CG2-CG1 3.93Å; I80-V124 HydrophobicContact CG2-CG2 3.76Å; I80-M127 HydrophobicContact CD1-CE 4.32Å
81	I	93.3	Very high	89.1	Confident	28 Å²	28	38.1 Å²	38.1	14%	0.144	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-42.3	177.5	-67.2	164.1	0	0	0	111.2	K77 T78 L84 Q85 E121 V124 R125	K77-I81 WeakPolarHBondContact O-CG1 3.41Å; K77-I81 PolarHBondContact O-N 3.15Å; T78-I81 PolarHBondContact O-N 3.17Å; I81-L84 PolarHBondContact O-N 2.9Å; I81-Q85 WeakPolarHBondContact O-CG 3.37Å; I81-Q85 PolarHBondContact O-N 2.99Å; I81-Q85 PolarHBondContact O-NE2 3.4Å; I81-E121 HydrophobicContact CG2-CG 4.37Å; I81-V124 HydrophobicContact CD1-CG1 4.12Å; I81-V124 HydrophobicContact CG1-CB 4.35Å; I81-V124 HydrophobicContact CG1-CG1 3.78Å; I81-R125 HydrophobicContact CD1-CG 3.71Å
82	N	90.3	Very high	88.7	Confident	54 Å²	54	39.8 Å²	39.8	29%	0.289	21%	0.208	S	C	.	.	H	α-helix	trans	-68.3	-35.7	177.7	-73.1	-21.3	0	0	0	112.3	T78 F79 I80 Q85 F86 I229	T78-N82 VanDerWaalsContact O-CB 3.3Å; T78-N82 WeakPolarHBondContact O-CB 3.29Å; T78-N82 PolarHBondContact O-N 2.89Å; T78-N82 PolarHBondContact O-ND2 2.96Å; F79-N82 PolarHBondContact O-N 2.78Å; I80-N82 VanDerWaalsContact C-N 3.31Å; I80-N82 PolarHBondContact O-N 2.9Å; N82-Q85 WeakPolarHBondContact O-CB 3.25Å; N82-Q85 PolarHBondContact O-N 3.49Å; N82-F86 WeakPolarHBondContact O-CD2 3.14Å; N82-F86 WeakPolarHBondContact O-CE2 3.15Å; N82-I229 HydrophobicContact CB-CD1 3.61Å
83	L	88.5	Confident	88.3	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-70.1	-40.6	174.5	-175.7	58.1	0	0	0	111.7	F60 F79 I80 Q85 F86 M166 F232 L236	F60-L83 HydrophobicContact CE1-CD2 3.97Å; F60-L83 HydrophobicContact CZ-CD2 4Å; F79-L83 HydrophobicContact CZ-CD2 4.5Å; F79-L83 WeakPolarHBondContact O-CB 3.45Å; F79-L83 PolarHBondContact O-N 3.2Å; I80-L83 PolarHBondContact O-N 3.27Å; L83-Q85 PolarHBondContact O-N 2.84Å; L83-Q85 VanDerWaalsContact O-N 3.14Å; L83-F86 PolarHBondContact O-N 2.93Å; L83-M166 HydrophobicContact CD2-CE 3.66Å; L83-M166 HydrophobicContact CD2-SD 3.77Å; L83-F232 HydrophobicContact CD1-CB 3.67Å; L83-L236 HydrophobicContact CD1-CD1 4.21Å
84	L	89.1	Confident	88.1	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-21.2	171.6	-71.8	167.3	0	0	0	112.5	F60 I80 I81 F86 L87 V89 V96 K117 V120 E121 V124	F60-L84 HydrophobicContact CE2-CD2 4.42Å; I80-L84 HydrophobicContact CG2-CD1 3.92Å; I80-L84 HydrophobicContact CG2-CG 4.4Å; I80-L84 WeakPolarHBondContact O-CB 3.36Å; I80-L84 VanDerWaalsContact O-CG 3.27Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 2.92Å; I81-L84 PolarHBondContact O-N 2.9Å; L84-F86 PolarHBondContact O-N 3.2Å; L84-L87 HydrophobicContact CD2-CD1 4.37Å; L84-L87 PolarHBondContact O-N 3.44Å; L84-V89 HydrophobicContact CD2-CG2 4.05Å; L84-V96 HydrophobicContact CD2-CG1 4.32Å; L84-V96 HydrophobicContact CD2-CG2 4.12Å; L84-K117 WeakPolarHBondContact O-CD 3.32Å; L84-K117 WeakPolarHBondContact O-CE 3.41Å; L84-V120 HydrophobicContact CD1-CB 4.48Å; L84-V120 HydrophobicContact CD1-CG1 3.65Å; L84-V120 HydrophobicContact CD2-CG1 3.98Å; L84-E121 HydrophobicContact CD1-CG 4.28Å; L84-V124 HydrophobicContact CD1-CG2 4.42Å
85	Q	86.6	Confident	88.2	Confident	81 Å²	81	38 Å²	38	38%	0.379	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.8	173	-64.2	-47.4	-43.4	0	0	113.4	I81 N82 L83 K117 E121	I81-Q85 WeakPolarHBondContact O-CG 3.37Å; I81-Q85 PolarHBondContact O-N 2.99Å; I81-Q85 PolarHBondContact O-NE2 3.4Å; N82-Q85 WeakPolarHBondContact O-CB 3.25Å; N82-Q85 PolarHBondContact O-N 3.49Å; L83-Q85 PolarHBondContact O-N 2.84Å; L83-Q85 VanDerWaalsContact O-N 3.14Å; Q85-K117 PolarHBondContact O-NZ 3.4Å; Q85-E121 PolarHBondContact NE2-OE1 3.39Å
86	F	79.7	Confident	88.3	Confident	54 Å²	54	35.1 Å²	35.1	24%	0.237	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-8	-177.9	-51.1	-66.6	0	0	0	113.8	C51 N82 L83 L84 I229 K233 C237	C51-F86 WeakPolarHBondContact CB-O 3.39Å; C51-F86 PolarHBondContact SG-O 3.34Å; N82-F86 WeakPolarHBondContact O-CD2 3.14Å; N82-F86 WeakPolarHBondContact O-CE2 3.15Å; L83-F86 PolarHBondContact O-N 2.93Å; L84-F86 PolarHBondContact O-N 3.2Å; F86-I229 HydrophobicContact CD2-CG2 4.01Å; F86-I229 HydrophobicContact CE2-CG2 3.4Å; F86-I229 VanDerWaalsContact CE2-CG2 3.4Å; F86-I229 HydrophobicContact CZ-CG2 4.34Å; F86-K233 HydrophobicContact CB-CG 4.27Å; F86-K233 HydrophobicContact CD1-CD 3.59Å; F86-K233 VanDerWaalsContact CD1-CE 3.47Å; F86-K233 HydrophobicContact CD1-CG 4.03Å; F86-K233 HydrophobicContact CD2-CB 4.42Å; F86-K233 HydrophobicContact CD2-CD 4.35Å; F86-K233 HydrophobicContact CD2-CG 4.46Å; F86-K233 HydrophobicContact CE1-CD 3.73Å; F86-K233 HydrophobicContact CE2-CD 4.47Å; F86-K233 HydrophobicContact CG-CB 4.34Å; F86-K233 HydrophobicContact CG-CD 3.92Å; F86-K233 HydrophobicContact CG-CG 3.94Å; F86-K233 HydrophobicContact CZ-CD 4.17Å; F86-C237 PolarHBondContact O-SG 3.47Å; F86-C237 VanDerWaalsContact O-SG 3.39Å
87	L	81.8	Confident	88.4	Confident	12 Å²	12	35.2 Å²	35.2	6%	0.063	19%	0.185	C	C	.	.	S	Bend	trans	-92.1	130.9	179.1	-65.8	176.6	0	0	0	111.6	L84 V89 L236	L84-L87 HydrophobicContact CD2-CD1 4.37Å; L84-L87 PolarHBondContact O-N 3.44Å; L87-V89 HydrophobicContact CB-CG2 4.06Å; L87-V89 PolarHBondContact O-N 3.35Å; L87-V89 VanDerWaalsContact O-N 3.13Å; L87-L236 HydrophobicContact CD2-CB 4.3Å; L87-L236 HydrophobicContact CD2-CD1 4.23Å
88	D	84.9	Confident	88.6	Confident	77 Å²	77	33.9 Å²	33.9	41%	0.412	18%	0.179	S	C	.	.			trans	-78.8	88.2	168	178.4	22.4	0	0	0	108.9	S93 T94	D88-S93 VanDerWaalsContact O-CB 3.29Å; D88-S93 WeakPolarHBondContact O-CB 3.41Å; D88-S93 PolarHBondContact O-OG 2.93Å; D88-S93 VanDerWaalsContact OD2-CB 3.3Å; D88-S93 WeakPolarHBondContact OD2-CB 3.48Å; D88-T94 WeakPolarHBondContact O-CB 3.47Å; D88-T94 PolarHBondContact O-N 2.84Å; D88-T94 PolarHBondContact O-OG1 3.34Å; D88-T94 VanDerWaalsContact O-OG1 3.13Å
89	V	87.8	Confident	88.8	Confident	17 Å²	17	31.1 Å²	31.1	10%	0.103	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-85.3	120	-176.6	-178.3	0	0	0	0	110.8	L84 L87 T94 V96 K117 V120	L84-V89 HydrophobicContact CD2-CG2 4.05Å; L87-V89 HydrophobicContact CB-CG2 4.06Å; L87-V89 PolarHBondContact O-N 3.35Å; L87-V89 VanDerWaalsContact O-N 3.13Å; V89-T94 WeakPolarHBondContact CA-O 3.05Å; V89-V96 HydrophobicContact CG1-CG2 4.16Å; V89-V96 HydrophobicContact CG2-CG2 3.87Å; V89-K117 HydrophobicContact CB-CB 4.05Å; V89-K117 HydrophobicContact CG2-CB 4.33Å; V89-V120 HydrophobicContact CG1-CG2 4.12Å
90	G	84.8	Confident	88.9	Confident	13 Å²	13	31.1 Å²	31.1	13%	0.134	16%	0.162	C	C	.	.	S	Bend	trans	179.2	161.6	179.7	0	0	0	0	0	113.3	N92 S93 T94	G90-N92 PolarHBondContact O-N 3.01Å; G90-S93 WeakPolarHBondContact CA-OG 3.08Å; G90-S93 PolarHBondContact N-OG 2.95Å; G90-S93 CarbonylContact O-C 3.52Å; G90-S93 PolarHBondContact O-N 2.92Å; G90-S93 PolarHBondContact O-OG 3.26Å; G90-T94 PolarHBondContact N-O 3.36Å; G90-T94 CarbonylContact O-C 3.59Å
91	L	81.4	Confident	89	Confident	88 Å²	88	31.1 Å²	31.1	46%	0.461	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.7	-173	-72.8	172.2	0	0	0	115	R95 T115	L91-R95 PolarHBondContact O-NE 3.31Å; L91-R95 PolarHBondContact O-NH2 3.2Å; L91-T115 HydrophobicContact CD1-CG2 4.05Å; L91-T115 HydrophobicContact CD2-CG2 3.81Å; L91-T115 HydrophobicContact CG-CG2 3.94Å
92	N	80.5	Confident	88.8	Confident	146 Å²	146	29.8 Å²	29.8	78%	0.781	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-13.3	-179.4	-66.1	-24.9	0	0	0	113.3	G90 R155	G90-N92 PolarHBondContact O-N 3.01Å; N92-R155 PolarHBondContact O-NH1 3.29Å
93	S	83.8	Confident	88.7	Confident	16 Å²	16	30.4 Å²	30.4	11%	0.112	16%	0.163	C	C	.	.	S	Bend	trans	-106.1	-117.3	-179.4	48.5	0	0	0	0	109.9	A55 L56 D88 G90 R155	A55-S93 WeakPolarHBondContact CA-O 3.4Å; L56-S93 PolarHBondContact N-O 3.05Å; D88-S93 VanDerWaalsContact O-CB 3.29Å; D88-S93 WeakPolarHBondContact O-CB 3.41Å; D88-S93 PolarHBondContact O-OG 2.93Å; D88-S93 VanDerWaalsContact OD2-CB 3.3Å; D88-S93 WeakPolarHBondContact OD2-CB 3.48Å; G90-S93 WeakPolarHBondContact CA-OG 3.08Å; G90-S93 PolarHBondContact N-OG 2.95Å; G90-S93 CarbonylContact O-C 3.52Å; G90-S93 PolarHBondContact O-N 2.92Å; G90-S93 PolarHBondContact O-OG 3.26Å; S93-R155 VanDerWaalsContact O-CZ 3.32Å; S93-R155 PolarHBondContact O-NH1 2.87Å; S93-R155 PolarHBondContact O-NH2 3.46Å
94	T	88.7	Confident	88.7	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.025	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.9	176.8	-52.1	0	0	0	0	110.3	L56 F58 D88 V89 G90 V96	L56-T94 HydrophobicContact CB-CG2 4.06Å; L56-T94 WeakPolarHBondContact O-CA 3.05Å; F58-T94 HydrophobicContact CB-CG2 4Å; D88-T94 WeakPolarHBondContact O-CB 3.47Å; D88-T94 PolarHBondContact O-N 2.84Å; D88-T94 PolarHBondContact O-OG1 3.34Å; D88-T94 VanDerWaalsContact O-OG1 3.13Å; V89-T94 WeakPolarHBondContact CA-O 3.05Å; G90-T94 PolarHBondContact N-O 3.36Å; G90-T94 CarbonylContact O-C 3.59Å; T94-V96 HydrophobicContact CG2-CG2 3.96Å
95	R	92.8	Very high	89	Confident	55 Å²	55	35.8 Å²	35.8	21%	0.208	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	134.8	166.4	-64.4	178.1	-174.2	-172.1	-2.3	107.8	L56 D57 F58 L91 L111 G153	L56-R95 PolarHBondContact O-N 3.13Å; D57-R95 HydrophobicContact CB-CB 4.16Å; F58-R95 PolarHBondContact N-O 3.13Å; L91-R95 PolarHBondContact O-NE 3.31Å; L91-R95 PolarHBondContact O-NH2 3.2Å; R95-L111 HydrophobicContact CB-CB 4.18Å; R95-L111 HydrophobicContact CB-CD2 3.98Å; R95-L111 WeakPolarHBondContact O-CD2 3.44Å; R95-G153 WeakPolarHBondContact CD-O 3.47Å; R95-G153 PolarHBondContact NH1-O 2.97Å
96	V	94.9	Very high	89.3	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.9	-176.5	-174.9	0	0	0	0	109.4	F58 F60 L84 V89 T94 F109 V120	F58-V96 CarbonylContact O-C 2.89Å; F58-V96 VanDerWaalsContact O-CA 3.29Å; F58-V96 WeakPolarHBondContact O-CA 3.32Å; F60-V96 HydrophobicContact CD2-CG1 3.81Å; F60-V96 HydrophobicContact CE2-CG1 3.8Å; L84-V96 HydrophobicContact CD2-CG1 4.32Å; L84-V96 HydrophobicContact CD2-CG2 4.12Å; V89-V96 HydrophobicContact CG1-CG2 4.16Å; V89-V96 HydrophobicContact CG2-CG2 3.87Å; T94-V96 HydrophobicContact CG2-CG2 3.96Å; V96-F109 HydrophobicContact CG1-CE2 4.28Å; V96-F109 WeakPolarHBondContact O-CE2 3.38Å; V96-V120 HydrophobicContact CB-CG1 4.32Å; V96-V120 HydrophobicContact CG1-CG1 4.05Å
97	G	96.2	Very high	90	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	158.9	166.5	0	0	0	0	0	110.1	F58 V59 F60 F109	F58-G97 PolarHBondContact O-N 3.24Å; V59-G97 WeakPolarHBondContact CA-O 3.42Å; F60-G97 PolarHBondContact N-O 2.79Å; G97-F109 WeakPolarHBondContact CA-O 3.27Å
98	L	97.6	Very high	90.7	Very high	2 Å²	2	38 Å²	38	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	132	174.7	-169.9	154.5	0	0	0	110.2	F60 I80 E108 F109 V124 M127	F60-L98 HydrophobicContact CB-CB 4.25Å; F60-L98 HydrophobicContact CB-CD1 3.98Å; F60-L98 HydrophobicContact CB-CG 3.81Å; F60-L98 HydrophobicContact CG-CD1 4.48Å; F60-L98 WeakPolarHBondContact O-CA 3.36Å; I80-L98 HydrophobicContact CD1-CD1 4.1Å; I80-L98 HydrophobicContact CG2-CD1 4.49Å; L98-E108 HydrophobicContact CD2-CB 3.76Å; L98-E108 HydrophobicContact CD2-CG 3.55Å; L98-E108 PolarHBondContact O-N 3.04Å; L98-F109 HydrophobicContact CB-CD1 4.24Å; L98-F109 HydrophobicContact CB-CD2 4.37Å; L98-F109 HydrophobicContact CB-CE1 3.64Å; L98-F109 HydrophobicContact CB-CE2 3.79Å; L98-F109 HydrophobicContact CB-CZ 3.38Å; L98-F109 HydrophobicContact CD1-CE1 4.32Å; L98-F109 HydrophobicContact CD1-CZ 4.17Å; L98-F109 HydrophobicContact CG-CE1 4.46Å; L98-F109 HydrophobicContact CG-CZ 4.39Å; L98-F109 PolarHBondContact N-O 3.47Å; L98-F109 PolarHBondContact O-N 2.95Å; L98-F109 VanDerWaalsContact O-N 3.15Å; L98-V124 HydrophobicContact CD1-CG2 3.88Å; L98-M127 HydrophobicContact CD1-CE 4.28Å; L98-M127 HydrophobicContact CD1-SD 3.65Å; L98-M127 HydrophobicContact CD2-SD 3.33Å; L98-M127 WeakPolarHBondContact CD2-SD 3.25Å; L98-M127 HydrophobicContact CG-SD 4.17Å
99	L	96.3	Very high	91.2	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.4	166.1	61.1	110.2	0	0	0	109.7	V59 F60 V61 I62 V105 Q106 A139 Y142 A147	V59-L99 HydrophobicContact CG1-CD2 3.79Å; F60-L99 PolarHBondContact O-N 3.01Å; V61-L99 WeakPolarHBondContact CA-O 3.39Å; V61-L99 HydrophobicContact CB-CD1 4.33Å; V61-L99 HydrophobicContact CG1-CD1 3.91Å; V61-L99 HydrophobicContact CG2-CD1 4.11Å; V61-L99 HydrophobicContact CG2-CD2 4.22Å; V61-L99 HydrophobicContact CG2-CG 4.13Å; I62-L99 PolarHBondContact N-O 3.44Å; L99-V105 HydrophobicContact CB-CG1 4.45Å; L99-V105 HydrophobicContact CD1-CG1 3.74Å; L99-Q106 WeakPolarHBondContact CA-O 3.47Å; L99-A139 HydrophobicContact CD1-CB 4.46Å; L99-Y142 HydrophobicContact CD2-CD1 4.09Å; L99-Y142 HydrophobicContact CD2-CE1 4.4Å; L99-A147 HydrophobicContact CD2-CB 4.04Å
100	Q	95.6	Very high	91.6	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	156.3	168.2	58.9	168.7	-25.5	0	0	110.3	I62 S64 Y73 Q106 E108 Q128 L130	I62-Q100 HydrophobicContact CB-CB 4.41Å; I62-Q100 CarbonylContact O-C 3.59Å; I62-Q100 WeakPolarHBondContact O-CA 3.33Å; I62-Q100 WeakPolarHBondContact O-CB 3.46Å; S64-Q100 PolarHBondContact OG-OE1 3.06Å; Y73-Q100 PolarHBondContact OH-OE1 3.23Å; Q100-Q106 HydrophobicContact CG-CB 4.22Å; Q100-Q106 PolarHBondContact N-O 2.9Å; Q100-Q106 PolarHBondContact O-N 3.46Å; Q100-Q106 VanDerWaalsContact O-O 3.12Å; Q100-E108 HydrophobicContact CG-CG 4.13Å; Q100-E108 PolarHBondContact NE2-OE1 2.88Å; Q100-Q128 PolarHBondContact NE2-O 3.2Å; Q100-Q128 PolarHBondContact OE1-O 2.94Å; Q100-L130 HydrophobicContact CG-CD1 4.17Å
101	Y	93.9	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	154	-179.6	74	-83.6	0	0	0	112.6	V61 I62 D63 S64 V104 T134 M135 T136 A139 T169	V61-Y101 HydrophobicContact CG1-CD1 3.94Å; V61-Y101 HydrophobicContact CG1-CE1 3.93Å; I62-Y101 WeakPolarHBondContact O-CD1 3.46Å; I62-Y101 PolarHBondContact O-N 3.17Å; D63-Y101 HydrophobicContact CB-CE1 3.88Å; D63-Y101 HydrophobicContact CB-CE2 4.46Å; S64-Y101 WeakPolarHBondContact CA-O 3.18Å; S64-Y101 WeakPolarHBondContact CB-O 3.27Å; S64-Y101 PolarHBondContact N-O 3.04Å; Y101-V104 CarbonylContact C-O 3.52Å; Y101-V104 WeakPolarHBondContact CA-O 3.36Å; Y101-T134 HydrophobicContact CE2-CG2 4.07Å; Y101-M135 WeakPolarHBondContact CD2-O 3.34Å; Y101-T136 HydrophobicContact CE2-CG2 4.46Å; Y101-T136 WeakPolarHBondContact CE2-OG1 3.48Å; Y101-T136 WeakPolarHBondContact OH-CG2 2.99Å; Y101-T136 PolarHBondContact OH-OG1 3.48Å; Y101-A139 HydrophobicContact CD1-CB 3.66Å; Y101-A139 HydrophobicContact CD2-CB 3.99Å; Y101-A139 HydrophobicContact CE1-CB 4.18Å; Y101-A139 HydrophobicContact CE2-CB 4.48Å; Y101-A139 HydrophobicContact CG-CB 3.55Å; Y101-T169 WeakPolarHBondContact OH-CB 3.28Å; Y101-T169 PolarHBondContact OH-OG1 2.73Å
102	G	90.1	Very high	92.7	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-148	-112.1	169.5	0	0	0	0	0	109.5	V104 T132 G133 M135	G102-V104 PolarHBondContact N-O 2.79Å; G102-T132 WeakPolarHBondContact CA-OG1 3.34Å; G102-G133 CarbonylContact C-O 3.54Å; G102-G133 WeakPolarHBondContact CA-O 3.34Å; G102-G133 CarbonylContact O-C 3.59Å; G102-M135 WeakPolarHBondContact O-CB 3.4Å; G102-M135 WeakPolarHBondContact O-CG 3.44Å; G102-M135 PolarHBondContact O-N 2.78Å
103	S	88.6	Confident	93.3	Very high	66 Å²	66	30.4 Å²	30.4	46%	0.462	17%	0.172	S	C	.	.	S	Bend	trans	-72.6	-17.9	164.2	-68.5	0	0	0	0	113.3	T132 G133	S103-T132 PolarHBondContact N-OG1 2.94Å; S103-G133 WeakPolarHBondContact OG-CA 3.19Å; S103-G133 PolarHBondContact OG-N 2.93Å
104	V	88.9	Confident	93.7	Very high	87 Å²	87	31.6 Å²	31.6	53%	0.527	18%	0.176	S	C	.	.	S	Bend	trans	-134.8	158.4	176	-65.5	0	0	0	0	109.2	Y101 G102	Y101-V104 CarbonylContact C-O 3.52Å; Y101-V104 WeakPolarHBondContact CA-O 3.36Å; G102-V104 PolarHBondContact N-O 2.79Å
105	V	93.7	Very high	93.7	Very high	27 Å²	27	34.7 Å²	34.7	16%	0.164	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.2	171.3	178.9	0	0	0	0	108.9	L99 L138 A139 Y142	L99-V105 HydrophobicContact CB-CG1 4.45Å; L99-V105 HydrophobicContact CD1-CG1 3.74Å; V105-L138 HydrophobicContact CG2-CB 4.44Å; V105-L138 HydrophobicContact CG2-CD2 4.1Å; V105-L138 HydrophobicContact CG2-CG 3.84Å; V105-A139 HydrophobicContact CG2-CB 4.12Å; V105-Y142 HydrophobicContact CB-CG 4.45Å; V105-Y142 HydrophobicContact CG1-CD1 3.79Å; V105-Y142 HydrophobicContact CG1-CD2 4.26Å; V105-Y142 HydrophobicContact CG1-CE1 4.3Å; V105-Y142 HydrophobicContact CG1-CG 3.77Å
106	Q	94.3	Very high	93.6	Very high	75 Å²	75	34.1 Å²	34.1	35%	0.35	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	109.9	176.9	-179.5	170.4	-50.7	0	0	109.4	L99 Q100 E108 L130	L99-Q106 WeakPolarHBondContact CA-O 3.47Å; Q100-Q106 HydrophobicContact CG-CB 4.22Å; Q100-Q106 PolarHBondContact N-O 2.9Å; Q100-Q106 PolarHBondContact O-N 3.46Å; Q100-Q106 VanDerWaalsContact O-O 3.12Å; Q106-E108 PolarHBondContact NE2-OE1 2.77Å; Q106-E108 PolarHBondContact O-N 2.94Å; Q106-L130 HydrophobicContact CB-CD1 4.36Å
107	P	94.4	Very high	93.5	Very high	61 Å²	61	36.8 Å²	36.8	40%	0.396	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.8	169.6	30.8	-33.9	0	0	0	109.4	Y142	P107-Y142 HydrophobicContact CB-CE1 4.42Å
108	E	95.9	Very high	93.3	Very high	57 Å²	57	39.9 Å²	39.9	27%	0.266	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-42	173.1	-63.4	-67	125.9	0	0	110.1	L98 Q100 Q106 M127	L98-E108 HydrophobicContact CD2-CB 3.76Å; L98-E108 HydrophobicContact CD2-CG 3.55Å; L98-E108 PolarHBondContact O-N 3.04Å; Q100-E108 HydrophobicContact CG-CG 4.13Å; Q100-E108 PolarHBondContact NE2-OE1 2.88Å; Q106-E108 PolarHBondContact NE2-OE1 2.77Å; Q106-E108 PolarHBondContact O-N 2.94Å; E108-M127 HydrophobicContact CG-CG 4.14Å; E108-M127 HydrophobicContact CG-SD 4.1Å
109	F	96.3	Very high	93.1	Very high	10 Å²	10	43.9 Å²	43.9	4%	0.044	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	148.1	171.8	53.1	-92.2	0	0	0	112.5	V96 G97 L98 T113 H114 V120 A123 V124	V96-F109 HydrophobicContact CG1-CE2 4.28Å; V96-F109 WeakPolarHBondContact O-CE2 3.38Å; G97-F109 WeakPolarHBondContact CA-O 3.27Å; L98-F109 HydrophobicContact CB-CD1 4.24Å; L98-F109 HydrophobicContact CB-CD2 4.37Å; L98-F109 HydrophobicContact CB-CE1 3.64Å; L98-F109 HydrophobicContact CB-CE2 3.79Å; L98-F109 HydrophobicContact CB-CZ 3.38Å; L98-F109 HydrophobicContact CD1-CE1 4.32Å; L98-F109 HydrophobicContact CD1-CZ 4.17Å; L98-F109 HydrophobicContact CG-CE1 4.46Å; L98-F109 HydrophobicContact CG-CZ 4.39Å; L98-F109 PolarHBondContact N-O 3.47Å; L98-F109 PolarHBondContact O-N 2.95Å; L98-F109 VanDerWaalsContact O-N 3.15Å; F109-T113 HydrophobicContact CB-CG2 3.94Å; F109-H114 AromaticContact CD1-NE2 3.96Å; F109-H114 AromaticContact CD2-CD2 3.78Å; F109-H114 AromaticContact CG-CD2 3.65Å; F109-H114 AromaticContact CG-NE2 3.83Å; F109-V120 HydrophobicContact CE2-CG1 3.95Å; F109-V120 HydrophobicContact CZ-CG1 3.73Å; F109-A123 HydrophobicContact CD1-CB 3.63Å; F109-A123 HydrophobicContact CE1-CB 3.55Å; F109-V124 HydrophobicContact CE1-CG2 4.38Å; F109-V124 HydrophobicContact CZ-CG2 4.29Å
110	S	96.1	Very high	93	Very high	23 Å²	23	43.8 Å²	43.8	16%	0.161	26%	0.255	C	S	.	.			trans	-91.3	167.4	179.3	-59.9	0	0	0	0	112.3	N112 T113 Q152	S110-N112 WeakPolarHBondContact CB-OD1 3.38Å; S110-N112 PolarHBondContact O-N 3.22Å; S110-T113 PolarHBondContact N-OG1 3.27Å; S110-T113 WeakPolarHBondContact O-CB 3.4Å; S110-T113 PolarHBondContact O-N 3.2Å; S110-T113 PolarHBondContact O-OG1 3.44Å; S110-Q152 PolarHBondContact OG-OE1 3.02Å
111	L	94.8	Very high	93	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.4	-176	-66.8	162.8	0	0	0	114.2	D57 F58 V59 R95 A147 F148 Q152 A154	D57-L111 HydrophobicContact CB-CD1 3.99Å; D57-L111 HydrophobicContact CB-CD2 3.74Å; D57-L111 HydrophobicContact CB-CG 4.48Å; F58-L111 VanDerWaalsContact O-CD2 3.3Å; F58-L111 WeakPolarHBondContact O-CD2 3.37Å; V59-L111 HydrophobicContact CG2-CD1 4.26Å; V59-L111 HydrophobicContact CG2-CD2 3.99Å; V59-L111 HydrophobicContact CG2-CG 4.21Å; R95-L111 HydrophobicContact CB-CB 4.18Å; R95-L111 HydrophobicContact CB-CD2 3.98Å; R95-L111 WeakPolarHBondContact O-CD2 3.44Å; L111-A147 WeakPolarHBondContact CD1-O 3.47Å; L111-F148 HydrophobicContact CD1-CD1 4.14Å; L111-F148 HydrophobicContact CD1-CE1 4.36Å; L111-Q152 WeakPolarHBondContact CB-O 3.41Å; L111-Q152 PolarHBondContact N-O 3Å; L111-A154 HydrophobicContact CD1-CB 3.71Å
112	N	92.7	Very high	93.1	Very high	77 Å²	77	49.3 Å²	49.3	41%	0.412	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-5.4	176	55.8	9.6	0	0	0	114.6	S110 E151 Q152	S110-N112 WeakPolarHBondContact CB-OD1 3.38Å; S110-N112 PolarHBondContact O-N 3.22Å; N112-E151 PolarHBondContact ND2-O 3.36Å; N112-Q152 PolarHBondContact N-O 3.02Å; N112-Q152 PolarHBondContact OD1-O 3.14Å
113	T	93.8	Very high	93.3	Very high	70 Å²	70	50.5 Å²	50.5	43%	0.429	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-36.8	-172.2	-49.4	0	0	0	0	113.3	F109 S110	F109-T113 HydrophobicContact CB-CG2 3.94Å; S110-T113 PolarHBondContact N-OG1 3.27Å; S110-T113 WeakPolarHBondContact O-CB 3.4Å; S110-T113 PolarHBondContact O-N 3.2Å; S110-T113 PolarHBondContact O-OG1 3.44Å
114	H	93.2	Very high	93.7	Very high	41 Å²	41	47.3 Å²	47.3	19%	0.19	27%	0.268	C	S	.	.			trans	-123.9	133	-176.1	-64	-32.5	0	0	0	110.9	F109 Q119 V120 A123	F109-H114 AromaticContact CD1-NE2 3.96Å; F109-H114 AromaticContact CD2-CD2 3.78Å; F109-H114 AromaticContact CG-CD2 3.65Å; F109-H114 AromaticContact CG-NE2 3.83Å; H114-Q119 HydrophobicContact CB-CB 4.03Å; H114-V120 HydrophobicContact CB-CG2 3.61Å; H114-A123 WeakPolarHBondContact NE2-CB 3.37Å
115	T	88	Confident	93.9	Very high	70 Å²	70	48.1 Å²	48.1	43%	0.429	26%	0.262	S	S	.	.			trans	-108.8	-5.1	-172.8	64	0	0	0	0	113.1	L91 Q119	L91-T115 HydrophobicContact CD1-CG2 4.05Å; L91-T115 HydrophobicContact CD2-CG2 3.81Å; L91-T115 HydrophobicContact CG-CG2 3.94Å; T115-Q119 VanDerWaalsContact N-OE1 3.15Å
116	S	91.1	Very high	94	Very high	43 Å²	43	51.8 Å²	51.8	30%	0.301	28%	0.28	S	S	.	.	S	Bend	trans	-139.5	146.7	-179.3	67.1	0	0	0	0	111.6	A118 Q119 V120	S116-A118 VanDerWaalsContact C-N 3.27Å; S116-A118 PolarHBondContact O-N 2.87Å; S116-Q119 PolarHBondContact O-N 3.32Å; S116-Q119 VanDerWaalsContact O-N 3.16Å; S116-Q119 VanDerWaalsContact OG-CD 3.23Å; S116-Q119 WeakPolarHBondContact OG-CG 3.35Å; S116-Q119 PolarHBondContact OG-OE1 3.38Å; S116-V120 PolarHBondContact O-N 3.19Å
117	K	91.6	Very high	94	Very high	56 Å²	56	48.4 Å²	48.4	24%	0.243	27%	0.265	C	S	.	.	H	α-helix	trans	-52.4	-41	177.4	-179.2	174.6	156.7	-169	0	113.5	L84 Q85 V89 Q119 V120 E121	L84-K117 WeakPolarHBondContact O-CD 3.32Å; L84-K117 WeakPolarHBondContact O-CE 3.41Å; Q85-K117 PolarHBondContact O-NZ 3.4Å; V89-K117 HydrophobicContact CB-CB 4.05Å; V89-K117 HydrophobicContact CG2-CB 4.33Å; K117-Q119 VanDerWaalsContact C-N 3.31Å; K117-Q119 PolarHBondContact O-N 3.37Å; K117-V120 PolarHBondContact O-N 2.85Å; K117-E121 WeakPolarHBondContact CE-OE1 3.48Å; K117-E121 HydrophobicContact CG-CG 4.38Å; K117-E121 WeakPolarHBondContact O-CG 3.26Å; K117-E121 PolarHBondContact O-N 2.88Å
118	A	93	Very high	93.8	Very high	67 Å²	67	52.9 Å²	52.9	55%	0.554	28%	0.28	S	S	*	.	H	α-helix	trans	-62.2	-36.5	-178.8	0	0	0	0	0	113	S116 E122	S116-A118 VanDerWaalsContact C-N 3.27Å; S116-A118 PolarHBondContact O-N 2.87Å; A118-E122 WeakPolarHBondContact O-CB 3.16Å; A118-E122 PolarHBondContact O-N 2.86Å; A118-E122 VanDerWaalsContact O-N 3.15Å
119	Q	94.1	Very high	93.7	Very high	86 Å²	86	52.6 Å²	52.6	40%	0.402	28%	0.279	S	S	.	.	H	α-helix	trans	-68.4	-43.2	174.9	-69.6	164.9	-40.1	0	0	111.5	H114 T115 S116 K117 E122 A123	H114-Q119 HydrophobicContact CB-CB 4.03Å; T115-Q119 VanDerWaalsContact N-OE1 3.15Å; S116-Q119 PolarHBondContact O-N 3.32Å; S116-Q119 VanDerWaalsContact O-N 3.16Å; S116-Q119 VanDerWaalsContact OG-CD 3.23Å; S116-Q119 WeakPolarHBondContact OG-CG 3.35Å; S116-Q119 PolarHBondContact OG-OE1 3.38Å; K117-Q119 VanDerWaalsContact C-N 3.31Å; K117-Q119 PolarHBondContact O-N 3.37Å; Q119-E122 PolarHBondContact O-N 3.03Å; Q119-A123 PolarHBondContact O-N 3Å
120	V	94.2	Very high	93.3	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-62.2	-46.6	177.6	-179.8	0	0	0	0	111	L84 V89 V96 F109 H114 S116 K117 E122 A123 V124	L84-V120 HydrophobicContact CD1-CB 4.48Å; L84-V120 HydrophobicContact CD1-CG1 3.65Å; L84-V120 HydrophobicContact CD2-CG1 3.98Å; V89-V120 HydrophobicContact CG1-CG2 4.12Å; V96-V120 HydrophobicContact CB-CG1 4.32Å; V96-V120 HydrophobicContact CG1-CG1 4.05Å; F109-V120 HydrophobicContact CE2-CG1 3.95Å; F109-V120 HydrophobicContact CZ-CG1 3.73Å; H114-V120 HydrophobicContact CB-CG2 3.61Å; S116-V120 PolarHBondContact O-N 3.19Å; K117-V120 PolarHBondContact O-N 2.85Å; V120-E122 VanDerWaalsContact C-N 3.27Å; V120-E122 PolarHBondContact O-N 3.05Å; V120-A123 PolarHBondContact O-N 3.29Å; V120-V124 VanDerWaalsContact O-CG2 3.25Å; V120-V124 WeakPolarHBondContact O-CG2 3.44Å; V120-V124 PolarHBondContact O-N 2.68Å
121	E	94.9	Very high	92.8	Very high	29 Å²	29	54.6 Å²	54.6	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-37.5	176.3	-73	-177.3	-159	0	0	112.6	I81 L84 Q85 K117 V124 R125	I81-E121 HydrophobicContact CG2-CG 4.37Å; L84-E121 HydrophobicContact CD1-CG 4.28Å; Q85-E121 PolarHBondContact NE2-OE1 3.39Å; K117-E121 WeakPolarHBondContact CE-OE1 3.48Å; K117-E121 HydrophobicContact CG-CG 4.38Å; K117-E121 WeakPolarHBondContact O-CG 3.26Å; K117-E121 PolarHBondContact O-N 2.88Å; E121-V124 PolarHBondContact O-N 3.43Å; E121-R125 WeakPolarHBondContact O-CG 3.34Å; E121-R125 PolarHBondContact O-N 2.03Å; E121-R125 IonicContact OE2-NH1 2.69Å; E121-R125 PolarHBondContact OE2-NH1 3.14Å; E121-R125 IonicContact OE2-NH2 3.19Å
122	E	95.1	Very high	92.5	Very high	88 Å²	88	57.1 Å²	57.1	41%	0.411	31%	0.308	S	S	.	.	H	α-helix	trans	-72.3	-39.2	179.5	-167.9	54.8	-150.3	0	0	112.2	A118 Q119 V120 V124 R125 N126	A118-E122 WeakPolarHBondContact O-CB 3.16Å; A118-E122 PolarHBondContact O-N 2.86Å; A118-E122 VanDerWaalsContact O-N 3.15Å; Q119-E122 PolarHBondContact O-N 3.03Å; V120-E122 VanDerWaalsContact C-N 3.27Å; V120-E122 PolarHBondContact O-N 3.05Å; E122-V124 VanDerWaalsContact C-N 3.34Å; E122-V124 PolarHBondContact O-N 2.82Å; E122-R125 PolarHBondContact O-N 2.81Å; E122-R125 IonicContact OE2-CZ 2.68Å; E122-R125 IonicContact OE2-NE 2.84Å; E122-R125 PolarHBondContact OE2-NE 2.85Å; E122-R125 IonicContact OE2-NH2 2.58Å; E122-R125 PolarHBondContact OE2-NH2 3.07Å; E122-N126 PolarHBondContact O-N 2.89Å; E122-N126 PolarHBondContact O-ND2 3.11Å; E122-N126 PolarHBondContact OE1-ND2 3.48Å
123	A	95.1	Very high	92.2	Very high	24 Å²	24	54 Å²	54	20%	0.198	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-45.5	170.3	0	0	0	0	0	111.3	F109 H114 Q119 V120 R125 N126 M127	F109-A123 HydrophobicContact CD1-CB 3.63Å; F109-A123 HydrophobicContact CE1-CB 3.55Å; H114-A123 WeakPolarHBondContact NE2-CB 3.37Å; Q119-A123 PolarHBondContact O-N 3Å; V120-A123 PolarHBondContact O-N 3.29Å; A123-R125 PolarHBondContact O-N 3.2Å; A123-N126 PolarHBondContact O-N 3Å; A123-N126 VanDerWaalsContact O-N 3.17Å; A123-M127 WeakPolarHBondContact O-CG 3.44Å; A123-M127 PolarHBondContact O-N 2.93Å
124	V	96.1	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-39.5	177.2	172.2	0	0	0	0	112.5	K77 I80 I81 L84 L98 F109 V120 E121 E122 N126 M127	K77-V124 HydrophobicContact CB-CG1 4.23Å; I80-V124 HydrophobicContact CB-CG1 4.06Å; I80-V124 HydrophobicContact CG2-CG1 3.93Å; I80-V124 HydrophobicContact CG2-CG2 3.76Å; I81-V124 HydrophobicContact CD1-CG1 4.12Å; I81-V124 HydrophobicContact CG1-CB 4.35Å; I81-V124 HydrophobicContact CG1-CG1 3.78Å; L84-V124 HydrophobicContact CD1-CG2 4.42Å; L98-V124 HydrophobicContact CD1-CG2 3.88Å; F109-V124 HydrophobicContact CE1-CG2 4.38Å; F109-V124 HydrophobicContact CZ-CG2 4.29Å; V120-V124 VanDerWaalsContact O-CG2 3.25Å; V120-V124 WeakPolarHBondContact O-CG2 3.44Å; V120-V124 PolarHBondContact O-N 2.68Å; E121-V124 PolarHBondContact O-N 3.43Å; E122-V124 VanDerWaalsContact C-N 3.34Å; E122-V124 PolarHBondContact O-N 2.82Å; V124-N126 VanDerWaalsContact C-N 3.32Å; V124-N126 PolarHBondContact O-N 3.08Å; V124-M127 HydrophobicContact CB-CE 4.49Å; V124-M127 HydrophobicContact CG1-CE 3.98Å
125	R	94.6	Very high	91.7	Very high	103 Å²	103	51.7 Å²	51.7	39%	0.389	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-40.7	175.9	-79	-175.4	-79.5	-90	0.5	112.1	K77 I81 E121 E122 A123	K77-R125 PolarHBondContact NZ-O 3.15Å; I81-R125 HydrophobicContact CD1-CG 3.71Å; E121-R125 WeakPolarHBondContact O-CG 3.34Å; E121-R125 PolarHBondContact O-N 2.03Å; E121-R125 IonicContact OE2-NH1 2.69Å; E121-R125 PolarHBondContact OE2-NH1 3.14Å; E121-R125 IonicContact OE2-NH2 3.19Å; E122-R125 PolarHBondContact O-N 2.81Å; E122-R125 IonicContact OE2-CZ 2.68Å; E122-R125 IonicContact OE2-NE 2.84Å; E122-R125 PolarHBondContact OE2-NE 2.85Å; E122-R125 IonicContact OE2-NH2 2.58Å; E122-R125 PolarHBondContact OE2-NH2 3.07Å; A123-R125 PolarHBondContact O-N 3.2Å
126	N	94.9	Very high	91.8	Very high	105 Å²	105	48.4 Å²	48.4	56%	0.561	26%	0.26	S	S	*	.	H	α-helix	trans	-83.8	-3.6	-173.9	-69.6	-61	0	0	0	115.1	E122 A123 V124	E122-N126 PolarHBondContact O-N 2.89Å; E122-N126 PolarHBondContact O-ND2 3.11Å; E122-N126 PolarHBondContact OE1-ND2 3.48Å; A123-N126 PolarHBondContact O-N 3Å; A123-N126 VanDerWaalsContact O-N 3.17Å; V124-N126 VanDerWaalsContact C-N 3.32Å; V124-N126 PolarHBondContact O-N 3.08Å
127	M	93.8	Very high	91.8	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.02	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-59.1	137.4	177.8	-59.3	-175.1	-49.3	0	0	112.6	K77 I80 L98 E108 A123 V124	K77-M127 WeakPolarHBondContact CE-O 3.39Å; K77-M127 HydrophobicContact CG-CE 3.86Å; K77-M127 PolarHBondContact NZ-O 3.04Å; I80-M127 HydrophobicContact CD1-CE 4.32Å; L98-M127 HydrophobicContact CD1-CE 4.28Å; L98-M127 HydrophobicContact CD1-SD 3.65Å; L98-M127 HydrophobicContact CD2-SD 3.33Å; L98-M127 WeakPolarHBondContact CD2-SD 3.25Å; L98-M127 HydrophobicContact CG-SD 4.17Å; E108-M127 HydrophobicContact CG-CG 4.14Å; E108-M127 HydrophobicContact CG-SD 4.1Å; A123-M127 WeakPolarHBondContact O-CG 3.44Å; A123-M127 PolarHBondContact O-N 2.93Å; V124-M127 HydrophobicContact CB-CE 4.49Å; V124-M127 HydrophobicContact CG1-CE 3.98Å
128	Q	91.8	Very high	91.8	Very high	155 Å²	155	47 Å²	47	72%	0.724	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-103.5	135.4	178.2	-60.7	-173.4	6.8	0	0	111.2	Q100	Q100-Q128 PolarHBondContact NE2-O 3.2Å; Q100-Q128 PolarHBondContact OE1-O 2.94Å
129	H	92.5	Very high	91.8	Very high	51 Å²	51	43.8 Å²	43.8	24%	0.236	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-74.4	128.1	179.5	178	-130.2	0	0	0	111.2	S64 S65 I68 Y73	S64-H129 PolarHBondContact O-CD2 2.94Å; S64-H129 PolarHBondContact O-NE2 2.77Å; S64-H129 PolarHBondContact OG-CD2 3.05Å; S65-H129 PolarHBondContact O-NE2 3.18Å; I68-H129 PolarHBondContact O-CE1 2.89Å; I68-H129 PolarHBondContact O-NE2 2.66Å; Y73-H129 HydrophobicContact CD1-CB 3.87Å; Y73-H129 HydrophobicContact CD2-CB 4.41Å; Y73-H129 AromaticContact CD2-CD2 3.58Å; Y73-H129 HydrophobicContact CE1-CB 4.01Å; Y73-H129 AromaticContact CE2-CD2 3.93Å; Y73-H129 HydrophobicContact CG-CB 4.08Å; Y73-H129 AromaticContact CG-CD2 3.91Å
130	L	89.1	Confident	91.8	Very high	42 Å²	42	39.9 Å²	39.9	22%	0.22	21%	0.206	C	C	.	.			trans	-80.7	-32.4	-173.6	-58.1	179.1	0	0	0	113.1	S64 Q100 Q106 T132	S64-L130 PolarHBondContact OG-N 2.87Å; Q100-L130 HydrophobicContact CG-CD1 4.17Å; Q106-L130 HydrophobicContact CB-CD1 4.36Å; L130-T132 VanDerWaalsContact C-N 3.27Å; L130-T132 PolarHBondContact O-N 2.88Å
131	A	85.4	Confident	91.8	Very high	32 Å²	32	43 Å²	43	26%	0.264	22%	0.221	S	C	.	.			trans	52.7	35.1	-179	0	0	0	0	0	115.4	S64 R66	S64-A131 PolarHBondContact O-N 2.93Å; R66-A131 PolarHBondContact NE-O 3.36Å; R66-A131 PolarHBondContact NH2-O 2.83Å
132	T	87.1	Confident	91.8	Very high	55 Å²	55	44.6 Å²	44.6	34%	0.337	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-104	-154.9	179.3	55.8	0	0	0	0	112.5	S65 R66 G102 S103 L130	S65-T132 CarbonylContact C-O 3.54Å; S65-T132 WeakPolarHBondContact CA-O 3.48Å; R66-T132 WeakPolarHBondContact CB-O 3.31Å; R66-T132 PolarHBondContact N-O 2.84Å; G102-T132 WeakPolarHBondContact CA-OG1 3.34Å; S103-T132 PolarHBondContact N-OG1 2.94Å; L130-T132 VanDerWaalsContact C-N 3.27Å; L130-T132 PolarHBondContact O-N 2.88Å
133	G	86.7	Confident	91.8	Very high	12 Å²	12	40.6 Å²	40.6	12%	0.124	21%	0.208	C	C	.	.			trans	-72.6	-159.8	179.1	0	0	0	0	0	113.8	S65 G102 S103	S65-G133 WeakPolarHBondContact CB-O 3.34Å; G102-G133 CarbonylContact C-O 3.54Å; G102-G133 WeakPolarHBondContact CA-O 3.34Å; G102-G133 CarbonylContact O-C 3.59Å; S103-G133 WeakPolarHBondContact OG-CA 3.19Å; S103-G133 PolarHBondContact OG-N 2.93Å
134	T	86.8	Confident	91.7	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.049	21%	0.207	C	C	.	.			trans	-139.4	77.2	-173.9	-44.7	0	0	0	0	111.6	D63 S65 Y101 T136 Q174	D63-T134 WeakPolarHBondContact OD2-CG2 3.47Å; S65-T134 WeakPolarHBondContact CB-OG1 3.44Å; S65-T134 PolarHBondContact OG-OG1 2.9Å; Y101-T134 HydrophobicContact CE2-CG2 4.07Å; T134-T136 PolarHBondContact O-N 3.45Å; T134-Q174 PolarHBondContact O-N 2.84Å
135	M	90	Very high	91.5	Very high	55 Å²	55	46.2 Å²	46.2	27%	0.271	23%	0.23	S	C	.	.			trans	-93	74.8	180	-59	-63.6	-67.7	0	0	111.1	Y101 G102 L138 A139 Q174 D175	Y101-M135 WeakPolarHBondContact CD2-O 3.34Å; G102-M135 WeakPolarHBondContact O-CB 3.4Å; G102-M135 WeakPolarHBondContact O-CG 3.44Å; G102-M135 PolarHBondContact O-N 2.78Å; M135-L138 HydrophobicContact CB-CB 4Å; M135-L138 HydrophobicContact CB-CD2 4.34Å; M135-A139 PolarHBondContact O-N 3.1Å; M135-Q174 HydrophobicContact SD-CB 4.1Å; M135-D175 WeakPolarHBondContact CA-OD2 3.03Å; M135-D175 HydrophobicContact CE-CB 3.7Å; M135-D175 HydrophobicContact SD-CB 4.25Å
136	T	89.8	Confident	91.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-73	-34.7	-174.7	-51.1	0	0	0	0	112	Y101 T134 A139 I140 I167 D175 V177 I207	Y101-T136 HydrophobicContact CE2-CG2 4.46Å; Y101-T136 WeakPolarHBondContact CE2-OG1 3.48Å; Y101-T136 WeakPolarHBondContact OH-CG2 2.99Å; Y101-T136 PolarHBondContact OH-OG1 3.48Å; T134-T136 PolarHBondContact O-N 3.45Å; T136-A139 PolarHBondContact O-N 3.23Å; T136-I140 HydrophobicContact CG2-CD1 4.17Å; T136-I140 VanDerWaalsContact O-CG1 3.3Å; T136-I140 WeakPolarHBondContact O-CG1 3.34Å; T136-I140 PolarHBondContact O-N 3Å; T136-I167 HydrophobicContact CG2-CG2 4.45Å; T136-D175 PolarHBondContact N-OD1 3.22Å; T136-D175 PolarHBondContact N-OD2 2.93Å; T136-V177 HydrophobicContact CG2-CG1 4.33Å; T136-I207 HydrophobicContact CG2-CD1 4.05Å
137	G	90.4	Very high	91.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.2	-47.5	175.8	0	0	0	0	0	111.3	A139 I140 Q141 D175	G137-A139 VanDerWaalsContact C-N 3.29Å; G137-A139 PolarHBondContact O-N 3.46Å; G137-I140 PolarHBondContact O-N 2.98Å; G137-I140 VanDerWaalsContact O-N 3.16Å; G137-Q141 PolarHBondContact O-N 3.42Å; G137-D175 VanDerWaalsContact CA-OD2 3.26Å; G137-D175 WeakPolarHBondContact CA-OD2 3.46Å; G137-D175 PolarHBondContact N-OD1 3.08Å; G137-D175 PolarHBondContact N-OD2 2.87Å
138	L	91.9	Very high	91.6	Very high	68 Å²	68	38.9 Å²	38.9	36%	0.356	20%	0.202	S	C	.	.	H	α-helix	trans	-58.1	-39.4	173.7	-176	65.4	0	0	0	112.3	V105 M135 Q141 Y142 D175	V105-L138 HydrophobicContact CG2-CB 4.44Å; V105-L138 HydrophobicContact CG2-CD2 4.1Å; V105-L138 HydrophobicContact CG2-CG 3.84Å; M135-L138 HydrophobicContact CB-CB 4Å; M135-L138 HydrophobicContact CB-CD2 4.34Å; L138-Q141 PolarHBondContact O-N 3.39Å; L138-Y142 WeakPolarHBondContact O-CB 3.34Å; L138-Y142 PolarHBondContact O-N 2.98Å; L138-D175 PolarHBondContact N-OD2 3.22Å
139	A	93.8	Very high	91.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66	-39.4	176.5	0	0	0	0	0	112.7	V61 L99 Y101 V105 M135 T136 G137 T143	V61-A139 HydrophobicContact CG1-CB 3.96Å; L99-A139 HydrophobicContact CD1-CB 4.46Å; Y101-A139 HydrophobicContact CD1-CB 3.66Å; Y101-A139 HydrophobicContact CD2-CB 3.99Å; Y101-A139 HydrophobicContact CE1-CB 4.18Å; Y101-A139 HydrophobicContact CE2-CB 4.48Å; Y101-A139 HydrophobicContact CG-CB 3.55Å; V105-A139 HydrophobicContact CG2-CB 4.12Å; M135-A139 PolarHBondContact O-N 3.1Å; T136-A139 PolarHBondContact O-N 3.23Å; G137-A139 VanDerWaalsContact C-N 3.29Å; G137-A139 PolarHBondContact O-N 3.46Å; A139-T143 WeakPolarHBondContact O-CB 3.45Å; A139-T143 PolarHBondContact O-N 3Å; A139-T143 PolarHBondContact O-OG1 2.95Å
140	I	94.1	Very high	91.7	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-44	174.6	-64.1	164.8	0	0	0	110.4	T136 G137 T143 M144 I167 I180 A181 A184 I191 I207	T136-I140 HydrophobicContact CG2-CD1 4.17Å; T136-I140 VanDerWaalsContact O-CG1 3.3Å; T136-I140 WeakPolarHBondContact O-CG1 3.34Å; T136-I140 PolarHBondContact O-N 3Å; G137-I140 PolarHBondContact O-N 2.98Å; G137-I140 VanDerWaalsContact O-N 3.16Å; I140-T143 WeakPolarHBondContact O-CB 3.3Å; I140-T143 PolarHBondContact O-N 3.27Å; I140-M144 PolarHBondContact O-N 3.05Å; I140-I167 HydrophobicContact CD1-CD1 4.01Å; I140-I167 HydrophobicContact CG1-CD1 3.63Å; I140-I180 HydrophobicContact CB-CG2 4.13Å; I140-I180 HydrophobicContact CG2-CG2 3.89Å; I140-A181 HydrophobicContact CD1-CB 4.25Å; I140-A184 HydrophobicContact CG2-CB 3.86Å; I140-I191 HydrophobicContact CG2-CD1 4.5Å; I140-I207 HydrophobicContact CD1-CG1 4.16Å; I140-I207 HydrophobicContact CD1-CG2 3.92Å
141	Q	94.1	Very high	91.9	Very high	67 Å²	67	42.4 Å²	42.4	31%	0.313	22%	0.22	S	C	.	.	H	α-helix	trans	-59	-51.7	177.1	-172.7	177.3	5.7	0	0	111.1	G137 L138 T143 M144 E145 I180	G137-Q141 PolarHBondContact O-N 3.42Å; L138-Q141 PolarHBondContact O-N 3.39Å; Q141-T143 VanDerWaalsContact C-N 3.25Å; Q141-T143 PolarHBondContact O-N 2.75Å; Q141-M144 PolarHBondContact O-N 3.06Å; Q141-M144 VanDerWaalsContact O-N 3.07Å; Q141-E145 VanDerWaalsContact CG-CD 3.48Å; Q141-E145 HydrophobicContact CG-CG 4.19Å; Q141-E145 VanDerWaalsContact CG-OE1 3.27Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.28Å; Q141-E145 PolarHBondContact NE2-OE1 3.48Å; Q141-E145 WeakPolarHBondContact O-CB 3.3Å; Q141-E145 PolarHBondContact O-N 3.25Å; Q141-I180 HydrophobicContact CB-CG2 3.79Å
142	Y	95.1	Very high	92.3	Very high	62 Å²	62	43.5 Å²	43.5	24%	0.243	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-37.2	176.5	-173.4	-83.8	0	0	0	112.3	L99 V105 P107 L138 M144 V146 A147	L99-Y142 HydrophobicContact CD2-CD1 4.09Å; L99-Y142 HydrophobicContact CD2-CE1 4.4Å; V105-Y142 HydrophobicContact CB-CG 4.45Å; V105-Y142 HydrophobicContact CG1-CD1 3.79Å; V105-Y142 HydrophobicContact CG1-CD2 4.26Å; V105-Y142 HydrophobicContact CG1-CE1 4.3Å; V105-Y142 HydrophobicContact CG1-CG 3.77Å; P107-Y142 HydrophobicContact CB-CE1 4.42Å; L138-Y142 WeakPolarHBondContact O-CB 3.34Å; L138-Y142 PolarHBondContact O-N 2.98Å; Y142-M144 VanDerWaalsContact C-N 3.34Å; Y142-M144 PolarHBondContact O-N 3.32Å; Y142-V146 HydrophobicContact CD1-CB 4.25Å; Y142-V146 HydrophobicContact CD2-CB 4.18Å; Y142-V146 HydrophobicContact CD2-CG2 3.94Å; Y142-V146 HydrophobicContact CE1-CB 4.01Å; Y142-V146 HydrophobicContact CE1-CG1 4.08Å; Y142-V146 HydrophobicContact CE2-CB 3.95Å; Y142-V146 HydrophobicContact CE2-CG1 4Å; Y142-V146 HydrophobicContact CE2-CG2 3.88Å; Y142-V146 HydrophobicContact CG-CB 4.32Å; Y142-V146 HydrophobicContact CG-CG2 4.42Å; Y142-V146 WeakPolarHBondContact O-CA 3.08Å; Y142-V146 WeakPolarHBondContact O-CB 3.44Å; Y142-V146 PolarHBondContact O-N 3.45Å; Y142-A147 PolarHBondContact O-N 2.81Å
143	T	94.6	Very high	92.5	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.025	21%	0.206	C	C	.	.	I	π-helix	trans	-62	-42.5	175.9	-59.4	0	0	0	0	111.5	V59 V61 A139 I140 Q141 F148 A165	V59-T143 HydrophobicContact CG1-CG2 4.4Å; V61-T143 HydrophobicContact CG2-CG2 4.2Å; V61-T143 VanDerWaalsContact CG2-OG1 3.32Å; V61-T143 WeakPolarHBondContact CG2-OG1 3.41Å; A139-T143 WeakPolarHBondContact O-CB 3.45Å; A139-T143 PolarHBondContact O-N 3Å; A139-T143 PolarHBondContact O-OG1 2.95Å; I140-T143 WeakPolarHBondContact O-CB 3.3Å; I140-T143 PolarHBondContact O-N 3.27Å; Q141-T143 VanDerWaalsContact C-N 3.25Å; Q141-T143 PolarHBondContact O-N 2.75Å; T143-F148 HydrophobicContact CG2-CD2 3.82Å; T143-F148 HydrophobicContact CG2-CE2 3.63Å; T143-F148 WeakPolarHBondContact O-CD2 3.31Å; T143-F148 PolarHBondContact O-N 3.3Å; T143-F148 VanDerWaalsContact O-N 3.17Å; T143-A165 HydrophobicContact CG2-CB 4.06Å
144	M	92.9	Very high	92.8	Very high	38 Å²	38	40.7 Å²	40.7	19%	0.187	20%	0.201	C	C	.	.	I	π-helix	trans	-72.1	-50.6	178.6	177.9	175.4	66.6	0	0	113	I140 Q141 Y142 E183 A184 A187 I189	I140-M144 PolarHBondContact O-N 3.05Å; Q141-M144 PolarHBondContact O-N 3.06Å; Q141-M144 VanDerWaalsContact O-N 3.07Å; Y142-M144 VanDerWaalsContact C-N 3.34Å; Y142-M144 PolarHBondContact O-N 3.32Å; M144-E183 HydrophobicContact CE-CB 4.05Å; M144-E183 HydrophobicContact SD-CB 4.09Å; M144-A184 HydrophobicContact CB-CB 4.39Å; M144-A184 VanDerWaalsContact SD-CA 3.59Å; M144-A184 HydrophobicContact SD-CB 4.18Å; M144-A187 HydrophobicContact CG-CB 4.29Å; M144-A187 HydrophobicContact SD-CB 4Å; M144-I189 HydrophobicContact CB-CD1 3.83Å; M144-I189 HydrophobicContact CG-CD1 3.95Å
145	E	92.6	Very high	93	Very high	105 Å²	105	41.1 Å²	41.1	49%	0.491	20%	0.202	S	C	.	.	I	π-helix	trans	-81.5	-28.4	-170.5	-67.9	179.3	-177	0	0	113.5	Q141 T149	Q141-E145 VanDerWaalsContact CG-CD 3.48Å; Q141-E145 HydrophobicContact CG-CG 4.19Å; Q141-E145 VanDerWaalsContact CG-OE1 3.27Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.28Å; Q141-E145 PolarHBondContact NE2-OE1 3.48Å; Q141-E145 WeakPolarHBondContact O-CB 3.3Å; Q141-E145 PolarHBondContact O-N 3.25Å; E145-T149 WeakPolarHBondContact O-CG2 3.46Å
146	V	94.9	Very high	92.9	Very high	42 Å²	42	40.4 Å²	40.4	26%	0.255	20%	0.202	S	C	.	.	I	π-helix	trans	-120.2	-58.6	-173.5	-173.4	0	0	0	0	111.6	Y142 F148 T149 Q152	Y142-V146 HydrophobicContact CD1-CB 4.25Å; Y142-V146 HydrophobicContact CD2-CB 4.18Å; Y142-V146 HydrophobicContact CD2-CG2 3.94Å; Y142-V146 HydrophobicContact CE1-CB 4.01Å; Y142-V146 HydrophobicContact CE1-CG1 4.08Å; Y142-V146 HydrophobicContact CE2-CB 3.95Å; Y142-V146 HydrophobicContact CE2-CG1 4Å; Y142-V146 HydrophobicContact CE2-CG2 3.88Å; Y142-V146 HydrophobicContact CG-CB 4.32Å; Y142-V146 HydrophobicContact CG-CG2 4.42Å; Y142-V146 WeakPolarHBondContact O-CA 3.08Å; Y142-V146 WeakPolarHBondContact O-CB 3.44Å; Y142-V146 PolarHBondContact O-N 3.45Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.46Å; V146-T149 WeakPolarHBondContact O-CB 3.48Å; V146-T149 WeakPolarHBondContact O-CG2 3.19Å; V146-T149 PolarHBondContact O-N 3.35Å; V146-T149 VanDerWaalsContact O-N 3.09Å; V146-T149 PolarHBondContact O-OG1 2.87Å; V146-Q152 HydrophobicContact CG1-CG 3.99Å; V146-Q152 WeakPolarHBondContact O-CG 3.49Å
147	A	95	Very high	92.5	Very high	12 Å²	12	46.5 Å²	46.5	10%	0.099	23%	0.228	C	C	.	.	I	π-helix	trans	-64	-31.9	-169.6	0	0	0	0	0	113.7	V59 L99 L111 Y142	V59-A147 HydrophobicContact CG1-CB 4.32Å; V59-A147 HydrophobicContact CG2-CB 4.35Å; L99-A147 HydrophobicContact CD2-CB 4.04Å; L111-A147 WeakPolarHBondContact CD1-O 3.47Å; Y142-A147 PolarHBondContact O-N 2.81Å
148	F	95.3	Very high	92	Very high	3 Å²	3	51.2 Å²	51.2	1%	0.013	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	22.7	176.4	-76.4	-60.7	0	0	0	115	D57 V59 L111 T143 V146 A154 R163 A165 I189	D57-F148 WeakPolarHBondContact O-CE1 3.23Å; V59-F148 HydrophobicContact CB-CE1 4.48Å; V59-F148 HydrophobicContact CB-CE2 4.18Å; V59-F148 HydrophobicContact CB-CZ 3.83Å; V59-F148 HydrophobicContact CG2-CD1 4.33Å; V59-F148 HydrophobicContact CG2-CE1 3.69Å; V59-F148 HydrophobicContact CG2-CE2 4.03Å; V59-F148 HydrophobicContact CG2-CZ 3.51Å; L111-F148 HydrophobicContact CD1-CD1 4.14Å; L111-F148 HydrophobicContact CD1-CE1 4.36Å; T143-F148 HydrophobicContact CG2-CD2 3.82Å; T143-F148 HydrophobicContact CG2-CE2 3.63Å; T143-F148 WeakPolarHBondContact O-CD2 3.31Å; T143-F148 PolarHBondContact O-N 3.3Å; T143-F148 VanDerWaalsContact O-N 3.17Å; V146-F148 VanDerWaalsContact C-N 3.3Å; V146-F148 PolarHBondContact O-N 3.46Å; F148-A154 VanDerWaalsContact C-CB 3.5Å; F148-A154 HydrophobicContact CD1-CB 4.39Å; F148-A154 WeakPolarHBondContact O-CB 3.3Å; F148-R163 HydrophobicContact CD1-CB 3.81Å; F148-R163 HydrophobicContact CD1-CG 3.75Å; F148-R163 HydrophobicContact CE1-CB 3.67Å; F148-R163 HydrophobicContact CE1-CG 3.99Å; F148-R163 HydrophobicContact CE2-CB 4.46Å; F148-R163 HydrophobicContact CG-CB 4.28Å; F148-R163 HydrophobicContact CG-CG 4.39Å; F148-R163 HydrophobicContact CZ-CB 4.02Å; F148-R163 PolarHBondContact O-NH1 2.99Å; F148-A165 HydrophobicContact CE2-CB 4.32Å; F148-I189 HydrophobicContact CD2-CD1 3.79Å; F148-I189 HydrophobicContact CD2-CG1 4.02Å; F148-I189 HydrophobicContact CD2-CG2 4.08Å; F148-I189 HydrophobicContact CE2-CD1 4.46Å; F148-I189 HydrophobicContact CE2-CG1 4.42Å; F148-I189 HydrophobicContact CE2-CG2 3.65Å; F148-I189 HydrophobicContact CZ-CG2 4.44Å
149	T	93.8	Very high	91.3	Very high	40 Å²	40	53 Å²	53	25%	0.245	27%	0.27	C	S	.	.	S	Bend	trans	-83	156.2	170.5	61.9	0	0	0	0	112.3	E145 V146 E151 Q152 G153 A154	E145-T149 WeakPolarHBondContact O-CG2 3.46Å; V146-T149 WeakPolarHBondContact O-CB 3.48Å; V146-T149 WeakPolarHBondContact O-CG2 3.19Å; V146-T149 PolarHBondContact O-N 3.35Å; V146-T149 VanDerWaalsContact O-N 3.09Å; V146-T149 PolarHBondContact O-OG1 2.87Å; T149-E151 VanDerWaalsContact C-N 3.26Å; T149-E151 PolarHBondContact O-N 2.84Å; T149-Q152 PolarHBondContact O-N 2.65Å; T149-Q152 VanDerWaalsContact OG1-CG 3.32Å; T149-Q152 WeakPolarHBondContact OG1-CG 3.37Å; T149-Q152 PolarHBondContact OG1-N 2.54Å; T149-G153 PolarHBondContact O-N 2.77Å; T149-A154 WeakPolarHBondContact O-CB 3.4Å; T149-A154 PolarHBondContact O-N 3.16Å
150	E	92.6	Very high	90.4	Very high	119 Å²	119	61.4 Å²	61.4	56%	0.556	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.7	175.8	-63.1	-177.6	-157.5	0	0	111.6	G153 A154 P156	E150-G153 PolarHBondContact O-N 3.5Å; E150-A154 WeakPolarHBondContact CA-O 3.23Å; E150-P156 VanDerWaalsContact OE1-CA 3.25Å; E150-P156 WeakPolarHBondContact OE1-CA 3.24Å; E150-P156 WeakPolarHBondContact OE1-CB 3.38Å
151	E	92.2	Very high	89.9	Confident	164 Å²	164	62.8 Å²	62.8	77%	0.766	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-41	173.5	-61	-177	-179.5	0	0	112.4	N112 T149 G153	N112-E151 PolarHBondContact ND2-O 3.36Å; T149-E151 VanDerWaalsContact C-N 3.26Å; T149-E151 PolarHBondContact O-N 2.84Å; E151-G153 PolarHBondContact O-N 3.35Å
152	Q	95	Very high	89.5	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.252	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	5.2	174.7	-60.5	-53.4	-40	0	0	113.5	S110 L111 N112 V146 T149	S110-Q152 PolarHBondContact OG-OE1 3.02Å; L111-Q152 WeakPolarHBondContact CB-O 3.41Å; L111-Q152 PolarHBondContact N-O 3Å; N112-Q152 PolarHBondContact N-O 3.02Å; N112-Q152 PolarHBondContact OD1-O 3.14Å; V146-Q152 HydrophobicContact CG1-CG 3.99Å; V146-Q152 WeakPolarHBondContact O-CG 3.49Å; T149-Q152 PolarHBondContact O-N 2.65Å; T149-Q152 VanDerWaalsContact OG1-CG 3.32Å; T149-Q152 WeakPolarHBondContact OG1-CG 3.37Å; T149-Q152 PolarHBondContact OG1-N 2.54Å
153	G	91.4	Very high	89.3	Confident	5 Å²	5	58.8 Å²	58.8	5%	0.052	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	4.8	172.1	0	0	0	0	0	116.1	R95 T149 E150 E151	R95-G153 WeakPolarHBondContact CD-O 3.47Å; R95-G153 PolarHBondContact NH1-O 2.97Å; T149-G153 PolarHBondContact O-N 2.77Å; E150-G153 PolarHBondContact O-N 3.5Å; E151-G153 PolarHBondContact O-N 3.35Å
154	A	92.2	Very high	89.2	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.025	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.9	147.8	170.9	0	0	0	0	0	110.6	D57 L111 F148 T149 E150	D57-A154 WeakPolarHBondContact OD2-CA 3.44Å; L111-A154 HydrophobicContact CD1-CB 3.71Å; F148-A154 VanDerWaalsContact C-CB 3.5Å; F148-A154 HydrophobicContact CD1-CB 4.39Å; F148-A154 WeakPolarHBondContact O-CB 3.3Å; T149-A154 WeakPolarHBondContact O-CB 3.4Å; T149-A154 PolarHBondContact O-N 3.16Å; E150-A154 WeakPolarHBondContact CA-O 3.23Å
155	R	91.3	Very high	89.3	Confident	17 Å²	17	57 Å²	57	6%	0.064	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-78.3	148	178.6	-82.8	170.1	-73.1	-158	-8.1	111.4	L56 D57 N92 S93 L159 I161 R163	L56-R155 PolarHBondContact O-NH2 3.46Å; D57-R155 IonicContact OD1-CZ 2.7Å; D57-R155 IonicContact OD1-NE 2.71Å; D57-R155 PolarHBondContact OD1-NE 3.2Å; D57-R155 IonicContact OD1-NH2 3.9Å; D57-R155 PolarHBondContact OD1-NH2 2.93Å; D57-R155 PolarHBondContact OD2-N 3.25Å; N92-R155 PolarHBondContact O-NH1 3.29Å; S93-R155 VanDerWaalsContact O-CZ 3.32Å; S93-R155 PolarHBondContact O-NH1 2.87Å; S93-R155 PolarHBondContact O-NH2 3.46Å; R155-L159 HydrophobicContact CB-CD1 4.46Å; R155-I161 HydrophobicContact CB-CB 4.08Å; R155-I161 HydrophobicContact CB-CG1 3.78Å; R155-I161 HydrophobicContact CB-CG2 4.39Å; R155-I161 HydrophobicContact CG-CG1 4.49Å; R155-R163 PolarHBondContact O-NH2 3.43Å
156	P	87.3	Confident	89.4	Confident	41 Å²	41	52 Å²	52	27%	0.266	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-54.6	140	-179.4	-27	32.3	0	0	0	113.2	E150 S158 L159	E150-P156 VanDerWaalsContact OE1-CA 3.25Å; E150-P156 WeakPolarHBondContact OE1-CA 3.24Å; E150-P156 WeakPolarHBondContact OE1-CB 3.38Å; P156-S158 PolarHBondContact O-N 3.37Å; P156-L159 PolarHBondContact O-N 2.9Å
157	K	81.4	Confident	89.4	Confident	129 Å²	129	50.1 Å²	50.1	56%	0.561	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-57.5	-26.4	-179.4	-68.9	-170.8	178.5	-170.6	0	112.5	L159 Q160	K157-L159 VanDerWaalsContact C-N 3.27Å; K157-L159 PolarHBondContact O-N 3.41Å; K157-Q160 PolarHBondContact O-N 2.98Å; K157-Q160 VanDerWaalsContact O-N 3.11Å
158	S	79.6	Confident	89.3	Confident	98 Å²	98	49.7 Å²	49.7	69%	0.685	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-61.8	-28	175.2	56	0	0	0	0	114.3	P156 Q160	P156-S158 PolarHBondContact O-N 3.37Å; S158-Q160 VanDerWaalsContact C-N 3.26Å; S158-Q160 PolarHBondContact O-N 3.17Å
159	L	77.8	Confident	89.2	Confident	106 Å²	106	49.7 Å²	49.7	56%	0.555	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-80	-5.9	176.6	-62.5	-178.3	0	0	0	113.2	R155 P156 K157 I161	R155-L159 HydrophobicContact CB-CD1 4.46Å; P156-L159 PolarHBondContact O-N 2.9Å; K157-L159 VanDerWaalsContact C-N 3.27Å; K157-L159 PolarHBondContact O-N 3.41Å; L159-I161 HydrophobicContact CB-CD1 4.37Å; L159-I161 HydrophobicContact CB-CG1 3.88Å; L159-I161 PolarHBondContact O-N 2.81Å; L159-I161 VanDerWaalsContact O-N 3.15Å
160	Q	75.6	Confident	88.7	Confident	176 Å²	176	49 Å²	49	82%	0.822	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	32.2	-179.5	-56.3	-178.1	22.7	0	0	113.7	K157 S158	K157-Q160 PolarHBondContact O-N 2.98Å; K157-Q160 VanDerWaalsContact O-N 3.11Å; S158-Q160 VanDerWaalsContact C-N 3.26Å; S158-Q160 PolarHBondContact O-N 3.17Å
161	I	83.1	Confident	87.7	Confident	34 Å²	34	44 Å²	44	17%	0.174	23%	0.23	C	C	.	.			trans	-69.1	128.9	174.4	-59.3	-51.3	0	0	0	109.5	A55 R155 L159	A55-I161 HydrophobicContact CB-CD1 3.72Å; R155-I161 HydrophobicContact CB-CB 4.08Å; R155-I161 HydrophobicContact CB-CG1 3.78Å; R155-I161 HydrophobicContact CB-CG2 4.39Å; R155-I161 HydrophobicContact CG-CG1 4.49Å; L159-I161 HydrophobicContact CB-CD1 4.37Å; L159-I161 HydrophobicContact CB-CG1 3.88Å; L159-I161 PolarHBondContact O-N 2.81Å; L159-I161 VanDerWaalsContact O-N 3.15Å
162	P	85.9	Confident	87.1	Confident	21 Å²	21	44 Å²	44	14%	0.136	22%	0.222	C	C	.	.			trans	-60.8	138.2	176	-21.6	32.8	0	0	0	111.7	A55 L56 D57 I164 P258	A55-P162 WeakPolarHBondContact O-CD 3.48Å; L56-P162 HydrophobicContact CD2-CB 3.78Å; L56-P162 HydrophobicContact CD2-CG 3.72Å; D57-P162 VanDerWaalsContact CA-O 3.25Å; D57-P162 WeakPolarHBondContact CA-O 2.97Å; D57-P162 PolarHBondContact N-O 2.94Å; P162-I164 HydrophobicContact CB-CG1 4.48Å; P162-P258 HydrophobicContact CB-CB 4.17Å; P162-P258 HydrophobicContact CG-CB 3.32Å; P162-P258 HydrophobicContact CG-CG 3.44Å; P162-P258 VanDerWaalsContact CG-CG 3.44Å
163	R	90.9	Very high	86.6	Confident	24 Å²	24	42.9 Å²	42.9	9%	0.091	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	114.4	175	-66	174.6	-179.7	-154.2	-7.9	108.1	D57 F148 R155 I189 Q190	D57-R163 CarbonylContact O-C 3.56Å; D57-R163 WeakPolarHBondContact O-CA 3.41Å; F148-R163 HydrophobicContact CD1-CB 3.81Å; F148-R163 HydrophobicContact CD1-CG 3.75Å; F148-R163 HydrophobicContact CE1-CB 3.67Å; F148-R163 HydrophobicContact CE1-CG 3.99Å; F148-R163 HydrophobicContact CE2-CB 4.46Å; F148-R163 HydrophobicContact CG-CB 4.28Å; F148-R163 HydrophobicContact CG-CG 4.39Å; F148-R163 HydrophobicContact CZ-CB 4.02Å; F148-R163 PolarHBondContact O-NH1 2.99Å; R155-R163 PolarHBondContact O-NH2 3.43Å; R163-I189 HydrophobicContact CB-CG1 4.44Å; R163-Q190 PolarHBondContact O-N 2.9Å
164	I	91.9	Very high	86.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	118.5	-172.1	-58	-179.9	0	0	0	108.9	L56 D57 F58 V59 P162 Q190 F192 L236 A259	L56-I164 HydrophobicContact CD2-CD1 4.21Å; D57-I164 PolarHBondContact O-N 3.14Å; F58-I164 HydrophobicContact CD2-CB 3.92Å; F58-I164 HydrophobicContact CD2-CG2 3.9Å; F58-I164 HydrophobicContact CE2-CB 4.22Å; F58-I164 HydrophobicContact CE2-CG2 3.66Å; F58-I164 HydrophobicContact CZ-CG2 4.44Å; V59-I164 PolarHBondContact N-O 3Å; P162-I164 HydrophobicContact CB-CG1 4.48Å; I164-Q190 CarbonylContact C-O 3.59Å; I164-Q190 WeakPolarHBondContact CA-O 3.28Å; I164-Q190 HydrophobicContact CG1-CB 4.4Å; I164-F192 HydrophobicContact CG2-CD2 3.59Å; I164-F192 HydrophobicContact CG2-CE2 3.68Å; I164-L236 HydrophobicContact CD1-CD2 3.92Å; I164-A259 HydrophobicContact CD1-CB 4.07Å
165	A	95	Very high	85.7	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.025	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.1	170.3	0	0	0	0	0	109.5	V59 T143 F148 I189 Q190 I191 F192	V59-A165 WeakPolarHBondContact O-CA 3.27Å; T143-A165 HydrophobicContact CG2-CB 4.06Å; F148-A165 HydrophobicContact CE2-CB 4.32Å; A165-I189 HydrophobicContact CB-CG2 3.98Å; A165-Q190 PolarHBondContact N-O 3.21Å; A165-I191 HydrophobicContact CB-CG1 4.46Å; A165-I191 WeakPolarHBondContact O-CA 3.44Å; A165-F192 PolarHBondContact O-N 3.13Å
166	M	94.6	Very high	85.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	107.2	170	177.6	173.3	-75.5	0	0	109.3	F58 V59 F60 V61 F79 L83 V168 I194 F232	F58-M166 HydrophobicContact CE1-CB 4.02Å; F58-M166 HydrophobicContact CZ-CB 3.77Å; F58-M166 HydrophobicContact CZ-CE 4.1Å; F58-M166 HydrophobicContact CZ-SD 4.37Å; V59-M166 PolarHBondContact O-N 2.92Å; F60-M166 HydrophobicContact CD1-CB 4.27Å; F60-M166 HydrophobicContact CD1-CG 4.39Å; F60-M166 HydrophobicContact CD1-SD 4.09Å; F60-M166 HydrophobicContact CE1-SD 3.71Å; V61-M166 PolarHBondContact N-O 3.48Å; F79-M166 HydrophobicContact CE1-SD 3.82Å; F79-M166 HydrophobicContact CZ-SD 4.07Å; L83-M166 HydrophobicContact CD2-CE 3.66Å; L83-M166 HydrophobicContact CD2-SD 3.77Å; M166-V168 HydrophobicContact CG-CG2 4.41Å; M166-I194 HydrophobicContact CE-CD1 4.18Å; M166-I194 HydrophobicContact CG-CD1 3.96Å; M166-I194 HydrophobicContact SD-CD1 3.86Å; M166-F232 HydrophobicContact CE-CD1 3.49Å; M166-F232 VanDerWaalsContact CE-CD1 3.49Å; M166-F232 HydrophobicContact CE-CD2 3.88Å; M166-F232 HydrophobicContact CE-CE1 3.34Å; M166-F232 HydrophobicContact CE-CE2 3.75Å; M166-F232 HydrophobicContact CE-CG 3.77Å; M166-F232 HydrophobicContact CE-CZ 3.5Å; M166-F232 VanDerWaalsContact CE-CZ 3.5Å
167	I	95	Very high	85.5	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	123.9	179.8	-55.8	176	0	0	0	108.7	V61 T136 I140 I191 F192 I194 I207	V61-I167 HydrophobicContact CB-CB 4.46Å; V61-I167 HydrophobicContact CB-CG1 3.93Å; V61-I167 HydrophobicContact CG1-CG1 4.12Å; V61-I167 HydrophobicContact CG1-CG2 4.37Å; V61-I167 HydrophobicContact CG2-CG1 4.38Å; V61-I167 WeakPolarHBondContact O-CA 3.49Å; T136-I167 HydrophobicContact CG2-CG2 4.45Å; I140-I167 HydrophobicContact CD1-CD1 4.01Å; I140-I167 HydrophobicContact CG1-CD1 3.63Å; I167-I191 HydrophobicContact CD1-CG2 3.46Å; I167-I191 VanDerWaalsContact CD1-CG2 3.46Å; I167-I191 HydrophobicContact CG1-CG2 4.06Å; I167-F192 PolarHBondContact N-O 2.91Å; I167-I194 PolarHBondContact O-N 2.89Å; I167-I207 HydrophobicContact CD1-CG2 3.56Å
168	V	94.1	Very high	85.7	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.6	174.4	-175.8	0	0	0	0	108.4	V61 I62 D63 V76 M166 I194 V196 I225	V61-V168 PolarHBondContact O-N 3.16Å; I62-V168 HydrophobicContact CD1-CB 4.05Å; I62-V168 HydrophobicContact CD1-CG2 3.82Å; D63-V168 WeakPolarHBondContact CB-O 3.44Å; D63-V168 PolarHBondContact N-O 3.33Å; V76-V168 HydrophobicContact CG1-CG1 4.44Å; M166-V168 HydrophobicContact CG-CG2 4.41Å; V168-I194 WeakPolarHBondContact CA-O 3.39Å; V168-I194 HydrophobicContact CG2-CB 4.32Å; V168-I194 HydrophobicContact CG2-CD1 4.19Å; V168-V196 HydrophobicContact CG1-CG2 4.32Å; V168-I225 HydrophobicContact CG1-CD1 3.79Å
169	T	92	Very high	86.1	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	149.8	-178.9	-177	0	0	0	0	112.4	D63 Y101 I194 G195 V196 L204	D63-T169 WeakPolarHBondContact OD2-CA 3.42Å; D63-T169 WeakPolarHBondContact OD2-CB 3.3Å; D63-T169 PolarHBondContact OD2-OG1 3.35Å; Y101-T169 WeakPolarHBondContact OH-CB 3.28Å; Y101-T169 PolarHBondContact OH-OG1 2.73Å; T169-I194 PolarHBondContact N-O 3.18Å; T169-G195 CarbonylContact O-C 3.5Å; T169-G195 WeakPolarHBondContact O-CA 3.34Å; T169-V196 PolarHBondContact O-N 3Å; T169-L204 HydrophobicContact CG2-CD1 4.3Å
170	D	84.1	Confident	86.7	Confident	25 Å²	25	48.8 Å²	48.8	13%	0.134	24%	0.239	C	C	.	.	S	Bend	trans	-112	-7.4	179.7	89.6	-33.4	0	0	0	114.6	S67 I68 V196 V199 F222	S67-D170 WeakPolarHBondContact CB-OD1 3.46Å; S67-D170 VanDerWaalsContact CB-OD2 3.24Å; S67-D170 WeakPolarHBondContact CB-OD2 3.32Å; S67-D170 PolarHBondContact OG-OD1 3.34Å; S67-D170 PolarHBondContact OG-OD2 3.25Å; I68-D170 HydrophobicContact CD1-CB 4.41Å; I68-D170 HydrophobicContact CG1-CB 4.05Å; I68-D170 VanDerWaalsContact CG1-CG 3.41Å; I68-D170 WeakPolarHBondContact CG1-OD2 3.45Å; I68-D170 PolarHBondContact N-OD2 3.28Å; D170-V196 VanDerWaalsContact CA-O 3.3Å; D170-V196 WeakPolarHBondContact CA-O 3.41Å; D170-V196 HydrophobicContact CB-CB 4.33Å; D170-V199 VanDerWaalsContact C-CG2 3.48Å; D170-V199 WeakPolarHBondContact O-CG2 3.01Å; D170-F222 HydrophobicContact CB-CE2 4.1Å; D170-F222 HydrophobicContact CB-CZ 3.75Å
171	G	72.1	Confident	87.5	Confident	15 Å²	15	40.4 Å²	40.4	16%	0.155	20%	0.2	C	C	.	.	S	Bend	trans	-123.1	-178.8	-169.1	0	0	0	0	0	114.6
172	R	79.4	Confident	87.7	Confident	163 Å²	163	40.2 Å²	40.2	62%	0.615	20%	0.204	S	C	*	.			trans	-83.9	140.2	161.6	-66.3	-176.8	-174.2	176.4	-0.6	108.4	E200	R172-E200 IonicContact CZ-OE1 3.16Å; R172-E200 IonicContact NE-OE1 2.66Å; R172-E200 PolarHBondContact NE-OE1 2.98Å; R172-E200 IonicContact NH1-OE1 2.82Å; R172-E200 IonicContact NH2-OE1 3.69Å; R172-E200 PolarHBondContact NH2-OE1 3.21Å
173	P	83.7	Confident	87.9	Confident	30 Å²	30	44.3 Å²	44.3	20%	0.195	22%	0.221	C	C	.	.			trans	-61.2	148.7	172.1	29.8	-36	0	0	0	110.5	D175 V177 T203	P173-D175 VanDerWaalsContact C-N 3.34Å; P173-V177 HydrophobicContact CB-CG1 3.59Å; P173-V177 HydrophobicContact CG-CG1 3.75Å; P173-V177 HydrophobicContact CG-CG2 4.04Å; P173-T203 HydrophobicContact CG-CG2 3.74Å
174	Q	81.6	Confident	88	Confident	131 Å²	131	43.3 Å²	43.3	61%	0.612	22%	0.218	S	C	*	.	S	Bend	trans	-92.4	-4	174	-65.1	177.5	-19.6	0	0	111.9	T134 M135	T134-Q174 PolarHBondContact O-N 2.84Å; M135-Q174 HydrophobicContact SD-CB 4.1Å
175	D	84.3	Confident	87.9	Confident	33 Å²	33	46.7 Å²	46.7	18%	0.176	23%	0.231	C	C	.	.	S	Bend	trans	-126.4	171.3	-179.8	54.5	-4.1	0	0	0	112.3	M135 T136 G137 L138 P173	M135-D175 WeakPolarHBondContact CA-OD2 3.03Å; M135-D175 HydrophobicContact CE-CB 3.7Å; M135-D175 HydrophobicContact SD-CB 4.25Å; T136-D175 PolarHBondContact N-OD1 3.22Å; T136-D175 PolarHBondContact N-OD2 2.93Å; G137-D175 VanDerWaalsContact CA-OD2 3.26Å; G137-D175 WeakPolarHBondContact CA-OD2 3.46Å; G137-D175 PolarHBondContact N-OD1 3.08Å; G137-D175 PolarHBondContact N-OD2 2.87Å; L138-D175 PolarHBondContact N-OD2 3.22Å; P173-D175 VanDerWaalsContact C-N 3.34Å
176	T	85.3	Confident	87.4	Confident	97 Å²	97	54.7 Å²	54.7	60%	0.595	27%	0.267	S	S	*	.			trans	-76.5	124.7	177.5	45.4	0	0	0	0	110.7
177	V	88.2	Confident	87	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.281	C	S	.	.			trans	-113	-24.9	-175.1	-65.2	0	0	0	0	113.6	T136 P173 E179 A181 T203 I207	T136-V177 HydrophobicContact CG2-CG1 4.33Å; P173-V177 HydrophobicContact CB-CG1 3.59Å; P173-V177 HydrophobicContact CG-CG1 3.75Å; P173-V177 HydrophobicContact CG-CG2 4.04Å; V177-E179 PolarHBondContact O-N 3.43Å; V177-A181 WeakPolarHBondContact O-CB 3.34Å; V177-A181 PolarHBondContact O-N 3.35Å; V177-T203 HydrophobicContact CG2-CG2 3.81Å; V177-I207 HydrophobicContact CB-CD1 4.38Å; V177-I207 HydrophobicContact CB-CG1 4.05Å; V177-I207 HydrophobicContact CG1-CD1 4.48Å; V177-I207 HydrophobicContact CG2-CD1 4.26Å; V177-I207 HydrophobicContact CG2-CG1 4.01Å
178	E	86	Confident	86.5	Confident	89 Å²	89	58.5 Å²	58.5	42%	0.416	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-48.9	-171.6	-74.7	62.2	-155.9	0	0	112.8	A182 A206	E178-A182 PolarHBondContact O-N 2.99Å; E178-A206 HydrophobicContact CG-CB 3.92Å
179	E	88	Confident	86.3	Confident	144 Å²	144	58.7 Å²	58.7	67%	0.673	31%	0.306	S	S	*	.	H	α-helix	trans	-74	-52.6	-176	-65.2	176.4	168.4	0	0	111	V177 A181 A182 E183	V177-E179 PolarHBondContact O-N 3.43Å; E179-A181 VanDerWaalsContact C-N 3.29Å; E179-A181 PolarHBondContact O-N 3.44Å; E179-A182 WeakPolarHBondContact O-CA 3.17Å; E179-A182 VanDerWaalsContact O-CB 3.29Å; E179-A182 WeakPolarHBondContact O-CB 3.45Å; E179-A182 PolarHBondContact O-N 2.94Å; E179-E183 PolarHBondContact O-N 3.4Å
180	I	90.8	Very high	86.2	Confident	29 Å²	29	59.8 Å²	59.8	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-39.2	179.7	-53.8	177.5	0	0	0	111.2	I140 Q141 A182 E183 A184	I140-I180 HydrophobicContact CB-CG2 4.13Å; I140-I180 HydrophobicContact CG2-CG2 3.89Å; Q141-I180 HydrophobicContact CB-CG2 3.79Å; I180-A182 VanDerWaalsContact C-N 3.32Å; I180-A182 PolarHBondContact O-N 3.18Å; I180-E183 PolarHBondContact O-N 2.89Å; I180-A184 WeakPolarHBondContact O-CB 3.47Å; I180-A184 PolarHBondContact O-N 2.99Å
181	A	91.7	Very high	86.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-69.3	-28.5	174.7	0	0	0	0	0	112.9	I140 V177 E179 R185 A206	I140-A181 HydrophobicContact CD1-CB 4.25Å; V177-A181 WeakPolarHBondContact O-CB 3.34Å; V177-A181 PolarHBondContact O-N 3.35Å; E179-A181 VanDerWaalsContact C-N 3.29Å; E179-A181 PolarHBondContact O-N 3.44Å; A181-R185 VanDerWaalsContact C-CZ 3.49Å; A181-R185 VanDerWaalsContact O-CG 3.27Å; A181-R185 WeakPolarHBondContact O-CG 3.4Å; A181-R185 PolarHBondContact O-N 2.86Å; A181-R185 PolarHBondContact O-NE 3.32Å; A181-R185 PolarHBondContact O-NH1 3.46Å; A181-A206 WeakPolarHBondContact CB-O 3.32Å
182	A	87.4	Confident	87.7	Confident	31 Å²	31	58 Å²	58	26%	0.256	30%	0.297	S	S	.	.	H	α-helix	trans	-67.9	-48.2	172.1	0	0	0	0	0	111.1	E178 E179 I180 A184 R185 E186	E178-A182 PolarHBondContact O-N 2.99Å; E179-A182 WeakPolarHBondContact O-CA 3.17Å; E179-A182 VanDerWaalsContact O-CB 3.29Å; E179-A182 WeakPolarHBondContact O-CB 3.45Å; E179-A182 PolarHBondContact O-N 2.94Å; I180-A182 VanDerWaalsContact C-N 3.32Å; I180-A182 PolarHBondContact O-N 3.18Å; A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 3.46Å; A182-R185 VanDerWaalsContact CA-NH2 3.25Å; A182-R185 WeakPolarHBondContact O-CB 3.49Å; A182-R185 PolarHBondContact O-N 2.81Å; A182-R185 VanDerWaalsContact O-N 3.13Å; A182-E186 WeakPolarHBondContact O-CG 3.34Å; A182-E186 PolarHBondContact O-N 2.94Å
183	E	90.9	Very high	88.4	Confident	107 Å²	107	50.2 Å²	50.2	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-57.7	-45.1	175.8	-67	179.1	-170.2	0	0	112	M144 E179 I180 R185 E186 A187	M144-E183 HydrophobicContact CE-CB 4.05Å; M144-E183 HydrophobicContact SD-CB 4.09Å; E179-E183 PolarHBondContact O-N 3.4Å; I180-E183 PolarHBondContact O-N 2.89Å; E183-R185 VanDerWaalsContact C-N 3.32Å; E183-R185 PolarHBondContact O-N 3.33Å; E183-E186 PolarHBondContact O-N 2.92Å; E183-E186 VanDerWaalsContact O-N 3.17Å; E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.31Å
184	A	91.1	Very high	88.8	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-39.2	176.7	0	0	0	0	0	112.7	I140 M144 I180 A182 A187 I189 I191	I140-A184 HydrophobicContact CG2-CB 3.86Å; M144-A184 HydrophobicContact CB-CB 4.39Å; M144-A184 VanDerWaalsContact SD-CA 3.59Å; M144-A184 HydrophobicContact SD-CB 4.18Å; I180-A184 WeakPolarHBondContact O-CB 3.47Å; I180-A184 PolarHBondContact O-N 2.99Å; A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 3.46Å; A184-A187 PolarHBondContact O-N 2.83Å; A184-I189 HydrophobicContact CB-CD1 4.38Å; A184-I189 VanDerWaalsContact O-CB 3.26Å; A184-I189 WeakPolarHBondContact O-CB 3.49Å; A184-I189 PolarHBondContact O-N 2.89Å; A184-I191 HydrophobicContact CB-CD1 3.91Å
185	R	90	Very high	89.3	Confident	72 Å²	72	42.6 Å²	42.6	27%	0.272	23%	0.23	S	C	.	.	H	α-helix	trans	-66.7	-41.7	173.7	-72.3	-179.1	-61	-101.6	2.5	112.1	A181 A182 E183 A187 G188 I191 A206 I207 G208	A181-R185 VanDerWaalsContact C-CZ 3.49Å; A181-R185 VanDerWaalsContact O-CG 3.27Å; A181-R185 WeakPolarHBondContact O-CG 3.4Å; A181-R185 PolarHBondContact O-N 2.86Å; A181-R185 PolarHBondContact O-NE 3.32Å; A181-R185 PolarHBondContact O-NH1 3.46Å; A182-R185 VanDerWaalsContact CA-NH2 3.25Å; A182-R185 WeakPolarHBondContact O-CB 3.49Å; A182-R185 PolarHBondContact O-N 2.81Å; A182-R185 VanDerWaalsContact O-N 3.13Å; E183-R185 VanDerWaalsContact C-N 3.32Å; E183-R185 PolarHBondContact O-N 3.33Å; R185-A187 VanDerWaalsContact C-N 3.33Å; R185-G188 PolarHBondContact O-N 2.9Å; R185-G188 VanDerWaalsContact O-N 3.11Å; R185-I191 HydrophobicContact CG-CD1 4.27Å; R185-A206 PolarHBondContact NH1-O 2.91Å; R185-A206 PolarHBondContact NH2-O 2.99Å; R185-I207 PolarHBondContact NH1-O 2.84Å; R185-G208 PolarHBondContact NH1-O 2.8Å
186	E	86	Confident	89.6	Confident	170 Å²	170	41.1 Å²	41.1	79%	0.794	22%	0.222	S	C	*	.	H	α-helix	trans	-67.5	-33	177	-71.3	-173.6	-178	0	0	112.5	A182 E183 G188	A182-E186 WeakPolarHBondContact O-CG 3.34Å; A182-E186 PolarHBondContact O-N 2.94Å; E183-E186 PolarHBondContact O-N 2.92Å; E183-E186 VanDerWaalsContact O-N 3.17Å; E186-G188 PolarHBondContact O-N 3.23Å; E186-G188 VanDerWaalsContact O-N 3.08Å
187	A	84.6	Confident	89.5	Confident	34 Å²	34	38 Å²	38	28%	0.281	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-6.7	171.3	0	0	0	0	0	113.9	M144 E183 A184 R185 I189	M144-A187 HydrophobicContact CG-CB 4.29Å; M144-A187 HydrophobicContact SD-CB 4Å; E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.31Å; A184-A187 PolarHBondContact O-N 2.83Å; R185-A187 VanDerWaalsContact C-N 3.33Å; A187-I189 HydrophobicContact CB-CD1 4.5Å
188	G	84.7	Confident	89	Confident	51 Å²	51	49.5 Å²	49.5	53%	0.526	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	16.5	178.7	0	0	0	0	0	114.3	R185 E186	R185-G188 PolarHBondContact O-N 2.9Å; R185-G188 VanDerWaalsContact O-N 3.11Å; E186-G188 PolarHBondContact O-N 3.23Å; E186-G188 VanDerWaalsContact O-N 3.08Å
189	I	91	Very high	88.7	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.7	177.1	-54.2	164.4	0	0	0	108.9	M144 F148 R163 A165 A184 A187 I191	M144-I189 HydrophobicContact CB-CD1 3.83Å; M144-I189 HydrophobicContact CG-CD1 3.95Å; F148-I189 HydrophobicContact CD2-CD1 3.79Å; F148-I189 HydrophobicContact CD2-CG1 4.02Å; F148-I189 HydrophobicContact CD2-CG2 4.08Å; F148-I189 HydrophobicContact CE2-CD1 4.46Å; F148-I189 HydrophobicContact CE2-CG1 4.42Å; F148-I189 HydrophobicContact CE2-CG2 3.65Å; F148-I189 HydrophobicContact CZ-CG2 4.44Å; R163-I189 HydrophobicContact CB-CG1 4.44Å; A165-I189 HydrophobicContact CB-CG2 3.98Å; A184-I189 HydrophobicContact CB-CD1 4.38Å; A184-I189 VanDerWaalsContact O-CB 3.26Å; A184-I189 WeakPolarHBondContact O-CB 3.49Å; A184-I189 PolarHBondContact O-N 2.89Å; A187-I189 HydrophobicContact CB-CD1 4.5Å; I189-I191 HydrophobicContact CG2-CG1 4.34Å
190	Q	90.3	Very high	88.1	Confident	26 Å²	26	42.6 Å²	42.6	12%	0.121	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.7	178.8	-171.7	177.2	1.2	0	0	109.7	R163 I164 A165 F192 H215	R163-Q190 PolarHBondContact O-N 2.9Å; I164-Q190 CarbonylContact C-O 3.59Å; I164-Q190 WeakPolarHBondContact CA-O 3.28Å; I164-Q190 HydrophobicContact CG1-CB 4.4Å; A165-Q190 PolarHBondContact N-O 3.21Å; Q190-F192 HydrophobicContact CG-CE2 4.16Å; Q190-H215 PolarHBondContact NE2-NE2 2.89Å
191	I	93.3	Very high	87.7	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.5	-172.5	-55.4	176.7	0	0	0	109.6	I140 A165 I167 A184 R185 I189 I207 S209 H215	I140-I191 HydrophobicContact CG2-CD1 4.5Å; A165-I191 HydrophobicContact CB-CG1 4.46Å; A165-I191 WeakPolarHBondContact O-CA 3.44Å; I167-I191 HydrophobicContact CD1-CG2 3.46Å; I167-I191 VanDerWaalsContact CD1-CG2 3.46Å; I167-I191 HydrophobicContact CG1-CG2 4.06Å; A184-I191 HydrophobicContact CB-CD1 3.91Å; R185-I191 HydrophobicContact CG-CD1 4.27Å; I189-I191 HydrophobicContact CG2-CG1 4.34Å; I191-I207 HydrophobicContact CG2-CG2 3.87Å; I191-S209 PolarHBondContact N-OG 3.23Å; I191-S209 PolarHBondContact O-N 3.32Å; I191-H215 WeakPolarHBondContact O-CB 3.45Å
192	F	92.9	Very high	87.1	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	116.1	164.7	-70.1	-92.1	0	0	0	109	I164 A165 I167 Q190 H215 F232 K235	I164-F192 HydrophobicContact CG2-CD2 3.59Å; I164-F192 HydrophobicContact CG2-CE2 3.68Å; A165-F192 PolarHBondContact O-N 3.13Å; I167-F192 PolarHBondContact N-O 2.91Å; Q190-F192 HydrophobicContact CG-CE2 4.16Å; F192-H215 CarbonylContact C-O 3.47Å; F192-H215 WeakPolarHBondContact CA-O 3.04Å; F192-H215 HydrophobicContact CD1-CB 4.08Å; F192-H215 AromaticContact CD1-CD2 3.79Å; F192-H215 HydrophobicContact CE1-CB 4.43Å; F192-H215 AromaticContact CE1-CD2 3.4Å; F192-H215 WeakPolarHBondContact CE1-CD2 3.35Å; F192-H215 AromaticContact CE2-CD2 3.95Å; F192-H215 AromaticContact CZ-CD2 3.49Å; F192-H215 VanDerWaalsContact CZ-CD2 3.49Å; F192-H215 WeakPolarHBondContact CZ-CD2 3.39Å; F192-F232 HydrophobicContact CB-CE1 4.11Å; F192-F232 HydrophobicContact CB-CZ 4.44Å; F192-F232 HydrophobicContact CD1-CD1 4.42Å; F192-F232 AromaticContact CD1-CE1 3.49Å; F192-F232 HydrophobicContact CD1-CE1 3.49Å; F192-F232 VanDerWaalsContact CD1-CE1 3.49Å; F192-F232 HydrophobicContact CD1-CZ 4.28Å; F192-F232 HydrophobicContact CE1-CE1 4.01Å; F192-F232 AromaticContact CG-CE1 3.88Å; F192-F232 HydrophobicContact CG-CE1 3.88Å; F192-K235 HydrophobicContact CE1-CD 4.32Å
193	A	93.8	Very high	87	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	115.8	-179	0	0	0	0	0	110.1	L204 I207 H215 V216 H217	A193-L204 HydrophobicContact CB-CD1 3.8Å; A193-L204 HydrophobicContact CB-CG 3.9Å; A193-I207 HydrophobicContact CB-CB 4.32Å; A193-I207 HydrophobicContact CB-CG2 4.01Å; A193-H215 PolarHBondContact N-O 3.21Å; A193-V216 WeakPolarHBondContact O-CA 3.46Å; A193-H217 PolarHBondContact O-N 3.44Å
194	I	93.6	Very high	86.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	108.3	178.8	-54.6	177.1	0	0	0	108.4	F79 M166 I167 V168 T169 V196 H217 I225 L228 F232	F79-I194 HydrophobicContact CE1-CD1 4.16Å; F79-I194 HydrophobicContact CZ-CD1 3.92Å; M166-I194 HydrophobicContact CE-CD1 4.18Å; M166-I194 HydrophobicContact CG-CD1 3.96Å; M166-I194 HydrophobicContact SD-CD1 3.86Å; I167-I194 PolarHBondContact O-N 2.89Å; V168-I194 WeakPolarHBondContact CA-O 3.39Å; V168-I194 HydrophobicContact CG2-CB 4.32Å; V168-I194 HydrophobicContact CG2-CD1 4.19Å; T169-I194 PolarHBondContact N-O 3.18Å; I194-V196 HydrophobicContact CG2-CG2 4.48Å; I194-H217 CarbonylContact C-O 3.57Å; I194-H217 WeakPolarHBondContact CA-O 3.26Å; I194-I225 HydrophobicContact CG2-CD1 4.08Å; I194-I225 HydrophobicContact CG2-CG1 4.1Å; I194-L228 HydrophobicContact CD1-CD1 4.24Å; I194-L228 HydrophobicContact CG1-CD1 4.37Å; I194-L228 HydrophobicContact CG2-CD1 3.72Å; I194-F232 HydrophobicContact CD1-CE2 3.52Å; I194-F232 HydrophobicContact CD1-CZ 3.65Å; I194-F232 HydrophobicContact CG1-CE2 4.28Å; I194-F232 HydrophobicContact CG1-CZ 4.06Å
195	G	91.9	Very high	86.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135	172.7	0	0	0	0	0	110.8	T169 H217 L218 V219	T169-G195 CarbonylContact O-C 3.5Å; T169-G195 WeakPolarHBondContact O-CA 3.34Å; G195-H217 PolarHBondContact N-O 2.91Å; G195-L218 WeakPolarHBondContact O-CA 3.36Å; G195-V219 PolarHBondContact O-N 2.96Å
196	V	89.7	Confident	86.5	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.9	177.2	-173.4	0	0	0	0	110.3	V168 T169 D170 I194 R198 V219 N221 F222 I225	V168-V196 HydrophobicContact CG1-CG2 4.32Å; T169-V196 PolarHBondContact O-N 3Å; D170-V196 VanDerWaalsContact CA-O 3.3Å; D170-V196 WeakPolarHBondContact CA-O 3.41Å; D170-V196 HydrophobicContact CB-CB 4.33Å; I194-V196 HydrophobicContact CG2-CG2 4.48Å; V196-R198 PolarHBondContact O-N 3.06Å; V196-V219 HydrophobicContact CB-CG2 4.28Å; V196-V219 HydrophobicContact CG1-CG2 4.17Å; V196-V219 HydrophobicContact CG2-CG2 3.87Å; V196-N221 VanDerWaalsContact CG1-C 3.46Å; V196-F222 HydrophobicContact CB-CD1 4.42Å; V196-F222 HydrophobicContact CB-CE1 4.09Å; V196-F222 HydrophobicContact CB-CE2 4.3Å; V196-F222 HydrophobicContact CB-CZ 4.03Å; V196-F222 HydrophobicContact CG1-CB 4.37Å; V196-F222 HydrophobicContact CG1-CD1 3.85Å; V196-F222 HydrophobicContact CG1-CD2 3.6Å; V196-F222 HydrophobicContact CG1-CE1 3.94Å; V196-F222 HydrophobicContact CG1-CE2 3.71Å; V196-F222 HydrophobicContact CG1-CG 3.68Å; V196-F222 HydrophobicContact CG1-CZ 3.88Å; V196-F222 HydrophobicContact CG2-CD1 4.22Å; V196-F222 HydrophobicContact CG2-CE1 3.98Å; V196-F222 HydrophobicContact CG2-CZ 4.41Å; V196-I225 HydrophobicContact CG2-CD1 4.15Å
197	G	83.5	Confident	86.7	Confident	31 Å²	31	40.5 Å²	40.5	32%	0.32	21%	0.209	S	C	.	.	S	Bend	trans	77	-119.3	177.8	0	0	0	0	0	113.1	V219	G197-V219 PolarHBondContact N-O 3.46Å
198	R	77.9	Confident	87	Confident	242 Å²	242	38.9 Å²	38.9	91%	0.913	20%	0.196	S	C	*	.	S	Bend	trans	-104.1	53.9	-168.9	-68.5	-172.9	178.8	176.1	1.4	112.9	V196	V196-R198 PolarHBondContact O-N 3.06Å
199	V	78.9	Confident	87.2	Confident	14 Å²	14	36.9 Å²	36.9	9%	0.085	17%	0.174	C	C	.	.			trans	-90.5	139.9	175.8	-174	0	0	0	0	110.8	D170 M201 L204 L218	D170-V199 VanDerWaalsContact C-CG2 3.48Å; D170-V199 WeakPolarHBondContact O-CG2 3.01Å; V199-M201 PolarHBondContact O-N 3.23Å; V199-L204 HydrophobicContact CG1-CB 4.36Å; V199-L204 HydrophobicContact CG1-CD1 4.16Å; V199-L218 HydrophobicContact CB-CD1 3.98Å
200	E	77.1	Confident	86.6	Confident	75 Å²	75	40.7 Å²	40.7	35%	0.35	19%	0.192	S	C	.	.			trans	-73.4	124.2	174.6	-71.9	-167.3	-176.8	0	0	111.6	R172 K202 T203 L204	R172-E200 IonicContact CZ-OE1 3.16Å; R172-E200 IonicContact NE-OE1 2.66Å; R172-E200 PolarHBondContact NE-OE1 2.98Å; R172-E200 IonicContact NH1-OE1 2.82Å; R172-E200 IonicContact NH2-OE1 3.69Å; R172-E200 PolarHBondContact NH2-OE1 3.21Å; E200-K202 PolarHBondContact O-N 3.48Å; E200-K202 VanDerWaalsContact O-N 3.14Å; E200-T203 PolarHBondContact O-N 2.03Å; E200-L204 PolarHBondContact O-N 3.08Å
201	M	80.6	Confident	86.1	Confident	68 Å²	68	39.9 Å²	39.9	34%	0.335	19%	0.189	S	C	.	.	H	α-helix	trans	-59.4	-25.7	176.1	-175.7	58	66	0	0	112.7	V199 K205 V216 L218	V199-M201 PolarHBondContact O-N 3.23Å; M201-K205 HydrophobicContact CG-CD 4Å; M201-K205 HydrophobicContact CG-CG 4.39Å; M201-K205 VanDerWaalsContact O-CB 3.25Å; M201-K205 WeakPolarHBondContact O-CB 3.48Å; M201-K205 WeakPolarHBondContact O-CD 3.37Å; M201-K205 WeakPolarHBondContact O-CG 3.25Å; M201-K205 PolarHBondContact O-N 3.23Å; M201-K205 HydrophobicContact SD-CD 4.22Å; M201-K205 HydrophobicContact SD-CG 4.08Å; M201-V216 HydrophobicContact SD-CG1 3.69Å; M201-L218 HydrophobicContact CE-CB 3.71Å; M201-L218 HydrophobicContact CE-CD2 3.99Å; M201-L218 HydrophobicContact CE-CG 4.46Å
202	K	80.4	Confident	85.6	Confident	167 Å²	167	42.5 Å²	42.5	73%	0.726	20%	0.201	S	C	*	.	H	α-helix	trans	-64.5	-53.9	174.3	-175.7	-174.5	174.2	-168.9	0	111	E200 K205 A206	E200-K202 PolarHBondContact O-N 3.48Å; E200-K202 VanDerWaalsContact O-N 3.14Å; K202-K205 PolarHBondContact O-N 3.43Å; K202-A206 PolarHBondContact O-N 3.21Å
203	T	84	Confident	84.8	Confident	17 Å²	17	46 Å²	46	10%	0.104	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-42	177.8	-47.8	0	0	0	0	111.6	P173 V177 E200 K205 A206 I207	P173-T203 HydrophobicContact CG-CG2 3.74Å; V177-T203 HydrophobicContact CG2-CG2 3.81Å; E200-T203 PolarHBondContact O-N 2.03Å; T203-K205 VanDerWaalsContact C-N 3.31Å; T203-K205 PolarHBondContact O-N 3.29Å; T203-A206 WeakPolarHBondContact O-CA 3.49Å; T203-A206 WeakPolarHBondContact O-CB 3.2Å; T203-A206 PolarHBondContact O-N 3.26Å; T203-I207 HydrophobicContact CG2-CD1 4.36Å; T203-I207 WeakPolarHBondContact O-CG1 3.43Å; T203-I207 PolarHBondContact O-N 3.38Å; T203-I207 VanDerWaalsContact O-N 3.08Å
204	L	87.9	Confident	84	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-34.3	178.9	-157.1	73.1	0	0	0	112.3	T169 A193 V199 E200 I207 G208 V216 H217	T169-L204 HydrophobicContact CG2-CD1 4.3Å; A193-L204 HydrophobicContact CB-CD1 3.8Å; A193-L204 HydrophobicContact CB-CG 3.9Å; V199-L204 HydrophobicContact CG1-CB 4.36Å; V199-L204 HydrophobicContact CG1-CD1 4.16Å; E200-L204 PolarHBondContact O-N 3.08Å; L204-I207 PolarHBondContact O-N 2.92Å; L204-G208 PolarHBondContact O-N 3.48Å; L204-V216 HydrophobicContact CB-CG1 4.05Å; L204-V216 HydrophobicContact CD2-CG1 3.63Å; L204-V216 HydrophobicContact CG-CG1 3.77Å; L204-H217 WeakPolarHBondContact CD2-O 3Å
205	K	87.9	Confident	83.6	Confident	89 Å²	89	48.3 Å²	48.3	39%	0.387	24%	0.236	S	C	.	.	H	α-helix	trans	-71.5	-29.7	168.8	-74.8	171.9	177.8	169.4	0	113.4	M201 K202 T203 I207 H212 V216	M201-K205 HydrophobicContact CG-CD 4Å; M201-K205 HydrophobicContact CG-CG 4.39Å; M201-K205 VanDerWaalsContact O-CB 3.25Å; M201-K205 WeakPolarHBondContact O-CB 3.48Å; M201-K205 WeakPolarHBondContact O-CD 3.37Å; M201-K205 WeakPolarHBondContact O-CG 3.25Å; M201-K205 PolarHBondContact O-N 3.23Å; M201-K205 HydrophobicContact SD-CD 4.22Å; M201-K205 HydrophobicContact SD-CG 4.08Å; K202-K205 PolarHBondContact O-N 3.43Å; T203-K205 VanDerWaalsContact C-N 3.31Å; T203-K205 PolarHBondContact O-N 3.29Å; K205-I207 PolarHBondContact O-N 3.21Å; K205-H212 HydrophobicContact CG-CB 4.11Å; K205-H212 PolarHBondContact O-NE2 2.82Å; K205-V216 HydrophobicContact CG-CG1 4.17Å; K205-V216 HydrophobicContact CG-CG2 4.3Å
206	A	86.9	Confident	83.5	Confident	20 Å²	20	49 Å²	49	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-68.4	-26.4	173.6	0	0	0	0	0	112.2	E178 A181 R185 K202 T203	E178-A206 HydrophobicContact CG-CB 3.92Å; A181-A206 WeakPolarHBondContact CB-O 3.32Å; R185-A206 PolarHBondContact NH1-O 2.91Å; R185-A206 PolarHBondContact NH2-O 2.99Å; K202-A206 PolarHBondContact O-N 3.21Å; T203-A206 WeakPolarHBondContact O-CA 3.49Å; T203-A206 WeakPolarHBondContact O-CB 3.2Å; T203-A206 PolarHBondContact O-N 3.26Å
207	I	90.3	Very high	83.4	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-86.1	-53.9	177	-64.9	165.1	0	0	0	111.7	T136 I140 I167 V177 R185 I191 A193 T203 L204 K205	T136-I207 HydrophobicContact CG2-CD1 4.05Å; I140-I207 HydrophobicContact CD1-CG1 4.16Å; I140-I207 HydrophobicContact CD1-CG2 3.92Å; I167-I207 HydrophobicContact CD1-CG2 3.56Å; V177-I207 HydrophobicContact CB-CD1 4.38Å; V177-I207 HydrophobicContact CB-CG1 4.05Å; V177-I207 HydrophobicContact CG1-CD1 4.48Å; V177-I207 HydrophobicContact CG2-CD1 4.26Å; V177-I207 HydrophobicContact CG2-CG1 4.01Å; R185-I207 PolarHBondContact NH1-O 2.84Å; I191-I207 HydrophobicContact CG2-CG2 3.87Å; A193-I207 HydrophobicContact CB-CB 4.32Å; A193-I207 HydrophobicContact CB-CG2 4.01Å; T203-I207 HydrophobicContact CG2-CD1 4.36Å; T203-I207 WeakPolarHBondContact O-CG1 3.43Å; T203-I207 PolarHBondContact O-N 3.38Å; T203-I207 VanDerWaalsContact O-N 3.08Å; L204-I207 PolarHBondContact O-N 2.92Å; K205-I207 PolarHBondContact O-N 3.21Å
208	G	89.6	Confident	83.6	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.251	C	S	.	.	S	Bend	trans	-66.7	157.1	-171.8	0	0	0	0	0	115.4	R185 L204	R185-G208 PolarHBondContact NH1-O 2.8Å; L204-G208 PolarHBondContact O-N 3.48Å
209	S	89.1	Confident	84	Confident	10 Å²	10	41.6 Å²	41.6	7%	0.07	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-75.9	155.9	176.9	-68	0	0	0	0	113.6	I191 P211 H215	I191-S209 PolarHBondContact N-OG 3.23Å; I191-S209 PolarHBondContact O-N 3.32Å; S209-P211 CarbonylContact O-C 3.02Å; S209-H215 WeakPolarHBondContact O-CB 3.12Å; S209-H215 PolarHBondContact O-ND1 3.2Å
210	Q	79.4	Confident	84.1	Confident	86 Å²	86	44.1 Å²	44.1	40%	0.402	23%	0.233	S	C	.	.	S	Bend	trans	-78.1	148.1	171.2	-65.4	-156.4	-13	0	0	112.2	H215 P273	Q210-H215 PolarHBondContact O-CE1 3.21Å; Q210-H215 PolarHBondContact O-ND1 3.27Å; Q210-P273 PolarHBondContact NE2-O 3.38Å
211	P	80	Confident	84.4	Confident	8 Å²	8	43.8 Å²	43.8	5%	0.052	23%	0.233	C	C	.	.	S	Bend	cis	-70.4	138.4	-10.4	28.2	-35.3	0	0	0	111.8	S209 S213 E214 H215 Y261	S209-P211 CarbonylContact O-C 3.02Å; P211-S213 PolarHBondContact O-N 3.02Å; P211-E214 HydrophobicContact CG-CB 4.3Å; P211-E214 HydrophobicContact CG-CG 3.91Å; P211-E214 PolarHBondContact O-N 3.43Å; P211-H215 PolarHBondContact O-N 2.85Å; P211-H215 PolarHBondContact O-ND1 3.06Å; P211-Y261 HydrophobicContact CG-CE1 4.33Å; P211-Y261 HydrophobicContact CG-CE2 4.32Å
212	H	81.8	Confident	84.6	Confident	58 Å²	58	41.1 Å²	41.1	27%	0.269	22%	0.22	S	C	.	.	H	α-helix	trans	-61.6	-28.9	-176.3	-60.2	144.3	0	0	0	113.1	K205 E214 H215 V216	K205-H212 HydrophobicContact CG-CB 4.11Å; K205-H212 PolarHBondContact O-NE2 2.82Å; H212-E214 PolarHBondContact O-N 2.98Å; H212-E214 VanDerWaalsContact O-N 3.12Å; H212-H215 PolarHBondContact O-N 3.48Å; H212-V216 HydrophobicContact CB-CB 4.33Å; H212-V216 HydrophobicContact CB-CG2 3.87Å; H212-V216 VanDerWaalsContact O-CB 3.26Å; H212-V216 WeakPolarHBondContact O-CB 3.47Å; H212-V216 PolarHBondContact O-N 2.9Å
213	S	76.9	Confident	84.6	Confident	73 Å²	73	36.6 Å²	36.6	51%	0.51	21%	0.209	S	C	.	.	H	α-helix	trans	-58.8	-23	175.5	59.7	0	0	0	0	113.6	P211 H217	P211-S213 PolarHBondContact O-N 3.02Å; S213-H217 PolarHBondContact O-CE1 3.23Å
214	E	76.7	Confident	84.5	Confident	48 Å²	48	39.7 Å²	39.7	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-99.1	-29.5	-179.2	-61.8	-53.7	152.5	0	0	114	P211 H212 H217 K235 Y261	P211-E214 HydrophobicContact CG-CB 4.3Å; P211-E214 HydrophobicContact CG-CG 3.91Å; P211-E214 PolarHBondContact O-N 3.43Å; H212-E214 PolarHBondContact O-N 2.98Å; H212-E214 VanDerWaalsContact O-N 3.12Å; E214-H217 PolarHBondContact O-NE2 3.29Å; E214-K235 PolarHBondContact O-NZ 2.96Å; E214-K235 WeakPolarHBondContact OE2-CE 3.37Å; E214-K235 IonicContact OE2-NZ 2.65Å; E214-K235 PolarHBondContact OE2-NZ 3.23Å; E214-Y261 HydrophobicContact CG-CE1 4.08Å
215	H	85.8	Confident	84.4	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-112.5	-9.9	-170.5	-49.7	97	0	0	0	114.6	Q190 I191 F192 A193 S209 Q210 P211 H212 H217 S260	Q190-H215 PolarHBondContact NE2-NE2 2.89Å; I191-H215 WeakPolarHBondContact O-CB 3.45Å; F192-H215 CarbonylContact C-O 3.47Å; F192-H215 WeakPolarHBondContact CA-O 3.04Å; F192-H215 HydrophobicContact CD1-CB 4.08Å; F192-H215 AromaticContact CD1-CD2 3.79Å; F192-H215 HydrophobicContact CE1-CB 4.43Å; F192-H215 AromaticContact CE1-CD2 3.4Å; F192-H215 WeakPolarHBondContact CE1-CD2 3.35Å; F192-H215 AromaticContact CE2-CD2 3.95Å; F192-H215 AromaticContact CZ-CD2 3.49Å; F192-H215 VanDerWaalsContact CZ-CD2 3.49Å; F192-H215 WeakPolarHBondContact CZ-CD2 3.39Å; A193-H215 PolarHBondContact N-O 3.21Å; S209-H215 WeakPolarHBondContact O-CB 3.12Å; S209-H215 PolarHBondContact O-ND1 3.2Å; Q210-H215 PolarHBondContact O-CE1 3.21Å; Q210-H215 PolarHBondContact O-ND1 3.27Å; P211-H215 PolarHBondContact O-N 2.85Å; P211-H215 PolarHBondContact O-ND1 3.06Å; H212-H215 PolarHBondContact O-N 3.48Å; H215-H217 PolarHBondContact N-NE2 3.33Å; H215-S260 PolarHBondContact CE1-OG 3.02Å; H215-S260 PolarHBondContact NE2-OG 3.4Å
216	V	89.3	Confident	84	Confident	13 Å²	13	39.6 Å²	39.6	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	113.5	-178.3	-178.7	0	0	0	0	109	A193 M201 L204 K205 H212	A193-V216 WeakPolarHBondContact O-CA 3.46Å; M201-V216 HydrophobicContact SD-CG1 3.69Å; L204-V216 HydrophobicContact CB-CG1 4.05Å; L204-V216 HydrophobicContact CD2-CG1 3.63Å; L204-V216 HydrophobicContact CG-CG1 3.77Å; K205-V216 HydrophobicContact CG-CG1 4.17Å; K205-V216 HydrophobicContact CG-CG2 4.3Å; H212-V216 HydrophobicContact CB-CB 4.33Å; H212-V216 HydrophobicContact CB-CG2 3.87Å; H212-V216 VanDerWaalsContact O-CB 3.26Å; H212-V216 WeakPolarHBondContact O-CB 3.47Å; H212-V216 PolarHBondContact O-N 2.9Å
217	H	87.6	Confident	83.6	Confident	34 Å²	34	42.7 Å²	42.7	16%	0.157	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.8	-177.5	-63.4	-62.7	0	0	0	110.3	A193 I194 G195 L204 S213 E214 H215 L228 F232 K235	A193-H217 PolarHBondContact O-N 3.44Å; I194-H217 CarbonylContact C-O 3.57Å; I194-H217 WeakPolarHBondContact CA-O 3.26Å; G195-H217 PolarHBondContact N-O 2.91Å; L204-H217 WeakPolarHBondContact CD2-O 3Å; S213-H217 PolarHBondContact O-CE1 3.23Å; E214-H217 PolarHBondContact O-NE2 3.29Å; H215-H217 PolarHBondContact N-NE2 3.33Å; H217-L228 HydrophobicContact CB-CD1 3.94Å; H217-L228 HydrophobicContact CB-CD2 4.07Å; H217-F232 AromaticContact CD2-CZ 3.88Å; H217-K235 PolarHBondContact CE1-NZ 3.19Å; H217-K235 VanDerWaalsContact CE1-NZ 3.26Å; H217-K235 PolarHBondContact NE2-NZ 3.03Å; H217-K235 VanDerWaalsContact NE2-NZ 3.12Å
218	L	87.8	Confident	83.3	Confident	77 Å²	77	43.2 Å²	43.2	40%	0.403	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.2	176.7	-176.3	72.4	0	0	0	109.1	G195 V199 M201	G195-L218 WeakPolarHBondContact O-CA 3.36Å; V199-L218 HydrophobicContact CB-CD1 3.98Å; M201-L218 HydrophobicContact CE-CB 3.71Å; M201-L218 HydrophobicContact CE-CD2 3.99Å; M201-L218 HydrophobicContact CE-CG 4.46Å
219	V	85.8	Confident	82.9	Confident	9 Å²	9	44.2 Å²	44.2	6%	0.055	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146	176.9	-66.1	0	0	0	0	110.6	G195 V196 G197 N221 Q224 I225 L228	G195-V219 PolarHBondContact O-N 2.96Å; V196-V219 HydrophobicContact CB-CG2 4.28Å; V196-V219 HydrophobicContact CG1-CG2 4.17Å; V196-V219 HydrophobicContact CG2-CG2 3.87Å; G197-V219 PolarHBondContact N-O 3.46Å; V219-N221 VanDerWaalsContact C-N 3.29Å; V219-N221 PolarHBondContact O-N 2.95Å; V219-Q224 HydrophobicContact CB-CB 3.99Å; V219-Q224 HydrophobicContact CG1-CB 4.4Å; V219-I225 HydrophobicContact CG2-CB 4.38Å; V219-I225 HydrophobicContact CG2-CG1 4.49Å; V219-L228 HydrophobicContact CG1-CD1 3.91Å; V219-L228 HydrophobicContact CG1-CD2 4.12Å; V219-L228 HydrophobicContact CG1-CG 4Å
220	A	80.6	Confident	82	Confident	68 Å²	68	47.6 Å²	47.6	56%	0.562	27%	0.272	S	S	*	.	S	Bend	trans	-74	-18.8	-170.3	0	0	0	0	0	114	Q224	A220-Q224 VanDerWaalsContact CB-OE1 3.27Å
221	N	84.1	Confident	81.7	Confident	67 Å²	67	45.5 Å²	45.5	36%	0.358	27%	0.265	S	S	.	.	S	Bend	trans	-164.7	166.5	177.7	55.1	70	0	0	0	110.4	V196 V219 S223 Q224	V196-N221 VanDerWaalsContact CG1-C 3.46Å; V219-N221 VanDerWaalsContact C-N 3.29Å; V219-N221 PolarHBondContact O-N 2.95Å; N221-S223 VanDerWaalsContact C-N 3.26Å; N221-S223 PolarHBondContact O-N 2.98Å; N221-S223 WeakPolarHBondContact OD1-CB 3.45Å; N221-S223 PolarHBondContact OD1-N 3.36Å; N221-S223 VanDerWaalsContact OD1-N 3.17Å; N221-Q224 PolarHBondContact O-N 3.48Å; N221-Q224 PolarHBondContact OD1-N 2.86Å
222	F	83.9	Confident	81.6	Confident	12 Å²	12	45.1 Å²	45.1	5%	0.053	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-60.8	-29.8	-179	-73.9	-83.5	0	0	0	114	I68 D72 K75 V76 D170 V196 Q224 I225	I68-F222 HydrophobicContact CB-CZ 4.39Å; I68-F222 HydrophobicContact CD1-CZ 4.04Å; I68-F222 HydrophobicContact CG1-CE2 4.49Å; I68-F222 HydrophobicContact CG1-CZ 3.85Å; I68-F222 HydrophobicContact CG2-CE1 4.33Å; I68-F222 HydrophobicContact CG2-CE2 4.29Å; I68-F222 HydrophobicContact CG2-CZ 3.85Å; D72-F222 HydrophobicContact CB-CB 4.12Å; D72-F222 HydrophobicContact CB-CD1 4.4Å; D72-F222 HydrophobicContact CB-CD2 3.47Å; D72-F222 VanDerWaalsContact CB-CD2 3.47Å; D72-F222 HydrophobicContact CB-CE2 3.94Å; D72-F222 HydrophobicContact CB-CG 3.73Å; K75-F222 HydrophobicContact CB-CB 4.3Å; K75-F222 HydrophobicContact CD-CB 3.78Å; V76-F222 HydrophobicContact CG2-CD1 3.56Å; V76-F222 HydrophobicContact CG2-CE1 3.47Å; V76-F222 VanDerWaalsContact CG2-CE1 3.47Å; D170-F222 HydrophobicContact CB-CE2 4.1Å; D170-F222 HydrophobicContact CB-CZ 3.75Å; V196-F222 HydrophobicContact CB-CD1 4.42Å; V196-F222 HydrophobicContact CB-CE1 4.09Å; V196-F222 HydrophobicContact CB-CE2 4.3Å; V196-F222 HydrophobicContact CB-CZ 4.03Å; V196-F222 HydrophobicContact CG1-CB 4.37Å; V196-F222 HydrophobicContact CG1-CD1 3.85Å; V196-F222 HydrophobicContact CG1-CD2 3.6Å; V196-F222 HydrophobicContact CG1-CE1 3.94Å; V196-F222 HydrophobicContact CG1-CE2 3.71Å; V196-F222 HydrophobicContact CG1-CG 3.68Å; V196-F222 HydrophobicContact CG1-CZ 3.88Å; V196-F222 HydrophobicContact CG2-CD1 4.22Å; V196-F222 HydrophobicContact CG2-CE1 3.98Å; V196-F222 HydrophobicContact CG2-CZ 4.41Å; F222-Q224 PolarHBondContact O-N 3.39Å; F222-I225 WeakPolarHBondContact O-CB 3.09Å; F222-I225 WeakPolarHBondContact O-CG2 3.06Å; F222-I225 PolarHBondContact O-N 2.72Å; F222-I225 VanDerWaalsContact O-N 3.17Å
223	S	81.8	Confident	81.2	Confident	72 Å²	72	46.4 Å²	46.4	50%	0.503	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-67.7	-19.4	176.1	-50.4	0	0	0	0	113	K75 N221	K75-S223 PolarHBondContact NZ-OG 2.89Å; N221-S223 VanDerWaalsContact C-N 3.26Å; N221-S223 PolarHBondContact O-N 2.98Å; N221-S223 WeakPolarHBondContact OD1-CB 3.45Å; N221-S223 PolarHBondContact OD1-N 3.36Å; N221-S223 VanDerWaalsContact OD1-N 3.17Å
224	Q	82.4	Confident	80.7	Confident	82 Å²	82	46.7 Å²	46.7	38%	0.383	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-87.9	-10.9	174.9	-71.9	179.5	-4.1	0	0	113.7	V219 A220 N221 F222 E226 T227	V219-Q224 HydrophobicContact CB-CB 3.99Å; V219-Q224 HydrophobicContact CG1-CB 4.4Å; A220-Q224 VanDerWaalsContact CB-OE1 3.27Å; N221-Q224 PolarHBondContact O-N 3.48Å; N221-Q224 PolarHBondContact OD1-N 2.86Å; F222-Q224 PolarHBondContact O-N 3.39Å; Q224-E226 PolarHBondContact O-N 3.45Å; Q224-T227 WeakPolarHBondContact O-CB 3.29Å; Q224-T227 WeakPolarHBondContact O-CG2 3.39Å; Q224-T227 PolarHBondContact O-N 3.47Å; Q224-T227 PolarHBondContact O-OG1 2.93Å
225	I	85.3	Confident	80.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-61.1	-30.8	-179.4	-153.1	176	0	0	0	111.6	F79 V168 I194 V196 V219 F222 T227 L228	F79-I225 HydrophobicContact CB-CG2 3.78Å; F79-I225 HydrophobicContact CD1-CD1 4.02Å; F79-I225 HydrophobicContact CD1-CG1 4.41Å; F79-I225 HydrophobicContact CD2-CB 4.47Å; F79-I225 HydrophobicContact CD2-CG1 4.08Å; F79-I225 HydrophobicContact CD2-CG2 3.93Å; F79-I225 HydrophobicContact CE1-CD1 4.23Å; F79-I225 HydrophobicContact CE1-CG1 4.48Å; F79-I225 HydrophobicContact CE2-CG1 4.16Å; F79-I225 WeakPolarHBondContact CE2-O 3.18Å; F79-I225 HydrophobicContact CG-CD1 4.19Å; F79-I225 HydrophobicContact CG-CG1 4.22Å; F79-I225 HydrophobicContact CG-CG2 3.91Å; F79-I225 HydrophobicContact CZ-CG1 4.36Å; V168-I225 HydrophobicContact CG1-CD1 3.79Å; I194-I225 HydrophobicContact CG2-CD1 4.08Å; I194-I225 HydrophobicContact CG2-CG1 4.1Å; V196-I225 HydrophobicContact CG2-CD1 4.15Å; V219-I225 HydrophobicContact CG2-CB 4.38Å; V219-I225 HydrophobicContact CG2-CG1 4.49Å; F222-I225 WeakPolarHBondContact O-CB 3.09Å; F222-I225 WeakPolarHBondContact O-CG2 3.06Å; F222-I225 PolarHBondContact O-N 2.72Å; F222-I225 VanDerWaalsContact O-N 3.17Å; I225-T227 PolarHBondContact O-N 3.08Å; I225-L228 HydrophobicContact CG1-CD1 4.29Å; I225-L228 VanDerWaalsContact O-CB 3.32Å; I225-L228 WeakPolarHBondContact O-CB 3.49Å; I225-L228 PolarHBondContact O-N 3.47Å; I225-L228 VanDerWaalsContact O-N 3.08Å
226	E	78.5	Confident	79.7	Confident	88 Å²	88	45.5 Å²	45.5	41%	0.411	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-61.5	-27.2	176.6	-61.8	-164.3	141.5	0	0	113.4	Q224 L228 I229	Q224-E226 PolarHBondContact O-N 3.45Å; E226-L228 PolarHBondContact O-N 2.62Å; E226-I229 HydrophobicContact CB-CD1 3.93Å; E226-I229 HydrophobicContact CG-CD1 4.29Å; E226-I229 VanDerWaalsContact O-CB 3.24Å; E226-I229 WeakPolarHBondContact O-CB 3.36Å; E226-I229 WeakPolarHBondContact O-CD1 3.44Å; E226-I229 VanDerWaalsContact O-CG1 3.23Å; E226-I229 WeakPolarHBondContact O-CG1 3.37Å; E226-I229 PolarHBondContact O-N 3.03Å
227	T	80.1	Confident	78.6	Confident	86 Å²	86	45.5 Å²	45.5	53%	0.528	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-60.8	-31.2	176.4	66.5	0	0	0	0	111.9	Q224 I225 I229 S230	Q224-T227 WeakPolarHBondContact O-CB 3.29Å; Q224-T227 WeakPolarHBondContact O-CG2 3.39Å; Q224-T227 PolarHBondContact O-N 3.47Å; Q224-T227 PolarHBondContact O-OG1 2.93Å; I225-T227 PolarHBondContact O-N 3.08Å; T227-I229 PolarHBondContact O-N 3.41Å; T227-S230 PolarHBondContact O-N 3.38Å; T227-S230 PolarHBondContact O-OG 3.03Å
228	L	82.8	Confident	77.1	Confident	14 Å²	14	45.6 Å²	45.6	7%	0.073	27%	0.274	C	S	.	.	H	α-helix	trans	-70.2	-18	178.9	-54.1	179.7	0	0	0	112.9	F79 I194 H217 V219 I225 E226 S230 V231 F232	F79-L228 HydrophobicContact CE2-CB 4.4Å; I194-L228 HydrophobicContact CD1-CD1 4.24Å; I194-L228 HydrophobicContact CG1-CD1 4.37Å; I194-L228 HydrophobicContact CG2-CD1 3.72Å; H217-L228 HydrophobicContact CB-CD1 3.94Å; H217-L228 HydrophobicContact CB-CD2 4.07Å; V219-L228 HydrophobicContact CG1-CD1 3.91Å; V219-L228 HydrophobicContact CG1-CD2 4.12Å; V219-L228 HydrophobicContact CG1-CG 4Å; I225-L228 HydrophobicContact CG1-CD1 4.29Å; I225-L228 VanDerWaalsContact O-CB 3.32Å; I225-L228 WeakPolarHBondContact O-CB 3.49Å; I225-L228 PolarHBondContact O-N 3.47Å; I225-L228 VanDerWaalsContact O-N 3.08Å; E226-L228 PolarHBondContact O-N 2.62Å; L228-S230 PolarHBondContact O-N 3.4Å; L228-V231 CarbonylContact O-C 3.55Å; L228-V231 WeakPolarHBondContact O-CA 3.42Å; L228-V231 WeakPolarHBondContact O-CB 3.02Å; L228-V231 PolarHBondContact O-N 2.99Å; L228-F232 HydrophobicContact CB-CD2 3.85Å; L228-F232 HydrophobicContact CB-CE2 3.73Å; L228-F232 HydrophobicContact CD1-CE2 4.2Å; L228-F232 WeakPolarHBondContact O-CD2 3.37Å; L228-F232 PolarHBondContact O-N 2.81Å
229	I	81	Confident	75.4	Confident	22 Å²	22	45 Å²	45	11%	0.113	29%	0.287	C	S	.	.	H	α-helix	trans	-55.2	-40.7	177	-64.2	165.7	0	0	0	110.3	F79 N82 F86 E226 T227 V231 F232 K233	F79-I229 HydrophobicContact CD2-CD1 4.28Å; F79-I229 HydrophobicContact CD2-CG1 3.81Å; F79-I229 HydrophobicContact CE2-CG1 3.9Å; N82-I229 HydrophobicContact CB-CD1 3.61Å; F86-I229 HydrophobicContact CD2-CG2 4.01Å; F86-I229 HydrophobicContact CE2-CG2 3.4Å; F86-I229 VanDerWaalsContact CE2-CG2 3.4Å; F86-I229 HydrophobicContact CZ-CG2 4.34Å; E226-I229 HydrophobicContact CB-CD1 3.93Å; E226-I229 HydrophobicContact CG-CD1 4.29Å; E226-I229 VanDerWaalsContact O-CB 3.24Å; E226-I229 WeakPolarHBondContact O-CB 3.36Å; E226-I229 WeakPolarHBondContact O-CD1 3.44Å; E226-I229 VanDerWaalsContact O-CG1 3.23Å; E226-I229 WeakPolarHBondContact O-CG1 3.37Å; E226-I229 PolarHBondContact O-N 3.03Å; T227-I229 PolarHBondContact O-N 3.41Å; I229-V231 VanDerWaalsContact C-N 3.33Å; I229-V231 PolarHBondContact O-N 2.66Å; I229-F232 PolarHBondContact O-N 2.62Å; I229-K233 WeakPolarHBondContact O-CB 3.47Å; I229-K233 PolarHBondContact O-N 2.86Å
230	S	70.3	Confident	73.8	Confident	81 Å²	81	48.2 Å²	48.2	57%	0.566	31%	0.309	S	S	*	.	H	α-helix	trans	-62.8	-38.5	176.6	67.4	0	0	0	0	112.9	T227 L228 S234	T227-S230 PolarHBondContact O-N 3.38Å; T227-S230 PolarHBondContact O-OG 3.03Å; L228-S230 PolarHBondContact O-N 3.4Å; S230-S234 PolarHBondContact O-N 3.46Å; S230-S234 PolarHBondContact O-OG 2.03Å
231	V	73.7	Confident	72.6	Confident	42 Å²	42	48.1 Å²	48.1	26%	0.255	30%	0.3	S	S	.	.	H	α-helix	trans	-72.1	-42.6	179.1	-177.5	0	0	0	0	110.9	L228 I229 S234 K235	L228-V231 CarbonylContact O-C 3.55Å; L228-V231 WeakPolarHBondContact O-CA 3.42Å; L228-V231 WeakPolarHBondContact O-CB 3.02Å; L228-V231 PolarHBondContact O-N 2.99Å; I229-V231 VanDerWaalsContact C-N 3.33Å; I229-V231 PolarHBondContact O-N 2.66Å; V231-S234 PolarHBondContact O-OG 2.99Å; V231-K235 HydrophobicContact CG1-CD 4.01Å; V231-K235 WeakPolarHBondContact O-CB 3.15Å; V231-K235 WeakPolarHBondContact O-CD 3.35Å; V231-K235 VanDerWaalsContact O-CG 3.25Å; V231-K235 WeakPolarHBondContact O-CG 3.41Å; V231-K235 PolarHBondContact O-N 2.78Å
232	F	76.7	Confident	71.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-72.6	-35.1	177.4	-74	-64.9	0	0	0	112.6	F79 L83 M166 F192 I194 H217 L228 I229 K235 L236	F79-F232 HydrophobicContact CZ-CD2 4.25Å; F79-F232 HydrophobicContact CZ-CE2 4.29Å; L83-F232 HydrophobicContact CD1-CB 3.67Å; M166-F232 HydrophobicContact CE-CD1 3.49Å; M166-F232 VanDerWaalsContact CE-CD1 3.49Å; M166-F232 HydrophobicContact CE-CD2 3.88Å; M166-F232 HydrophobicContact CE-CE1 3.34Å; M166-F232 HydrophobicContact CE-CE2 3.75Å; M166-F232 HydrophobicContact CE-CG 3.77Å; M166-F232 HydrophobicContact CE-CZ 3.5Å; M166-F232 VanDerWaalsContact CE-CZ 3.5Å; F192-F232 HydrophobicContact CB-CE1 4.11Å; F192-F232 HydrophobicContact CB-CZ 4.44Å; F192-F232 HydrophobicContact CD1-CD1 4.42Å; F192-F232 AromaticContact CD1-CE1 3.49Å; F192-F232 HydrophobicContact CD1-CE1 3.49Å; F192-F232 VanDerWaalsContact CD1-CE1 3.49Å; F192-F232 HydrophobicContact CD1-CZ 4.28Å; F192-F232 HydrophobicContact CE1-CE1 4.01Å; F192-F232 AromaticContact CG-CE1 3.88Å; F192-F232 HydrophobicContact CG-CE1 3.88Å; I194-F232 HydrophobicContact CD1-CE2 3.52Å; I194-F232 HydrophobicContact CD1-CZ 3.65Å; I194-F232 HydrophobicContact CG1-CE2 4.28Å; I194-F232 HydrophobicContact CG1-CZ 4.06Å; H217-F232 AromaticContact CD2-CZ 3.88Å; L228-F232 HydrophobicContact CB-CD2 3.85Å; L228-F232 HydrophobicContact CB-CE2 3.73Å; L228-F232 HydrophobicContact CD1-CE2 4.2Å; L228-F232 WeakPolarHBondContact O-CD2 3.37Å; L228-F232 PolarHBondContact O-N 2.81Å; I229-F232 PolarHBondContact O-N 2.62Å; F232-K235 PolarHBondContact O-N 2.98Å; F232-L236 HydrophobicContact CB-CD1 4.19Å; F232-L236 VanDerWaalsContact O-CB 3.31Å; F232-L236 WeakPolarHBondContact O-CB 3.45Å; F232-L236 WeakPolarHBondContact O-CG 3.3Å; F232-L236 PolarHBondContact O-N 3.47Å
233	K	73.4	Confident	70.4	Confident	85 Å²	85	47.6 Å²	47.6	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-59.6	-46.2	174	-178.7	-179.7	-178.6	175.7	0	112	F86 I229 C237	F86-K233 HydrophobicContact CB-CG 4.27Å; F86-K233 HydrophobicContact CD1-CD 3.59Å; F86-K233 VanDerWaalsContact CD1-CE 3.47Å; F86-K233 HydrophobicContact CD1-CG 4.03Å; F86-K233 HydrophobicContact CD2-CB 4.42Å; F86-K233 HydrophobicContact CD2-CD 4.35Å; F86-K233 HydrophobicContact CD2-CG 4.46Å; F86-K233 HydrophobicContact CE1-CD 3.73Å; F86-K233 HydrophobicContact CE2-CD 4.47Å; F86-K233 HydrophobicContact CG-CB 4.34Å; F86-K233 HydrophobicContact CG-CD 3.92Å; F86-K233 HydrophobicContact CG-CG 3.94Å; F86-K233 HydrophobicContact CZ-CD 4.17Å; I229-K233 WeakPolarHBondContact O-CB 3.47Å; I229-K233 PolarHBondContact O-N 2.86Å; K233-C237 VanDerWaalsContact O-CB 3.28Å; K233-C237 WeakPolarHBondContact O-CB 3.5Å; K233-C237 PolarHBondContact O-N 2.92Å; K233-C237 VanDerWaalsContact O-N 3.14Å
234	S	67	Low	69.3	Low	78 Å²	78	52.2 Å²	52.2	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-69.1	-35.1	178.8	61.6	0	0	0	0	112.6	S230 V231 G238	S230-S234 PolarHBondContact O-N 3.46Å; S230-S234 PolarHBondContact O-OG 2.03Å; V231-S234 PolarHBondContact O-OG 2.99Å; S234-G238 WeakPolarHBondContact O-CA 3Å; S234-G238 PolarHBondContact O-N 3.12Å
235	K	70.7	Confident	67.9	Low	15 Å²	15	52.8 Å²	52.8	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-71.2	-56.6	177	-70.6	172.5	-177.9	-172.6	0	112.4	F192 E214 H217 V231 F232 C237 G238 A259	F192-K235 HydrophobicContact CE1-CD 4.32Å; E214-K235 PolarHBondContact O-NZ 2.96Å; E214-K235 WeakPolarHBondContact OE2-CE 3.37Å; E214-K235 IonicContact OE2-NZ 2.65Å; E214-K235 PolarHBondContact OE2-NZ 3.23Å; H217-K235 PolarHBondContact CE1-NZ 3.19Å; H217-K235 VanDerWaalsContact CE1-NZ 3.26Å; H217-K235 PolarHBondContact NE2-NZ 3.03Å; H217-K235 VanDerWaalsContact NE2-NZ 3.12Å; V231-K235 HydrophobicContact CG1-CD 4.01Å; V231-K235 WeakPolarHBondContact O-CB 3.15Å; V231-K235 WeakPolarHBondContact O-CD 3.35Å; V231-K235 VanDerWaalsContact O-CG 3.25Å; V231-K235 WeakPolarHBondContact O-CG 3.41Å; V231-K235 PolarHBondContact O-N 2.78Å; F232-K235 PolarHBondContact O-N 2.98Å; K235-C237 PolarHBondContact O-N 3.38Å; K235-G238 PolarHBondContact O-N 3.49Å; K235-A259 VanDerWaalsContact O-CA 3.3Å; K235-A259 WeakPolarHBondContact O-CA 3.26Å
236	L	70.8	Confident	66.5	Low	11 Å²	11	56.7 Å²	56.7	6%	0.058	34%	0.342	C	S	.	.	H	α-helix	trans	-71.4	-29.9	-173.3	-61.8	169.6	0	0	0	112.9	F58 L83 L87 I164 F232 A259	F58-L236 HydrophobicContact CE2-CD1 4.01Å; F58-L236 HydrophobicContact CE2-CD2 4.04Å; L83-L236 HydrophobicContact CD1-CD1 4.21Å; L87-L236 HydrophobicContact CD2-CB 4.3Å; L87-L236 HydrophobicContact CD2-CD1 4.23Å; I164-L236 HydrophobicContact CD1-CD2 3.92Å; F232-L236 HydrophobicContact CB-CD1 4.19Å; F232-L236 VanDerWaalsContact O-CB 3.31Å; F232-L236 WeakPolarHBondContact O-CB 3.45Å; F232-L236 WeakPolarHBondContact O-CG 3.3Å; F232-L236 PolarHBondContact O-N 3.47Å; L236-A259 HydrophobicContact CD2-CB 3.89Å
237	C	67.2	Low	65.7	Low	13 Å²	13	61.2 Å²	61.2	9%	0.088	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	11	177.8	-58.4	0	0	0	0	114.8	C51 F86 K233 K235 G239	C51-C237 HydrophobicContact CB-CB 3.8Å; C51-C237 WeakPolarHBondContact CB-SG 3.5Å; C51-C237 WeakPolarHBondContact SG-CB 3.03Å; C51-C237 CovalentContact SG-SG 2.03Å; C51-C237 PolarHBondContact SG-SG 3.35Å; F86-C237 PolarHBondContact O-SG 3.47Å; F86-C237 VanDerWaalsContact O-SG 3.39Å; K233-C237 VanDerWaalsContact O-CB 3.28Å; K233-C237 WeakPolarHBondContact O-CB 3.5Å; K233-C237 PolarHBondContact O-N 2.92Å; K233-C237 VanDerWaalsContact O-N 3.14Å; K235-C237 PolarHBondContact O-N 3.38Å; C237-G239 PolarHBondContact O-N 2.86Å
238	G	55.7	Low	65.1	Low	35 Å²	35	58 Å²	58	36%	0.361	34%	0.342	S	S	.	.			trans	-75.1	59.7	178.2	0	0	0	0	0	113.4	S234 K235 S240	S234-G238 WeakPolarHBondContact O-CA 3Å; S234-G238 PolarHBondContact O-N 3.12Å; K235-G238 PolarHBondContact O-N 3.49Å; G238-S240 PolarHBondContact O-N 2.94Å
239	G	51.3	Low	64.7	Low	65 Å²	65	64.8 Å²	64.8	67%	0.67	37%	0.374	S	S	*	.			trans	-67.9	20.9	-169.4	0	0	0	0	0	117.5	C237	C237-G239 PolarHBondContact O-N 2.86Å
240	S	52.1	Low	64.5	Low	76 Å²	76	65 Å²	65	53%	0.531	38%	0.377	S	S	.	.	S	Bend	trans	-138.8	105.8	177.7	65	0	0	0	0	111.4	G238 M242 V245	G238-S240 PolarHBondContact O-N 2.94Å; S240-M242 PolarHBondContact O-N 3.23Å; S240-M242 VanDerWaalsContact O-N 3.16Å; S240-V245 VanDerWaalsContact O-CG2 3.23Å; S240-V245 WeakPolarHBondContact O-CG2 3.06Å
241	D	56.6	Low	65	Low	67 Å²	67	65.6 Å²	65.6	36%	0.358	37%	0.371	S	S	.	.			trans	25.7	77.4	161.3	-157.1	-7.4	0	0	0	114.5	C243 K244 S256	D241-C243 PolarHBondContact O-N 2.68Å; D241-K244 HydrophobicContact CB-CB 4.38Å; D241-K244 HydrophobicContact CB-CD 4.03Å; D241-K244 HydrophobicContact CB-CG 4.23Å; D241-K244 WeakPolarHBondContact O-CB 3.4Å; D241-K244 PolarHBondContact O-N 2.84Å; D241-K244 VanDerWaalsContact OD2-CD 3.28Å; D241-K244 WeakPolarHBondContact OD2-CD 3.5Å; D241-K244 WeakPolarHBondContact OD2-CE 3.3Å; D241-K244 IonicContact OD2-NZ 3.12Å; D241-K244 PolarHBondContact OD2-NZ 2.7Å; D241-S256 VanDerWaalsContact C-OG 3.26Å; D241-S256 WeakPolarHBondContact OD1-CB 3.34Å; D241-S256 PolarHBondContact OD1-OG 3.42Å
242	M	58.4	Low	65.5	Low	32 Å²	32	65.6 Å²	65.6	16%	0.158	37%	0.368	C	S	.	.	H	α-helix	trans	-42.7	-38	-178	-80.2	-85.1	-112.9	0	0	113.7	S240 K244 V245 V246 H248 S256 S260	S240-M242 PolarHBondContact O-N 3.23Å; S240-M242 VanDerWaalsContact O-N 3.16Å; M242-K244 PolarHBondContact O-N 2.88Å; M242-V245 PolarHBondContact O-N 2.03Å; M242-V246 PolarHBondContact O-N 3.36Å; M242-H248 PolarHBondContact O-CD2 2.81Å; M242-H248 PolarHBondContact O-NE2 3.15Å; M242-S256 PolarHBondContact N-OG 2.66Å; M242-S260 WeakPolarHBondContact CG-O 3.35Å
243	C	63.1	Low	65.7	Low	35 Å²	35	68.2 Å²	68.2	24%	0.236	38%	0.381	C	S	.	.	H	α-helix	trans	-67.4	-9.3	176.9	-61.5	0	0	0	0	116	D241 C254 V255 S256	D241-C243 PolarHBondContact O-N 2.68Å; C243-C254 HydrophobicContact CB-CB 3.65Å; C243-C254 WeakPolarHBondContact CB-SG 3.06Å; C243-C254 WeakPolarHBondContact SG-CB 3.48Å; C243-C254 CovalentContact SG-SG 2.03Å; C243-C254 PolarHBondContact SG-SG 3.17Å; C243-V255 VanDerWaalsContact SG-C 3.53Å; C243-V255 PolarHBondContact SG-N 3.37Å; C243-V255 VanDerWaalsContact SG-N 3.43Å; C243-S256 WeakPolarHBondContact CB-OG 3.49Å; C243-S256 PolarHBondContact N-OG 2.82Å; C243-S256 PolarHBondContact SG-N 3.31Å; C243-S256 PolarHBondContact SG-OG 3.18Å
244	K	57.6	Low	66	Low	170 Å²	170	66 Å²	66	74%	0.739	38%	0.376	S	S	*	.	H	α-helix	trans	-104	-21.8	172.8	-67.8	-179.1	178.2	136.4	0	113.3	D241 M242	D241-K244 HydrophobicContact CB-CB 4.38Å; D241-K244 HydrophobicContact CB-CD 4.03Å; D241-K244 HydrophobicContact CB-CG 4.23Å; D241-K244 WeakPolarHBondContact O-CB 3.4Å; D241-K244 PolarHBondContact O-N 2.84Å; D241-K244 VanDerWaalsContact OD2-CD 3.28Å; D241-K244 WeakPolarHBondContact OD2-CD 3.5Å; D241-K244 WeakPolarHBondContact OD2-CE 3.3Å; D241-K244 IonicContact OD2-NZ 3.12Å; D241-K244 PolarHBondContact OD2-NZ 2.7Å; M242-K244 PolarHBondContact O-N 2.88Å
245	V	54.3	Low	66.5	Low	94 Å²	94	64 Å²	64	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-90.3	-32.3	-175.7	-175	0	0	0	0	111.7	S240 M242	S240-V245 VanDerWaalsContact O-CG2 3.23Å; S240-V245 WeakPolarHBondContact O-CG2 3.06Å; M242-V245 PolarHBondContact O-N 2.03Å
246	V	55.7	Low	66.4	Low	81 Å²	81	65.1 Å²	65.1	49%	0.491	37%	0.37	S	S	.	.	S	Bend	trans	-139.7	139.7	-178.3	179.6	0	0	0	0	110.2	M242 H248	M242-V246 PolarHBondContact O-N 3.36Å; V246-H248 PolarHBondContact O-CD2 1.95Å; V246-H248 PolarHBondContact O-N 3.12Å; V246-H248 PolarHBondContact O-NE2 2.67Å
247	E	60.5	Low	65.9	Low	184 Å²	184	66.2 Å²	66.2	86%	0.86	38%	0.379	S	S	*	.			trans	-77.2	100.3	172.9	-74.5	-162	157.4	0	0	111.4	Q249	E247-Q249 VanDerWaalsContact C-N 3.28Å; E247-Q249 PolarHBondContact O-N 3.05Å
248	H	68.6	Low	65.4	Low	18 Å²	18	68.4 Å²	68.4	8%	0.083	39%	0.393	C	S	.	.			trans	-80	-0.8	-174.6	-68.5	-53.4	0	0	0	116	M242 V246 C250 Y261 K276	M242-H248 PolarHBondContact O-CD2 2.81Å; M242-H248 PolarHBondContact O-NE2 3.15Å; V246-H248 PolarHBondContact O-CD2 1.95Å; V246-H248 PolarHBondContact O-N 3.12Å; V246-H248 PolarHBondContact O-NE2 2.67Å; H248-C250 VanDerWaalsContact C-N 3.28Å; H248-C250 PolarHBondContact O-N 3.17Å; H248-Y261 HydrophobicContact CB-CD1 4.16Å; H248-Y261 HydrophobicContact CB-CD2 3.69Å; H248-Y261 HydrophobicContact CB-CE1 3.95Å; H248-Y261 HydrophobicContact CB-CE2 3.48Å; H248-Y261 VanDerWaalsContact CB-CE2 3.48Å; H248-Y261 HydrophobicContact CB-CG 4.03Å; H248-Y261 AromaticContact CD2-CD1 3.71Å; H248-Y261 AromaticContact CD2-CG 3.74Å; H248-Y261 AromaticContact CE1-CD1 3.56Å; H248-Y261 AromaticContact CE1-CE1 3.66Å; H248-Y261 AromaticContact CG-CD1 3.44Å; H248-Y261 VanDerWaalsContact CG-CD1 3.44Å; H248-Y261 AromaticContact CG-CD2 3.85Å; H248-Y261 AromaticContact CG-CE1 3.46Å; H248-Y261 VanDerWaalsContact CG-CE1 3.46Å; H248-Y261 AromaticContact CG-CE2 3.89Å; H248-Y261 AromaticContact CG-CG 3.63Å; H248-Y261 AromaticContact CG-CZ 3.67Å; H248-Y261 AromaticContact ND1-CD1 3.37Å; H248-Y261 WeakPolarHBondContact ND1-CD1 3Å; H248-Y261 AromaticContact ND1-CE1 3.1Å; H248-Y261 WeakPolarHBondContact ND1-CE1 3.34Å; H248-Y261 AromaticContact ND1-CZ 3.6Å; H248-Y261 AromaticContact NE2-CD1 3.78Å; H248-K276 PolarHBondContact O-NZ 3.26Å
249	Q	74.1	Confident	65.3	Low	156 Å²	156	67.2 Å²	67.2	73%	0.729	38%	0.38	S	S	*	.			trans	61.4	28.2	180	-51.8	171.2	7.7	0	0	114.5	E247 Q251	E247-Q249 VanDerWaalsContact C-N 3.28Å; E247-Q249 PolarHBondContact O-N 3.05Å; Q249-Q251 PolarHBondContact O-N 3.25Å
250	C	77.1	Confident	65.9	Low	26 Å²	26	64.3 Å²	64.3	18%	0.176	35%	0.349	C	S	.	.			trans	-63.5	124.7	168.6	-63.7	0	0	0	0	110.4	H248 H252 C254 C263	H248-C250 VanDerWaalsContact C-N 3.28Å; H248-C250 PolarHBondContact O-N 3.17Å; C250-H252 PolarHBondContact O-N 3.2Å; C250-C254 HydrophobicContact CB-CB 4.07Å; C250-C263 WeakPolarHBondContact CA-SG 3.38Å; C250-C263 HydrophobicContact CB-CB 3.58Å; C250-C263 WeakPolarHBondContact CB-SG 3.47Å; C250-C263 WeakPolarHBondContact SG-CA 3.1Å; C250-C263 WeakPolarHBondContact SG-CB 3.4Å; C250-C263 CovalentContact SG-SG 2.03Å; C250-C263 PolarHBondContact SG-SG 3.06Å
251	Q	80.8	Confident	66.8	Low	94 Å²	94	60.9 Å²	60.9	44%	0.439	33%	0.325	S	S	.	.	S	Bend	trans	-61.1	-32.5	-177.9	-179.2	-177.6	-35.1	0	0	113.1	Q249 K276 T277 C278	Q249-Q251 PolarHBondContact O-N 3.25Å; Q251-K276 PolarHBondContact N-O 3.02Å; Q251-T277 VanDerWaalsContact OE1-CB 3.26Å; Q251-C278 PolarHBondContact NE2-O 3.01Å; Q251-C278 PolarHBondContact OE1-O 2.98Å
252	H	83.3	Confident	67.7	Low	43 Å²	43	64.6 Å²	64.6	20%	0.199	33%	0.334	C	S	.	.	S	Bend	trans	-122.8	-65.9	-171.8	-80.2	166.8	0	0	0	114.9	C250 R264 R266 F269 C278	C250-H252 PolarHBondContact O-N 3.2Å; H252-R264 WeakPolarHBondContact CB-O 3.36Å; H252-R266 HydrophobicContact CB-CG 4.21Å; H252-F269 AromaticContact CE1-CD1 3.49Å; H252-F269 VanDerWaalsContact CE1-CD1 3.49Å; H252-F269 WeakPolarHBondContact CE1-CD1 3.35Å; H252-F269 AromaticContact CE1-CD2 3.85Å; H252-F269 AromaticContact CE1-CE1 3.85Å; H252-F269 AromaticContact CE1-CG 3.51Å; H252-C278 VanDerWaalsContact ND1-CB 3.31Å; H252-C278 WeakPolarHBondContact ND1-CB 3.24Å; H252-C278 PolarHBondContact ND1-SG 3.26Å; H252-C278 VanDerWaalsContact ND1-SG 3.36Å
253	I	81.6	Confident	68.8	Low	54 Å²	54	63.3 Å²	63.3	28%	0.277	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.6	-177.6	-53.3	172.1	0	0	0	107.6	V255 C263 R264 R266	I253-V255 HydrophobicContact CG2-CG2 4.03Å; I253-C263 CarbonylContact O-C 3.55Å; I253-C263 WeakPolarHBondContact O-CA 3.45Å; I253-R264 HydrophobicContact CB-CB 4.39Å; I253-R264 VanDerWaalsContact CB-O 3.3Å; I253-R264 WeakPolarHBondContact CB-O 3.25Å; I253-R264 PolarHBondContact N-O 3.03Å; I253-R264 PolarHBondContact O-N 3.29Å; I253-R266 HydrophobicContact CD1-CG 4.16Å; I253-R266 HydrophobicContact CG1-CG 4.31Å
254	C	79.9	Confident	69.7	Low	39 Å²	39	68.1 Å²	68.1	26%	0.264	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.5	165.5	-173.8	0	0	0	0	108.5	C243 C250	C243-C254 HydrophobicContact CB-CB 3.65Å; C243-C254 WeakPolarHBondContact CB-SG 3.06Å; C243-C254 WeakPolarHBondContact SG-CB 3.48Å; C243-C254 CovalentContact SG-SG 2.03Å; C243-C254 PolarHBondContact SG-SG 3.17Å; C250-C254 HydrophobicContact CB-CB 4.07Å
255	V	78.2	Confident	70.9	Confident	37 Å²	37	60.9 Å²	60.9	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	113.4	173.5	-176.7	0	0	0	0	108.1	C243 I253 S257 Y261 R262 R264	C243-V255 VanDerWaalsContact SG-C 3.53Å; C243-V255 PolarHBondContact SG-N 3.37Å; C243-V255 VanDerWaalsContact SG-N 3.43Å; I253-V255 HydrophobicContact CG2-CG2 4.03Å; V255-S257 PolarHBondContact O-N 3.02Å; V255-Y261 WeakPolarHBondContact O-CA 3.44Å; V255-R262 HydrophobicContact CB-CG 4.12Å; V255-R262 PolarHBondContact N-O 2.87Å; V255-R262 PolarHBondContact O-N 2.92Å; V255-R264 HydrophobicContact CG2-CB 4.11Å
256	S	67.6	Low	72.1	Confident	38 Å²	38	63.9 Å²	63.9	27%	0.266	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	132.6	175.1	-62.2	0	0	0	0	109.9	D241 M242 C243	D241-S256 VanDerWaalsContact C-OG 3.26Å; D241-S256 WeakPolarHBondContact OD1-CB 3.34Å; D241-S256 PolarHBondContact OD1-OG 3.42Å; M242-S256 PolarHBondContact N-OG 2.66Å; C243-S256 WeakPolarHBondContact CB-OG 3.49Å; C243-S256 PolarHBondContact N-OG 2.82Å; C243-S256 PolarHBondContact SG-N 3.31Å; C243-S256 PolarHBondContact SG-OG 3.18Å
257	S	59.8	Low	72.9	Confident	34 Å²	34	69.8 Å²	69.8	24%	0.238	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	157.3	166.7	55.5	0	0	0	0	108.4	V255 A259 S260	V255-S257 PolarHBondContact O-N 3.02Å; S257-A259 PolarHBondContact O-N 2.6Å; S257-S260 CarbonylContact C-O 3.48Å; S257-S260 PolarHBondContact N-O 3.17Å; S257-S260 CarbonylContact O-C 3.58Å; S257-S260 PolarHBondContact O-N 3.23Å; S257-S260 VanDerWaalsContact OG-C 3.28Å; S257-S260 PolarHBondContact OG-O 2.69Å
258	P	56.8	Low	73	Confident	59 Å²	59	61.5 Å²	61.5	38%	0.383	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	133	172.5	-29.9	41.2	0	0	0	110.4	T54 L56 P162 S260	T54-P258 HydrophobicContact CG2-CB 4.33Å; L56-P258 HydrophobicContact CD2-CB 4.36Å; P162-P258 HydrophobicContact CB-CB 4.17Å; P162-P258 HydrophobicContact CG-CB 3.32Å; P162-P258 HydrophobicContact CG-CG 3.44Å; P162-P258 VanDerWaalsContact CG-CG 3.44Å; P258-S260 PolarHBondContact O-N 3.43Å; P258-S260 VanDerWaalsContact O-N 3.1Å
259	A	54.7	Low	73.3	Confident	10 Å²	10	63 Å²	63	8%	0.083	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	7.8	-173	0	0	0	0	0	118.4	I164 K235 L236 S257	I164-A259 HydrophobicContact CD1-CB 4.07Å; K235-A259 VanDerWaalsContact O-CA 3.3Å; K235-A259 WeakPolarHBondContact O-CA 3.26Å; L236-A259 HydrophobicContact CD2-CB 3.89Å; S257-A259 PolarHBondContact O-N 2.6Å
260	S	63.1	Low	73.3	Confident	4 Å²	4	58 Å²	58	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	-165.8	179.5	-162.5	0	0	0	0	113.6	H215 M242 S257 P258	H215-S260 PolarHBondContact CE1-OG 3.02Å; H215-S260 PolarHBondContact NE2-OG 3.4Å; M242-S260 WeakPolarHBondContact CG-O 3.35Å; S257-S260 CarbonylContact C-O 3.48Å; S257-S260 PolarHBondContact N-O 3.17Å; S257-S260 CarbonylContact O-C 3.58Å; S257-S260 PolarHBondContact O-N 3.23Å; S257-S260 VanDerWaalsContact OG-C 3.28Å; S257-S260 PolarHBondContact OG-O 2.69Å; P258-S260 PolarHBondContact O-N 3.43Å; P258-S260 VanDerWaalsContact O-N 3.1Å
261	Y	71.4	Confident	73.3	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.3	166.8	67.4	-82.1	0	0	0	108.8	P211 E214 H248 V255 K276	P211-Y261 HydrophobicContact CG-CE1 4.33Å; P211-Y261 HydrophobicContact CG-CE2 4.32Å; E214-Y261 HydrophobicContact CG-CE1 4.08Å; H248-Y261 HydrophobicContact CB-CD1 4.16Å; H248-Y261 HydrophobicContact CB-CD2 3.69Å; H248-Y261 HydrophobicContact CB-CE1 3.95Å; H248-Y261 HydrophobicContact CB-CE2 3.48Å; H248-Y261 VanDerWaalsContact CB-CE2 3.48Å; H248-Y261 HydrophobicContact CB-CG 4.03Å; H248-Y261 AromaticContact CD2-CD1 3.71Å; H248-Y261 AromaticContact CD2-CG 3.74Å; H248-Y261 AromaticContact CE1-CD1 3.56Å; H248-Y261 AromaticContact CE1-CE1 3.66Å; H248-Y261 AromaticContact CG-CD1 3.44Å; H248-Y261 VanDerWaalsContact CG-CD1 3.44Å; H248-Y261 AromaticContact CG-CD2 3.85Å; H248-Y261 AromaticContact CG-CE1 3.46Å; H248-Y261 VanDerWaalsContact CG-CE1 3.46Å; H248-Y261 AromaticContact CG-CE2 3.89Å; H248-Y261 AromaticContact CG-CG 3.63Å; H248-Y261 AromaticContact CG-CZ 3.67Å; H248-Y261 AromaticContact ND1-CD1 3.37Å; H248-Y261 WeakPolarHBondContact ND1-CD1 3Å; H248-Y261 AromaticContact ND1-CE1 3.1Å; H248-Y261 WeakPolarHBondContact ND1-CE1 3.34Å; H248-Y261 AromaticContact ND1-CZ 3.6Å; H248-Y261 AromaticContact NE2-CD1 3.78Å; V255-Y261 WeakPolarHBondContact O-CA 3.44Å; Y261-K276 WeakPolarHBondContact OH-CE 3.19Å; Y261-K276 PolarHBondContact OH-NZ 3.42Å
262	R	74.5	Confident	72.8	Confident	145 Å²	145	57.5 Å²	57.5	55%	0.547	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	135.7	165.6	61.6	-170.9	174.3	104	-4.2	109.6	V255	V255-R262 HydrophobicContact CB-CG 4.12Å; V255-R262 PolarHBondContact N-O 2.87Å; V255-R262 PolarHBondContact O-N 2.92Å
263	C	81.3	Confident	72	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.034	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	142.9	168.8	-53.4	0	0	0	0	109.2	C250 I253 L271 G275	C250-C263 WeakPolarHBondContact CA-SG 3.38Å; C250-C263 HydrophobicContact CB-CB 3.58Å; C250-C263 WeakPolarHBondContact CB-SG 3.47Å; C250-C263 WeakPolarHBondContact SG-CA 3.1Å; C250-C263 WeakPolarHBondContact SG-CB 3.4Å; C250-C263 CovalentContact SG-SG 2.03Å; C250-C263 PolarHBondContact SG-SG 3.06Å; I253-C263 CarbonylContact O-C 3.55Å; I253-C263 WeakPolarHBondContact O-CA 3.45Å; C263-L271 HydrophobicContact CB-CD1 3.98Å; C263-L271 WeakPolarHBondContact O-CD2 3.31Å; C263-G275 VanDerWaalsContact CB-O 3.24Å; C263-G275 WeakPolarHBondContact CB-O 3.23Å; C263-G275 PolarHBondContact SG-O 2.99Å; C263-G275 VanDerWaalsContact SG-O 3.38Å
264	R	82.6	Confident	71.1	Confident	136 Å²	136	61.8 Å²	61.8	51%	0.513	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.6	175.1	-174.6	175.4	65.1	149.9	-1.5	108.7	H252 I253 V255	H252-R264 WeakPolarHBondContact CB-O 3.36Å; I253-R264 HydrophobicContact CB-CB 4.39Å; I253-R264 VanDerWaalsContact CB-O 3.3Å; I253-R264 WeakPolarHBondContact CB-O 3.25Å; I253-R264 PolarHBondContact N-O 3.03Å; I253-R264 PolarHBondContact O-N 3.29Å; V255-R264 HydrophobicContact CG2-CB 4.11Å
265	C	83.2	Confident	70.7	Confident	18 Å²	18	60.2 Å²	60.2	12%	0.122	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-85.1	155	177	-58.6	0	0	0	0	111.7	F269 L271 C278	C265-F269 HydrophobicContact CB-CB 3.79Å; C265-F269 WeakPolarHBondContact CB-O 3.33Å; C265-L271 WeakPolarHBondContact SG-CA 3.41Å; C265-L271 PolarHBondContact SG-N 2.82Å; C265-L271 VanDerWaalsContact SG-N 3.38Å; C265-C278 WeakPolarHBondContact CA-SG 3.31Å; C265-C278 HydrophobicContact CB-CB 3.88Å; C265-C278 WeakPolarHBondContact CB-SG 3.39Å; C265-C278 VanDerWaalsContact SG-CA 3.59Å; C265-C278 WeakPolarHBondContact SG-CB 3.48Å; C265-C278 CovalentContact SG-SG 2.03Å; C265-C278 PolarHBondContact SG-SG 2.91Å
266	R	79.9	Confident	70.5	Confident	156 Å²	156	60.6 Å²	60.6	59%	0.589	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-68.5	162	165.9	-66.6	174.9	-174.4	-168.4	3.2	109.1	H252 I253 F269	H252-R266 HydrophobicContact CB-CG 4.21Å; I253-R266 HydrophobicContact CD1-CG 4.16Å; I253-R266 HydrophobicContact CG1-CG 4.31Å; R266-F269 WeakPolarHBondContact O-CB 3.24Å; R266-F269 PolarHBondContact O-N 3.32Å
267	K	71.9	Confident	71.1	Confident	205 Å²	205	61 Å²	61	89%	0.891	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	140.5	177.5	-168.9	-176.7	179.1	-169.5	0	109.9
268	G	62.6	Low	72.1	Confident	11 Å²	11	59.7 Å²	59.7	11%	0.113	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	14.6	-173.7	0	0	0	0	0	114.6	E281 M283	G268-E281 VanDerWaalsContact O-CB 3.31Å; G268-E281 WeakPolarHBondContact O-CB 3.38Å; G268-E281 PolarHBondContact O-N 3.39Å; G268-M283 VanDerWaalsContact CA-CE 3.45Å
269	F	74.1	Confident	73.1	Confident	50 Å²	50	62.6 Å²	62.6	22%	0.219	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	140.1	174.7	-66.4	-101.1	0	0	0	110.2	H252 C265 R266 C278 K279 A280	H252-F269 AromaticContact CE1-CD1 3.49Å; H252-F269 VanDerWaalsContact CE1-CD1 3.49Å; H252-F269 WeakPolarHBondContact CE1-CD1 3.35Å; H252-F269 AromaticContact CE1-CD2 3.85Å; H252-F269 AromaticContact CE1-CE1 3.85Å; H252-F269 AromaticContact CE1-CG 3.51Å; C265-F269 HydrophobicContact CB-CB 3.79Å; C265-F269 WeakPolarHBondContact CB-O 3.33Å; R266-F269 WeakPolarHBondContact O-CB 3.24Å; R266-F269 PolarHBondContact O-N 3.32Å; F269-C278 HydrophobicContact CB-CB 4.16Å; F269-C278 HydrophobicContact CD1-CB 4.48Å; F269-K279 CarbonylContact C-O 3.57Å; F269-K279 WeakPolarHBondContact CA-O 3.47Å; F269-K279 WeakPolarHBondContact CB-O 3.17Å; F269-A280 HydrophobicContact CD1-CB 4.01Å; F269-A280 HydrophobicContact CE1-CB 3.81Å
270	T	75.6	Confident	73.7	Confident	50 Å²	50	65.3 Å²	65.3	31%	0.307	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.6	177.8	47.3	0	0	0	0	110.7	C278 K279	T270-C278 CarbonylContact O-C 3.44Å; T270-C278 WeakPolarHBondContact O-CA 3.48Å; T270-K279 PolarHBondContact N-O 3.42Å; T270-K279 PolarHBondContact O-N 3.17Å; T270-K279 WeakPolarHBondContact OG1-CE 3.47Å; T270-K279 VanDerWaalsContact OG1-CG 3.23Å; T270-K279 WeakPolarHBondContact OG1-CG 3.24Å
271	L	76.3	Confident	73.8	Confident	70 Å²	70	69.7 Å²	69.7	37%	0.366	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.6	-178.4	-166	73.5	0	0	0	109.5	C263 C265 T277	C263-L271 HydrophobicContact CB-CD1 3.98Å; C263-L271 WeakPolarHBondContact O-CD2 3.31Å; C265-L271 WeakPolarHBondContact SG-CA 3.41Å; C265-L271 PolarHBondContact SG-N 2.82Å; C265-L271 VanDerWaalsContact SG-N 3.38Å; L271-T277 WeakPolarHBondContact CD1-O 3.28Å
272	N	71.1	Confident	73.5	Confident	39 Å²	39	73.8 Å²	73.8	21%	0.209	36%	0.363	C	S	.	.			trans	-75.7	161.5	177	-72.7	-35.2	0	0	0	111.3	D274 G275 T277 K279	N272-D274 PolarHBondContact O-N 2.86Å; N272-G275 PolarHBondContact O-N 2.89Å; N272-T277 WeakPolarHBondContact CB-O 3.19Å; N272-T277 WeakPolarHBondContact CB-OG1 3.39Å; N272-T277 PolarHBondContact N-O 3.44Å; N272-T277 PolarHBondContact ND2-OG1 3.19Å; N272-K279 PolarHBondContact ND2-N 3.14Å; N272-K279 WeakPolarHBondContact OD1-CB 3.41Å; N272-K279 WeakPolarHBondContact OD1-CD 3.46Å; N272-K279 VanDerWaalsContact OD1-CG 3.3Å; N272-K279 WeakPolarHBondContact OD1-CG 3.25Å
273	P	64.9	Low	73.2	Confident	112 Å²	112	69.5 Å²	69.5	73%	0.727	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-5.2	179.2	-24.2	35.1	0	0	0	115.8	Q210 G275	Q210-P273 PolarHBondContact NE2-O 3.38Å; P273-G275 VanDerWaalsContact C-N 3.26Å
274	D	64.4	Low	72.7	Confident	76 Å²	76	70.4 Å²	70.4	41%	0.406	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.7	171.8	65.4	7.7	0	0	0	113.1	N272 K276 T277	N272-D274 PolarHBondContact O-N 2.86Å; D274-K276 PolarHBondContact O-N 2.95Å; D274-K276 PolarHBondContact OD1-N 2.85Å; D274-T277 VanDerWaalsContact CG-OG1 3.29Å; D274-T277 PolarHBondContact OD1-N 2.88Å; D274-T277 PolarHBondContact OD1-OG1 2.97Å; D274-T277 WeakPolarHBondContact OD2-CB 3.35Å; D274-T277 VanDerWaalsContact OD2-CG2 3.25Å; D274-T277 WeakPolarHBondContact OD2-CG2 3.43Å; D274-T277 PolarHBondContact OD2-OG1 3.27Å
275	G	70.4	Confident	72	Confident	6 Å²	6	67.6 Å²	67.6	6%	0.062	36%	0.363	C	S	.	.	S	Bend	trans	69.6	10	-178.1	0	0	0	0	0	114.4	C263 N272 P273	C263-G275 VanDerWaalsContact CB-O 3.24Å; C263-G275 WeakPolarHBondContact CB-O 3.23Å; C263-G275 PolarHBondContact SG-O 2.99Å; C263-G275 VanDerWaalsContact SG-O 3.38Å; N272-G275 PolarHBondContact O-N 2.89Å; P273-G275 VanDerWaalsContact C-N 3.26Å
276	K	75.1	Confident	71.1	Confident	44 Å²	44	69.2 Å²	69.2	19%	0.191	38%	0.377	C	S	.	.	S	Bend	trans	-132.5	-42.4	-172.2	-65.6	-164	179.1	-153.1	0	115	H248 Q251 Y261 D274	H248-K276 PolarHBondContact O-NZ 3.26Å; Q251-K276 PolarHBondContact N-O 3.02Å; Y261-K276 WeakPolarHBondContact OH-CE 3.19Å; Y261-K276 PolarHBondContact OH-NZ 3.42Å; D274-K276 PolarHBondContact O-N 2.95Å; D274-K276 PolarHBondContact OD1-N 2.85Å
277	T	78.6	Confident	69.8	Low	48 Å²	48	67.3 Å²	67.3	29%	0.294	39%	0.394	S	S	.	.			trans	-94.1	159.5	-178	65.7	0	0	0	0	111.5	Q251 L271 N272 D274	Q251-T277 VanDerWaalsContact OE1-CB 3.26Å; L271-T277 WeakPolarHBondContact CD1-O 3.28Å; N272-T277 WeakPolarHBondContact CB-O 3.19Å; N272-T277 WeakPolarHBondContact CB-OG1 3.39Å; N272-T277 PolarHBondContact N-O 3.44Å; N272-T277 PolarHBondContact ND2-OG1 3.19Å; D274-T277 VanDerWaalsContact CG-OG1 3.29Å; D274-T277 PolarHBondContact OD1-N 2.88Å; D274-T277 PolarHBondContact OD1-OG1 2.97Å; D274-T277 WeakPolarHBondContact OD2-CB 3.35Å; D274-T277 VanDerWaalsContact OD2-CG2 3.25Å; D274-T277 WeakPolarHBondContact OD2-CG2 3.43Å; D274-T277 PolarHBondContact OD2-OG1 3.27Å
278	C	81.3	Confident	69.5	Low	6 Å²	6	64.5 Å²	64.5	4%	0.041	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	117.2	-174.6	-69	0	0	0	0	109.1	Q251 H252 C265 F269 T270	Q251-C278 PolarHBondContact NE2-O 3.01Å; Q251-C278 PolarHBondContact OE1-O 2.98Å; H252-C278 VanDerWaalsContact ND1-CB 3.31Å; H252-C278 WeakPolarHBondContact ND1-CB 3.24Å; H252-C278 PolarHBondContact ND1-SG 3.26Å; H252-C278 VanDerWaalsContact ND1-SG 3.36Å; C265-C278 WeakPolarHBondContact CA-SG 3.31Å; C265-C278 HydrophobicContact CB-CB 3.88Å; C265-C278 WeakPolarHBondContact CB-SG 3.39Å; C265-C278 VanDerWaalsContact SG-CA 3.59Å; C265-C278 WeakPolarHBondContact SG-CB 3.48Å; C265-C278 CovalentContact SG-SG 2.03Å; C265-C278 PolarHBondContact SG-SG 2.91Å; F269-C278 HydrophobicContact CB-CB 4.16Å; F269-C278 HydrophobicContact CD1-CB 4.48Å; T270-C278 CarbonylContact O-C 3.44Å; T270-C278 WeakPolarHBondContact O-CA 3.48Å
279	K	78.6	Confident	70	Confident	119 Å²	119	66.5 Å²	66.5	52%	0.517	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	143.9	168	63.7	-178.4	179.5	179.1	0	109.3	F269 T270 N272	F269-K279 CarbonylContact C-O 3.57Å; F269-K279 WeakPolarHBondContact CA-O 3.47Å; F269-K279 WeakPolarHBondContact CB-O 3.17Å; T270-K279 PolarHBondContact N-O 3.42Å; T270-K279 PolarHBondContact O-N 3.17Å; T270-K279 WeakPolarHBondContact OG1-CE 3.47Å; T270-K279 VanDerWaalsContact OG1-CG 3.23Å; T270-K279 WeakPolarHBondContact OG1-CG 3.24Å; N272-K279 PolarHBondContact ND2-N 3.14Å; N272-K279 WeakPolarHBondContact OD1-CB 3.41Å; N272-K279 WeakPolarHBondContact OD1-CD 3.46Å; N272-K279 VanDerWaalsContact OD1-CG 3.3Å; N272-K279 WeakPolarHBondContact OD1-CG 3.25Å
280	A	66	Low	70	Confident	67 Å²	67	65.6 Å²	65.6	55%	0.554	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	138.3	168.5	0	0	0	0	0	109	F269	F269-A280 HydrophobicContact CD1-CB 4.01Å; F269-A280 HydrophobicContact CE1-CB 3.81Å
281	E	65.4	Low	70.4	Confident	96 Å²	96	64 Å²	64	45%	0.449	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-79.3	117.4	170.3	-170.2	166	-146.8	0	0	107.3	G268 M283	G268-E281 VanDerWaalsContact O-CB 3.31Å; G268-E281 WeakPolarHBondContact O-CB 3.38Å; G268-E281 PolarHBondContact O-N 3.39Å; E281-M283 PolarHBondContact O-N 3.2Å
282	D	65.3	Low	70.9	Confident	90 Å²	90	64.9 Å²	64.9	48%	0.481	40%	0.396	S	S	.	.			trans	-76.3	93.3	-178.9	-167.7	-32.1	0	0	0	109	C284 A285 N297	D282-C284 VanDerWaalsContact C-N 3.25Å; D282-C284 PolarHBondContact O-N 3.36Å; D282-C284 PolarHBondContact OD1-N 3.48Å; D282-A285 HydrophobicContact CB-CB 3.83Å; D282-A285 WeakPolarHBondContact O-CB 3.49Å; D282-A285 PolarHBondContact O-N 2.96Å; D282-A285 PolarHBondContact OD1-N 2.84Å; D282-N297 VanDerWaalsContact CG-ND2 3.27Å; D282-N297 PolarHBondContact OD1-ND2 3.39Å; D282-N297 PolarHBondContact OD1-OD1 3.36Å
283	M	67.8	Low	71.6	Confident	56 Å²	56	65.4 Å²	65.4	28%	0.276	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-71.7	-22.9	-179.3	-59.9	-168.8	-173.6	0	0	112	G268 E281 A285 A286 N297 Y302	G268-M283 VanDerWaalsContact CA-CE 3.45Å; E281-M283 PolarHBondContact O-N 3.2Å; M283-A285 VanDerWaalsContact C-N 3.33Å; M283-A286 WeakPolarHBondContact O-CB 3.49Å; M283-A286 PolarHBondContact O-N 2.85Å; M283-N297 PolarHBondContact N-OD1 3.08Å; M283-Y302 HydrophobicContact CB-CD1 3.76Å; M283-Y302 HydrophobicContact CB-CG 4.46Å; M283-Y302 HydrophobicContact SD-CD1 4.31Å
284	C	71.6	Confident	72.6	Confident	24 Å²	24	63.4 Å²	63.4	16%	0.162	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-76.5	-16.4	170.7	-61	0	0	0	0	113.5	D282 A286 H289 C295 V296 N297	D282-C284 VanDerWaalsContact C-N 3.25Å; D282-C284 PolarHBondContact O-N 3.36Å; D282-C284 PolarHBondContact OD1-N 3.48Å; C284-A286 VanDerWaalsContact C-N 3.27Å; C284-H289 PolarHBondContact O-CD2 2.94Å; C284-H289 VanDerWaalsContact O-CD2 3.26Å; C284-C295 WeakPolarHBondContact CA-SG 3.36Å; C284-C295 HydrophobicContact CB-CB 3.7Å; C284-C295 WeakPolarHBondContact CB-SG 3.48Å; C284-C295 WeakPolarHBondContact SG-CB 3.49Å; C284-C295 CovalentContact SG-SG 2.04Å; C284-C295 PolarHBondContact SG-SG 3.12Å; C284-V296 PolarHBondContact SG-N 3.39Å; C284-V296 VanDerWaalsContact SG-N 3.44Å; C284-N297 PolarHBondContact N-OD1 3.42Å
285	A	68.1	Low	73.6	Confident	77 Å²	77	61 Å²	61	64%	0.636	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-80.3	-6.4	170.8	0	0	0	0	0	113.2	D282 M283	D282-A285 HydrophobicContact CB-CB 3.83Å; D282-A285 WeakPolarHBondContact O-CB 3.49Å; D282-A285 PolarHBondContact O-N 2.96Å; D282-A285 PolarHBondContact OD1-N 2.84Å; M283-A285 VanDerWaalsContact C-N 3.33Å
286	A	64	Low	74.2	Confident	51 Å²	51	62.9 Å²	62.9	42%	0.421	38%	0.379	S	S	.	.	S	Bend	trans	-70.1	129.8	168.5	0	0	0	0	0	110	M283 C284 D288 H289	M283-A286 WeakPolarHBondContact O-CB 3.49Å; M283-A286 PolarHBondContact O-N 2.85Å; C284-A286 VanDerWaalsContact C-N 3.27Å; A286-D288 PolarHBondContact O-N 3.28Å; A286-H289 PolarHBondContact O-CD2 2.97Å; A286-H289 PolarHBondContact O-N 3.28Å
287	A	51.9	Low	74.2	Confident	116 Å²	116	63.7 Å²	63.7	96%	0.959	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.3	-172.3	0	0	0	0	0	115.2
288	D	65.9	Low	73.8	Confident	147 Å²	147	65.7 Å²	65.7	79%	0.786	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.1	66.7	174.6	-174.2	15.2	0	0	0	110.4	A286	A286-D288 PolarHBondContact O-N 3.28Å
289	H	72.8	Confident	72.6	Confident	53 Å²	53	68.9 Å²	68.9	25%	0.245	42%	0.42	C	S	.	.			trans	-80.6	-1.6	172.8	64.6	67.1	0	0	0	112.7	C284 A286 C291 Y302	C284-H289 PolarHBondContact O-CD2 2.94Å; C284-H289 VanDerWaalsContact O-CD2 3.26Å; A286-H289 PolarHBondContact O-CD2 2.97Å; A286-H289 PolarHBondContact O-N 3.28Å; H289-C291 VanDerWaalsContact C-N 3.32Å; H289-C291 PolarHBondContact ND1-N 3.35Å; H289-C291 PolarHBondContact O-N 3.31Å; H289-C291 VanDerWaalsContact O-N 3.17Å; H289-Y302 VanDerWaalsContact O-CE2 3.24Å; H289-Y302 WeakPolarHBondContact O-CE2 3.31Å; H289-Y302 VanDerWaalsContact O-CZ 3.32Å; H289-Y302 PolarHBondContact O-OH 2.83Å
290	G	75.2	Confident	71.6	Confident	30 Å²	30	71.3 Å²	71.3	31%	0.309	44%	0.439	S	S	.	.			trans	53.2	37.4	172.5	0	0	0	0	0	116.3	K317	G290-K317 WeakPolarHBondContact O-CB 3.28Å; G290-K317 VanDerWaalsContact O-CD 3.31Å; G290-K317 WeakPolarHBondContact O-CD 3.46Å; G290-K317 WeakPolarHBondContact O-CG 3.42Å
291	C	84.3	Confident	71.8	Confident	17 Å²	17	69 Å²	69	12%	0.115	42%	0.421	C	S	.	.			trans	-105.4	132.4	167.9	-63.7	0	0	0	0	109.3	H289 C295 C304	H289-C291 VanDerWaalsContact C-N 3.32Å; H289-C291 PolarHBondContact ND1-N 3.35Å; H289-C291 PolarHBondContact O-N 3.31Å; H289-C291 VanDerWaalsContact O-N 3.17Å; C291-C295 HydrophobicContact CB-CB 4.22Å; C291-C304 WeakPolarHBondContact CA-SG 3.4Å; C291-C304 HydrophobicContact CB-CB 3.61Å; C291-C304 WeakPolarHBondContact CB-SG 3.39Å; C291-C304 WeakPolarHBondContact SG-CA 3.46Å; C291-C304 WeakPolarHBondContact SG-CB 3.48Å; C291-C304 CovalentContact SG-SG 2.03Å; C291-C304 PolarHBondContact SG-SG 3.17Å
292	D	85.8	Confident	72.5	Confident	89 Å²	89	68.2 Å²	68.2	48%	0.476	42%	0.415	S	S	.	.	S	Bend	trans	-69	-37.1	-175.9	-173.3	30.8	0	0	0	113.2	K317 C319	D292-K317 VanDerWaalsContact CB-O 3.28Å; D292-K317 WeakPolarHBondContact CB-O 3.01Å; D292-K317 PolarHBondContact N-O 3.32Å; D292-K317 VanDerWaalsContact N-O 3.07Å; D292-C319 HydrophobicContact CB-CB 4.49Å; D292-C319 WeakPolarHBondContact OD2-CB 3.4Å; D292-C319 PolarHBondContact OD2-N 3.13Å
293	H	86.9	Confident	73.4	Confident	49 Å²	49	67.6 Å²	67.6	23%	0.227	41%	0.409	C	S	.	.	S	Bend	trans	-119.9	-64	-175.3	-85.2	154.2	0	0	0	116.2	R307 Y310 C319	H293-R307 HydrophobicContact CB-CG 4.22Å; H293-Y310 AromaticContact CE1-CD1 3.61Å; H293-Y310 AromaticContact CE1-CD2 3.91Å; H293-Y310 AromaticContact CE1-CE1 3.84Å; H293-Y310 AromaticContact CE1-CG 3.66Å; H293-C319 WeakPolarHBondContact ND1-CB 3.07Å; H293-C319 PolarHBondContact ND1-SG 2.81Å
294	I	85.8	Confident	74.3	Confident	71 Å²	71	65.3 Å²	65.3	36%	0.364	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	129.3	-175.3	-53.7	171.5	0	0	0	107.5	V296 C304 R305 R307	I294-V296 HydrophobicContact CG2-CG2 4.03Å; I294-C304 CarbonylContact O-C 3.46Å; I294-C304 WeakPolarHBondContact O-CA 3.49Å; I294-R305 HydrophobicContact CB-CB 4.29Å; I294-R305 VanDerWaalsContact CB-O 3.31Å; I294-R305 WeakPolarHBondContact CB-O 3.48Å; I294-R305 PolarHBondContact N-O 3.02Å; I294-R305 PolarHBondContact O-N 3.3Å; I294-R307 HydrophobicContact CD1-CG 4.1Å; I294-R307 HydrophobicContact CG1-CG 4.29Å
295	C	84.6	Confident	75.1	Confident	25 Å²	25	70.8 Å²	70.8	17%	0.169	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.5	167.6	-176.3	0	0	0	0	109.2	C284 C291	C284-C295 WeakPolarHBondContact CA-SG 3.36Å; C284-C295 HydrophobicContact CB-CB 3.7Å; C284-C295 WeakPolarHBondContact CB-SG 3.48Å; C284-C295 WeakPolarHBondContact SG-CB 3.49Å; C284-C295 CovalentContact SG-SG 2.04Å; C284-C295 PolarHBondContact SG-SG 3.12Å; C291-C295 HydrophobicContact CB-CB 4.22Å
296	V	82.8	Confident	75.8	Confident	46 Å²	46	68.5 Å²	68.5	28%	0.279	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.4	174.8	-177.8	0	0	0	0	109.5	C284 I294 Y302 E303 R305	C284-V296 PolarHBondContact SG-N 3.39Å; C284-V296 VanDerWaalsContact SG-N 3.44Å; I294-V296 HydrophobicContact CG2-CG2 4.03Å; V296-Y302 CarbonylContact O-C 3.58Å; V296-Y302 VanDerWaalsContact O-CA 3.28Å; V296-Y302 WeakPolarHBondContact O-CA 3.33Å; V296-E303 HydrophobicContact CB-CG 4.06Å; V296-E303 PolarHBondContact N-O 3.46Å; V296-E303 PolarHBondContact O-N 3.42Å; V296-R305 HydrophobicContact CG2-CG 4.13Å
297	N	75.1	Confident	76.7	Confident	61 Å²	61	72.8 Å²	72.8	33%	0.326	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	134	173.8	-66.1	-66.5	0	0	0	110.8	D282 M283 C284	D282-N297 VanDerWaalsContact CG-ND2 3.27Å; D282-N297 PolarHBondContact OD1-ND2 3.39Å; D282-N297 PolarHBondContact OD1-OD1 3.36Å; M283-N297 PolarHBondContact N-OD1 3.08Å; C284-N297 PolarHBondContact N-OD1 3.42Å
298	L	70.8	Confident	77.9	Confident	90 Å²	90	72.5 Å²	72.5	47%	0.471	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	168.5	175.4	-63.5	-179.3	0	0	0	110.2	D300 G301 E303	L298-D300 PolarHBondContact O-N 3.41Å; L298-G301 CarbonylContact C-O 3.59Å; L298-G301 PolarHBondContact N-O 3.15Å; L298-G301 PolarHBondContact O-N 3.47Å; L298-E303 HydrophobicContact CD1-CB 3.84Å; L298-E303 HydrophobicContact CD1-CG 3.8Å; L298-E303 HydrophobicContact CD2-CG 4.36Å; L298-E303 HydrophobicContact CG-CB 4.48Å; L298-E303 HydrophobicContact CG-CG 4.08Å
299	A	56.3	Low	77.9	Confident	73 Å²	73	65.7 Å²	65.7	60%	0.603	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23.8	-179.9	0	0	0	0	0	114.1
300	D	58	Low	78.4	Confident	170 Å²	170	66 Å²	66	91%	0.909	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	18.6	-177.3	-66.9	-56.7	0	0	0	113.2	L298	L298-D300 PolarHBondContact O-N 3.41Å
301	G	70.3	Confident	78.6	Confident	17 Å²	17	70 Å²	70	18%	0.175	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154	-142.1	179	0	0	0	0	0	113.6	L298	L298-G301 CarbonylContact C-O 3.59Å; L298-G301 PolarHBondContact N-O 3.15Å; L298-G301 PolarHBondContact O-N 3.47Å
302	Y	79.6	Confident	78.6	Confident	81 Å²	81	72.2 Å²	72.2	32%	0.318	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	153.4	165.9	66.3	-87.4	0	0	0	110	M283 H289 V296 K317	M283-Y302 HydrophobicContact CB-CD1 3.76Å; M283-Y302 HydrophobicContact CB-CG 4.46Å; M283-Y302 HydrophobicContact SD-CD1 4.31Å; H289-Y302 VanDerWaalsContact O-CE2 3.24Å; H289-Y302 WeakPolarHBondContact O-CE2 3.31Å; H289-Y302 VanDerWaalsContact O-CZ 3.32Å; H289-Y302 PolarHBondContact O-OH 2.83Å; V296-Y302 CarbonylContact O-C 3.58Å; V296-Y302 VanDerWaalsContact O-CA 3.28Å; V296-Y302 WeakPolarHBondContact O-CA 3.33Å; Y302-K317 PolarHBondContact OH-NZ 3.42Å
303	E	84.9	Confident	78.5	Confident	76 Å²	76	69.5 Å²	69.5	36%	0.355	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.4	166.7	65.6	176	-164.5	0	0	110.4	V296 L298 R305	V296-E303 HydrophobicContact CB-CG 4.06Å; V296-E303 PolarHBondContact N-O 3.46Å; V296-E303 PolarHBondContact O-N 3.42Å; L298-E303 HydrophobicContact CD1-CB 3.84Å; L298-E303 HydrophobicContact CD1-CG 3.8Å; L298-E303 HydrophobicContact CD2-CG 4.36Å; L298-E303 HydrophobicContact CG-CB 4.48Å; L298-E303 HydrophobicContact CG-CG 4.08Å; E303-R305 HydrophobicContact CG-CG 4.14Å; E303-R305 VanDerWaalsContact OE1-CD 3.29Å; E303-R305 WeakPolarHBondContact OE1-CD 3.37Å; E303-R305 IonicContact OE1-NE 3.27Å
304	C	86.6	Confident	78.3	Confident	9 Å²	9	75.4 Å²	75.4	6%	0.061	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	137.4	167.3	-53.5	0	0	0	0	109.2	C291 I294 L312 L316	C291-C304 WeakPolarHBondContact CA-SG 3.4Å; C291-C304 HydrophobicContact CB-CB 3.61Å; C291-C304 WeakPolarHBondContact CB-SG 3.39Å; C291-C304 WeakPolarHBondContact SG-CA 3.46Å; C291-C304 WeakPolarHBondContact SG-CB 3.48Å; C291-C304 CovalentContact SG-SG 2.03Å; C291-C304 PolarHBondContact SG-SG 3.17Å; I294-C304 CarbonylContact O-C 3.46Å; I294-C304 WeakPolarHBondContact O-CA 3.49Å; C304-L312 HydrophobicContact CB-CD1 4.04Å; C304-L312 WeakPolarHBondContact O-CD2 3.42Å; C304-L316 WeakPolarHBondContact CB-O 3.48Å
305	R	86.8	Confident	78.1	Confident	139 Å²	139	75.3 Å²	75.3	53%	0.525	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.1	176	-59.3	-175.2	74.2	166.9	-3.6	110	I294 V296 E303	I294-R305 HydrophobicContact CB-CB 4.29Å; I294-R305 VanDerWaalsContact CB-O 3.31Å; I294-R305 WeakPolarHBondContact CB-O 3.48Å; I294-R305 PolarHBondContact N-O 3.02Å; I294-R305 PolarHBondContact O-N 3.3Å; V296-R305 HydrophobicContact CG2-CG 4.13Å; E303-R305 HydrophobicContact CG-CG 4.14Å; E303-R305 VanDerWaalsContact OE1-CD 3.29Å; E303-R305 WeakPolarHBondContact OE1-CD 3.37Å; E303-R305 IonicContact OE1-NE 3.27Å
306	C	84.6	Confident	77.9	Confident	28 Å²	28	79.8 Å²	79.8	19%	0.189	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-91.9	150.9	177.9	-58.2	0	0	0	0	111.7	Y310 E311 L312 C319	C306-Y310 WeakPolarHBondContact CB-O 3.33Å; C306-E311 VanDerWaalsContact SG-C 3.51Å; C306-L312 WeakPolarHBondContact SG-CA 3.39Å; C306-L312 PolarHBondContact SG-N 3.49Å; C306-L312 VanDerWaalsContact SG-N 3.38Å; C306-C319 WeakPolarHBondContact CA-SG 3.04Å; C306-C319 HydrophobicContact CB-CB 3.81Å; C306-C319 WeakPolarHBondContact CB-SG 3.38Å; C306-C319 VanDerWaalsContact SG-CA 3.53Å; C306-C319 WeakPolarHBondContact SG-CB 3.45Å; C306-C319 CovalentContact SG-SG 2.04Å; C306-C319 PolarHBondContact SG-SG 3.05Å
307	R	81.9	Confident	78	Confident	142 Å²	142	81.4 Å²	81.4	54%	0.536	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-66.7	155.3	169.5	-66.4	176.6	-175	-157	3.7	109.5	H293 I294 G309 Y310	H293-R307 HydrophobicContact CB-CG 4.22Å; I294-R307 HydrophobicContact CD1-CG 4.1Å; I294-R307 HydrophobicContact CG1-CG 4.29Å; R307-G309 PolarHBondContact O-N 3.46Å; R307-Y310 HydrophobicContact CB-CD2 4.37Å; R307-Y310 WeakPolarHBondContact O-CB 3.42Å; R307-Y310 PolarHBondContact O-N 3.4Å; R307-Y310 VanDerWaalsContact O-N 3.14Å
308	P	76.3	Confident	78.5	Confident	110 Å²	110	81.1 Å²	81.1	71%	0.714	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	136.8	173.5	-26.8	35.4	0	0	0	111.8
309	G	67.5	Low	79.3	Confident	3 Å²	3	77.2 Å²	77.2	3%	0.031	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	4.7	-172.7	0	0	0	0	0	115.6	R307 I322 Y324	R307-G309 PolarHBondContact O-N 3.46Å; G309-I322 PolarHBondContact O-N 3.06Å; G309-Y324 WeakPolarHBondContact CA-OH 3.38Å
310	Y	81.6	Confident	80.5	Confident	60 Å²	60	77.9 Å²	77.9	24%	0.235	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.4	179.4	-61.7	-103	0	0	0	111.2	H293 C306 R307 C319 N320 R321	H293-Y310 AromaticContact CE1-CD1 3.61Å; H293-Y310 AromaticContact CE1-CD2 3.91Å; H293-Y310 AromaticContact CE1-CE1 3.84Å; H293-Y310 AromaticContact CE1-CG 3.66Å; C306-Y310 WeakPolarHBondContact CB-O 3.33Å; R307-Y310 HydrophobicContact CB-CD2 4.37Å; R307-Y310 WeakPolarHBondContact O-CB 3.42Å; R307-Y310 PolarHBondContact O-N 3.4Å; R307-Y310 VanDerWaalsContact O-N 3.14Å; Y310-C319 WeakPolarHBondContact CD1-O 3.33Å; Y310-N320 CarbonylContact C-O 3.54Å; Y310-N320 WeakPolarHBondContact CA-O 3.46Å; Y310-N320 WeakPolarHBondContact CB-O 3.06Å; Y310-R321 VanDerWaalsContact CD1-CA 3.44Å; Y310-R321 HydrophobicContact CD1-CB 3.86Å; Y310-R321 HydrophobicContact CE1-CB 3.71Å; Y310-R321 HydrophobicContact CE1-CG 4.3Å; Y310-R321 PolarHBondContact OH-NE 3.29Å; Y310-R321 PolarHBondContact OH-NH2 3.37Å
311	E	80.8	Confident	81.4	Confident	115 Å²	115	76.9 Å²	76.9	54%	0.537	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	144.7	173.8	58.2	174.4	-155.3	0	0	111.2	C306 C319 N320 I322	C306-E311 VanDerWaalsContact SG-C 3.51Å; E311-C319 CarbonylContact O-C 3.58Å; E311-C319 WeakPolarHBondContact O-CA 3.42Å; E311-N320 HydrophobicContact CG-CB 4.39Å; E311-N320 PolarHBondContact N-O 3.39Å; E311-N320 PolarHBondContact O-N 3.35Å; E311-I322 HydrophobicContact CB-CD1 4.02Å; E311-I322 HydrophobicContact CB-CG1 3.84Å; E311-I322 HydrophobicContact CG-CG1 3.88Å
312	L	84.2	Confident	81.5	Confident	63 Å²	63	77.8 Å²	77.8	33%	0.33	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	124.9	178	-168.2	74.4	0	0	0	108.7	C304 C306 L316	C304-L312 HydrophobicContact CB-CD1 4.04Å; C304-L312 WeakPolarHBondContact O-CD2 3.42Å; C306-L312 WeakPolarHBondContact SG-CA 3.39Å; C306-L312 PolarHBondContact SG-N 3.49Å; C306-L312 VanDerWaalsContact SG-N 3.38Å; L312-L316 HydrophobicContact CD2-CB 4.28Å; L312-L316 HydrophobicContact CD2-CD2 4.11Å
313	T	82.6	Confident	81.2	Confident	31 Å²	31	77.2 Å²	77.2	19%	0.19	38%	0.376	C	S	.	.			trans	-73.7	173.1	-179.2	93.1	0	0	0	0	111.8	D315 L316 T318 N320	T313-D315 PolarHBondContact O-N 3.46Å; T313-D315 PolarHBondContact OG1-OD1 3.03Å; T313-L316 PolarHBondContact O-N 3.26Å; T313-T318 HydrophobicContact CG2-CG2 4.17Å; T313-T318 WeakPolarHBondContact CG2-O 3.42Å; T313-T318 PolarHBondContact N-O 3.24Å; T313-N320 HydrophobicContact CG2-CB 4.11Å; T313-N320 VanDerWaalsContact CG2-CG 3.48Å; T313-N320 WeakPolarHBondContact CG2-ND2 2.98Å
314	I	82.8	Confident	80.8	Confident	173 Å²	173	75.6 Å²	75.6	89%	0.887	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.6	-176.5	-156.8	165.8	0	0	0	114	L316	I314-L316 PolarHBondContact O-N 3.1Å
315	D	82.4	Confident	80.4	Confident	70 Å²	70	76.3 Å²	76.3	37%	0.374	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-8.9	171.5	74.3	-14.1	0	0	0	113.9	T313 K317 T318	T313-D315 PolarHBondContact O-N 3.46Å; T313-D315 PolarHBondContact OG1-OD1 3.03Å; D315-K317 PolarHBondContact O-N 3.39Å; D315-K317 PolarHBondContact OD1-N 3.48Å; D315-T318 PolarHBondContact OD1-N 2.98Å; D315-T318 VanDerWaalsContact OD2-CB 3.25Å; D315-T318 WeakPolarHBondContact OD2-CB 3.46Å; D315-T318 PolarHBondContact OD2-N 3.02Å; D315-T318 PolarHBondContact OD2-OG1 3Å
316	L	80.1	Confident	80	Confident	119 Å²	119	76.2 Å²	76.2	62%	0.623	38%	0.382	S	S	*	.	S	Bend	trans	58.7	24.4	-175.3	-53.6	176.4	0	0	0	114.1	C304 L312 T313 I314	C304-L316 WeakPolarHBondContact CB-O 3.48Å; L312-L316 HydrophobicContact CD2-CB 4.28Å; L312-L316 HydrophobicContact CD2-CD2 4.11Å; T313-L316 PolarHBondContact O-N 3.26Å; I314-L316 PolarHBondContact O-N 3.1Å
317	K	84.8	Confident	79.3	Confident	80 Å²	80	79.5 Å²	79.5	35%	0.348	40%	0.397	S	S	.	.	S	Bend	trans	-138	-43.7	-172.7	-73.6	-176.7	165.4	-134.6	0	114.6	G290 D292 Y302 D315	G290-K317 WeakPolarHBondContact O-CB 3.28Å; G290-K317 VanDerWaalsContact O-CD 3.31Å; G290-K317 WeakPolarHBondContact O-CD 3.46Å; G290-K317 WeakPolarHBondContact O-CG 3.42Å; D292-K317 VanDerWaalsContact CB-O 3.28Å; D292-K317 WeakPolarHBondContact CB-O 3.01Å; D292-K317 PolarHBondContact N-O 3.32Å; D292-K317 VanDerWaalsContact N-O 3.07Å; Y302-K317 PolarHBondContact OH-NZ 3.42Å; D315-K317 PolarHBondContact O-N 3.39Å; D315-K317 PolarHBondContact OD1-N 3.48Å
318	T	85.8	Confident	78.2	Confident	55 Å²	55	75.8 Å²	75.8	34%	0.337	40%	0.403	S	S	.	.			trans	-86.1	147.7	-178	-56.6	0	0	0	0	110.9	T313 D315	T313-T318 HydrophobicContact CG2-CG2 4.17Å; T313-T318 WeakPolarHBondContact CG2-O 3.42Å; T313-T318 PolarHBondContact N-O 3.24Å; D315-T318 PolarHBondContact OD1-N 2.98Å; D315-T318 VanDerWaalsContact OD2-CB 3.25Å; D315-T318 WeakPolarHBondContact OD2-CB 3.46Å; D315-T318 PolarHBondContact OD2-N 3.02Å; D315-T318 PolarHBondContact OD2-OG1 3Å
319	C	86.9	Confident	77.9	Confident	8 Å²	8	76.1 Å²	76.1	5%	0.054	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	101.5	-178	-72.8	0	0	0	0	112.5	D292 H293 C306 Y310 E311	D292-C319 HydrophobicContact CB-CB 4.49Å; D292-C319 WeakPolarHBondContact OD2-CB 3.4Å; D292-C319 PolarHBondContact OD2-N 3.13Å; H293-C319 WeakPolarHBondContact ND1-CB 3.07Å; H293-C319 PolarHBondContact ND1-SG 2.81Å; C306-C319 WeakPolarHBondContact CA-SG 3.04Å; C306-C319 HydrophobicContact CB-CB 3.81Å; C306-C319 WeakPolarHBondContact CB-SG 3.38Å; C306-C319 VanDerWaalsContact SG-CA 3.53Å; C306-C319 WeakPolarHBondContact SG-CB 3.45Å; C306-C319 CovalentContact SG-SG 2.04Å; C306-C319 PolarHBondContact SG-SG 3.05Å; Y310-C319 WeakPolarHBondContact CD1-O 3.33Å; E311-C319 CarbonylContact O-C 3.58Å; E311-C319 WeakPolarHBondContact O-CA 3.42Å
320	N	82.4	Confident	78.2	Confident	87 Å²	87	77.9 Å²	77.9	47%	0.465	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	142.6	176.4	-76.6	-10	0	0	0	111	Y310 E311 T313 I322	Y310-N320 CarbonylContact C-O 3.54Å; Y310-N320 WeakPolarHBondContact CA-O 3.46Å; Y310-N320 WeakPolarHBondContact CB-O 3.06Å; E311-N320 HydrophobicContact CG-CB 4.39Å; E311-N320 PolarHBondContact N-O 3.39Å; E311-N320 PolarHBondContact O-N 3.35Å; T313-N320 HydrophobicContact CG2-CB 4.11Å; T313-N320 VanDerWaalsContact CG2-CG 3.48Å; T313-N320 WeakPolarHBondContact CG2-ND2 2.98Å; N320-I322 PolarHBondContact O-N 3.02Å
321	R	76.1	Confident	77.8	Confident	149 Å²	149	77.4 Å²	77.4	56%	0.562	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.3	174.7	-176.5	176.9	-68.8	-152.5	2.9	109.7	Y310 D323	Y310-R321 VanDerWaalsContact CD1-CA 3.44Å; Y310-R321 HydrophobicContact CD1-CB 3.86Å; Y310-R321 HydrophobicContact CE1-CB 3.71Å; Y310-R321 HydrophobicContact CE1-CG 4.3Å; Y310-R321 PolarHBondContact OH-NE 3.29Å; Y310-R321 PolarHBondContact OH-NH2 3.37Å; R321-D323 PolarHBondContact O-N 3.23Å
322	I	72.3	Confident	78.1	Confident	36 Å²	36	72.7 Å²	72.7	19%	0.185	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-77.8	118	170.2	-59.3	166.3	0	0	0	107.4	G309 E311 N320 Y324 L327	G309-I322 PolarHBondContact O-N 3.06Å; E311-I322 HydrophobicContact CB-CD1 4.02Å; E311-I322 HydrophobicContact CB-CG1 3.84Å; E311-I322 HydrophobicContact CG-CG1 3.88Å; N320-I322 PolarHBondContact O-N 3.02Å; I322-Y324 HydrophobicContact CB-CD2 4.4Å; I322-Y324 HydrophobicContact CB-CE1 4.48Å; I322-Y324 HydrophobicContact CB-CE2 3.88Å; I322-Y324 HydrophobicContact CG2-CD1 3.99Å; I322-Y324 HydrophobicContact CG2-CD2 4.1Å; I322-Y324 HydrophobicContact CG2-CE1 3.82Å; I322-Y324 HydrophobicContact CG2-CE2 3.91Å; I322-Y324 HydrophobicContact CG2-CG 4.13Å; I322-Y324 WeakPolarHBondContact O-CD2 3.4Å; I322-Y324 PolarHBondContact O-N 3.05Å; I322-L327 HydrophobicContact CG2-CD1 4.21Å
323	D	75	Confident	78.1	Confident	68 Å²	68	74.9 Å²	74.9	36%	0.364	41%	0.408	S	S	.	.			trans	-84.2	108.4	164.2	-161	-56.3	0	0	0	108.8	R321 C325 D326 S338	R321-D323 PolarHBondContact O-N 3.23Å; D323-C325 VanDerWaalsContact C-N 3.27Å; D323-C325 PolarHBondContact O-N 3.44Å; D323-C325 WeakPolarHBondContact OD1-CB 3.37Å; D323-C325 PolarHBondContact OD1-N 2.95Å; D323-D326 HydrophobicContact CB-CB 4.22Å; D323-D326 PolarHBondContact O-N 2.99Å; D323-D326 PolarHBondContact OD1-N 3.38Å; D323-S338 VanDerWaalsContact CG-OG 3.27Å; D323-S338 WeakPolarHBondContact OD1-CB 3.29Å; D323-S338 PolarHBondContact OD1-OG 2.97Å
324	Y	76.1	Confident	78.4	Confident	43 Å²	43	75.6 Å²	75.6	17%	0.169	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-14	-175.2	-69.1	-87.2	0	0	0	113.6	G309 I322 L327 S338 G341 S342	G309-Y324 WeakPolarHBondContact CA-OH 3.38Å; I322-Y324 HydrophobicContact CB-CD2 4.4Å; I322-Y324 HydrophobicContact CB-CE1 4.48Å; I322-Y324 HydrophobicContact CB-CE2 3.88Å; I322-Y324 HydrophobicContact CG2-CD1 3.99Å; I322-Y324 HydrophobicContact CG2-CD2 4.1Å; I322-Y324 HydrophobicContact CG2-CE1 3.82Å; I322-Y324 HydrophobicContact CG2-CE2 3.91Å; I322-Y324 HydrophobicContact CG2-CG 4.13Å; I322-Y324 WeakPolarHBondContact O-CD2 3.4Å; I322-Y324 PolarHBondContact O-N 3.05Å; Y324-L327 HydrophobicContact CD1-CD1 3.89Å; Y324-S338 PolarHBondContact N-OG 3.47Å; Y324-G341 VanDerWaalsContact CE2-C 3.47Å; Y324-G341 WeakPolarHBondContact OH-CA 3.35Å; Y324-S342 VanDerWaalsContact CD2-O 3.27Å; Y324-S342 WeakPolarHBondContact CD2-O 3.3Å
325	C	78.2	Confident	78.5	Confident	23 Å²	23	70.6 Å²	70.6	16%	0.155	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-35.7	172.7	-62.4	0	0	0	0	111.2	D323 L327 G328 H330 C336 V337 S338	D323-C325 VanDerWaalsContact C-N 3.27Å; D323-C325 PolarHBondContact O-N 3.44Å; D323-C325 WeakPolarHBondContact OD1-CB 3.37Å; D323-C325 PolarHBondContact OD1-N 2.95Å; C325-L327 PolarHBondContact O-N 3.43Å; C325-G328 PolarHBondContact O-N 3.24Å; C325-H330 PolarHBondContact O-CD2 3.28Å; C325-C336 WeakPolarHBondContact CA-SG 3.25Å; C325-C336 HydrophobicContact CB-CB 3.78Å; C325-C336 WeakPolarHBondContact CB-SG 3.36Å; C325-C336 WeakPolarHBondContact SG-CB 3.09Å; C325-C336 CovalentContact SG-SG 2.04Å; C325-C336 PolarHBondContact SG-SG 3.06Å; C325-V337 PolarHBondContact SG-N 3.26Å; C325-V337 VanDerWaalsContact SG-N 3.44Å; C325-S338 PolarHBondContact N-OG 2.87Å; C325-S338 PolarHBondContact SG-N 2.9Å; C325-S338 VanDerWaalsContact SG-N 3.44Å; C325-S338 PolarHBondContact SG-OG 3.45Å
326	D	77.4	Confident	78.7	Confident	137 Å²	137	68.6 Å²	68.6	73%	0.733	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-15.5	178.1	-70.7	-17.8	0	0	0	113.6	D323 G328	D323-D326 HydrophobicContact CB-CB 4.22Å; D323-D326 PolarHBondContact O-N 2.99Å; D323-D326 PolarHBondContact OD1-N 3.38Å; D326-G328 PolarHBondContact O-N 3.08Å
327	L	70	Confident	78.9	Confident	97 Å²	97	66.1 Å²	66.1	51%	0.508	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.3	173.4	-64.1	175.8	0	0	0	113.9	I322 Y324 C325 N329	I322-L327 HydrophobicContact CG2-CD1 4.21Å; Y324-L327 HydrophobicContact CD1-CD1 3.89Å; C325-L327 PolarHBondContact O-N 3.43Å; L327-N329 PolarHBondContact O-N 3.06Å
328	G	60	Low	78.5	Confident	65 Å²	65	64 Å²	64	67%	0.67	36%	0.36	S	S	*	.	S	Bend	trans	66.7	-1.1	171.4	0	0	0	0	0	116.6	C325 D326	C325-G328 PolarHBondContact O-N 3.24Å; D326-G328 PolarHBondContact O-N 3.08Å
329	N	68.2	Low	77.9	Confident	117 Å²	117	64.7 Å²	64.7	63%	0.626	36%	0.361	S	S	*	.			trans	-108.6	6.7	-177.1	69	11.2	0	0	0	113.7	L327 G331	L327-N329 PolarHBondContact O-N 3.06Å; N329-G331 VanDerWaalsContact C-N 3.26Å; N329-G331 PolarHBondContact O-N 2.98Å
330	H	74.6	Confident	76.6	Confident	39 Å²	39	68.4 Å²	68.4	18%	0.181	39%	0.385	C	S	.	.			trans	-63.5	-28.5	-173	62.3	85.9	0	0	0	113.2	C325 C332 Y343 K358	C325-H330 PolarHBondContact O-CD2 3.28Å; H330-C332 VanDerWaalsContact C-N 3.27Å; H330-C332 WeakPolarHBondContact ND1-CB 3.41Å; H330-C332 PolarHBondContact ND1-N 3.3Å; H330-C332 PolarHBondContact ND1-SG 3.48Å; H330-C332 PolarHBondContact O-N 3.2Å; H330-Y343 HydrophobicContact CB-CD1 4.25Å; H330-Y343 HydrophobicContact CB-CD2 3.7Å; H330-Y343 HydrophobicContact CB-CE1 4.09Å; H330-Y343 HydrophobicContact CB-CE2 3.55Å; H330-Y343 HydrophobicContact CB-CG 4.06Å; H330-Y343 WeakPolarHBondContact O-CE2 3.33Å; H330-Y343 PolarHBondContact O-OH 3.36Å; H330-K358 PolarHBondContact O-NZ 2.98Å
331	G	74.1	Confident	75.8	Confident	50 Å²	50	65.7 Å²	65.7	52%	0.515	38%	0.378	S	S	.	.			trans	63.2	30.3	172.4	0	0	0	0	0	114.1	N329	N329-G331 VanDerWaalsContact C-N 3.26Å; N329-G331 PolarHBondContact O-N 2.98Å
332	C	85.4	Confident	75.5	Confident	17 Å²	17	61 Å²	61	12%	0.115	37%	0.368	C	S	.	.			trans	-78.1	133.9	170.3	-58.3	0	0	0	0	109.2	H330 H334 C345	H330-C332 VanDerWaalsContact C-N 3.27Å; H330-C332 WeakPolarHBondContact ND1-CB 3.41Å; H330-C332 PolarHBondContact ND1-N 3.3Å; H330-C332 PolarHBondContact ND1-SG 3.48Å; H330-C332 PolarHBondContact O-N 3.2Å; C332-H334 VanDerWaalsContact C-N 3.33Å; C332-C345 WeakPolarHBondContact CA-SG 3.48Å; C332-C345 HydrophobicContact CB-CB 3.57Å; C332-C345 WeakPolarHBondContact CB-SG 3.49Å; C332-C345 WeakPolarHBondContact SG-CA 3.33Å; C332-C345 WeakPolarHBondContact SG-CB 3.42Å; C332-C345 CovalentContact SG-SG 2.03Å; C332-C345 PolarHBondContact SG-SG 3.04Å
333	E	85.9	Confident	76	Confident	108 Å²	108	62.4 Å²	62.4	51%	0.505	37%	0.372	S	S	.	.	S	Bend	trans	-67.9	-34.9	176.2	-177	179.1	178.6	0	0	112.3	K358 T359 C360	E333-K358 PolarHBondContact N-O 3.05Å; E333-T359 WeakPolarHBondContact OE2-CA 3.41Å; E333-T359 WeakPolarHBondContact OE2-CB 3.02Å; E333-C360 PolarHBondContact OE2-N 3.1Å
334	H	87.6	Confident	76.4	Confident	46 Å²	46	63.3 Å²	63.3	21%	0.213	38%	0.376	C	S	.	.	S	Bend	trans	-113.3	-112.4	178.9	-74.6	151	0	0	0	111.8	C332 S346 K348 C360	C332-H334 VanDerWaalsContact C-N 3.33Å; H334-S346 WeakPolarHBondContact CB-O 3.1Å; H334-K348 HydrophobicContact CB-CG 4.31Å; H334-C360 WeakPolarHBondContact ND1-CB 3.36Å; H334-C360 PolarHBondContact ND1-SG 3.05Å
335	N	86	Confident	76.9	Confident	68 Å²	68	61.6 Å²	61.6	36%	0.364	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	146.4	-171.4	-48.2	-39.3	0	0	0	109.7	C345 S346	N335-C345 CarbonylContact O-C 3.58Å; N335-C345 WeakPolarHBondContact O-CA 3.31Å; N335-S346 WeakPolarHBondContact CB-O 3.34Å; N335-S346 PolarHBondContact N-O 3.25Å; N335-S346 PolarHBondContact O-N 2.78Å
336	C	86.1	Confident	77.2	Confident	29 Å²	29	62.5 Å²	62.5	20%	0.196	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	141.8	169.5	-177.8	0	0	0	0	109.4	C325	C325-C336 WeakPolarHBondContact CA-SG 3.25Å; C325-C336 HydrophobicContact CB-CB 3.78Å; C325-C336 WeakPolarHBondContact CB-SG 3.36Å; C325-C336 WeakPolarHBondContact SG-CB 3.09Å; C325-C336 CovalentContact SG-SG 2.04Å; C325-C336 PolarHBondContact SG-SG 3.06Å
337	V	83.3	Confident	77.6	Confident	67 Å²	67	57.3 Å²	57.3	41%	0.406	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	117.9	173.4	-177.8	0	0	0	0	108.8	C325 Y343 I344	C325-V337 PolarHBondContact SG-N 3.26Å; C325-V337 VanDerWaalsContact SG-N 3.44Å; V337-Y343 WeakPolarHBondContact O-CA 3.05Å; V337-I344 HydrophobicContact CB-CG2 4.06Å; V337-I344 PolarHBondContact N-O 2.98Å; V337-I344 PolarHBondContact O-N 3.26Å
338	S	78	Confident	78.1	Confident	34 Å²	34	58.1 Å²	58.1	24%	0.238	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	132.3	178.6	-81.8	0	0	0	0	112	D323 Y324 C325	D323-S338 VanDerWaalsContact CG-OG 3.27Å; D323-S338 WeakPolarHBondContact OD1-CB 3.29Å; D323-S338 PolarHBondContact OD1-OG 2.97Å; Y324-S338 PolarHBondContact N-OG 3.47Å; C325-S338 PolarHBondContact N-OG 2.87Å; C325-S338 PolarHBondContact SG-N 2.9Å; C325-S338 VanDerWaalsContact SG-N 3.44Å; C325-S338 PolarHBondContact SG-OG 3.45Å
339	L	71.6	Confident	78.8	Confident	70 Å²	70	65.2 Å²	65.2	37%	0.366	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	161.3	178.3	-64.4	177.1	0	0	0	109.8	G341 S342 I344	L339-G341 PolarHBondContact O-N 3.07Å; L339-S342 CarbonylContact C-O 3.55Å; L339-S342 WeakPolarHBondContact CA-O 3.5Å; L339-S342 PolarHBondContact N-O 2.88Å; L339-S342 PolarHBondContact O-N 3.33Å; L339-I344 HydrophobicContact CD1-CB 4.1Å; L339-I344 HydrophobicContact CD1-CG2 3.89Å; L339-I344 HydrophobicContact CG-CG2 4.33Å
340	P	60.4	Low	78.8	Confident	86 Å²	86	61 Å²	61	56%	0.558	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	97.5	175.3	-22.1	34.8	0	0	0	111.9
341	G	65.1	Low	79	Confident	31 Å²	31	63 Å²	63	32%	0.32	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.4	-1.5	179	0	0	0	0	0	115.6	Y324 L339	Y324-G341 VanDerWaalsContact CE2-C 3.47Å; Y324-G341 WeakPolarHBondContact OH-CA 3.35Å; L339-G341 PolarHBondContact O-N 3.07Å
342	S	70.1	Confident	79.1	Confident	49 Å²	49	64 Å²	64	34%	0.343	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-175.7	-176.7	66.7	0	0	0	0	112.3	Y324 L339	Y324-S342 VanDerWaalsContact CD2-O 3.27Å; Y324-S342 WeakPolarHBondContact CD2-O 3.3Å; L339-S342 CarbonylContact C-O 3.55Å; L339-S342 WeakPolarHBondContact CA-O 3.5Å; L339-S342 PolarHBondContact N-O 2.88Å; L339-S342 PolarHBondContact O-N 3.33Å
343	Y	82.4	Confident	79	Confident	67 Å²	67	66.2 Å²	66.2	26%	0.263	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	158	164.8	60.9	-85	0	0	0	108.9	H330 V337 K358	H330-Y343 HydrophobicContact CB-CD1 4.25Å; H330-Y343 HydrophobicContact CB-CD2 3.7Å; H330-Y343 HydrophobicContact CB-CE1 4.09Å; H330-Y343 HydrophobicContact CB-CE2 3.55Å; H330-Y343 HydrophobicContact CB-CG 4.06Å; H330-Y343 WeakPolarHBondContact O-CE2 3.33Å; H330-Y343 PolarHBondContact O-OH 3.36Å; V337-Y343 WeakPolarHBondContact O-CA 3.05Å; Y343-K358 PolarHBondContact OH-NZ 3.43Å
344	I	84.2	Confident	78.6	Confident	87 Å²	87	63.5 Å²	63.5	45%	0.446	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.3	167.8	-168.3	167.5	0	0	0	110.1	V337 L339	V337-I344 HydrophobicContact CB-CG2 4.06Å; V337-I344 PolarHBondContact N-O 2.98Å; V337-I344 PolarHBondContact O-N 3.26Å; L339-I344 HydrophobicContact CD1-CB 4.1Å; L339-I344 HydrophobicContact CD1-CG2 3.89Å; L339-I344 HydrophobicContact CG-CG2 4.33Å
345	C	85.7	Confident	78.1	Confident	6 Å²	6	64.8 Å²	64.8	4%	0.041	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	140	172.3	-55.4	0	0	0	0	109.9	C332 N335 L353 G357	C332-C345 WeakPolarHBondContact CA-SG 3.48Å; C332-C345 HydrophobicContact CB-CB 3.57Å; C332-C345 WeakPolarHBondContact CB-SG 3.49Å; C332-C345 WeakPolarHBondContact SG-CA 3.33Å; C332-C345 WeakPolarHBondContact SG-CB 3.42Å; C332-C345 CovalentContact SG-SG 2.03Å; C332-C345 PolarHBondContact SG-SG 3.04Å; N335-C345 CarbonylContact O-C 3.58Å; N335-C345 WeakPolarHBondContact O-CA 3.31Å; C345-L353 HydrophobicContact CB-CD1 3.96Å; C345-L353 WeakPolarHBondContact O-CD2 3.43Å; C345-G357 WeakPolarHBondContact CB-O 3.5Å; C345-G357 PolarHBondContact SG-O 3.42Å
346	S	84.7	Confident	77.7	Confident	43 Å²	43	65.8 Å²	65.8	30%	0.301	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.1	175.4	57.9	0	0	0	0	111.3	H334 N335	H334-S346 WeakPolarHBondContact CB-O 3.1Å; N335-S346 WeakPolarHBondContact CB-O 3.34Å; N335-S346 PolarHBondContact N-O 3.25Å; N335-S346 PolarHBondContact O-N 2.78Å
347	C	85.6	Confident	77.4	Confident	28 Å²	28	65.9 Å²	65.9	19%	0.189	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-86.7	152.7	-176.3	-59.1	0	0	0	0	112	F351 V352 L353 C360	C347-F351 HydrophobicContact CB-CB 3.83Å; C347-V352 VanDerWaalsContact SG-C 3.51Å; C347-L353 WeakPolarHBondContact SG-CA 3.45Å; C347-L353 PolarHBondContact SG-N 2.87Å; C347-L353 VanDerWaalsContact SG-N 3.38Å; C347-C360 WeakPolarHBondContact CA-SG 3.4Å; C347-C360 HydrophobicContact CB-CB 3.88Å; C347-C360 WeakPolarHBondContact CB-SG 3.48Å; C347-C360 WeakPolarHBondContact SG-CB 3.42Å; C347-C360 CovalentContact SG-SG 2.03Å; C347-C360 PolarHBondContact SG-SG 3.45Å
348	K	81.8	Confident	77.4	Confident	114 Å²	114	66.2 Å²	66.2	50%	0.496	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-68.2	157.4	169.4	-65.8	170.5	-175.3	168.2	0	109.8	H334 G350 F351	H334-K348 HydrophobicContact CB-CG 4.31Å; K348-G350 PolarHBondContact O-N 3.18Å; K348-F351 PolarHBondContact O-N 3.38Å
349	K	73.9	Confident	77.6	Confident	213 Å²	213	67 Å²	67	93%	0.926	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	133.3	-178.6	-173.1	-178.7	179.2	-175.2	0	111.1
350	G	67.8	Low	78.3	Confident	29 Å²	29	64.1 Å²	64.1	30%	0.299	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	-2.9	-176.4	0	0	0	0	0	114.9	K348 I363	K348-G350 PolarHBondContact O-N 3.18Å; G350-I363 WeakPolarHBondContact O-CG1 3.38Å; G350-I363 PolarHBondContact O-N 2.91Å
351	F	79.2	Confident	79.1	Confident	80 Å²	80	62.3 Å²	62.3	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.6	179.8	-64.1	-103.1	0	0	0	111.3	C347 K348 C360 S361 Q362	C347-F351 HydrophobicContact CB-CB 3.83Å; K348-F351 PolarHBondContact O-N 3.38Å; F351-C360 HydrophobicContact CB-CB 4.14Å; F351-C360 HydrophobicContact CD1-CB 4.46Å; F351-S361 CarbonylContact C-O 3.59Å; F351-S361 WeakPolarHBondContact CA-O 3.45Å; F351-S361 WeakPolarHBondContact CB-O 3.47Å; F351-Q362 HydrophobicContact CD1-CB 4.12Å; F351-Q362 HydrophobicContact CE1-CB 3.94Å; F351-Q362 HydrophobicContact CE1-CG 4.37Å
352	V	77.1	Confident	79.6	Confident	71 Å²	71	66.7 Å²	66.7	43%	0.43	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	144.4	174.2	-82.8	0	0	0	0	110.5	C347 N354 C360 S361 I363	C347-V352 VanDerWaalsContact SG-C 3.51Å; V352-N354 PolarHBondContact O-N 2.03Å; V352-C360 CarbonylContact O-C 3.53Å; V352-C360 WeakPolarHBondContact O-CA 3.49Å; V352-S361 PolarHBondContact N-O 3.39Å; V352-S361 PolarHBondContact O-N 2.87Å; V352-I363 HydrophobicContact CB-CG1 4.42Å; V352-I363 HydrophobicContact CG1-CD1 4.15Å; V352-I363 HydrophobicContact CG1-CG1 3.77Å; V352-I363 HydrophobicContact CG2-CG1 4.14Å
353	L	82.1	Confident	79.4	Confident	65 Å²	65	66.8 Å²	66.8	34%	0.34	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.8	177.8	-166.4	73	0	0	0	109.3	C345 C347	C345-L353 HydrophobicContact CB-CD1 3.96Å; C345-L353 WeakPolarHBondContact O-CD2 3.43Å; C347-L353 WeakPolarHBondContact SG-CA 3.45Å; C347-L353 PolarHBondContact SG-N 2.87Å; C347-L353 VanDerWaalsContact SG-N 3.38Å
354	N	77.2	Confident	78.5	Confident	50 Å²	50	68 Å²	68	27%	0.267	37%	0.374	S	S	.	.			trans	-74.1	169.8	-178.7	-70	-31.6	0	0	0	111.9	V352 D356 G357 T359 C360 S361	V352-N354 PolarHBondContact O-N 2.03Å; N354-D356 PolarHBondContact O-N 3.44Å; N354-G357 PolarHBondContact O-N 3.06Å; N354-T359 WeakPolarHBondContact CB-O 3.27Å; N354-T359 WeakPolarHBondContact CB-OG1 3.33Å; N354-T359 PolarHBondContact N-O 3.44Å; N354-T359 PolarHBondContact ND2-O 2.72Å; N354-T359 PolarHBondContact ND2-OG1 3.02Å; N354-C360 PolarHBondContact ND2-N 2.89Å; N354-S361 PolarHBondContact ND2-N 2.85Å; N354-S361 WeakPolarHBondContact OD1-CB 3.42Å; N354-S361 PolarHBondContact OD1-N 2.58Å; N354-S361 PolarHBondContact OD1-OG 2.04Å
355	A	77.6	Confident	77.6	Confident	73 Å²	73	67 Å²	67	60%	0.603	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-21.7	178	0	0	0	0	0	114.8	G357 Q598	A355-G357 VanDerWaalsContact C-N 3.28Å; A355-Q598 HydrophobicContact CB-CG 4.11Å; A355-Q598 VanDerWaalsContact CB-NE2 3.27Å
356	D	78.2	Confident	76.7	Confident	89 Å²	89	67.1 Å²	67.1	48%	0.476	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.2	178.3	65.2	7	0	0	0	113.6	N354 K358 T359	N354-D356 PolarHBondContact O-N 3.44Å; D356-K358 PolarHBondContact O-N 3.17Å; D356-K358 PolarHBondContact OD1-N 3.47Å; D356-T359 VanDerWaalsContact CG-OG1 3.24Å; D356-T359 PolarHBondContact OD1-N 2.91Å; D356-T359 PolarHBondContact OD1-OG1 3.32Å; D356-T359 WeakPolarHBondContact OD2-CB 3.38Å; D356-T359 VanDerWaalsContact OD2-CG2 3.29Å; D356-T359 WeakPolarHBondContact OD2-CG2 3.15Å; D356-T359 PolarHBondContact OD2-OG1 2.61Å
357	G	79.1	Confident	75.6	Confident	32 Å²	32	68.7 Å²	68.7	33%	0.33	38%	0.383	S	S	.	.	S	Bend	trans	66.9	13.2	-177.9	0	0	0	0	0	114.5	C345 N354 A355	C345-G357 WeakPolarHBondContact CB-O 3.5Å; C345-G357 PolarHBondContact SG-O 3.42Å; N354-G357 PolarHBondContact O-N 3.06Å; A355-G357 VanDerWaalsContact C-N 3.28Å
358	K	82.9	Confident	74.3	Confident	74 Å²	74	71.4 Å²	71.4	32%	0.322	41%	0.408	S	S	.	.	S	Bend	trans	-136	-38.8	-170.3	-69.8	-170.2	177.5	-128.5	0	114.8	H330 E333 Y343 D356	H330-K358 PolarHBondContact O-NZ 2.98Å; E333-K358 PolarHBondContact N-O 3.05Å; Y343-K358 PolarHBondContact OH-NZ 3.43Å; D356-K358 PolarHBondContact O-N 3.17Å; D356-K358 PolarHBondContact OD1-N 3.47Å
359	T	82.8	Confident	73.1	Confident	51 Å²	51	68.9 Å²	68.9	31%	0.313	41%	0.414	S	S	.	.			trans	-97	161.8	178.6	62	0	0	0	0	111.7	E333 N354 D356	E333-T359 WeakPolarHBondContact OE2-CA 3.41Å; E333-T359 WeakPolarHBondContact OE2-CB 3.02Å; N354-T359 WeakPolarHBondContact CB-O 3.27Å; N354-T359 WeakPolarHBondContact CB-OG1 3.33Å; N354-T359 PolarHBondContact N-O 3.44Å; N354-T359 PolarHBondContact ND2-O 2.72Å; N354-T359 PolarHBondContact ND2-OG1 3.02Å; D356-T359 VanDerWaalsContact CG-OG1 3.24Å; D356-T359 PolarHBondContact OD1-N 2.91Å; D356-T359 PolarHBondContact OD1-OG1 3.32Å; D356-T359 WeakPolarHBondContact OD2-CB 3.38Å; D356-T359 VanDerWaalsContact OD2-CG2 3.29Å; D356-T359 WeakPolarHBondContact OD2-CG2 3.15Å; D356-T359 PolarHBondContact OD2-OG1 2.61Å
360	C	86	Confident	72.2	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.061	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	115.5	-171.8	-69.9	0	0	0	0	110.9	E333 H334 C347 F351 V352 N354	E333-C360 PolarHBondContact OE2-N 3.1Å; H334-C360 WeakPolarHBondContact ND1-CB 3.36Å; H334-C360 PolarHBondContact ND1-SG 3.05Å; C347-C360 WeakPolarHBondContact CA-SG 3.4Å; C347-C360 HydrophobicContact CB-CB 3.88Å; C347-C360 WeakPolarHBondContact CB-SG 3.48Å; C347-C360 WeakPolarHBondContact SG-CB 3.42Å; C347-C360 CovalentContact SG-SG 2.03Å; C347-C360 PolarHBondContact SG-SG 3.45Å; F351-C360 HydrophobicContact CB-CB 4.14Å; F351-C360 HydrophobicContact CD1-CB 4.46Å; V352-C360 CarbonylContact O-C 3.53Å; V352-C360 WeakPolarHBondContact O-CA 3.49Å; N354-C360 PolarHBondContact ND2-N 2.89Å
361	S	78.6	Confident	72.1	Confident	48 Å²	48	65 Å²	65	34%	0.336	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	150.6	170.5	54.4	0	0	0	0	111.4	F351 V352 N354	F351-S361 CarbonylContact C-O 3.59Å; F351-S361 WeakPolarHBondContact CA-O 3.45Å; F351-S361 WeakPolarHBondContact CB-O 3.47Å; V352-S361 PolarHBondContact N-O 3.39Å; V352-S361 PolarHBondContact O-N 2.87Å; N354-S361 PolarHBondContact ND2-N 2.85Å; N354-S361 WeakPolarHBondContact OD1-CB 3.42Å; N354-S361 PolarHBondContact OD1-N 2.58Å; N354-S361 PolarHBondContact OD1-OG 2.04Å
362	Q	75.2	Confident	71.4	Confident	122 Å²	122	63.5 Å²	63.5	57%	0.57	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	142.7	174.7	-166.9	173.2	10.3	0	0	109.9	F351 D364	F351-Q362 HydrophobicContact CD1-CB 4.12Å; F351-Q362 HydrophobicContact CE1-CB 3.94Å; F351-Q362 HydrophobicContact CE1-CG 4.37Å; Q362-D364 PolarHBondContact O-N 3.09Å
363	I	65.1	Low	71.4	Confident	52 Å²	52	61.2 Å²	61.2	27%	0.267	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-68	120	-178.3	-63.5	168.5	0	0	0	110.3	G350 V352 H365 N379	G350-I363 WeakPolarHBondContact O-CG1 3.38Å; G350-I363 PolarHBondContact O-N 2.91Å; V352-I363 HydrophobicContact CB-CG1 4.42Å; V352-I363 HydrophobicContact CG1-CD1 4.15Å; V352-I363 HydrophobicContact CG1-CG1 3.77Å; V352-I363 HydrophobicContact CG2-CG1 4.14Å; I363-H365 VanDerWaalsContact CG2-CE1 3.49Å; I363-H365 WeakPolarHBondContact CG2-CE1 3.31Å; I363-N379 PolarHBondContact O-ND2 2.71Å; I363-N379 VanDerWaalsContact O-ND2 3.16Å
364	D	63.9	Low	71.2	Confident	92 Å²	92	63.1 Å²	63.1	49%	0.492	40%	0.404	S	S	.	.			trans	-90.4	98.4	166.4	-171.3	-12.5	0	0	0	110.1	Q362 C366 A367	Q362-D364 PolarHBondContact O-N 3.09Å; D364-C366 PolarHBondContact O-N 3.06Å; D364-C366 WeakPolarHBondContact OD1-CA 3.48Å; D364-C366 WeakPolarHBondContact OD1-CB 3.36Å; D364-C366 PolarHBondContact OD1-N 2.88Å; D364-A367 HydrophobicContact CB-CB 4.12Å; D364-A367 PolarHBondContact OD1-N 3.47Å
365	H	65.7	Low	71.4	Confident	67 Å²	67	63.2 Å²	63.2	31%	0.31	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-8.8	180	-53.9	-90.1	0	0	0	112.8	I363 N379 T380 E381	I363-H365 VanDerWaalsContact CG2-CE1 3.49Å; I363-H365 WeakPolarHBondContact CG2-CE1 3.31Å; H365-N379 VanDerWaalsContact CB-OD1 3.3Å; H365-N379 WeakPolarHBondContact CB-OD1 3.38Å; H365-N379 PolarHBondContact CD2-OD1 3.17Å; H365-N379 VanDerWaalsContact CD2-OD1 3.29Å; H365-N379 PolarHBondContact N-OD1 2.79Å; H365-T380 PolarHBondContact CD2-O 2.88Å; H365-E381 PolarHBondContact NE2-O 2.88Å
366	C	65.6	Low	71.3	Confident	7 Å²	7	63.7 Å²	63.7	5%	0.047	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-15	179.1	-66.2	0	0	0	0	114.2	D364 A368 G369 F377 M378 N379 C384	D364-C366 PolarHBondContact O-N 3.06Å; D364-C366 WeakPolarHBondContact OD1-CA 3.48Å; D364-C366 WeakPolarHBondContact OD1-CB 3.36Å; D364-C366 PolarHBondContact OD1-N 2.88Å; C366-A368 PolarHBondContact O-N 2.94Å; C366-A368 VanDerWaalsContact O-N 3.07Å; C366-G369 PolarHBondContact O-N 3.49Å; C366-F377 HydrophobicContact CB-CD2 3.75Å; C366-F377 HydrophobicContact CB-CE2 3.88Å; C366-M378 VanDerWaalsContact SG-C 3.5Å; C366-N379 HydrophobicContact CB-CB 4.45Å; C366-N379 VanDerWaalsContact SG-CA 3.51Å; C366-N379 PolarHBondContact SG-N 3.03Å; C366-N379 VanDerWaalsContact SG-N 3.41Å; C366-C384 VanDerWaalsContact CA-SG 3.52Å; C366-C384 HydrophobicContact CB-CB 4.03Å; C366-C384 WeakPolarHBondContact CB-SG 3.3Å; C366-C384 VanDerWaalsContact SG-CA 3.53Å; C366-C384 WeakPolarHBondContact SG-CB 3.27Å; C366-C384 CovalentContact SG-SG 2.04Å; C366-C384 PolarHBondContact SG-SG 3.26Å
367	A	63.1	Low	71.4	Confident	76 Å²	76	64.2 Å²	64.2	63%	0.628	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.8	-170.9	0	0	0	0	0	115.6	D364 G369	D364-A367 HydrophobicContact CB-CB 4.12Å; D364-A367 PolarHBondContact OD1-N 3.47Å; A367-G369 PolarHBondContact O-N 3.19Å
368	A	58.4	Low	71.2	Confident	85 Å²	85	67.2 Å²	67.2	70%	0.702	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.6	-178.6	0	0	0	0	0	115	C366 S370	C366-A368 PolarHBondContact O-N 2.94Å; C366-A368 VanDerWaalsContact O-N 3.07Å; A368-S370 PolarHBondContact O-N 3.47Å; A368-S370 VanDerWaalsContact O-N 3.09Å
369	G	54.7	Low	70.3	Confident	61 Å²	61	66.7 Å²	66.7	63%	0.629	40%	0.398	S	S	*	.	S	Bend	trans	71.5	-0.1	172	0	0	0	0	0	116.7	C366 A367	C366-G369 PolarHBondContact O-N 3.49Å; A367-G369 PolarHBondContact O-N 3.19Å
370	S	55.4	Low	69.6	Low	102 Å²	102	66.3 Å²	66.3	71%	0.713	40%	0.396	S	S	*	.			trans	-114.9	28.1	-176.7	58	0	0	0	0	113.8	A368 G372	A368-S370 PolarHBondContact O-N 3.47Å; A368-S370 VanDerWaalsContact O-N 3.09Å; S370-G372 PolarHBondContact O-N 2.81Å
371	H	65.6	Low	68.3	Low	58 Å²	58	73.6 Å²	73.6	27%	0.269	43%	0.429	S	S	.	.			trans	-65.3	-18.6	-174.5	38.5	-99.7	0	0	0	114.7	C373 F377	H371-C373 VanDerWaalsContact C-N 3.27Å; H371-C373 PolarHBondContact O-N 2.04Å; H371-F377 AromaticContact CD2-CD1 3.59Å; H371-F377 AromaticContact CD2-CG 3.83Å; H371-F377 AromaticContact CE1-CD1 3.67Å; H371-F377 AromaticContact CE1-CE1 3.41Å; H371-F377 VanDerWaalsContact CE1-CE1 3.41Å; H371-F377 WeakPolarHBondContact CE1-CE1 3.43Å; H371-F377 AromaticContact CE1-CE2 3.94Å; H371-F377 AromaticContact CE1-CZ 3.56Å; H371-F377 AromaticContact NE2-CD1 3.26Å; H371-F377 VanDerWaalsContact NE2-CD1 3.26Å; H371-F377 WeakPolarHBondContact NE2-CD1 3.45Å; H371-F377 AromaticContact NE2-CE1 3.31Å; H371-F377 VanDerWaalsContact NE2-CE1 3.31Å; H371-F377 WeakPolarHBondContact NE2-CE1 3.35Å; H371-F377 AromaticContact NE2-CG 3.88Å; H371-F377 AromaticContact NE2-CZ 3.95Å
372	G	66.3	Low	67.4	Low	49 Å²	49	76.9 Å²	76.9	51%	0.505	45%	0.447	S	S	.	.			trans	67.2	21.6	167.5	0	0	0	0	0	115.6	S370	S370-G372 PolarHBondContact O-N 2.81Å
373	C	77	Confident	66.8	Low	23 Å²	23	73.4 Å²	73.4	16%	0.155	44%	0.436	C	S	.	.			trans	-79.4	142.6	172.6	-55.5	0	0	0	0	110.6	H371 F377 C386	H371-C373 VanDerWaalsContact C-N 3.27Å; H371-C373 PolarHBondContact O-N 2.04Å; C373-F377 HydrophobicContact CB-CB 4.4Å; C373-C386 WeakPolarHBondContact CA-SG 3.34Å; C373-C386 HydrophobicContact CB-CB 3.61Å; C373-C386 WeakPolarHBondContact CB-SG 3.21Å; C373-C386 WeakPolarHBondContact SG-CA 3.31Å; C373-C386 WeakPolarHBondContact SG-CB 3.06Å; C373-C386 CovalentContact SG-SG 2.03Å; C373-C386 PolarHBondContact SG-SG 2.66Å
374	E	77.2	Confident	67.1	Low	105 Å²	105	72.7 Å²	72.7	49%	0.491	44%	0.435	S	S	.	.	S	Bend	trans	-70.5	-32.5	175.8	-172.1	-171.5	145.1	0	0	112.5	K399 T400 C401	E374-K399 PolarHBondContact N-O 2.7Å; E374-T400 WeakPolarHBondContact OE2-CA 3.43Å; E374-T400 WeakPolarHBondContact OE2-CB 3.49Å; E374-C401 PolarHBondContact OE2-N 2.96Å
375	Q	81.2	Confident	67.8	Low	53 Å²	53	71.1 Å²	71.1	25%	0.248	43%	0.429	C	S	.	.	S	Bend	trans	-127.2	-113.4	-174.7	-59.9	-173.7	1.3	0	0	111.5	T389 C401	Q375-T389 PolarHBondContact OE1-OG1 3.46Å; Q375-C401 HydrophobicContact CG-CB 4.09Å
376	E	76.3	Confident	68.5	Low	82 Å²	82	68.6 Å²	68.6	38%	0.383	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	160.9	-178.7	-60.6	178.6	174.6	0	0	111.4	K387 T389	E376-K387 CarbonylContact C-O 3.41Å; E376-K387 WeakPolarHBondContact CA-O 3.47Å; E376-K387 HydrophobicContact CB-CB 4.12Å; E376-K387 WeakPolarHBondContact CB-O 3.47Å; E376-K387 PolarHBondContact N-O 2.56Å; E376-K387 PolarHBondContact O-N 2.91Å; E376-K387 VanDerWaalsContact O-O 3.09Å; E376-K387 IonicContact OE2-NZ 2.7Å; E376-K387 PolarHBondContact OE2-NZ 3.43Å; E376-T389 HydrophobicContact CG-CG2 4.14Å
377	F	78.4	Confident	69.3	Low	100 Å²	100	72.9 Å²	72.9	44%	0.439	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150	172.7	61.6	-89.2	0	0	0	109.7	C366 H371 C373 V385	C366-F377 HydrophobicContact CB-CD2 3.75Å; C366-F377 HydrophobicContact CB-CE2 3.88Å; H371-F377 AromaticContact CD2-CD1 3.59Å; H371-F377 AromaticContact CD2-CG 3.83Å; H371-F377 AromaticContact CE1-CD1 3.67Å; H371-F377 AromaticContact CE1-CE1 3.41Å; H371-F377 VanDerWaalsContact CE1-CE1 3.41Å; H371-F377 WeakPolarHBondContact CE1-CE1 3.43Å; H371-F377 AromaticContact CE1-CE2 3.94Å; H371-F377 AromaticContact CE1-CZ 3.56Å; H371-F377 AromaticContact NE2-CD1 3.26Å; H371-F377 VanDerWaalsContact NE2-CD1 3.26Å; H371-F377 WeakPolarHBondContact NE2-CD1 3.45Å; H371-F377 AromaticContact NE2-CE1 3.31Å; H371-F377 VanDerWaalsContact NE2-CE1 3.31Å; H371-F377 WeakPolarHBondContact NE2-CE1 3.35Å; H371-F377 AromaticContact NE2-CG 3.88Å; H371-F377 AromaticContact NE2-CZ 3.95Å; C373-F377 HydrophobicContact CB-CB 4.4Å; F377-V385 WeakPolarHBondContact CA-O 3.46Å
378	M	75	Confident	70.2	Confident	96 Å²	96	70 Å²	70	47%	0.473	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.6	177.6	59.3	-179.8	-72.5	0	0	111.6	C366 T380 V385 K387	C366-M378 VanDerWaalsContact SG-C 3.5Å; M378-T380 HydrophobicContact CE-CG2 4.47Å; M378-V385 HydrophobicContact CG-CB 4.47Å; M378-V385 PolarHBondContact N-O 3.24Å; M378-V385 PolarHBondContact O-N 3.49Å; M378-K387 HydrophobicContact SD-CD 4.4Å
379	N	65.6	Low	71.2	Confident	63 Å²	63	68.4 Å²	68.4	34%	0.337	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	130.3	174.7	-170.9	43.8	0	0	0	109.7	I363 H365 C366	I363-N379 PolarHBondContact O-ND2 2.71Å; I363-N379 VanDerWaalsContact O-ND2 3.16Å; H365-N379 VanDerWaalsContact CB-OD1 3.3Å; H365-N379 WeakPolarHBondContact CB-OD1 3.38Å; H365-N379 PolarHBondContact CD2-OD1 3.17Å; H365-N379 VanDerWaalsContact CD2-OD1 3.29Å; H365-N379 PolarHBondContact N-OD1 2.79Å; C366-N379 HydrophobicContact CB-CB 4.45Å; C366-N379 VanDerWaalsContact SG-CA 3.51Å; C366-N379 PolarHBondContact SG-N 3.03Å; C366-N379 VanDerWaalsContact SG-N 3.41Å
380	T	67.9	Low	72.1	Confident	42 Å²	42	73.1 Å²	73.1	26%	0.258	40%	0.404	S	S	.	.			trans	-115	171.1	172	72.3	0	0	0	0	109.3	H365 M378 T382 S383 V385	H365-T380 PolarHBondContact CD2-O 2.88Å; M378-T380 HydrophobicContact CE-CG2 4.47Å; T380-T382 PolarHBondContact O-N 3.15Å; T380-S383 WeakPolarHBondContact CB-O 3.42Å; T380-S383 PolarHBondContact N-O 3.03Å; T380-S383 PolarHBondContact OG1-N 3.32Å; T380-S383 PolarHBondContact OG1-O 3.47Å; T380-S383 PolarHBondContact OG1-OG 3.2Å; T380-V385 HydrophobicContact CG2-CB 4.31Å; T380-V385 HydrophobicContact CG2-CG2 3.79Å
381	E	58.4	Low	72.6	Confident	163 Å²	163	70.5 Å²	70.5	76%	0.762	39%	0.393	S	S	*	.	S	Bend	trans	-57.6	-23.4	-177.3	-62	-175.5	170.7	0	0	114.2	H365	H365-E381 PolarHBondContact NE2-O 2.88Å
382	T	58.6	Low	73.3	Confident	117 Å²	117	71.8 Å²	71.8	72%	0.718	40%	0.396	S	S	*	.	S	Bend	trans	-127.1	-10.5	-173.3	58.3	0	0	0	0	115.4	T380	T380-T382 PolarHBondContact O-N 3.15Å
383	S	63.8	Low	73.8	Confident	48 Å²	48	73.2 Å²	73.2	34%	0.336	40%	0.396	S	S	.	.			trans	-165	165	-175.5	68	0	0	0	0	113.7	T380 V385	T380-S383 WeakPolarHBondContact CB-O 3.42Å; T380-S383 PolarHBondContact N-O 3.03Å; T380-S383 PolarHBondContact OG1-N 3.32Å; T380-S383 PolarHBondContact OG1-O 3.47Å; T380-S383 PolarHBondContact OG1-OG 3.2Å; S383-V385 WeakPolarHBondContact OG-CG2 3.32Å
384	C	71.6	Confident	74	Confident	37 Å²	37	75.5 Å²	75.5	25%	0.25	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.6	165.2	-162.7	0	0	0	0	109.7	C366	C366-C384 VanDerWaalsContact CA-SG 3.52Å; C366-C384 HydrophobicContact CB-CB 4.03Å; C366-C384 WeakPolarHBondContact CB-SG 3.3Å; C366-C384 VanDerWaalsContact SG-CA 3.53Å; C366-C384 WeakPolarHBondContact SG-CB 3.27Å; C366-C384 CovalentContact SG-SG 2.04Å; C366-C384 PolarHBondContact SG-SG 3.26Å
385	V	78.1	Confident	74.1	Confident	60 Å²	60	76.3 Å²	76.3	36%	0.364	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.4	-177.2	-177.7	0	0	0	0	110.3	F377 M378 T380 S383	F377-V385 WeakPolarHBondContact CA-O 3.46Å; M378-V385 HydrophobicContact CG-CB 4.47Å; M378-V385 PolarHBondContact N-O 3.24Å; M378-V385 PolarHBondContact O-N 3.49Å; T380-V385 HydrophobicContact CG2-CB 4.31Å; T380-V385 HydrophobicContact CG2-CG2 3.79Å; S383-V385 WeakPolarHBondContact OG-CG2 3.32Å
386	C	80.6	Confident	74.1	Confident	13 Å²	13	80.3 Å²	80.3	9%	0.088	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	143.7	178.2	-55.7	0	0	0	0	111.9	C373 L394 G398	C373-C386 WeakPolarHBondContact CA-SG 3.34Å; C373-C386 HydrophobicContact CB-CB 3.61Å; C373-C386 WeakPolarHBondContact CB-SG 3.21Å; C373-C386 WeakPolarHBondContact SG-CA 3.31Å; C373-C386 WeakPolarHBondContact SG-CB 3.06Å; C373-C386 CovalentContact SG-SG 2.03Å; C373-C386 PolarHBondContact SG-SG 2.66Å; C386-L394 HydrophobicContact CB-CD1 3.94Å; C386-G398 WeakPolarHBondContact CB-O 3.39Å; C386-G398 PolarHBondContact SG-O 3.14Å
387	K	81.8	Confident	74.1	Confident	97 Å²	97	80.4 Å²	80.4	42%	0.422	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.7	178	179.3	175.3	167.3	-107.7	0	109.8	E376 M378	E376-K387 CarbonylContact C-O 3.41Å; E376-K387 WeakPolarHBondContact CA-O 3.47Å; E376-K387 HydrophobicContact CB-CB 4.12Å; E376-K387 WeakPolarHBondContact CB-O 3.47Å; E376-K387 PolarHBondContact N-O 2.56Å; E376-K387 PolarHBondContact O-N 2.91Å; E376-K387 VanDerWaalsContact O-O 3.09Å; E376-K387 IonicContact OE2-NZ 2.7Å; E376-K387 PolarHBondContact OE2-NZ 3.43Å; M378-K387 HydrophobicContact SD-CD 4.4Å
388	C	82.4	Confident	74	Confident	15 Å²	15	77.3 Å²	77.3	10%	0.101	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-96.2	147.3	175.9	-58.3	0	0	0	0	111.4	Y392 T393 L394 C401	C388-Y392 WeakPolarHBondContact CB-O 3.25Å; C388-T393 VanDerWaalsContact SG-C 3.59Å; C388-L394 WeakPolarHBondContact SG-CA 3.48Å; C388-L394 PolarHBondContact SG-N 3.25Å; C388-L394 VanDerWaalsContact SG-N 3.4Å; C388-C401 WeakPolarHBondContact CA-SG 3.35Å; C388-C401 HydrophobicContact CB-CB 3.89Å; C388-C401 WeakPolarHBondContact CB-SG 3.28Å; C388-C401 VanDerWaalsContact SG-CA 3.52Å; C388-C401 WeakPolarHBondContact SG-CB 3.34Å; C388-C401 CovalentContact SG-SG 2.04Å; C388-C401 PolarHBondContact SG-SG 3.09Å
389	T	80.2	Confident	74.2	Confident	52 Å²	52	78 Å²	78	32%	0.319	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-65.6	160.6	171.4	56.2	0	0	0	0	111.3	Q375 E376 G391 Y392	Q375-T389 PolarHBondContact OE1-OG1 3.46Å; E376-T389 HydrophobicContact CG-CG2 4.14Å; T389-G391 PolarHBondContact O-N 3.24Å; T389-Y392 WeakPolarHBondContact O-CB 3.39Å; T389-Y392 PolarHBondContact O-N 2.99Å
390	N	72.3	Confident	74.9	Confident	161 Å²	161	76.9 Å²	76.9	86%	0.861	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	133.3	-177	-70.5	-22.2	0	0	0	111.5
391	G	66.6	Low	75.6	Confident	47 Å²	47	75.3 Å²	75.3	49%	0.485	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	4.1	-173.3	0	0	0	0	0	114.5	T389 V404	T389-G391 PolarHBondContact O-N 3.24Å; G391-V404 WeakPolarHBondContact O-CB 3.4Å; G391-V404 PolarHBondContact O-N 2.89Å
392	Y	79.3	Confident	76.7	Confident	84 Å²	84	72.1 Å²	72.1	33%	0.329	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.1	175.9	-67.7	-108.6	0	0	0	111.3	C388 T389 C401 Q402 K403	C388-Y392 WeakPolarHBondContact CB-O 3.25Å; T389-Y392 WeakPolarHBondContact O-CB 3.39Å; T389-Y392 PolarHBondContact O-N 2.99Å; Y392-C401 HydrophobicContact CD1-CB 4.21Å; Y392-Q402 CarbonylContact C-O 3.51Å; Y392-Q402 WeakPolarHBondContact CA-O 3.27Å; Y392-K403 HydrophobicContact CD1-CB 3.94Å; Y392-K403 HydrophobicContact CD1-CG 4.48Å; Y392-K403 HydrophobicContact CE1-CB 3.56Å; Y392-K403 HydrophobicContact CE1-CG 3.98Å; Y392-K403 HydrophobicContact CE2-CG 4.22Å
393	T	78.1	Confident	77.4	Confident	80 Å²	80	71.3 Å²	71.3	49%	0.491	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	141.6	174.6	45.8	0	0	0	0	111.3	C388 R395 Q402 V404	C388-T393 VanDerWaalsContact SG-C 3.59Å; T393-R395 PolarHBondContact O-N 3.07Å; T393-Q402 PolarHBondContact N-O 3.4Å; T393-Q402 PolarHBondContact O-N 3.36Å; T393-V404 HydrophobicContact CG2-CG2 3.67Å
394	L	80.6	Confident	77.7	Confident	71 Å²	71	72 Å²	72	37%	0.372	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.1	178.8	-165.4	72.4	0	0	0	109.8	C386 C388	C386-L394 HydrophobicContact CB-CD1 3.94Å; C388-L394 WeakPolarHBondContact SG-CA 3.48Å; C388-L394 PolarHBondContact SG-N 3.25Å; C388-L394 VanDerWaalsContact SG-N 3.4Å
395	R	80.3	Confident	77.2	Confident	121 Å²	121	74.7 Å²	74.7	46%	0.457	41%	0.409	S	S	.	.			trans	-74.1	167.7	177.6	-76.8	173.6	158	169.2	2	111.5	T393 D397 G398 T400 Q402	T393-R395 PolarHBondContact O-N 3.07Å; R395-D397 PolarHBondContact O-N 3.41Å; R395-G398 PolarHBondContact O-N 2.99Å; R395-T400 WeakPolarHBondContact CB-O 3.36Å; R395-T400 WeakPolarHBondContact CD-OG1 3.22Å; R395-T400 PolarHBondContact N-O 2.93Å; R395-Q402 HydrophobicContact CG-CB 3.92Å
396	S	79.6	Confident	76.4	Confident	138 Å²	138	74.6 Å²	74.6	97%	0.965	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-10.5	178.7	50.4	0	0	0	0	114.8	G398	S396-G398 VanDerWaalsContact C-N 3.28Å
397	D	77.9	Confident	75.5	Confident	84 Å²	84	74.6 Å²	74.6	45%	0.449	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.8	170.9	66.4	8.6	0	0	0	113.7	R395 K399 T400	R395-D397 PolarHBondContact O-N 3.41Å; D397-K399 PolarHBondContact O-N 3.49Å; D397-K399 PolarHBondContact OD1-N 3.41Å; D397-T400 VanDerWaalsContact CG-OG1 3.31Å; D397-T400 PolarHBondContact OD1-N 2.68Å; D397-T400 PolarHBondContact OD1-OG1 2.9Å; D397-T400 WeakPolarHBondContact OD2-CB 3.06Å; D397-T400 VanDerWaalsContact OD2-CG2 3.31Å; D397-T400 WeakPolarHBondContact OD2-CG2 3.02Å; D397-T400 PolarHBondContact OD2-OG1 2.8Å
398	G	75.6	Confident	74.6	Confident	34 Å²	34	73.7 Å²	73.7	35%	0.351	42%	0.421	S	S	.	.	S	Bend	trans	69	12.6	-178.9	0	0	0	0	0	114.8	C386 R395 S396	C386-G398 WeakPolarHBondContact CB-O 3.39Å; C386-G398 PolarHBondContact SG-O 3.14Å; R395-G398 PolarHBondContact O-N 2.99Å; S396-G398 VanDerWaalsContact C-N 3.28Å
399	K	78.1	Confident	73.6	Confident	112 Å²	112	78.4 Å²	78.4	49%	0.487	45%	0.445	S	S	.	.	S	Bend	trans	-137.2	-34.3	-171.8	-66.1	-172.9	-178	-170.6	0	115.3	E374 D397	E374-K399 PolarHBondContact N-O 2.7Å; D397-K399 PolarHBondContact O-N 3.49Å; D397-K399 PolarHBondContact OD1-N 3.41Å
400	T	80.7	Confident	72.5	Confident	39 Å²	39	78.4 Å²	78.4	24%	0.239	46%	0.456	C	S	.	.			trans	-101.8	153.6	-178.1	64.7	0	0	0	0	112.4	E374 R395 D397	E374-T400 WeakPolarHBondContact OE2-CA 3.43Å; E374-T400 WeakPolarHBondContact OE2-CB 3.49Å; R395-T400 WeakPolarHBondContact CB-O 3.36Å; R395-T400 WeakPolarHBondContact CD-OG1 3.22Å; R395-T400 PolarHBondContact N-O 2.93Å; D397-T400 VanDerWaalsContact CG-OG1 3.31Å; D397-T400 PolarHBondContact OD1-N 2.68Å; D397-T400 PolarHBondContact OD1-OG1 2.9Å; D397-T400 WeakPolarHBondContact OD2-CB 3.06Å; D397-T400 VanDerWaalsContact OD2-CG2 3.31Å; D397-T400 WeakPolarHBondContact OD2-CG2 3.02Å; D397-T400 PolarHBondContact OD2-OG1 2.8Å
401	C	83.9	Confident	71.9	Confident	8 Å²	8	74.6 Å²	74.6	5%	0.054	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.2	-170.2	-71.7	0	0	0	0	111.2	E374 Q375 C388 Y392	E374-C401 PolarHBondContact OE2-N 2.96Å; Q375-C401 HydrophobicContact CG-CB 4.09Å; C388-C401 WeakPolarHBondContact CA-SG 3.35Å; C388-C401 HydrophobicContact CB-CB 3.89Å; C388-C401 WeakPolarHBondContact CB-SG 3.28Å; C388-C401 VanDerWaalsContact SG-CA 3.52Å; C388-C401 WeakPolarHBondContact SG-CB 3.34Å; C388-C401 CovalentContact SG-SG 2.04Å; C388-C401 PolarHBondContact SG-SG 3.09Å; Y392-C401 HydrophobicContact CD1-CB 4.21Å
402	Q	81.3	Confident	71.8	Confident	97 Å²	97	74.2 Å²	74.2	45%	0.453	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.9	176.7	-179.7	157.3	-25.4	0	0	110.9	Y392 T393 R395 V404	Y392-Q402 CarbonylContact C-O 3.51Å; Y392-Q402 WeakPolarHBondContact CA-O 3.27Å; T393-Q402 PolarHBondContact N-O 3.4Å; T393-Q402 PolarHBondContact O-N 3.36Å; R395-Q402 HydrophobicContact CG-CB 3.92Å; Q402-V404 PolarHBondContact O-N 2.77Å
403	K	72.8	Confident	71.2	Confident	100 Å²	100	72.4 Å²	72.4	44%	0.435	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	127.6	172.6	-165	174.7	-176.3	176.9	0	110	Y392 D423	Y392-K403 HydrophobicContact CD1-CB 3.94Å; Y392-K403 HydrophobicContact CD1-CG 4.48Å; Y392-K403 HydrophobicContact CE1-CB 3.56Å; Y392-K403 HydrophobicContact CE1-CG 3.98Å; Y392-K403 HydrophobicContact CE2-CG 4.22Å; K403-D423 IonicContact NZ-OD1 2.81Å; K403-D423 PolarHBondContact NZ-OD1 3.08Å
404	V	69.7	Low	71.1	Confident	63 Å²	63	69.5 Å²	69.5	38%	0.382	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-79.1	136.6	172	-176.8	0	0	0	0	108.1	G391 T393 Q402 P406	G391-V404 WeakPolarHBondContact O-CB 3.4Å; G391-V404 PolarHBondContact O-N 2.89Å; T393-V404 HydrophobicContact CG2-CG2 3.67Å; Q402-V404 PolarHBondContact O-N 2.77Å; V404-P406 WeakPolarHBondContact O-CD 3.22Å
405	D	62.2	Low	70.9	Confident	92 Å²	92	70.7 Å²	70.7	49%	0.492	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.9	119.2	171.8	-176	-30.2	0	0	0	109.1	C407 A408	D405-C407 PolarHBondContact O-N 2.97Å; D405-C407 PolarHBondContact OD1-N 3.12Å; D405-A408 HydrophobicContact CB-CB 3.92Å; D405-A408 PolarHBondContact O-N 3.1Å
406	P	59.8	Low	70.9	Confident	58 Å²	58	66.9 Å²	66.9	38%	0.377	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.2	-176.6	-24.3	34.6	0	0	0	115.1	V404 C425	V404-P406 WeakPolarHBondContact O-CD 3.22Å; P406-C425 VanDerWaalsContact C-SG 3.56Å; P406-C425 PolarHBondContact O-SG 3.26Å
407	C	63.1	Low	70.7	Confident	13 Å²	13	64 Å²	64	9%	0.088	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	2.1	-175.2	-50.2	0	0	0	0	113.9	D405 C425	D405-C407 PolarHBondContact O-N 2.97Å; D405-C407 PolarHBondContact OD1-N 3.12Å; C407-C425 WeakPolarHBondContact CA-SG 3.4Å; C407-C425 HydrophobicContact CB-CB 4.26Å; C407-C425 WeakPolarHBondContact CB-SG 3.48Å; C407-C425 VanDerWaalsContact SG-CA 3.58Å; C407-C425 WeakPolarHBondContact SG-CB 3.47Å; C407-C425 CovalentContact SG-SG 2.04Å; C407-C425 PolarHBondContact SG-SG 2.91Å
408	A	62.4	Low	70.7	Confident	79 Å²	79	64.7 Å²	64.7	65%	0.653	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.1	-174.2	0	0	0	0	0	115.2	D405	D405-A408 HydrophobicContact CB-CB 3.92Å; D405-A408 PolarHBondContact O-N 3.1Å
409	D	60.9	Low	70.6	Confident	113 Å²	113	66.2 Å²	66.2	60%	0.604	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-6.4	-178	75.6	-12	0	0	0	114.2	S411	D409-S411 PolarHBondContact O-N 2.83Å; D409-S411 WeakPolarHBondContact OD1-CB 3.35Å; D409-S411 PolarHBondContact OD1-N 2.95Å; D409-S411 PolarHBondContact OD1-OG 3.03Å; D409-S411 WeakPolarHBondContact OD2-CB 3.46Å; D409-S411 PolarHBondContact OD2-OG 3.07Å
410	G	57.6	Low	70	Confident	53 Å²	53	64.8 Å²	64.8	55%	0.546	38%	0.384	S	S	.	.	S	Bend	trans	71.5	6.2	-176.6	0	0	0	0	0	115.5	H412	G410-H412 VanDerWaalsContact C-N 3.34Å; G410-H412 PolarHBondContact O-N 2.87Å
411	S	59.7	Low	69.1	Low	80 Å²	80	65.2 Å²	65.2	56%	0.559	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.2	-175.3	80.3	0	0	0	0	114.3	D409 G413	D409-S411 PolarHBondContact O-N 2.83Å; D409-S411 WeakPolarHBondContact OD1-CB 3.35Å; D409-S411 PolarHBondContact OD1-N 2.95Å; D409-S411 PolarHBondContact OD1-OG 3.03Å; D409-S411 WeakPolarHBondContact OD2-CB 3.46Å; D409-S411 PolarHBondContact OD2-OG 3.07Å; S411-G413 PolarHBondContact O-N 3.03Å
412	H	64.6	Low	68.2	Low	39 Å²	39	68.3 Å²	68.3	18%	0.181	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-20.9	-175.3	50.7	79.5	0	0	0	114.6	G410 C414 F418 C425	G410-H412 VanDerWaalsContact C-N 3.34Å; G410-H412 PolarHBondContact O-N 2.87Å; H412-C414 VanDerWaalsContact C-N 3.28Å; H412-C414 PolarHBondContact O-N 3.05Å; H412-F418 AromaticContact CE1-CD1 3.33Å; H412-F418 WeakPolarHBondContact CE1-CD1 3.24Å; H412-F418 AromaticContact CE1-CE1 3.36Å; H412-F418 WeakPolarHBondContact CE1-CE1 3.42Å; H412-F418 AromaticContact CE1-CG 3.72Å; H412-F418 AromaticContact CE1-CZ 3.76Å; H412-F418 AromaticContact ND1-CD1 3.81Å; H412-F418 AromaticContact ND1-CG 3.81Å; H412-F418 AromaticContact NE2-CD1 3.95Å; H412-F418 AromaticContact NE2-CE1 3.62Å; H412-F418 AromaticContact NE2-CE2 3.78Å; H412-F418 AromaticContact NE2-CZ 3.52Å; H412-C425 HydrophobicContact CB-CB 3.84Å
413	G	66.8	Low	67.2	Low	46 Å²	46	69.5 Å²	69.5	47%	0.474	44%	0.435	S	S	.	.			trans	67.4	22	164.7	0	0	0	0	0	115.7	S411	S411-G413 PolarHBondContact O-N 3.03Å
414	C	75.8	Confident	66.5	Low	19 Å²	19	67.7 Å²	67.7	13%	0.128	44%	0.435	C	S	.	.			trans	-78.4	132.6	175	-57.4	0	0	0	0	110.7	H412 Q416 F418 C427	H412-C414 VanDerWaalsContact C-N 3.28Å; H412-C414 PolarHBondContact O-N 3.05Å; C414-Q416 VanDerWaalsContact C-N 3.3Å; C414-Q416 PolarHBondContact O-N 3.4Å; C414-F418 HydrophobicContact CB-CB 4.16Å; C414-C427 WeakPolarHBondContact CA-SG 3.46Å; C414-C427 HydrophobicContact CB-CB 3.6Å; C414-C427 WeakPolarHBondContact CB-SG 3.2Å; C414-C427 WeakPolarHBondContact SG-CA 3.29Å; C414-C427 WeakPolarHBondContact SG-CB 3.37Å; C414-C427 CovalentContact SG-SG 2.03Å; C414-C427 PolarHBondContact SG-SG 2.81Å
415	E	76.4	Confident	66.4	Low	97 Å²	97	66.4 Å²	66.4	45%	0.453	43%	0.428	S	S	.	.	S	Bend	trans	-67	-30.1	179.9	-171.9	-166.6	122.3	0	0	113	R436 K440 T441 C442	E415-R436 IonicContact OE2-NH1 3.22Å; E415-K440 PolarHBondContact N-O 3.1Å; E415-T441 WeakPolarHBondContact OE2-CA 3.33Å; E415-T441 VanDerWaalsContact OE2-CB 3.27Å; E415-T441 WeakPolarHBondContact OE2-CB 3.42Å; E415-C442 PolarHBondContact OE2-N 2.88Å
416	Q	79.4	Confident	67.1	Low	40 Å²	40	65.1 Å²	65.1	19%	0.187	42%	0.424	C	S	.	.	S	Bend	trans	-128.4	-91.9	-172.9	-60.8	-173.4	5.3	0	0	112.5	C414 C442	C414-Q416 VanDerWaalsContact C-N 3.3Å; C414-Q416 PolarHBondContact O-N 3.4Å; Q416-C442 VanDerWaalsContact CD-SG 3.54Å; Q416-C442 HydrophobicContact CG-CB 4.2Å
417	E	76.8	Confident	68	Low	79 Å²	79	62.9 Å²	62.9	37%	0.369	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	157.3	-176.6	-72.1	167.6	-165.3	0	0	110.6	C427 R428 R430	E417-C427 CarbonylContact O-C 3.59Å; E417-C427 WeakPolarHBondContact O-CA 3.46Å; E417-R428 HydrophobicContact CB-CB 4.18Å; E417-R428 PolarHBondContact N-O 3.46Å; E417-R428 PolarHBondContact O-N 2.95Å; E417-R430 HydrophobicContact CG-CG 4.46Å; E417-R430 WeakPolarHBondContact OE1-CG 3.43Å; E417-R430 IonicContact OE1-CZ 3.85Å; E417-R430 IonicContact OE1-NE 3.8Å; E417-R430 PolarHBondContact OE1-NE 3.47Å; E417-R430 IonicContact OE1-NH2 3.76Å
418	F	77.1	Confident	68.8	Low	97 Å²	97	69.2 Å²	69.2	43%	0.425	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150.7	178.5	64.5	-84.6	0	0	0	110.6	H412 C414 V426	H412-F418 AromaticContact CE1-CD1 3.33Å; H412-F418 WeakPolarHBondContact CE1-CD1 3.24Å; H412-F418 AromaticContact CE1-CE1 3.36Å; H412-F418 WeakPolarHBondContact CE1-CE1 3.42Å; H412-F418 AromaticContact CE1-CG 3.72Å; H412-F418 AromaticContact CE1-CZ 3.76Å; H412-F418 AromaticContact ND1-CD1 3.81Å; H412-F418 AromaticContact ND1-CG 3.81Å; H412-F418 AromaticContact NE2-CD1 3.95Å; H412-F418 AromaticContact NE2-CE1 3.62Å; H412-F418 AromaticContact NE2-CE2 3.78Å; H412-F418 AromaticContact NE2-CZ 3.52Å; C414-F418 HydrophobicContact CB-CB 4.16Å; F418-V426 WeakPolarHBondContact CA-O 3.49Å
419	V	73.5	Confident	69.6	Low	67 Å²	67	66.8 Å²	66.8	41%	0.406	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	138.6	178.3	-75.6	0	0	0	0	110.3	A421 V426 R428	V419-A421 PolarHBondContact O-N 2.77Å; V419-V426 PolarHBondContact N-O 2.7Å; V419-V426 PolarHBondContact O-N 2.86Å; V419-R428 HydrophobicContact CG2-CG 4.29Å
420	S	65.9	Low	70.4	Confident	81 Å²	81	68.4 Å²	68.4	57%	0.566	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	122.2	176.3	-48.2	0	0	0	0	110.2
421	A	60.8	Low	71.1	Confident	49 Å²	49	76.1 Å²	76.1	41%	0.405	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	92.8	-179.4	0	0	0	0	0	109.9	V419 D423 S424 V426	V419-A421 PolarHBondContact O-N 2.77Å; A421-D423 PolarHBondContact O-N 3.32Å; A421-S424 CarbonylContact C-O 3.52Å; A421-S424 PolarHBondContact N-O 2.95Å; A421-S424 PolarHBondContact O-N 3.39Å; A421-S424 PolarHBondContact O-OG 3.01Å; A421-V426 HydrophobicContact CB-CB 4.49Å; A421-V426 HydrophobicContact CB-CG2 3.83Å
422	G	66.4	Low	71.4	Confident	73 Å²	73	74.4 Å²	74.4	75%	0.753	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-120.7	-176	0	0	0	0	0	111.5	S424	G422-S424 VanDerWaalsContact C-N 3.33Å
423	D	59.3	Low	71.9	Confident	122 Å²	122	76.2 Å²	76.2	65%	0.652	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	15.9	-179.2	-61.3	-38.6	0	0	0	113.4	K403 A421	K403-D423 IonicContact NZ-OD1 2.81Å; K403-D423 PolarHBondContact NZ-OD1 3.08Å; A421-D423 PolarHBondContact O-N 3.32Å
424	S	59	Low	72.3	Confident	62 Å²	62	77.9 Å²	77.9	43%	0.434	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.4	-177	70	0	0	0	0	113.8	A421 G422	A421-S424 CarbonylContact C-O 3.52Å; A421-S424 PolarHBondContact N-O 2.95Å; A421-S424 PolarHBondContact O-N 3.39Å; A421-S424 PolarHBondContact O-OG 3.01Å; G422-S424 VanDerWaalsContact C-N 3.33Å
425	C	67.6	Low	72.3	Confident	36 Å²	36	80.2 Å²	80.2	24%	0.243	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.1	172.1	-45.5	0	0	0	0	109.6	P406 C407 H412	P406-C425 VanDerWaalsContact C-SG 3.56Å; P406-C425 PolarHBondContact O-SG 3.26Å; C407-C425 WeakPolarHBondContact CA-SG 3.4Å; C407-C425 HydrophobicContact CB-CB 4.26Å; C407-C425 WeakPolarHBondContact CB-SG 3.48Å; C407-C425 VanDerWaalsContact SG-CA 3.58Å; C407-C425 WeakPolarHBondContact SG-CB 3.47Å; C407-C425 CovalentContact SG-SG 2.04Å; C407-C425 PolarHBondContact SG-SG 2.91Å; H412-C425 HydrophobicContact CB-CB 3.84Å
426	V	76.6	Confident	72.4	Confident	65 Å²	65	80.5 Å²	80.5	39%	0.394	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.5	-179	177.6	0	0	0	0	110.3	F418 V419 A421	F418-V426 WeakPolarHBondContact CA-O 3.49Å; V419-V426 PolarHBondContact N-O 2.7Å; V419-V426 PolarHBondContact O-N 2.86Å; A421-V426 HydrophobicContact CB-CB 4.49Å; A421-V426 HydrophobicContact CB-CG2 3.83Å
427	C	79.4	Confident	72.2	Confident	10 Å²	10	85.4 Å²	85.4	7%	0.068	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	146.8	-179.7	-51.5	0	0	0	0	112.4	C414 E417 L435 G439	C414-C427 WeakPolarHBondContact CA-SG 3.46Å; C414-C427 HydrophobicContact CB-CB 3.6Å; C414-C427 WeakPolarHBondContact CB-SG 3.2Å; C414-C427 WeakPolarHBondContact SG-CA 3.29Å; C414-C427 WeakPolarHBondContact SG-CB 3.37Å; C414-C427 CovalentContact SG-SG 2.03Å; C414-C427 PolarHBondContact SG-SG 2.81Å; E417-C427 CarbonylContact O-C 3.59Å; E417-C427 WeakPolarHBondContact O-CA 3.46Å; C427-L435 HydrophobicContact CB-CD1 4.04Å; C427-G439 WeakPolarHBondContact CB-O 3.32Å; C427-G439 PolarHBondContact SG-O 3.45Å; C427-G439 VanDerWaalsContact SG-O 3.39Å
428	R	78.4	Confident	72.2	Confident	147 Å²	147	85.7 Å²	85.7	56%	0.555	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	147.7	175.2	-73.2	-179.6	58.7	157.8	-2	110.3	E417 V419	E417-R428 HydrophobicContact CB-CB 4.18Å; E417-R428 PolarHBondContact N-O 3.46Å; E417-R428 PolarHBondContact O-N 2.95Å; V419-R428 HydrophobicContact CG2-CG 4.29Å
429	C	79.4	Confident	72	Confident	28 Å²	28	82.7 Å²	82.7	19%	0.189	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-103.9	149.4	175.9	-58.9	0	0	0	0	111.6	F433 L435 C442	C429-F433 HydrophobicContact CB-CB 3.93Å; C429-L435 WeakPolarHBondContact SG-CA 3.41Å; C429-L435 PolarHBondContact SG-N 3.39Å; C429-L435 VanDerWaalsContact SG-N 3.43Å; C429-C442 VanDerWaalsContact CA-SG 3.55Å; C429-C442 HydrophobicContact CB-CB 3.94Å; C429-C442 WeakPolarHBondContact CB-SG 3.25Å; C429-C442 VanDerWaalsContact SG-CA 3.59Å; C429-C442 WeakPolarHBondContact SG-CB 3.34Å; C429-C442 CovalentContact SG-SG 2.04Å; C429-C442 PolarHBondContact SG-SG 3.44Å
430	R	78.9	Confident	72.2	Confident	146 Å²	146	84.5 Å²	84.5	55%	0.551	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-71.9	161.1	174	-68.6	177	178.4	162.5	8.1	111.2	E417 G432 F433	E417-R430 HydrophobicContact CG-CG 4.46Å; E417-R430 WeakPolarHBondContact OE1-CG 3.43Å; E417-R430 IonicContact OE1-CZ 3.85Å; E417-R430 IonicContact OE1-NE 3.8Å; E417-R430 PolarHBondContact OE1-NE 3.47Å; E417-R430 IonicContact OE1-NH2 3.76Å; R430-G432 PolarHBondContact O-N 3.01Å; R430-F433 PolarHBondContact O-N 3.45Å; R430-F433 VanDerWaalsContact O-N 3.07Å
431	K	71.4	Confident	72.8	Confident	215 Å²	215	82.5 Å²	82.5	94%	0.935	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	130.1	-178	-166.8	177.8	-178	-177.7	0	111.1
432	G	65.4	Low	73.7	Confident	44 Å²	44	80.4 Å²	80.4	45%	0.454	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-0.2	-174.9	0	0	0	0	0	114.9	R430 V445	R430-G432 PolarHBondContact O-N 3.01Å; G432-V445 PolarHBondContact O-N 2.84Å
433	F	76.4	Confident	74.3	Confident	77 Å²	77	82.9 Å²	82.9	34%	0.338	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.8	176.8	-64.6	-106.6	0	0	0	110.9	C429 R430 C442 K443 K444	C429-F433 HydrophobicContact CB-CB 3.93Å; R430-F433 PolarHBondContact O-N 3.45Å; R430-F433 VanDerWaalsContact O-N 3.07Å; F433-C442 HydrophobicContact CB-CB 4.09Å; F433-C442 HydrophobicContact CD1-CB 4.26Å; F433-K443 CarbonylContact C-O 3.28Å; F433-K443 VanDerWaalsContact CA-O 3.23Å; F433-K443 WeakPolarHBondContact CA-O 3.38Å; F433-K444 HydrophobicContact CD1-CB 4.04Å; F433-K444 HydrophobicContact CE1-CB 3.68Å; F433-K444 HydrophobicContact CE1-CG 4.19Å; F433-K444 HydrophobicContact CZ-CB 4.21Å; F433-K444 HydrophobicContact CZ-CG 4.21Å
434	T	74.3	Confident	74.7	Confident	81 Å²	81	82.9 Å²	82.9	50%	0.497	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.6	172.8	47	0	0	0	0	110.9	R436 C442 K443 V445	T434-R436 PolarHBondContact O-N 3.08Å; T434-C442 WeakPolarHBondContact O-CA 3.5Å; T434-K443 PolarHBondContact N-O 3.31Å; T434-K443 PolarHBondContact O-N 2.04Å; T434-V445 HydrophobicContact CG2-CG2 3.75Å
435	L	76.9	Confident	75.1	Confident	69 Å²	69	82.8 Å²	82.8	36%	0.361	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	129.4	177.3	-165.4	70.2	0	0	0	108.9	C427 C429	C427-L435 HydrophobicContact CB-CD1 4.04Å; C429-L435 WeakPolarHBondContact SG-CA 3.41Å; C429-L435 PolarHBondContact SG-N 3.39Å; C429-L435 VanDerWaalsContact SG-N 3.43Å
436	R	76.9	Confident	74.7	Confident	102 Å²	102	84.9 Å²	84.9	39%	0.385	43%	0.432	S	S	.	.			trans	-68.7	162.1	176.2	-70.3	-159.3	-174.5	83.1	0.2	110.2	E415 T434 D438 G439 T441 C442 K443	E415-R436 IonicContact OE2-NH1 3.22Å; T434-R436 PolarHBondContact O-N 3.08Å; R436-D438 PolarHBondContact O-N 2.94Å; R436-G439 PolarHBondContact O-N 3.46Å; R436-T441 WeakPolarHBondContact CB-O 3.49Å; R436-T441 VanDerWaalsContact CD-OG1 3.26Å; R436-T441 WeakPolarHBondContact CD-OG1 3.43Å; R436-T441 PolarHBondContact N-O 3.46Å; R436-T441 VanDerWaalsContact NH1-CB 3.29Å; R436-T441 PolarHBondContact NH1-OG1 3.21Å; R436-C442 PolarHBondContact NH1-O 2.76Å; R436-K443 HydrophobicContact CG-CB 4.03Å
437	P	76.8	Confident	73.8	Confident	144 Å²	144	84.9 Å²	84.9	94%	0.935	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-12.1	174.8	-25.3	35.5	0	0	0	115.2	G439	P437-G439 PolarHBondContact O-N 3.43Å
438	D	75.6	Confident	73	Confident	85 Å²	85	84.8 Å²	84.8	46%	0.455	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.4	171.7	63.6	25.5	0	0	0	113.9	R436 K440 T441	R436-D438 PolarHBondContact O-N 2.94Å; D438-K440 PolarHBondContact O-N 2.98Å; D438-K440 PolarHBondContact OD1-N 3.36Å; D438-T441 PolarHBondContact OD1-N 3.02Å; D438-T441 PolarHBondContact OD1-OG1 2.58Å; D438-T441 WeakPolarHBondContact OD2-CB 3.44Å; D438-T441 WeakPolarHBondContact OD2-CG2 3.5Å; D438-T441 PolarHBondContact OD2-OG1 2.84Å
439	G	73.3	Confident	72.1	Confident	34 Å²	34	81.2 Å²	81.2	35%	0.351	43%	0.434	S	S	.	.	S	Bend	trans	69.7	7	179.2	0	0	0	0	0	115	C427 R436 P437	C427-G439 WeakPolarHBondContact CB-O 3.32Å; C427-G439 PolarHBondContact SG-O 3.45Å; C427-G439 VanDerWaalsContact SG-O 3.39Å; R436-G439 PolarHBondContact O-N 3.46Å; P437-G439 PolarHBondContact O-N 3.43Å
440	K	76.5	Confident	71.2	Confident	104 Å²	104	85.4 Å²	85.4	45%	0.452	46%	0.455	S	S	.	.	S	Bend	trans	-132.1	-35.1	-170.6	-70.4	-169.1	177.1	-166.1	0	114.7	E415 D438	E415-K440 PolarHBondContact N-O 3.1Å; D438-K440 PolarHBondContact O-N 2.98Å; D438-K440 PolarHBondContact OD1-N 3.36Å
441	T	78.9	Confident	70.1	Confident	40 Å²	40	81 Å²	81	25%	0.245	46%	0.455	C	S	.	.			trans	-106.4	155.1	-175.9	75.2	0	0	0	0	112.1	E415 R436 D438	E415-T441 WeakPolarHBondContact OE2-CA 3.33Å; E415-T441 VanDerWaalsContact OE2-CB 3.27Å; E415-T441 WeakPolarHBondContact OE2-CB 3.42Å; R436-T441 WeakPolarHBondContact CB-O 3.49Å; R436-T441 VanDerWaalsContact CD-OG1 3.26Å; R436-T441 WeakPolarHBondContact CD-OG1 3.43Å; R436-T441 PolarHBondContact N-O 3.46Å; R436-T441 VanDerWaalsContact NH1-CB 3.29Å; R436-T441 PolarHBondContact NH1-OG1 3.21Å; D438-T441 PolarHBondContact OD1-N 3.02Å; D438-T441 PolarHBondContact OD1-OG1 2.58Å; D438-T441 WeakPolarHBondContact OD2-CB 3.44Å; D438-T441 WeakPolarHBondContact OD2-CG2 3.5Å; D438-T441 PolarHBondContact OD2-OG1 2.84Å
442	C	81	Confident	69.5	Low	5 Å²	5	74.9 Å²	74.9	3%	0.034	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.6	-173.6	-66.4	0	0	0	0	110.3	E415 Q416 C429 F433 T434 R436	E415-C442 PolarHBondContact OE2-N 2.88Å; Q416-C442 VanDerWaalsContact CD-SG 3.54Å; Q416-C442 HydrophobicContact CG-CB 4.2Å; C429-C442 VanDerWaalsContact CA-SG 3.55Å; C429-C442 HydrophobicContact CB-CB 3.94Å; C429-C442 WeakPolarHBondContact CB-SG 3.25Å; C429-C442 VanDerWaalsContact SG-CA 3.59Å; C429-C442 WeakPolarHBondContact SG-CB 3.34Å; C429-C442 CovalentContact SG-SG 2.04Å; C429-C442 PolarHBondContact SG-SG 3.44Å; F433-C442 HydrophobicContact CB-CB 4.09Å; F433-C442 HydrophobicContact CD1-CB 4.26Å; T434-C442 WeakPolarHBondContact O-CA 3.5Å; R436-C442 PolarHBondContact NH1-O 2.76Å
443	K	78.3	Confident	69.4	Low	125 Å²	125	74.8 Å²	74.8	54%	0.543	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.2	174.1	-170.6	-173.7	173.6	-173.5	0	109.2	F433 T434 R436 V445	F433-K443 CarbonylContact C-O 3.28Å; F433-K443 VanDerWaalsContact CA-O 3.23Å; F433-K443 WeakPolarHBondContact CA-O 3.38Å; T434-K443 PolarHBondContact N-O 3.31Å; T434-K443 PolarHBondContact O-N 2.04Å; R436-K443 HydrophobicContact CG-CB 4.03Å; K443-V445 PolarHBondContact O-N 3.2Å
444	K	68	Low	68.9	Low	121 Å²	121	73 Å²	73	53%	0.526	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	125.5	167.8	-169.5	-174	176.1	-167.1	0	107.8	F433 D464	F433-K444 HydrophobicContact CD1-CB 4.04Å; F433-K444 HydrophobicContact CE1-CB 3.68Å; F433-K444 HydrophobicContact CE1-CG 4.19Å; F433-K444 HydrophobicContact CZ-CB 4.21Å; F433-K444 HydrophobicContact CZ-CG 4.21Å; K444-D464 IonicContact NZ-OD1 2.73Å; K444-D464 PolarHBondContact NZ-OD1 2.98Å; K444-D464 VanDerWaalsContact NZ-OD1 3.14Å
445	V	67.3	Low	68.8	Low	60 Å²	60	70.1 Å²	70.1	36%	0.364	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-70.6	135.2	174.8	-178.5	0	0	0	0	108.1	G432 T434 K443	G432-V445 PolarHBondContact O-N 2.84Å; T434-V445 HydrophobicContact CG2-CG2 3.75Å; K443-V445 PolarHBondContact O-N 3.2Å
446	D	59.1	Low	68.6	Low	81 Å²	81	71.5 Å²	71.5	43%	0.433	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-67.2	126.8	175.5	-179.9	-30.7	0	0	0	108.9	C448 A449	D446-C448 PolarHBondContact O-N 2.83Å; D446-C448 PolarHBondContact OD1-N 3.12Å; D446-A449 HydrophobicContact CB-CB 3.84Å; D446-A449 PolarHBondContact O-N 2.84Å
447	P	58.1	Low	68.6	Low	65 Å²	65	68.4 Å²	68.4	42%	0.422	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-22.3	-179.5	-26.1	34.8	0	0	0	115.1
448	C	61.3	Low	68.5	Low	7 Å²	7	64.2 Å²	64.2	5%	0.047	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-2	-179.8	-51.1	0	0	0	0	113.4	D446 H453 F459 C466	D446-C448 PolarHBondContact O-N 2.83Å; D446-C448 PolarHBondContact OD1-N 3.12Å; C448-H453 PolarHBondContact O-CD2 3.25Å; C448-F459 HydrophobicContact CB-CD2 4.3Å; C448-F459 HydrophobicContact CB-CE2 4Å; C448-C466 VanDerWaalsContact CA-SG 3.53Å; C448-C466 HydrophobicContact CB-CB 4.19Å; C448-C466 WeakPolarHBondContact CB-SG 3.39Å; C448-C466 WeakPolarHBondContact SG-CB 3.42Å; C448-C466 CovalentContact SG-SG 2.04Å; C448-C466 PolarHBondContact SG-SG 3.39Å
449	A	60.6	Low	68.4	Low	73 Å²	73	64.2 Å²	64.2	60%	0.603	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-5.3	-172	0	0	0	0	0	115.8	D446	D446-A449 HydrophobicContact CB-CB 3.84Å; D446-A449 PolarHBondContact O-N 2.84Å
450	D	59.5	Low	68.2	Low	115 Å²	115	66.6 Å²	66.6	62%	0.615	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-4.1	175.9	76.5	-3.9	0	0	0	113.9	S452	D450-S452 VanDerWaalsContact C-N 3.3Å; D450-S452 VanDerWaalsContact CG-OG 3.28Å; D450-S452 PolarHBondContact O-N 2.79Å; D450-S452 WeakPolarHBondContact OD1-CB 3.38Å; D450-S452 PolarHBondContact OD1-N 3.29Å; D450-S452 PolarHBondContact OD1-OG 3.03Å; D450-S452 PolarHBondContact OD2-OG 3.27Å
451	G	56.4	Low	67.7	Low	54 Å²	54	64.8 Å²	64.8	56%	0.557	38%	0.38	S	S	*	.	S	Bend	trans	77.4	4.2	-179.4	0	0	0	0	0	115.4	H453	G451-H453 VanDerWaalsContact C-N 3.33Å; G451-H453 PolarHBondContact O-N 2.97Å
452	S	59.7	Low	66.7	Low	87 Å²	87	65.4 Å²	65.4	61%	0.608	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-3	-176.6	71.8	0	0	0	0	114.9	D450 G454	D450-S452 VanDerWaalsContact C-N 3.3Å; D450-S452 VanDerWaalsContact CG-OG 3.28Å; D450-S452 PolarHBondContact O-N 2.79Å; D450-S452 WeakPolarHBondContact OD1-CB 3.38Å; D450-S452 PolarHBondContact OD1-N 3.29Å; D450-S452 PolarHBondContact OD1-OG 3.03Å; D450-S452 PolarHBondContact OD2-OG 3.27Å; S452-G454 PolarHBondContact O-N 2.92Å; S452-G454 VanDerWaalsContact O-N 3.11Å
453	H	62.9	Low	66.1	Low	41 Å²	41	68.7 Å²	68.7	19%	0.19	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.7	-173.8	56.9	78.7	0	0	0	115.1	C448 G451 C455 F459 C466	C448-H453 PolarHBondContact O-CD2 3.25Å; G451-H453 VanDerWaalsContact C-N 3.33Å; G451-H453 PolarHBondContact O-N 2.97Å; H453-C455 PolarHBondContact O-N 3.24Å; H453-F459 AromaticContact CE1-CD1 3.24Å; H453-F459 WeakPolarHBondContact CE1-CD1 3.32Å; H453-F459 AromaticContact CE1-CE1 3.4Å; H453-F459 WeakPolarHBondContact CE1-CE1 3.45Å; H453-F459 AromaticContact CE1-CG 3.75Å; H453-F459 AromaticContact ND1-CD1 3.84Å; H453-F459 AromaticContact ND1-CG 3.9Å; H453-F459 AromaticContact NE2-CD1 3.71Å; H453-F459 AromaticContact NE2-CE1 3.39Å; H453-F459 WeakPolarHBondContact NE2-CE1 3.38Å; H453-F459 AromaticContact NE2-CZ 3.6Å; H453-C466 HydrophobicContact CB-CB 3.9Å
454	G	65.4	Low	65.2	Low	41 Å²	41	68.8 Å²	68.8	42%	0.423	43%	0.431	S	S	.	.			trans	67.9	28.9	166.4	0	0	0	0	0	116	S452 K481	S452-G454 PolarHBondContact O-N 2.92Å; S452-G454 VanDerWaalsContact O-N 3.11Å; G454-K481 WeakPolarHBondContact O-CB 3.05Å; G454-K481 WeakPolarHBondContact O-CD 3.31Å; G454-K481 WeakPolarHBondContact O-CG 3.4Å
455	C	72.3	Confident	64.7	Low	19 Å²	19	66.3 Å²	66.3	13%	0.128	43%	0.428	C	S	.	.			trans	-92	135.7	171.1	-58.5	0	0	0	0	110.1	H453 F459 C468	H453-C455 PolarHBondContact O-N 3.24Å; C455-F459 HydrophobicContact CB-CB 4.16Å; C455-C468 WeakPolarHBondContact CA-SG 3.03Å; C455-C468 HydrophobicContact CB-CB 3.6Å; C455-C468 WeakPolarHBondContact CB-SG 3.33Å; C455-C468 WeakPolarHBondContact SG-CA 3.43Å; C455-C468 WeakPolarHBondContact SG-CB 3Å; C455-C468 CovalentContact SG-SG 2.03Å; C455-C468 PolarHBondContact SG-SG 3.3Å
456	E	72.9	Confident	64.7	Low	98 Å²	98	65.2 Å²	65.2	46%	0.458	42%	0.423	S	S	.	.	S	Bend	trans	-70.8	-31.5	-179.2	-171.8	-169	125.1	0	0	113.2	K481 T482 C483	E456-K481 WeakPolarHBondContact CB-O 3.41Å; E456-K481 PolarHBondContact N-O 3.33Å; E456-T482 WeakPolarHBondContact OE2-CA 3.03Å; E456-T482 WeakPolarHBondContact OE2-CB 3.4Å; E456-C483 VanDerWaalsContact CD-N 3.31Å; E456-C483 PolarHBondContact OE2-N 3.1Å
457	Q	75.9	Confident	65.3	Low	38 Å²	38	65.2 Å²	65.2	18%	0.178	43%	0.426	C	S	.	.	S	Bend	trans	-126.8	-98	-173.5	-64.6	-168	-2.9	0	0	113.7	C483	Q457-C483 VanDerWaalsContact CD-CB 3.42Å; Q457-C483 HydrophobicContact CG-CB 3.84Å; Q457-C483 VanDerWaalsContact CG-SG 3.53Å
458	E	74.9	Confident	66.3	Low	56 Å²	56	63.1 Å²	63.1	26%	0.262	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	156.5	178.9	-59.4	-176.3	162.3	0	0	110.1	C468 R469 R471	E458-C468 CarbonylContact O-C 3.52Å; E458-C468 WeakPolarHBondContact O-CA 3.38Å; E458-R469 CarbonylContact C-O 3.56Å; E458-R469 WeakPolarHBondContact CA-O 3.28Å; E458-R469 HydrophobicContact CB-CB 4.21Å; E458-R469 WeakPolarHBondContact CB-O 3.32Å; E458-R469 PolarHBondContact N-O 2.78Å; E458-R469 PolarHBondContact O-N 3.3Å; E458-R469 VanDerWaalsContact O-O 3.1Å; E458-R469 IonicContact OE2-CZ 3.55Å; E458-R469 VanDerWaalsContact OE2-CZ 3.24Å; E458-R469 IonicContact OE2-NE 3.02Å; E458-R469 PolarHBondContact OE2-NE 3.15Å; E458-R469 IonicContact OE2-NH2 2.81Å; E458-R469 PolarHBondContact OE2-NH2 2.98Å; E458-R471 HydrophobicContact CG-CG 3.79Å
459	F	73	Confident	67	Low	85 Å²	85	69.7 Å²	69.7	37%	0.373	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	155.6	171.2	61.6	-84.3	0	0	0	109.5	C448 H453 C455 V467	C448-F459 HydrophobicContact CB-CD2 4.3Å; C448-F459 HydrophobicContact CB-CE2 4Å; H453-F459 AromaticContact CE1-CD1 3.24Å; H453-F459 WeakPolarHBondContact CE1-CD1 3.32Å; H453-F459 AromaticContact CE1-CE1 3.4Å; H453-F459 WeakPolarHBondContact CE1-CE1 3.45Å; H453-F459 AromaticContact CE1-CG 3.75Å; H453-F459 AromaticContact ND1-CD1 3.84Å; H453-F459 AromaticContact ND1-CG 3.9Å; H453-F459 AromaticContact NE2-CD1 3.71Å; H453-F459 AromaticContact NE2-CE1 3.39Å; H453-F459 WeakPolarHBondContact NE2-CE1 3.38Å; H453-F459 AromaticContact NE2-CZ 3.6Å; C455-F459 HydrophobicContact CB-CB 4.16Å; F459-V467 CarbonylContact C-O 3.42Å; F459-V467 WeakPolarHBondContact CA-O 3.45Å
460	V	70.7	Confident	67.7	Low	84 Å²	84	67.2 Å²	67.2	51%	0.509	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	131.7	179.2	-166.3	0	0	0	0	108.4	A462 V467	V460-A462 PolarHBondContact O-N 3.16Å; V460-V467 PolarHBondContact N-O 3.04Å; V460-V467 PolarHBondContact O-N 2.93Å
461	S	64.6	Low	68.5	Low	65 Å²	65	68.8 Å²	68.8	46%	0.455	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	123.6	176.3	-49.7	0	0	0	0	110.2
462	A	59.5	Low	68.8	Low	53 Å²	53	76.4 Å²	76.4	44%	0.438	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	89.3	179.9	0	0	0	0	0	109	V460 S465 V467	V460-A462 PolarHBondContact O-N 3.16Å; A462-S465 CarbonylContact C-O 3.57Å; A462-S465 PolarHBondContact N-O 3.38Å; A462-S465 PolarHBondContact O-N 3.43Å; A462-S465 PolarHBondContact O-OG 3.32Å; A462-V467 HydrophobicContact CB-CG2 4.07Å
463	G	67.1	Low	68.9	Low	75 Å²	75	73.9 Å²	73.9	77%	0.773	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	-131	-173	0	0	0	0	0	111.3	S465	G463-S465 VanDerWaalsContact C-N 3.27Å; G463-S465 PolarHBondContact O-N 3.15Å
464	D	59.7	Low	69.4	Low	127 Å²	127	75 Å²	75	68%	0.679	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	21.2	175.4	-69.6	-62.5	0	0	0	113.4	K444	K444-D464 IonicContact NZ-OD1 2.73Å; K444-D464 PolarHBondContact NZ-OD1 2.98Å; K444-D464 VanDerWaalsContact NZ-OD1 3.14Å
465	S	58	Low	69.4	Low	68 Å²	68	77.1 Å²	77.1	48%	0.476	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.7	178	69.8	0	0	0	0	114.4	A462 G463	A462-S465 CarbonylContact C-O 3.57Å; A462-S465 PolarHBondContact N-O 3.38Å; A462-S465 PolarHBondContact O-N 3.43Å; A462-S465 PolarHBondContact O-OG 3.32Å; G463-S465 VanDerWaalsContact C-N 3.27Å; G463-S465 PolarHBondContact O-N 3.15Å
466	C	66.9	Low	69.5	Low	38 Å²	38	80 Å²	80	26%	0.257	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134.7	-175.9	-36.5	0	0	0	0	111.2	C448 H453	C448-C466 VanDerWaalsContact CA-SG 3.53Å; C448-C466 HydrophobicContact CB-CB 4.19Å; C448-C466 WeakPolarHBondContact CB-SG 3.39Å; C448-C466 WeakPolarHBondContact SG-CB 3.42Å; C448-C466 CovalentContact SG-SG 2.04Å; C448-C466 PolarHBondContact SG-SG 3.39Å; H453-C466 HydrophobicContact CB-CB 3.9Å
467	V	72.4	Confident	69.5	Low	81 Å²	81	81.4 Å²	81.4	49%	0.491	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.2	179.4	-178	0	0	0	0	111	F459 V460 A462	F459-V467 CarbonylContact C-O 3.42Å; F459-V467 WeakPolarHBondContact CA-O 3.45Å; V460-V467 PolarHBondContact N-O 3.04Å; V460-V467 PolarHBondContact O-N 2.93Å; A462-V467 HydrophobicContact CB-CG2 4.07Å
468	C	78.2	Confident	69.1	Low	20 Å²	20	86.4 Å²	86.4	14%	0.135	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	151	-174	-47.5	0	0	0	0	114.3	C455 E458 L476 G480	C455-C468 WeakPolarHBondContact CA-SG 3.03Å; C455-C468 HydrophobicContact CB-CB 3.6Å; C455-C468 WeakPolarHBondContact CB-SG 3.33Å; C455-C468 WeakPolarHBondContact SG-CA 3.43Å; C455-C468 WeakPolarHBondContact SG-CB 3Å; C455-C468 CovalentContact SG-SG 2.03Å; C455-C468 PolarHBondContact SG-SG 3.3Å; E458-C468 CarbonylContact O-C 3.52Å; E458-C468 WeakPolarHBondContact O-CA 3.38Å; C468-L476 HydrophobicContact CB-CD1 4.47Å; C468-G480 VanDerWaalsContact CB-O 3.29Å; C468-G480 WeakPolarHBondContact CB-O 3.43Å; C468-G480 PolarHBondContact SG-O 3.13Å; C468-G480 VanDerWaalsContact SG-O 3.34Å
469	R	75.6	Confident	69	Low	145 Å²	145	88 Å²	88	55%	0.547	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.6	176.3	-162.1	179.8	76.6	165.6	2.5	110.8	E458	E458-R469 CarbonylContact C-O 3.56Å; E458-R469 WeakPolarHBondContact CA-O 3.28Å; E458-R469 HydrophobicContact CB-CB 4.21Å; E458-R469 WeakPolarHBondContact CB-O 3.32Å; E458-R469 PolarHBondContact N-O 2.78Å; E458-R469 PolarHBondContact O-N 3.3Å; E458-R469 VanDerWaalsContact O-O 3.1Å; E458-R469 IonicContact OE2-CZ 3.55Å; E458-R469 VanDerWaalsContact OE2-CZ 3.24Å; E458-R469 IonicContact OE2-NE 3.02Å; E458-R469 PolarHBondContact OE2-NE 3.15Å; E458-R469 IonicContact OE2-NH2 2.81Å; E458-R469 PolarHBondContact OE2-NH2 2.98Å
470	C	76.8	Confident	68.9	Low	21 Å²	21	85.6 Å²	85.6	14%	0.142	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-103.2	153.2	175.6	-55.6	0	0	0	0	112.6	F474 T475 L476 C483	C470-F474 HydrophobicContact CB-CB 4.01Å; C470-T475 VanDerWaalsContact SG-C 3.53Å; C470-L476 WeakPolarHBondContact SG-CA 3.35Å; C470-L476 VanDerWaalsContact SG-CB 3.54Å; C470-L476 WeakPolarHBondContact SG-CD1 3.39Å; C470-L476 PolarHBondContact SG-N 2.96Å; C470-C483 VanDerWaalsContact CA-SG 3.59Å; C470-C483 HydrophobicContact CB-CB 3.98Å; C470-C483 WeakPolarHBondContact CB-SG 3.11Å; C470-C483 WeakPolarHBondContact SG-CB 3.37Å; C470-C483 CovalentContact SG-SG 2.04Å; C470-C483 PolarHBondContact SG-SG 2.99Å
471	R	75.6	Confident	69	Low	148 Å²	148	86.8 Å²	86.8	56%	0.558	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-73.6	160.8	175.9	-62.3	-173.9	179.6	174.8	5.1	111.2	E458 G473 F474	E458-R471 HydrophobicContact CG-CG 3.79Å; R471-G473 PolarHBondContact O-N 3.45Å; R471-F474 PolarHBondContact O-N 3.23Å
472	K	62.2	Low	69.6	Low	214 Å²	214	85.4 Å²	85.4	93%	0.93	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	138.3	171	-87.9	-173.3	173.1	-177.6	0	110.2
473	G	62.8	Low	70.4	Confident	35 Å²	35	83 Å²	83	36%	0.361	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	3.9	-172.7	0	0	0	0	0	114.4	R471 I486	R471-G473 PolarHBondContact O-N 3.45Å; G473-I486 WeakPolarHBondContact O-CB 3.08Å; G473-I486 WeakPolarHBondContact O-CG1 3.25Å; G473-I486 PolarHBondContact O-N 3.35Å
474	F	72.5	Confident	70.6	Confident	64 Å²	64	85.8 Å²	85.8	28%	0.281	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154	178.1	-62.7	-111.2	0	0	0	112.5	C470 R471 C483 K484 K485	C470-F474 HydrophobicContact CB-CB 4.01Å; R471-F474 PolarHBondContact O-N 3.23Å; F474-C483 HydrophobicContact CB-CB 4.35Å; F474-C483 HydrophobicContact CD1-CB 4.43Å; F474-K484 CarbonylContact C-O 3.52Å; F474-K484 WeakPolarHBondContact CA-O 3.12Å; F474-K484 WeakPolarHBondContact CB-O 3.45Å; F474-K485 HydrophobicContact CD1-CB 3.72Å; F474-K485 HydrophobicContact CD1-CG 4.23Å; F474-K485 HydrophobicContact CE1-CB 3.34Å; F474-K485 HydrophobicContact CE1-CD 4.05Å; F474-K485 HydrophobicContact CE1-CG 3.58Å; F474-K485 HydrophobicContact CE2-CG 4.19Å; F474-K485 HydrophobicContact CZ-CB 3.89Å; F474-K485 HydrophobicContact CZ-CD 3.81Å; F474-K485 HydrophobicContact CZ-CG 3.54Å
475	T	66.4	Low	70.6	Confident	86 Å²	86	85.7 Å²	85.7	53%	0.528	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.4	175	56.1	0	0	0	0	112.8	C470 C483 K484	C470-T475 VanDerWaalsContact SG-C 3.53Å; T475-C483 CarbonylContact O-C 3.46Å; T475-C483 VanDerWaalsContact O-CA 3.29Å; T475-C483 WeakPolarHBondContact O-CA 3.5Å; T475-K484 PolarHBondContact N-O 3.25Å; T475-K484 PolarHBondContact O-N 3.06Å
476	L	74.3	Confident	70.6	Confident	79 Å²	79	86.8 Å²	86.8	41%	0.414	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	137.2	-178	-167	74.3	0	0	0	110.7	C468 C470 T482	C468-L476 HydrophobicContact CB-CD1 4.47Å; C470-L476 WeakPolarHBondContact SG-CA 3.35Å; C470-L476 VanDerWaalsContact SG-CB 3.54Å; C470-L476 WeakPolarHBondContact SG-CD1 3.39Å; C470-L476 PolarHBondContact SG-N 2.96Å; L476-T482 WeakPolarHBondContact CD1-O 3.22Å
477	R	72	Confident	70	Confident	128 Å²	128	92.2 Å²	92.2	48%	0.483	46%	0.459	S	S	.	.			trans	-83.8	163.3	178.7	-60	-162	-159.9	174.1	3.5	111.8	D479 G480 T482 C483	R477-D479 PolarHBondContact O-N 2.85Å; R477-G480 PolarHBondContact O-N 3.35Å; R477-G480 VanDerWaalsContact O-N 3.1Å; R477-T482 WeakPolarHBondContact CB-OG1 3.46Å; R477-T482 VanDerWaalsContact CD-OG1 3.25Å; R477-T482 WeakPolarHBondContact CD-OG1 3.3Å; R477-T482 WeakPolarHBondContact CG-O 3.37Å; R477-T482 PolarHBondContact N-O 3.4Å; R477-C483 PolarHBondContact NH2-O 3.34Å
478	P	69	Low	69.3	Low	143 Å²	143	96.1 Å²	96.1	93%	0.929	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-10.4	-179	-23.7	35.3	0	0	0	115.6	G480	P478-G480 PolarHBondContact O-N 3.36Å
479	D	71.3	Confident	68.3	Low	89 Å²	89	98.3 Å²	98.3	48%	0.476	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.3	173.6	66.5	4.4	0	0	0	113.4	R477 K481 T482	R477-D479 PolarHBondContact O-N 2.85Å; D479-K481 PolarHBondContact O-N 3.35Å; D479-K481 PolarHBondContact OD1-N 3.27Å; D479-T482 VanDerWaalsContact CG-OG1 3.27Å; D479-T482 PolarHBondContact OD1-N 3Å; D479-T482 PolarHBondContact OD1-OG1 2.81Å; D479-T482 WeakPolarHBondContact OD2-CB 3.12Å; D479-T482 WeakPolarHBondContact OD2-CG2 3.38Å; D479-T482 PolarHBondContact OD2-OG1 2.7Å
480	G	71.3	Confident	67.3	Low	35 Å²	35	99.2 Å²	99.2	36%	0.361	50%	0.502	S	S	.	.	S	Bend	trans	68.8	11.8	-179.3	0	0	0	0	0	114.2	C468 R477 P478	C468-G480 VanDerWaalsContact CB-O 3.29Å; C468-G480 WeakPolarHBondContact CB-O 3.43Å; C468-G480 PolarHBondContact SG-O 3.13Å; C468-G480 VanDerWaalsContact SG-O 3.34Å; R477-G480 PolarHBondContact O-N 3.35Å; R477-G480 VanDerWaalsContact O-N 3.1Å; P478-G480 PolarHBondContact O-N 3.36Å
481	K	73.6	Confident	66.1	Low	108 Å²	108	106.1 Å²	106.1	47%	0.47	54%	0.537	S	S	.	.	S	Bend	trans	-135.2	-35.9	-170.2	-73.2	-176.3	173.6	-169.2	0	114.7	G454 E456 D479	G454-K481 WeakPolarHBondContact O-CB 3.05Å; G454-K481 WeakPolarHBondContact O-CD 3.31Å; G454-K481 WeakPolarHBondContact O-CG 3.4Å; E456-K481 WeakPolarHBondContact CB-O 3.41Å; E456-K481 PolarHBondContact N-O 3.33Å; D479-K481 PolarHBondContact O-N 3.35Å; D479-K481 PolarHBondContact OD1-N 3.27Å
482	T	76.6	Confident	65	Low	37 Å²	37	101.9 Å²	101.9	23%	0.227	54%	0.539	C	S	.	.			trans	-104.2	156.5	-174.5	60.4	0	0	0	0	113.7	E456 L476 R477 D479	E456-T482 WeakPolarHBondContact OE2-CA 3.03Å; E456-T482 WeakPolarHBondContact OE2-CB 3.4Å; L476-T482 WeakPolarHBondContact CD1-O 3.22Å; R477-T482 WeakPolarHBondContact CB-OG1 3.46Å; R477-T482 VanDerWaalsContact CD-OG1 3.25Å; R477-T482 WeakPolarHBondContact CD-OG1 3.3Å; R477-T482 WeakPolarHBondContact CG-O 3.37Å; R477-T482 PolarHBondContact N-O 3.4Å; D479-T482 VanDerWaalsContact CG-OG1 3.27Å; D479-T482 PolarHBondContact OD1-N 3Å; D479-T482 PolarHBondContact OD1-OG1 2.81Å; D479-T482 WeakPolarHBondContact OD2-CB 3.12Å; D479-T482 WeakPolarHBondContact OD2-CG2 3.38Å; D479-T482 PolarHBondContact OD2-OG1 2.7Å
483	C	77.1	Confident	64.7	Low	3 Å²	3	96.1 Å²	96.1	2%	0.02	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	161.1	-174.3	-65.4	0	0	0	0	111.6	E456 Q457 C470 F474 T475 R477	E456-C483 VanDerWaalsContact CD-N 3.31Å; E456-C483 PolarHBondContact OE2-N 3.1Å; Q457-C483 VanDerWaalsContact CD-CB 3.42Å; Q457-C483 HydrophobicContact CG-CB 3.84Å; Q457-C483 VanDerWaalsContact CG-SG 3.53Å; C470-C483 VanDerWaalsContact CA-SG 3.59Å; C470-C483 HydrophobicContact CB-CB 3.98Å; C470-C483 WeakPolarHBondContact CB-SG 3.11Å; C470-C483 WeakPolarHBondContact SG-CB 3.37Å; C470-C483 CovalentContact SG-SG 2.04Å; C470-C483 PolarHBondContact SG-SG 2.99Å; F474-C483 HydrophobicContact CB-CB 4.35Å; F474-C483 HydrophobicContact CD1-CB 4.43Å; T475-C483 CarbonylContact O-C 3.46Å; T475-C483 VanDerWaalsContact O-CA 3.29Å; T475-C483 WeakPolarHBondContact O-CA 3.5Å; R477-C483 PolarHBondContact NH2-O 3.34Å
484	K	70.4	Confident	64.5	Low	132 Å²	132	99.6 Å²	99.6	57%	0.574	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.4	179	-172.1	-174.7	175.7	-175.1	0	111.6	F474 T475	F474-K484 CarbonylContact C-O 3.52Å; F474-K484 WeakPolarHBondContact CA-O 3.12Å; F474-K484 WeakPolarHBondContact CB-O 3.45Å; T475-K484 PolarHBondContact N-O 3.25Å; T475-K484 PolarHBondContact O-N 3.06Å
485	K	59.7	Low	63.9	Low	125 Å²	125	98.6 Å²	98.6	54%	0.543	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	154.4	-175.4	-166.7	171.9	178	-161.8	0	114.2	F474	F474-K485 HydrophobicContact CD1-CB 3.72Å; F474-K485 HydrophobicContact CD1-CG 4.23Å; F474-K485 HydrophobicContact CE1-CB 3.34Å; F474-K485 HydrophobicContact CE1-CD 4.05Å; F474-K485 HydrophobicContact CE1-CG 3.58Å; F474-K485 HydrophobicContact CE2-CG 4.19Å; F474-K485 HydrophobicContact CZ-CB 3.89Å; F474-K485 HydrophobicContact CZ-CD 3.81Å; F474-K485 HydrophobicContact CZ-CG 3.54Å
486	I	58.2	Low	63.7	Low	91 Å²	91	95 Å²	95	47%	0.467	52%	0.515	S	S	.	.			trans	-110.5	137.4	166.7	-58.5	170.1	0	0	0	108.8	G473	G473-I486 WeakPolarHBondContact O-CB 3.08Å; G473-I486 WeakPolarHBondContact O-CG1 3.25Å; G473-I486 PolarHBondContact O-N 3.35Å
487	E	54.7	Low	63.2	Low	152 Å²	152	96.7 Å²	96.7	71%	0.71	52%	0.521	S	S	*	.			trans	-118.1	155.2	-174.9	-58.7	-154.1	139.8	0	0	113.5
488	H	57.7	Low	63.1	Low	164 Å²	164	93 Å²	93	76%	0.759	51%	0.509	S	S	*	.			trans	-138.2	-7.2	-160.7	-75	-63.7	0	0	0	118.7
489	C	57.4	Low	63	Low	66 Å²	66	89.5 Å²	89.5	45%	0.446	48%	0.481	S	S	.	.			trans	-134	121.8	179	-56.9	0	0	0	0	111.5
490	L	53.8	Low	63	Low	163 Å²	163	90.2 Å²	90.2	85%	0.853	48%	0.48	S	S	*	.			trans	-136.7	140.8	175.8	-71.8	168.8	0	0	0	109.4
491	D	51.4	Low	62.6	Low	166 Å²	166	92.8 Å²	92.8	89%	0.888	48%	0.484	S	S	*	.	S	Bend	trans	58.6	112.4	168.8	-59	-26.6	0	0	0	120.5
492	G	53	Low	61.8	Low	59 Å²	59	92.4 Å²	92.4	61%	0.608	49%	0.487	S	S	*	.	S	Bend	trans	115.8	130.4	158.6	0	0	0	0	0	115.4	D494	G492-D494 PolarHBondContact O-N 3.47Å
493	N	55.7	Low	60.9	Low	94 Å²	94	93.9 Å²	93.9	50%	0.503	50%	0.497	S	S	.	.			trans	-70.2	111.4	178.6	-178.9	14.9	0	0	0	110.8	G495 C496 F500	N493-G495 PolarHBondContact O-N 3.41Å; N493-C496 PolarHBondContact ND2-O 3.02Å; N493-F500 HydrophobicContact CB-CE1 4.13Å; N493-F500 WeakPolarHBondContact OD1-CD1 3.17Å
494	D	57.7	Low	59.8	Low	107 Å²	107	103 Å²	103	57%	0.572	54%	0.539	S	S	*	.			trans	-67.9	38.4	-174.9	-88.2	-44.9	0	0	0	115.6	G492 K522	G492-D494 PolarHBondContact O-N 3.47Å; D494-K522 PolarHBondContact O-NZ 3.27Å
495	G	60.8	Low	59	Low	44 Å²	44	104.5 Å²	104.5	45%	0.454	55%	0.553	S	S	.	*	S	Bend	trans	71.5	31.3	175.8	0	0	0	0	0	114.1	N493 K522	N493-G495 PolarHBondContact O-N 3.41Å; G495-K522 VanDerWaalsContact O-CD 3.32Å; G495-K522 WeakPolarHBondContact O-CD 3.49Å
496	C	62.8	Low	58.6	Low	9 Å²	9	101.9 Å²	101.9	6%	0.061	55%	0.55	C	S	.	*			trans	-87.5	131.3	168.9	-58.2	0	0	0	0	109.9	N493 Q498 F500 C509	N493-C496 PolarHBondContact ND2-O 3.02Å; C496-Q498 VanDerWaalsContact C-N 3.29Å; C496-Q498 PolarHBondContact O-N 2.86Å; C496-F500 HydrophobicContact CB-CB 4.31Å; C496-C509 WeakPolarHBondContact CA-SG 3.25Å; C496-C509 HydrophobicContact CB-CB 3.6Å; C496-C509 WeakPolarHBondContact CB-SG 3.46Å; C496-C509 WeakPolarHBondContact SG-CA 3.26Å; C496-C509 WeakPolarHBondContact SG-CB 3.43Å; C496-C509 CovalentContact SG-SG 2.03Å; C496-C509 PolarHBondContact SG-SG 3.16Å
497	E	63.6	Low	58.7	Low	115 Å²	115	99.2 Å²	99.2	54%	0.537	54%	0.54	S	S	.	.	S	Bend	trans	-62.8	-33.7	-177.6	-175.4	-178	-170.8	0	0	112.9	K522 T523 C524	E497-K522 WeakPolarHBondContact CB-O 2.92Å; E497-K522 PolarHBondContact N-O 3.08Å; E497-K522 VanDerWaalsContact N-O 3.09Å; E497-T523 WeakPolarHBondContact OE2-CA 3.4Å; E497-T523 VanDerWaalsContact OE2-CB 3.23Å; E497-T523 WeakPolarHBondContact OE2-CB 3.36Å; E497-C524 PolarHBondContact OE2-N 3.3Å
498	Q	69.1	Low	59.2	Low	50 Å²	50	96 Å²	96	23%	0.234	53%	0.53	C	S	.	.	S	Bend	trans	-123.9	-71.4	-173	-61	-172.7	-4.6	0	0	112.9	C496	C496-Q498 VanDerWaalsContact C-N 3.29Å; C496-Q498 PolarHBondContact O-N 2.86Å
499	E	68.1	Low	59.8	Low	71 Å²	71	89.2 Å²	89.2	33%	0.332	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.6	-176	-64.7	-178.7	172.6	0	0	111.7	C509 K510 R512	E499-C509 CarbonylContact O-C 3.41Å; E499-C509 WeakPolarHBondContact O-CA 3.46Å; E499-K510 PolarHBondContact N-O 2.83Å; E499-K510 VanDerWaalsContact N-O 3.15Å; E499-K510 PolarHBondContact O-N 3.16Å; E499-R512 IonicContact OE1-CZ 3.8Å; E499-R512 IonicContact OE1-NE 2.61Å; E499-R512 PolarHBondContact OE1-NE 3.33Å; E499-R512 IonicContact OE1-NH2 3.32Å; E499-R512 PolarHBondContact OE1-NH2 3.39Å
500	F	69.8	Low	60.5	Low	103 Å²	103	91.6 Å²	91.6	45%	0.452	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.8	175.1	65.3	-90.9	0	0	0	110.8	N493 C496 V508	N493-F500 HydrophobicContact CB-CE1 4.13Å; N493-F500 WeakPolarHBondContact OD1-CD1 3.17Å; C496-F500 HydrophobicContact CB-CB 4.31Å; F500-V508 CarbonylContact C-O 3.55Å; F500-V508 WeakPolarHBondContact CA-O 3.31Å
501	I	63.3	Low	61.3	Low	89 Å²	89	84.7 Å²	84.7	46%	0.456	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.3	-178.2	-53.1	178.2	0	0	0	108.5	V508 K510	I501-V508 PolarHBondContact N-O 3.31Å; I501-V508 PolarHBondContact O-N 3.49Å; I501-K510 HydrophobicContact CD1-CB 4.4Å; I501-K510 HydrophobicContact CD1-CD 3.88Å
502	N	56	Low	62.3	Low	100 Å²	100	83.8 Å²	83.8	54%	0.535	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.5	176.1	-161.8	-4.4	0	0	0	109.6
503	T	58.1	Low	62.8	Low	69 Å²	69	90.2 Å²	90.2	42%	0.423	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	166.9	178.5	73.9	0	0	0	0	109.9	N505 S506 V508	T503-N505 PolarHBondContact O-N 3.36Å; T503-S506 WeakPolarHBondContact CA-O 3.06Å; T503-S506 WeakPolarHBondContact CB-O 2.96Å; T503-S506 PolarHBondContact N-O 3.35Å; T503-S506 PolarHBondContact O-N 2.91Å; T503-S506 PolarHBondContact OG1-O 2.98Å; T503-V508 HydrophobicContact CG2-CG2 4.48Å
504	E	54.8	Low	63	Low	195 Å²	195	88 Å²	88	91%	0.911	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-18.4	-166.1	-66.5	-171.5	132.7	0	0	116.2
505	N	52.8	Low	63.4	Low	162 Å²	162	88.3 Å²	88.3	87%	0.866	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.1	11.2	172.1	-63.9	-74.7	0	0	0	114.9	T503	T503-N505 PolarHBondContact O-N 3.36Å
506	S	51.2	Low	63.6	Low	70 Å²	70	89.6 Å²	89.6	49%	0.49	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	160.9	-173.3	-166.5	0	0	0	0	114.2	T503	T503-S506 WeakPolarHBondContact CA-O 3.06Å; T503-S506 WeakPolarHBondContact CB-O 2.96Å; T503-S506 PolarHBondContact N-O 3.35Å; T503-S506 PolarHBondContact O-N 2.91Å; T503-S506 PolarHBondContact OG1-O 2.98Å
507	C	60.8	Low	63.9	Low	36 Å²	36	92.8 Å²	92.8	24%	0.243	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141.4	172.9	-66.7	0	0	0	0	112.2
508	V	66.1	Low	64.2	Low	83 Å²	83	93.3 Å²	93.3	50%	0.503	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	143.7	-178.9	-174.9	0	0	0	0	112.4	F500 I501 T503	F500-V508 CarbonylContact C-O 3.55Å; F500-V508 WeakPolarHBondContact CA-O 3.31Å; I501-V508 PolarHBondContact N-O 3.31Å; I501-V508 PolarHBondContact O-N 3.49Å; T503-V508 HydrophobicContact CG2-CG2 4.48Å
509	C	70.5	Confident	64.3	Low	23 Å²	23	101.6 Å²	101.6	16%	0.155	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	151	-176.7	-52.4	0	0	0	0	114.9	C496 E499	C496-C509 WeakPolarHBondContact CA-SG 3.25Å; C496-C509 HydrophobicContact CB-CB 3.6Å; C496-C509 WeakPolarHBondContact CB-SG 3.46Å; C496-C509 WeakPolarHBondContact SG-CA 3.26Å; C496-C509 WeakPolarHBondContact SG-CB 3.43Å; C496-C509 CovalentContact SG-SG 2.03Å; C496-C509 PolarHBondContact SG-SG 3.16Å; E499-C509 CarbonylContact O-C 3.41Å; E499-C509 WeakPolarHBondContact O-CA 3.46Å
510	K	71.4	Confident	64.1	Low	116 Å²	116	102.6 Å²	102.6	50%	0.504	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.3	176.3	-174.3	-176.7	171.7	-163.6	0	112.1	E499 I501	E499-K510 PolarHBondContact N-O 2.83Å; E499-K510 VanDerWaalsContact N-O 3.15Å; E499-K510 PolarHBondContact O-N 3.16Å; I501-K510 HydrophobicContact CD1-CB 4.4Å; I501-K510 HydrophobicContact CD1-CD 3.88Å
511	C	69.4	Low	64	Low	18 Å²	18	99.4 Å²	99.4	12%	0.122	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-94.4	151.6	171	-58.3	0	0	0	0	112.8	L517 C524	C511-L517 WeakPolarHBondContact SG-CA 3.25Å; C511-L517 WeakPolarHBondContact SG-CD1 3.23Å; C511-C524 VanDerWaalsContact CA-SG 3.58Å; C511-C524 HydrophobicContact CB-CB 3.87Å; C511-C524 WeakPolarHBondContact CB-SG 3.47Å; C511-C524 WeakPolarHBondContact SG-CB 3.44Å; C511-C524 CovalentContact SG-SG 2.03Å; C511-C524 PolarHBondContact SG-SG 3.39Å
512	R	72.6	Confident	64.4	Low	147 Å²	147	100 Å²	100	56%	0.555	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-76.9	160.3	170.1	-65.7	179.5	171.5	159.7	5.9	111.5	E499 Y515	E499-R512 IonicContact OE1-CZ 3.8Å; E499-R512 IonicContact OE1-NE 2.61Å; E499-R512 PolarHBondContact OE1-NE 3.33Å; E499-R512 IonicContact OE1-NH2 3.32Å; E499-R512 PolarHBondContact OE1-NH2 3.39Å; R512-Y515 PolarHBondContact O-N 2.86Å
513	E	64.8	Low	65.1	Low	193 Å²	193	97 Å²	97	90%	0.902	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	151.1	-175.5	-67.1	-172.8	136.9	0	0	113.3	Y515	E513-Y515 PolarHBondContact O-N 2.87Å
514	G	59.5	Low	65.9	Low	48 Å²	48	94.3 Å²	94.3	50%	0.495	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	-11.9	-169.4	0	0	0	0	0	114.2	T526 V527	G514-T526 VanDerWaalsContact O-CA 3.29Å; G514-T526 WeakPolarHBondContact O-CA 3.5Å; G514-V527 PolarHBondContact O-N 3.48Å
515	Y	65.6	Low	66.4	Low	114 Å²	114	89.4 Å²	89.4	45%	0.447	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	152.9	178.7	-60.3	-113.2	0	0	0	112.5	R512 E513 C524 Q525 T526	R512-Y515 PolarHBondContact O-N 2.86Å; E513-Y515 PolarHBondContact O-N 2.87Å; Y515-C524 HydrophobicContact CD1-CB 4.26Å; Y515-C524 HydrophobicContact CG-CB 4.47Å; Y515-Q525 CarbonylContact C-O 3.46Å; Y515-Q525 WeakPolarHBondContact CA-O 3.33Å; Y515-T526 HydrophobicContact CD1-CG2 3.64Å; Y515-T526 HydrophobicContact CD2-CG2 4.25Å; Y515-T526 HydrophobicContact CE1-CG2 3.26Å; Y515-T526 HydrophobicContact CE2-CG2 3.9Å; Y515-T526 HydrophobicContact CG-CG2 4.11Å
516	T	65.9	Low	66.5	Low	70 Å²	70	85.9 Å²	85.9	43%	0.429	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	177.8	52.7	0	0	0	0	110.9	C524 Q525	T516-C524 CarbonylContact O-C 3.48Å; T516-C524 WeakPolarHBondContact O-CA 3.45Å; T516-Q525 PolarHBondContact N-O 2.79Å; T516-Q525 PolarHBondContact O-N 2.89Å; T516-Q525 WeakPolarHBondContact OG1-CG 3.44Å; T516-Q525 PolarHBondContact OG1-O 3.16Å
517	L	69.4	Low	66.5	Low	76 Å²	76	87.6 Å²	87.6	40%	0.398	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	131.5	-177.7	-166.6	74.4	0	0	0	110.6	C511 T523	C511-L517 WeakPolarHBondContact SG-CA 3.25Å; C511-L517 WeakPolarHBondContact SG-CD1 3.23Å; L517-T523 CarbonylContact C-O 3.58Å; L517-T523 WeakPolarHBondContact CA-O 3.28Å
518	R	69.5	Low	65.5	Low	126 Å²	126	92.1 Å²	92.1	48%	0.475	48%	0.476	S	S	.	.			trans	-74.8	165.8	176.2	-73.7	179.6	163.6	171.7	4.2	111.1	D520 G521 T523 Q525	R518-D520 PolarHBondContact O-N 2.62Å; R518-G521 PolarHBondContact O-N 3.44Å; R518-T523 WeakPolarHBondContact CB-O 3.38Å; R518-T523 VanDerWaalsContact CD-OG1 3.31Å; R518-T523 WeakPolarHBondContact CD-OG1 3.41Å; R518-T523 PolarHBondContact N-O 3.03Å; R518-Q525 HydrophobicContact CG-CB 4.41Å; R518-Q525 HydrophobicContact CG-CG 4.34Å
519	K	70.7	Confident	64.1	Low	225 Å²	225	95.7 Å²	95.7	98%	0.978	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9.1	-178.8	-70.3	-173.4	176	-178	0	114.8	G521	K519-G521 VanDerWaalsContact C-N 3.26Å
520	D	65	Low	62.3	Low	92 Å²	92	101.8 Å²	101.8	49%	0.492	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-9	172.6	63.1	12.1	0	0	0	113.3	R518 K522 T523	R518-D520 PolarHBondContact O-N 2.62Å; D520-K522 PolarHBondContact O-N 2.78Å; D520-K522 PolarHBondContact OD1-N 2.85Å; D520-T523 PolarHBondContact OD1-N 3.45Å; D520-T523 PolarHBondContact OD1-OG1 2.62Å; D520-T523 PolarHBondContact OD2-OG1 3.27Å
521	G	66.1	Low	60.3	Low	36 Å²	36	101.1 Å²	101.1	37%	0.371	52%	0.522	S	S	.	.	S	Bend	trans	70.6	8.5	-179.8	0	0	0	0	0	114.5	R518 K519	R518-G521 PolarHBondContact O-N 3.44Å; K519-G521 VanDerWaalsContact C-N 3.26Å
522	K	72.1	Confident	58.3	Low	100 Å²	100	107.7 Å²	107.7	44%	0.435	56%	0.555	S	S	.	*	S	Bend	trans	-133.1	-24.7	-172.4	-70.2	-175	170.6	-129.4	0	114.8	D494 G495 E497 D520	D494-K522 PolarHBondContact O-NZ 3.27Å; G495-K522 VanDerWaalsContact O-CD 3.32Å; G495-K522 WeakPolarHBondContact O-CD 3.49Å; E497-K522 WeakPolarHBondContact CB-O 2.92Å; E497-K522 PolarHBondContact N-O 3.08Å; E497-K522 VanDerWaalsContact N-O 3.09Å; D520-K522 PolarHBondContact O-N 2.78Å; D520-K522 PolarHBondContact OD1-N 2.85Å
523	T	71	Confident	56.2	Low	38 Å²	38	104.9 Å²	104.9	23%	0.233	56%	0.558	C	S	.	*			trans	-119	161.4	-176.5	68.1	0	0	0	0	115.1	E497 L517 R518 D520	E497-T523 WeakPolarHBondContact OE2-CA 3.4Å; E497-T523 VanDerWaalsContact OE2-CB 3.23Å; E497-T523 WeakPolarHBondContact OE2-CB 3.36Å; L517-T523 CarbonylContact C-O 3.58Å; L517-T523 WeakPolarHBondContact CA-O 3.28Å; R518-T523 WeakPolarHBondContact CB-O 3.38Å; R518-T523 VanDerWaalsContact CD-OG1 3.31Å; R518-T523 WeakPolarHBondContact CD-OG1 3.41Å; R518-T523 PolarHBondContact N-O 3.03Å; D520-T523 PolarHBondContact OD1-N 3.45Å; D520-T523 PolarHBondContact OD1-OG1 2.62Å; D520-T523 PolarHBondContact OD2-OG1 3.27Å
524	C	75.3	Confident	54.5	Low	12 Å²	12	104.3 Å²	104.3	8%	0.081	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.6	146.3	-165.1	-58.3	0	0	0	0	114.5	E497 C511 Y515 T516	E497-C524 PolarHBondContact OE2-N 3.3Å; C511-C524 VanDerWaalsContact CA-SG 3.58Å; C511-C524 HydrophobicContact CB-CB 3.87Å; C511-C524 WeakPolarHBondContact CB-SG 3.47Å; C511-C524 WeakPolarHBondContact SG-CB 3.44Å; C511-C524 CovalentContact SG-SG 2.03Å; C511-C524 PolarHBondContact SG-SG 3.39Å; Y515-C524 HydrophobicContact CD1-CB 4.26Å; Y515-C524 HydrophobicContact CG-CB 4.47Å; T516-C524 CarbonylContact O-C 3.48Å; T516-C524 WeakPolarHBondContact O-CA 3.45Å
525	Q	65	Low	52.9	Low	93 Å²	93	105.2 Å²	105.2	44%	0.435	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.2	145	-179.6	73.3	179.1	15.8	0	0	115.8	Y515 T516 R518	Y515-Q525 CarbonylContact C-O 3.46Å; Y515-Q525 WeakPolarHBondContact CA-O 3.33Å; T516-Q525 PolarHBondContact N-O 2.79Å; T516-Q525 PolarHBondContact O-N 2.89Å; T516-Q525 WeakPolarHBondContact OG1-CG 3.44Å; T516-Q525 PolarHBondContact OG1-O 3.16Å; R518-Q525 HydrophobicContact CG-CB 4.41Å; R518-Q525 HydrophobicContact CG-CG 4.34Å
526	T	53.9	Low	51	Low	88 Å²	88	106.1 Å²	106.1	54%	0.54	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	153.8	-168.7	43.9	0	0	0	0	117.4	G514 Y515	G514-T526 VanDerWaalsContact O-CA 3.29Å; G514-T526 WeakPolarHBondContact O-CA 3.5Å; Y515-T526 HydrophobicContact CD1-CG2 3.64Å; Y515-T526 HydrophobicContact CD2-CG2 4.25Å; Y515-T526 HydrophobicContact CE1-CG2 3.26Å; Y515-T526 HydrophobicContact CE2-CG2 3.9Å; Y515-T526 HydrophobicContact CG-CG2 4.11Å
527	V	52.4	Low	49	Very low	105 Å²	105	108.1 Å²	108.1	64%	0.636	60%	0.599	S	S	*	*			trans	-139.9	139.6	161.4	-172.8	0	0	0	0	109.1	G514	G514-V527 PolarHBondContact O-N 3.48Å
528	V	40	Very low	46.8	Very low	132 Å²	132	111 Å²	111	80%	0.8	61%	0.613	S	S	*	*			trans	-105.8	149.5	-169.6	178.2	0	0	0	0	113
529	E	36.1	Very low	44.6	Very low	158 Å²	158	115.3 Å²	115.3	74%	0.738	63%	0.631	S	S	*	*			trans	-80.9	-164.5	-168.7	-43.1	170.2	100.5	0	0	114
530	I	32	Very low	42.4	Very low	150 Å²	150	109.8 Å²	109.8	77%	0.769	62%	0.621	S	S	*	*				-152.2	155.5	55.4	-74.5	173.7	0	0	0	112.9
531	T	30.8	Very low	40.4	Very low	103 Å²	103	114.9 Å²	114.9	63%	0.632	64%	0.639	S	S	*	*			trans	-110.7	-168.3	-164.7	30.2	0	0	0	0	114.6
532	L	27.1	Very low	38.4	Very low	156 Å²	156	117.1 Å²	117.1	82%	0.817	65%	0.654	S	S	*	*			trans	101.2	146.7	160.6	-57.3	165.3	0	0	0	117
533	S	29.2	Very low	36.2	Very low	88 Å²	88	120.6 Å²	120.6	62%	0.615	67%	0.671	S	S	*	*			cis	-174.7	143.3	-31.3	51.7	0	0	0	0	110.2
534	L	28.4	Very low	34	Very low	180 Å²	180	123.6 Å²	123.6	94%	0.942	69%	0.693	S	S	*	*			trans	41	134.2	148.7	-69	160.3	0	0	0	122.3
535	G	25.9	Very low	31.5	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	73%	0.727	S	S	*	*			trans	125.8	94.6	131.1	0	0	0	0	0	121.3
536	V	25.5	Very low	29.6	Very low	134 Å²	134	134.2 Å²	134.2	81%	0.812	74%	0.742	S	S	*	*			trans	28.5	140.6	138.5	-136	0	0	0	0	124.1
537	T	23.3	Very low	28.1	Very low	112 Å²	112	138.3 Å²	138.3	69%	0.687	75%	0.753	S	S	*	*			trans	82.5	107.9	141.4	33.4	0	0	0	0	124.8
538	I	24	Very low	26.9	Very low	136 Å²	136	142.1 Å²	142.1	70%	0.697	76%	0.764	S	S	*	*				84.1	130.3	117.7	-69.6	-177.7	0	0	0	124.1
539	Y	22.4	Very low	26.2	Very low	216 Å²	216	145.4 Å²	145.4	85%	0.847	77%	0.767	S	S	*	*			trans	70.7	114.4	154.4	-76.2	-42.6	0	0	0	125.9
540	S	24.1	Very low	25.8	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	77%	0.773	S	S	*	*				109	137.7	116.7	76.5	0	0	0	0	123
541	K	24.4	Very low	25.5	Very low	200 Å²	200	150.4 Å²	150.4	87%	0.87	78%	0.779	S	S	*	*			trans	61.7	122.6	152.7	-98.5	-176	174.4	-177.9	0	122.8
542	A	24	Very low	25.3	Very low	83 Å²	83	152.2 Å²	152.2	69%	0.686	79%	0.785	S	S	*	*				48.5	143.5	125.7	0	0	0	0	0	120.3
543	E	25.9	Very low	25.3	Very low	172 Å²	172	151.7 Å²	151.7	80%	0.804	78%	0.781	S	S	*	*			cis	-167.7	156.1	16	-139	175.4	-128.8	0	0	111.1
544	C	23.5	Very low	25.1	Very low	102 Å²	102	158.9 Å²	158.9	69%	0.689	80%	0.795	S	S	*	*			trans	58.9	150.4	154.8	-74.5	0	0	0	0	120.4
545	K	24.3	Very low	25.1	Very low	181 Å²	181	159.3 Å²	159.3	79%	0.787	79%	0.792	S	S	*	*			cis	-164.9	170.9	-4.6	-129.6	173.7	-176.8	171.5	0	110.5
546	L	23.6	Very low	24.9	Very low	146 Å²	146	161.5 Å²	161.5	76%	0.764	80%	0.795	S	S	*	*			trans	85.8	110.4	160.4	-72.8	136.5	0	0	0	120.7
547	F	24.2	Very low	24.9	Very low	175 Å²	175	165.1 Å²	165.1	77%	0.768	80%	0.796	S	S	*	*			trans	56.6	99.4	133.7	-87.4	-112.3	0	0	0	121.1
548	E	25.5	Very low	25	Very low	185 Å²	185	170.4 Å²	170.4	86%	0.864	80%	0.803	S	S	*	*				-149.9	143	108.6	-106	175.5	-180	0	0	108.2
549	K	25.2	Very low	25.2	Very low	201 Å²	201	173 Å²	173	87%	0.874	81%	0.809	S	S	*	*			trans	-96.9	114.8	-169.8	-87.3	-174.1	175.2	179.5	0	112.3
550	H	29	Very low	25.9	Very low	185 Å²	185	167.9 Å²	167.9	86%	0.856	80%	0.803	S	S	*	*			trans	-69.7	156.3	-168.5	-91.8	-93.5	0	0	0	117.4
551	Y	25.9	Very low	26	Very low	227 Å²	227	170.6 Å²	170.6	89%	0.89	81%	0.808	S	S	*	*			trans	-101.3	166.7	159.4	-122.8	-98.4	0	0	0	111
552	D	26.6	Very low	26	Very low	141 Å²	141	165.3 Å²	165.3	75%	0.754	80%	0.801	S	S	*	*			trans	99.7	162	156.9	-141	2.9	0	0	0	120.4
553	I	27.4	Very low	26	Very low	145 Å²	145	167.3 Å²	167.3	74%	0.744	80%	0.804	S	S	*	*			trans	-113.3	132.7	-139.4	-60.1	157.1	0	0	0	113.6
554	R	24.8	Very low	26	Very low	240 Å²	240	167 Å²	167	91%	0.906	80%	0.803	S	S	*	*				169.7	164.9	129.7	-92.1	179	-160.1	-156.6	5.9	113.2
555	H	27.6	Very low	26.1	Very low	188 Å²	188	168.2 Å²	168.2	87%	0.87	81%	0.807	S	S	*	*			trans	-65.6	138	-173	-77.9	28.5	0	0	0	116
556	C	21.7	Very low	26.1	Very low	113 Å²	113	165.2 Å²	165.2	76%	0.764	80%	0.804	S	S	*	*				173.1	139	125.9	-99.1	0	0	0	0	114.7
557	Y	25.6	Very low	26.1	Very low	211 Å²	211	169.5 Å²	169.5	83%	0.827	81%	0.811	S	S	*	*			trans	38	131.7	148.1	-74.9	-79.7	0	0	0	122.3
558	R	24.9	Very low	26.1	Very low	222 Å²	222	165.2 Å²	165.2	84%	0.838	80%	0.803	S	S	*	*				179.6	147.8	71	-107.8	154	178.9	-166.3	0.2	108
559	K	28.2	Very low	26	Very low	190 Å²	190	164.3 Å²	164.3	83%	0.826	80%	0.803	S	S	*	*				55.1	157.6	76.2	-83.7	-169.1	179.6	-173.2	0	115.4
560	P	38.4	Very low	26.5	Very low	110 Å²	110	159.3 Å²	159.3	71%	0.714	79%	0.792	S	S	*	*			cis	-139.2	-175.6	-2.5	42.4	-24.4	0	0	0	116.3
561	L	24.9	Very low	26.3	Very low	166 Å²	166	159.8 Å²	159.8	87%	0.869	79%	0.791	S	S	*	*			trans	-175.1	116.1	133	-103.6	155.1	0	0	0	113.6
562	A	25.4	Very low	26.3	Very low	88 Å²	88	153.1 Å²	153.1	73%	0.727	78%	0.784	S	S	*	*			trans	49.9	146.8	141.2	0	0	0	0	0	122.4
563	V	24.4	Very low	26.2	Very low	125 Å²	125	153 Å²	153	76%	0.758	79%	0.792	S	S	*	*			cis	-141.7	156.2	28.3	170.5	0	0	0	0	114.2
564	Q	25.2	Very low	26.1	Very low	166 Å²	166	149.1 Å²	149.1	78%	0.776	79%	0.787	S	S	*	*			trans	-19.5	146	168.6	-70.6	155.4	-72.1	0	0	121.2
565	V	24.4	Very low	26.2	Very low	127 Å²	127	145.2 Å²	145.2	77%	0.77	78%	0.783	S	S	*	*				70.2	106.7	63	178.5	0	0	0	0	115.8
566	V	25.2	Very low	26.2	Very low	119 Å²	119	144 Å²	144	72%	0.721	78%	0.782	S	S	*	*			trans	47.7	125.5	143.7	-176.5	0	0	0	0	121.6
567	Y	23.9	Very low	26.4	Very low	236 Å²	236	142.3 Å²	142.3	93%	0.925	78%	0.776	S	S	*	*			trans	-140.6	156.7	135.9	-104.4	-82.5	0	0	0	110.8
568	S	24.4	Very low	26.5	Very low	85 Å²	85	137.8 Å²	137.8	59%	0.594	78%	0.776	S	S	*	*			trans	-121	145.2	-174.3	53.9	0	0	0	0	112.6
569	L	23.3	Very low	26.6	Very low	165 Å²	165	132.3 Å²	132.3	86%	0.864	77%	0.771	S	S	*	*			trans	69.1	161.6	156.9	-70.7	164.3	0	0	0	117.5
570	P	35.8	Very low	26.4	Very low	97 Å²	97	129.4 Å²	129.4	63%	0.63	77%	0.769	S	S	*	*			cis	-140.8	-171.4	-17.6	37.9	-17.5	0	0	0	116.3
571	F	24.1	Very low	25.8	Very low	194 Å²	194	129.9 Å²	129.9	85%	0.851	77%	0.77	S	S	*	*			trans	59.6	109.6	148.3	-79.1	-67.8	0	0	0	124.1
572	A	26.8	Very low	25.8	Very low	88 Å²	88	127 Å²	127	73%	0.727	76%	0.759	S	S	*	*				68.1	160.3	120.5	0	0	0	0	0	124.5
573	C	24.1	Very low	25.8	Very low	139 Å²	139	131.3 Å²	131.3	94%	0.939	76%	0.762	S	S	*	*			trans	67.2	149.2	-179	-76.3	0	0	0	0	117.2
574	G	25.3	Very low	25.8	Very low	62 Å²	62	130.1 Å²	130.1	64%	0.639	77%	0.765	S	S	*	*			cis	154.7	111.5	-7.3	0	0	0	0	0	114.3
575	I	26.7	Very low	25.9	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	77%	0.766	S	S	*	*			trans	61.9	144.6	153.5	-14.5	-177.4	0	0	0	120.6
576	L	26.7	Very low	26	Very low	162 Å²	162	130.5 Å²	130.5	85%	0.848	77%	0.767	S	S	*	*			trans	74.8	142.5	161.1	-54.3	-179.7	0	0	0	118
577	A	26.7	Very low	26	Very low	77 Å²	77	128.5 Å²	128.5	64%	0.636	77%	0.771	S	S	*	*			cis	160	160.7	-24	0	0	0	0	0	106.5
578	S	27.4	Very low	26.1	Very low	117 Å²	117	127.4 Å²	127.4	82%	0.818	77%	0.771	S	S	*	*			trans	84.5	132.8	174.2	-41	0	0	0	0	115.6
579	S	26.3	Very low	26.2	Very low	107 Å²	107	132.6 Å²	132.6	75%	0.748	78%	0.783	S	S	*	*			cis	-164.4	171	-8.1	-97.3	0	0	0	0	111
580	V	25.6	Very low	26.7	Very low	129 Å²	129	130.8 Å²	130.8	78%	0.782	78%	0.781	S	S	*	*			trans	93.7	90.9	158.1	-164.6	0	0	0	0	119
581	V	25.4	Very low	26.3	Very low	120 Å²	120	129.7 Å²	129.7	73%	0.727	79%	0.788	S	S	*	*			trans	66.7	100	131	-177	0	0	0	0	120.6
582	T	25.3	Very low	26.6	Very low	104 Å²	104	126.1 Å²	126.1	64%	0.638	79%	0.787	S	S	*	*				22.6	144	117	12	0	0	0	0	119.9
583	F	24.8	Very low	27.6	Very low	179 Å²	179	128.1 Å²	128.1	79%	0.785	79%	0.793	S	S	*	*			cis	-143	137.3	23	-98.8	-89.3	0	0	0	112.2
584	A	25.3	Very low	28	Very low	101 Å²	101	125.5 Å²	125.5	84%	0.835	79%	0.789	S	S	*	*			trans	-154.1	111.1	154.1	0	0	0	0	0	109.4
585	Q	25.9	Very low	28.2	Very low	171 Å²	171	126.1 Å²	126.1	80%	0.799	80%	0.796	S	S	*	*			trans	-147.7	136.1	177.7	-92.3	-175.1	-17.3	0	0	106.5
586	T	27.1	Very low	28.4	Very low	129 Å²	129	130.5 Å²	130.5	79%	0.791	80%	0.802	S	S	*	*			cis	-138.9	157.7	9	51.3	0	0	0	0	111.3
587	G	24.3	Very low	28.7	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	79%	0.792	S	S	*	*			trans	-143.4	116.9	165.2	0	0	0	0	0	109.2
588	F	26.4	Very low	29.5	Very low	213 Å²	213	131 Å²	131	93%	0.934	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-103	158.6	178.8	-120.5	-94.9	0	0	0	111.7
589	K	25.9	Very low	30.3	Very low	194 Å²	194	129.7 Å²	129.7	84%	0.843	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-78.4	161.1	-163.8	-84.9	-178.4	176.4	178.5	0	115.1
590	P	35.1	Very low	31.5	Very low	127 Å²	127	128 Å²	128	83%	0.825	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-91.7	159.1	-171.8	36.8	-36.8	0	0	0	115
591	G	27.3	Very low	33	Very low	75 Å²	75	125 Å²	125	77%	0.773	75%	0.745	S	S	*	*			trans	-130.5	152.6	159.3	0	0	0	0	0	110.2
592	S	30.2	Very low	34.9	Very low	118 Å²	118	121.3 Å²	121.3	83%	0.825	72%	0.721	S	S	*	*			trans	-96.8	-173.1	-168.3	-49	0	0	0	0	112.8
593	P	47.7	Very low	37	Very low	131 Å²	131	117.3 Å²	117.3	85%	0.851	70%	0.697	S	S	*	*				-128.1	169.8	-77	38.7	-23.9	0	0	0	113.9
594	G	33.4	Very low	38.8	Very low	84 Å²	84	116.1 Å²	116.1	87%	0.866	69%	0.694	S	S	*	*			trans	106.6	49.7	148.2	0	0	0	0	0	119.7
595	G	29.1	Very low	40.4	Very low	75 Å²	75	115.7 Å²	115.7	77%	0.773	68%	0.681	S	S	*	*			trans	-95.8	123.5	161.8	0	0	0	0	0	111.6
596	R	31.1	Very low	41.6	Very low	251 Å²	251	112.9 Å²	112.9	95%	0.947	67%	0.671	S	S	*	*			trans	-89.2	106.4	177.6	-156.5	-179.8	-152.4	168.6	5.8	109	Q598	R596-Q598 PolarHBondContact O-N 3.23Å
597	L	33.4	Very low	43.2	Very low	124 Å²	124	113.7 Å²	113.7	65%	0.649	67%	0.671	S	S	*	*			trans	-61.9	123.4	-175.7	-120.4	73.6	0	0	0	111.6	D619	L597-D619 HydrophobicContact CD2-CB 4.2Å; L597-D619 WeakPolarHBondContact CD2-OD2 3.39Å
598	Q	42.9	Very low	45.5	Very low	126 Å²	126	112.1 Å²	112.1	59%	0.589	64%	0.643	S	S	*	*			trans	-86.3	133.8	157.2	-66.9	172.3	3.4	0	0	107.2	A355 R596 V600	A355-Q598 HydrophobicContact CB-CG 4.11Å; A355-Q598 VanDerWaalsContact CB-NE2 3.27Å; R596-Q598 PolarHBondContact O-N 3.23Å; Q598-V600 VanDerWaalsContact C-N 3.34Å; Q598-V600 PolarHBondContact O-N 3Å
599	S	43.1	Very low	47.4	Very low	88 Å²	88	103.8 Å²	103.8	62%	0.615	62%	0.617	S	S	*	*			trans	-75.6	87.8	174.8	57.8	0	0	0	0	109.9	T618	S599-T618 WeakPolarHBondContact CA-O 3.38Å; S599-T618 WeakPolarHBondContact CB-O 3.47Å
600	V	51.4	Low	49.8	Very low	71 Å²	71	95.4 Å²	95.4	43%	0.43	58%	0.582	S	S	.	*			trans	-64.9	137.6	171	179.7	0	0	0	0	108.7	Q598 L602 T605	Q598-V600 VanDerWaalsContact C-N 3.34Å; Q598-V600 PolarHBondContact O-N 3Å; V600-L602 VanDerWaalsContact C-N 3.28Å; V600-L602 VanDerWaalsContact O-CD1 3.25Å; V600-L602 WeakPolarHBondContact O-CD1 3.34Å; V600-L602 PolarHBondContact O-N 2.89Å; V600-T605 HydrophobicContact CG1-CG2 3.77Å
601	D	58.8	Low	51.8	Low	66 Å²	66	94.5 Å²	94.5	35%	0.353	57%	0.567	S	S	.	*			trans	-74	84.2	170.8	-172.3	-20.5	0	0	0	109.3	C603 Q604 T605 S616	D601-C603 PolarHBondContact O-N 2.91Å; D601-C603 VanDerWaalsContact O-N 3.1Å; D601-C603 WeakPolarHBondContact OD1-CB 3.31Å; D601-C603 PolarHBondContact OD1-N 2.99Å; D601-Q604 HydrophobicContact CB-CG 4.44Å; D601-Q604 PolarHBondContact O-N 2.92Å; D601-Q604 PolarHBondContact OD2-NE2 2.97Å; D601-T605 PolarHBondContact O-N 3.49Å; D601-S616 WeakPolarHBondContact OD1-CB 3.38Å; D601-S616 PolarHBondContact OD1-OG 2.87Å
602	L	64.9	Low	54.4	Low	44 Å²	44	93.8 Å²	93.8	23%	0.23	54%	0.543	C	S	.	.	H	α-helix	trans	-57.4	-21.5	-177.4	-71.3	104.3	0	0	0	114.4	V600 Q604 S616 Y621	V600-L602 VanDerWaalsContact C-N 3.28Å; V600-L602 VanDerWaalsContact O-CD1 3.25Å; V600-L602 WeakPolarHBondContact O-CD1 3.34Å; V600-L602 PolarHBondContact O-N 2.89Å; L602-Q604 PolarHBondContact O-N 3.18Å; L602-S616 PolarHBondContact N-OG 3.44Å; L602-Y621 HydrophobicContact CB-CD1 3.99Å
603	C	68.3	Low	56.8	Low	20 Å²	20	91.6 Å²	91.6	14%	0.135	52%	0.522	C	S	.	.	H	α-helix	trans	-69.8	-15.9	172.2	-68.4	0	0	0	0	113.3	D601 H608 C614 F615 S616	D601-C603 PolarHBondContact O-N 2.91Å; D601-C603 VanDerWaalsContact O-N 3.1Å; D601-C603 WeakPolarHBondContact OD1-CB 3.31Å; D601-C603 PolarHBondContact OD1-N 2.99Å; C603-H608 PolarHBondContact O-CD2 3.16Å; C603-H608 VanDerWaalsContact O-CD2 3.23Å; C603-C614 HydrophobicContact CB-CB 3.76Å; C603-C614 WeakPolarHBondContact CB-SG 3.13Å; C603-C614 WeakPolarHBondContact SG-CB 3.18Å; C603-C614 CovalentContact SG-SG 2.04Å; C603-C614 PolarHBondContact SG-SG 3.42Å; C603-F615 PolarHBondContact SG-N 2.03Å; C603-S616 PolarHBondContact N-OG 2.83Å; C603-S616 PolarHBondContact SG-N 3.3Å; C603-S616 VanDerWaalsContact SG-N 3.38Å
604	Q	63.3	Low	58.3	Low	154 Å²	154	86.9 Å²	86.9	72%	0.72	49%	0.492	S	S	*	.	H	α-helix	trans	-108.2	-12.1	-179.3	-60.7	-168.8	44.3	0	0	113.8	D601 L602	D601-Q604 HydrophobicContact CB-CG 4.44Å; D601-Q604 PolarHBondContact O-N 2.92Å; D601-Q604 PolarHBondContact OD2-NE2 2.97Å; L602-Q604 PolarHBondContact O-N 3.18Å
605	T	58.2	Low	60.5	Low	91 Å²	91	87.1 Å²	87.1	56%	0.558	47%	0.469	S	S	*	.	H	α-helix	trans	-116.7	-12.1	-171.5	60.9	0	0	0	0	115.5	V600 D601	V600-T605 HydrophobicContact CG1-CG2 3.77Å; D601-T605 PolarHBondContact O-N 3.49Å
606	L	50.9	Low	62.5	Low	113 Å²	113	85.6 Å²	85.6	59%	0.592	45%	0.447	S	S	*	.	S	Bend	trans	-129.3	152.6	176.9	-134.5	83.7	0	0	0	110.1	H608	L606-H608 PolarHBondContact O-N 2.93Å
607	D	62.2	Low	64.5	Low	146 Å²	146	76.5 Å²	76.5	78%	0.781	42%	0.419	S	S	*	.			trans	-67	91.2	162.3	-177.1	5.2	0	0	0	108.7	G609	D607-G609 VanDerWaalsContact C-N 3.28Å; D607-G609 PolarHBondContact OD1-N 3.41Å
608	H	71.3	Confident	65.5	Low	44 Å²	44	75.3 Å²	75.3	20%	0.204	42%	0.417	C	S	.	.			trans	-76.9	-18	-174.4	59.1	81.9	0	0	0	111.6	C603 L606 C610 Y621 K636	C603-H608 PolarHBondContact O-CD2 3.16Å; C603-H608 VanDerWaalsContact O-CD2 3.23Å; L606-H608 PolarHBondContact O-N 2.93Å; H608-C610 VanDerWaalsContact C-N 3.25Å; H608-C610 VanDerWaalsContact ND1-CB 3.35Å; H608-C610 WeakPolarHBondContact ND1-CB 3.38Å; H608-C610 PolarHBondContact ND1-N 3.24Å; H608-C610 PolarHBondContact ND1-SG 3.38Å; H608-C610 PolarHBondContact O-N 2.75Å; H608-Y621 HydrophobicContact CB-CD1 4.22Å; H608-Y621 HydrophobicContact CB-CD2 3.92Å; H608-Y621 HydrophobicContact CB-CE1 3.92Å; H608-Y621 HydrophobicContact CB-CE2 3.6Å; H608-Y621 HydrophobicContact CB-CG 4.23Å; H608-Y621 WeakPolarHBondContact O-CE2 3.38Å; H608-Y621 PolarHBondContact O-OH 3.4Å; H608-K636 WeakPolarHBondContact O-CD 3Å; H608-K636 WeakPolarHBondContact O-CE 3.43Å; H608-K636 PolarHBondContact O-NZ 3.44Å
609	G	67.4	Low	66.2	Low	38 Å²	38	74.5 Å²	74.5	39%	0.392	42%	0.417	S	S	.	.			trans	66.2	16.1	176.1	0	0	0	0	0	115.7	D607 Q611	D607-G609 VanDerWaalsContact C-N 3.28Å; D607-G609 PolarHBondContact OD1-N 3.41Å; G609-Q611 PolarHBondContact O-N 2.84Å
610	C	76.4	Confident	67.4	Low	18 Å²	18	73.1 Å²	73.1	12%	0.122	41%	0.407	C	S	.	.			trans	-70.8	126.2	176.1	-59.7	0	0	0	0	110.2	H608 H612 C614 C623 K636	H608-C610 VanDerWaalsContact C-N 3.25Å; H608-C610 VanDerWaalsContact ND1-CB 3.35Å; H608-C610 WeakPolarHBondContact ND1-CB 3.38Å; H608-C610 PolarHBondContact ND1-N 3.24Å; H608-C610 PolarHBondContact ND1-SG 3.38Å; H608-C610 PolarHBondContact O-N 2.75Å; C610-H612 PolarHBondContact O-N 2.92Å; C610-C614 HydrophobicContact CB-CB 4.18Å; C610-C614 VanDerWaalsContact SG-SG 3.6Å; C610-C623 VanDerWaalsContact CA-SG 3.5Å; C610-C623 HydrophobicContact CB-CB 3.67Å; C610-C623 WeakPolarHBondContact CB-SG 3.05Å; C610-C623 VanDerWaalsContact SG-CA 3.54Å; C610-C623 WeakPolarHBondContact SG-CB 3.04Å; C610-C623 CovalentContact SG-SG 2.02Å; C610-C623 PolarHBondContact SG-SG 3.47Å; C610-K636 WeakPolarHBondContact CA-O 3.47Å
611	Q	75.7	Confident	68.7	Low	107 Å²	107	71.8 Å²	71.8	50%	0.5	40%	0.395	S	S	.	.	S	Bend	trans	-71.3	-27.4	-176.8	-176.4	-179.7	-19.1	0	0	114.3	G609 K636 C638	G609-Q611 PolarHBondContact O-N 2.84Å; Q611-K636 PolarHBondContact N-O 3.26Å; Q611-C638 HydrophobicContact CB-CB 4.07Å; Q611-C638 HydrophobicContact CG-CB 4.27Å; Q611-C638 PolarHBondContact NE2-O 3.05Å; Q611-C638 PolarHBondContact OE1-O 3.24Å
612	H	83.3	Confident	69.6	Low	60 Å²	60	72.7 Å²	72.7	28%	0.278	40%	0.399	S	S	.	.	S	Bend	trans	-122.7	-78.7	179.2	-71.9	154.3	0	0	0	113	C610 N626 F629 C638	C610-H612 PolarHBondContact O-N 2.92Å; H612-N626 PolarHBondContact ND1-N 3.01Å; H612-F629 AromaticContact CE1-CD1 3.69Å; H612-F629 AromaticContact CE1-CG 3.65Å; H612-C638 HydrophobicContact CB-CB 4.41Å; H612-C638 WeakPolarHBondContact ND1-CB 3.45Å; H612-C638 PolarHBondContact ND1-SG 3.38Å; H612-C638 VanDerWaalsContact ND1-SG 3.4Å
613	L	79.9	Confident	70.3	Confident	72 Å²	72	71 Å²	71	38%	0.377	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	143.6	-174.2	-56.2	170.9	0	0	0	109.9	F615 C623 K624	L613-F615 HydrophobicContact CB-CE2 3.68Å; L613-F615 HydrophobicContact CB-CZ 4.29Å; L613-F615 HydrophobicContact CD1-CE2 4.34Å; L613-F615 HydrophobicContact CD1-CZ 4.37Å; L613-C623 CarbonylContact O-C 3.56Å; L613-C623 WeakPolarHBondContact O-CA 3.42Å; L613-K624 HydrophobicContact CB-CB 4.47Å; L613-K624 WeakPolarHBondContact CB-O 3.38Å; L613-K624 PolarHBondContact N-O 3.28Å; L613-K624 PolarHBondContact O-N 3.49Å
614	C	79.6	Confident	70.7	Confident	32 Å²	32	74.9 Å²	74.9	22%	0.216	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.7	173.5	-169.5	0	0	0	0	109.2	C603 C610	C603-C614 HydrophobicContact CB-CB 3.76Å; C603-C614 WeakPolarHBondContact CB-SG 3.13Å; C603-C614 WeakPolarHBondContact SG-CB 3.18Å; C603-C614 CovalentContact SG-SG 2.04Å; C603-C614 PolarHBondContact SG-SG 3.42Å; C610-C614 HydrophobicContact CB-CB 4.18Å; C610-C614 VanDerWaalsContact SG-SG 3.6Å
615	F	79.6	Confident	71.4	Confident	89 Å²	89	68.8 Å²	68.8	39%	0.39	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	119.3	174	-60.4	-97.4	0	0	0	109.2	C603 L613 Y621 I622 K624	C603-F615 PolarHBondContact SG-N 2.03Å; L613-F615 HydrophobicContact CB-CE2 3.68Å; L613-F615 HydrophobicContact CB-CZ 4.29Å; L613-F615 HydrophobicContact CD1-CE2 4.34Å; L613-F615 HydrophobicContact CD1-CZ 4.37Å; F615-Y621 WeakPolarHBondContact O-CA 3.44Å; F615-I622 HydrophobicContact CB-CG1 3.94Å; F615-I622 PolarHBondContact N-O 3.14Å; F615-I622 PolarHBondContact O-N 2.04Å; F615-K624 HydrophobicContact CD2-CB 4.28Å; F615-K624 HydrophobicContact CD2-CD 3.84Å; F615-K624 HydrophobicContact CD2-CG 3.79Å; F615-K624 HydrophobicContact CE2-CB 3.82Å; F615-K624 HydrophobicContact CE2-CD 3.55Å; F615-K624 HydrophobicContact CE2-CG 3.72Å; F615-K624 HydrophobicContact CZ-CD 4.2Å
616	S	70.6	Confident	71.7	Confident	44 Å²	44	68 Å²	68	31%	0.308	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	141.5	175.4	-87.8	0	0	0	0	112.3	D601 L602 C603	D601-S616 WeakPolarHBondContact OD1-CB 3.38Å; D601-S616 PolarHBondContact OD1-OG 2.87Å; L602-S616 PolarHBondContact N-OG 3.44Å; C603-S616 PolarHBondContact N-OG 2.83Å; C603-S616 PolarHBondContact SG-N 3.3Å; C603-S616 VanDerWaalsContact SG-N 3.38Å
617	T	72.4	Confident	71.8	Confident	59 Å²	59	72.3 Å²	72.3	36%	0.362	39%	0.388	S	S	.	.			trans	-108.7	179.9	168.4	64.4	0	0	0	0	108.3	D619 S620 I622	T617-D619 PolarHBondContact O-N 3.01Å; T617-S620 PolarHBondContact N-O 3.49Å; T617-S620 VanDerWaalsContact OG1-C 3.28Å; T617-S620 PolarHBondContact OG1-N 3.29Å; T617-S620 PolarHBondContact OG1-O 3.48Å; T617-S620 VanDerWaalsContact OG1-O 3.1Å; T617-I622 HydrophobicContact CG2-CD1 4.47Å; T617-I622 HydrophobicContact CG2-CG1 4.36Å; T617-I622 HydrophobicContact CG2-CG2 4.2Å
618	T	55.4	Low	71	Confident	99 Å²	99	67.3 Å²	67.3	61%	0.607	37%	0.372	S	S	*	.	S	Bend	trans	-60.9	-29.4	-172.8	53	0	0	0	0	113.9	S599	S599-T618 WeakPolarHBondContact CA-O 3.38Å; S599-T618 WeakPolarHBondContact CB-O 3.47Å
619	D	58.3	Low	70.4	Confident	109 Å²	109	68.5 Å²	68.5	58%	0.583	38%	0.377	S	S	*	.	S	Bend	trans	-133.9	-1.4	-169.6	-55.2	38.8	0	0	0	112.2	L597 T617	L597-D619 HydrophobicContact CD2-CB 4.2Å; L597-D619 WeakPolarHBondContact CD2-OD2 3.39Å; T617-D619 PolarHBondContact O-N 3.01Å
620	S	66.8	Low	69.8	Low	59 Å²	59	70.5 Å²	70.5	41%	0.413	38%	0.378	S	S	.	.	S	Bend	trans	-159.2	-168.1	-172.8	-167.8	0	0	0	0	111.7	T617	T617-S620 PolarHBondContact N-O 3.49Å; T617-S620 VanDerWaalsContact OG1-C 3.28Å; T617-S620 PolarHBondContact OG1-N 3.29Å; T617-S620 PolarHBondContact OG1-O 3.48Å; T617-S620 VanDerWaalsContact OG1-O 3.1Å
621	Y	78.9	Confident	69.5	Low	44 Å²	44	73 Å²	73	17%	0.173	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	155.5	167.7	62.7	-86.9	0	0	0	111.4	L602 H608 F615 K636	L602-Y621 HydrophobicContact CB-CD1 3.99Å; H608-Y621 HydrophobicContact CB-CD1 4.22Å; H608-Y621 HydrophobicContact CB-CD2 3.92Å; H608-Y621 HydrophobicContact CB-CE1 3.92Å; H608-Y621 HydrophobicContact CB-CE2 3.6Å; H608-Y621 HydrophobicContact CB-CG 4.23Å; H608-Y621 WeakPolarHBondContact O-CE2 3.38Å; H608-Y621 PolarHBondContact O-OH 3.4Å; F615-Y621 WeakPolarHBondContact O-CA 3.44Å; Y621-K636 VanDerWaalsContact OH-CE 3.26Å; Y621-K636 WeakPolarHBondContact OH-CE 3.4Å; Y621-K636 PolarHBondContact OH-NZ 3.41Å
622	I	77.4	Confident	68.9	Low	84 Å²	84	68.7 Å²	68.7	43%	0.431	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.4	170.5	61.6	177.8	0	0	0	109.8	F615 T617	F615-I622 HydrophobicContact CB-CG1 3.94Å; F615-I622 PolarHBondContact N-O 3.14Å; F615-I622 PolarHBondContact O-N 2.04Å; T617-I622 HydrophobicContact CG2-CD1 4.47Å; T617-I622 HydrophobicContact CG2-CG1 4.36Å; T617-I622 HydrophobicContact CG2-CG2 4.2Å
623	C	80.3	Confident	67.9	Low	8 Å²	8	75.9 Å²	75.9	5%	0.054	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	151.1	171.9	-53.4	0	0	0	0	110.3	C610 L613 L631 G635	C610-C623 VanDerWaalsContact CA-SG 3.5Å; C610-C623 HydrophobicContact CB-CB 3.67Å; C610-C623 WeakPolarHBondContact CB-SG 3.05Å; C610-C623 VanDerWaalsContact SG-CA 3.54Å; C610-C623 WeakPolarHBondContact SG-CB 3.04Å; C610-C623 CovalentContact SG-SG 2.02Å; C610-C623 PolarHBondContact SG-SG 3.47Å; L613-C623 CarbonylContact O-C 3.56Å; L613-C623 WeakPolarHBondContact O-CA 3.42Å; C623-L631 HydrophobicContact CB-CD1 3.55Å; C623-L631 HydrophobicContact CB-CD2 4.32Å; C623-L631 WeakPolarHBondContact O-CD2 3.44Å; C623-G635 WeakPolarHBondContact CB-O 3.34Å; C623-G635 PolarHBondContact SG-O 3.2Å
624	K	77.2	Confident	67.5	Low	103 Å²	103	76.6 Å²	76.6	45%	0.448	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	163.7	165.1	-56.5	-175.6	-172.7	167.2	0	110.2	L613 F615	L613-K624 HydrophobicContact CB-CB 4.47Å; L613-K624 WeakPolarHBondContact CB-O 3.38Å; L613-K624 PolarHBondContact N-O 3.28Å; L613-K624 PolarHBondContact O-N 3.49Å; F615-K624 HydrophobicContact CD2-CB 4.28Å; F615-K624 HydrophobicContact CD2-CD 3.84Å; F615-K624 HydrophobicContact CD2-CG 3.79Å; F615-K624 HydrophobicContact CE2-CB 3.82Å; F615-K624 HydrophobicContact CE2-CD 3.55Å; F615-K624 HydrophobicContact CE2-CG 3.72Å; F615-K624 HydrophobicContact CZ-CD 4.2Å
625	C	77.2	Confident	67.2	Low	25 Å²	25	76.6 Å²	76.6	17%	0.169	42%	0.416	C	S	.	.			trans	-111.6	150.1	-176.1	-55.1	0	0	0	0	112	F629 L630 L631 C638	C625-F629 HydrophobicContact CB-CB 3.71Å; C625-F629 WeakPolarHBondContact CB-O 3.06Å; C625-L630 PolarHBondContact SG-O 3.16Å; C625-L630 VanDerWaalsContact SG-O 3.37Å; C625-L631 VanDerWaalsContact SG-CA 3.58Å; C625-L631 PolarHBondContact SG-N 2.88Å; C625-L631 VanDerWaalsContact SG-N 3.45Å; C625-C638 WeakPolarHBondContact CA-SG 3.05Å; C625-C638 HydrophobicContact CB-CB 3.78Å; C625-C638 WeakPolarHBondContact CB-SG 3.08Å; C625-C638 WeakPolarHBondContact SG-CA 3.35Å; C625-C638 WeakPolarHBondContact SG-CB 3.3Å; C625-C638 CovalentContact SG-SG 2.04Å; C625-C638 PolarHBondContact SG-SG 3.36Å
626	N	64.4	Low	67.2	Low	75 Å²	75	75.7 Å²	75.7	40%	0.401	41%	0.411	S	S	.	.			trans	-63.5	161.3	173.2	-67	-27.5	0	0	0	111.3	H612 G628 F629	H612-N626 PolarHBondContact ND1-N 3.01Å; N626-G628 PolarHBondContact O-N 2.99Å; N626-F629 PolarHBondContact O-N 3.07Å
627	E	52.7	Low	67.5	Low	203 Å²	203	75.5 Å²	75.5	95%	0.949	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	126	-174.3	-163.5	171.3	-152.6	0	0	111.9
628	G	45.6	Very low	67.4	Low	42 Å²	42	72.8 Å²	72.8	43%	0.433	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	19.1	-173.6	0	0	0	0	0	115.5	N626 P641	N626-G628 PolarHBondContact O-N 2.99Å; G628-P641 WeakPolarHBondContact O-CD 3.35Å
629	F	59.4	Low	67.4	Low	69 Å²	69	73.8 Å²	73.8	30%	0.303	39%	0.391	S	S	.	.			trans	-132.7	149.4	169.3	-70.3	-105.3	0	0	0	110.1	H612 C625 N626 E639 K640	H612-F629 AromaticContact CE1-CD1 3.69Å; H612-F629 AromaticContact CE1-CG 3.65Å; C625-F629 HydrophobicContact CB-CB 3.71Å; C625-F629 WeakPolarHBondContact CB-O 3.06Å; N626-F629 PolarHBondContact O-N 3.07Å; F629-E639 CarbonylContact C-O 3.49Å; F629-E639 VanDerWaalsContact CA-O 3.31Å; F629-E639 WeakPolarHBondContact CA-O 3.04Å; F629-K640 VanDerWaalsContact CD1-CA 3.48Å; F629-K640 HydrophobicContact CD1-CB 3.89Å; F629-K640 HydrophobicContact CD1-CG 4.47Å; F629-K640 VanDerWaalsContact CD1-N 3.27Å; F629-K640 HydrophobicContact CE1-CB 3.7Å; F629-K640 HydrophobicContact CE1-CG 4.21Å; F629-K640 HydrophobicContact CZ-CB 4.28Å; F629-K640 HydrophobicContact CZ-CD 4.33Å; F629-K640 HydrophobicContact CZ-CG 4.32Å
630	L	54.2	Low	66.8	Low	80 Å²	80	75.8 Å²	75.8	42%	0.419	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.1	175.8	-68	-179.3	0	0	0	110.6	C625 C638 E639 P641 D645	C625-L630 PolarHBondContact SG-O 3.16Å; C625-L630 VanDerWaalsContact SG-O 3.37Å; L630-C638 CarbonylContact O-C 3.54Å; L630-C638 WeakPolarHBondContact O-CA 3.46Å; L630-E639 PolarHBondContact N-O 3.3Å; L630-E639 PolarHBondContact O-N 3.43Å; L630-P641 HydrophobicContact CD1-CB 3.87Å; L630-P641 HydrophobicContact CG-CB 4.09Å; L630-D645 HydrophobicContact CD1-CB 4.44Å; L630-D645 WeakPolarHBondContact CD1-OD2 3.48Å
631	L	70.1	Confident	65.8	Low	71 Å²	71	74.7 Å²	74.7	37%	0.372	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	127.6	178.2	-165.4	73.9	0	0	0	109.5	C623 C625	C623-L631 HydrophobicContact CB-CD1 3.55Å; C623-L631 HydrophobicContact CB-CD2 4.32Å; C623-L631 WeakPolarHBondContact O-CD2 3.44Å; C625-L631 VanDerWaalsContact SG-CA 3.58Å; C625-L631 PolarHBondContact SG-N 2.88Å; C625-L631 VanDerWaalsContact SG-N 3.45Å
632	A	63.8	Low	64.3	Low	16 Å²	16	74 Å²	74	13%	0.132	39%	0.393	C	S	.	.			trans	-70.2	169.1	179.3	0	0	0	0	0	112.3	D634 G635 S637 E639	A632-D634 PolarHBondContact O-N 3.2Å; A632-D634 VanDerWaalsContact O-N 3.14Å; A632-G635 PolarHBondContact O-N 3.08Å; A632-S637 PolarHBondContact N-O 2.84Å; A632-E639 HydrophobicContact CB-CG 4.21Å
633	E	62.5	Low	63.1	Low	211 Å²	211	70.3 Å²	70.3	99%	0.986	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.4	-179.8	-67.7	-167.9	155.2	0	0	113.8	G635	E633-G635 PolarHBondContact O-N 2.64Å
634	D	71.9	Confident	61.6	Low	87 Å²	87	73.6 Å²	73.6	47%	0.465	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-9.4	172.4	72.6	-4.9	0	0	0	113.6	A632 K636 S637	A632-D634 PolarHBondContact O-N 3.2Å; A632-D634 VanDerWaalsContact O-N 3.14Å; D634-K636 PolarHBondContact O-N 2.8Å; D634-K636 PolarHBondContact OD1-N 2.71Å; D634-S637 PolarHBondContact OD1-N 2.96Å; D634-S637 VanDerWaalsContact OD2-CB 3.25Å; D634-S637 WeakPolarHBondContact OD2-CB 3.44Å; D634-S637 PolarHBondContact OD2-N 3.29Å; D634-S637 PolarHBondContact OD2-OG 2.99Å
635	G	72.6	Confident	60.4	Low	32 Å²	32	73.2 Å²	73.2	33%	0.33	39%	0.391	S	S	.	.	S	Bend	trans	70	12.7	-178.4	0	0	0	0	0	114.4	C623 A632 E633	C623-G635 WeakPolarHBondContact CB-O 3.34Å; C623-G635 PolarHBondContact SG-O 3.2Å; A632-G635 PolarHBondContact O-N 3.08Å; E633-G635 PolarHBondContact O-N 2.64Å
636	K	80.4	Confident	59.6	Low	70 Å²	70	72.2 Å²	72.2	30%	0.304	39%	0.385	S	S	.	.	S	Bend	trans	-136.5	-46	-168.5	-70.4	-171.1	-176.7	-144.9	0	114.3	H608 C610 Q611 Y621 D634	H608-K636 WeakPolarHBondContact O-CD 3Å; H608-K636 WeakPolarHBondContact O-CE 3.43Å; H608-K636 PolarHBondContact O-NZ 3.44Å; C610-K636 WeakPolarHBondContact CA-O 3.47Å; Q611-K636 PolarHBondContact N-O 3.26Å; Y621-K636 VanDerWaalsContact OH-CE 3.26Å; Y621-K636 WeakPolarHBondContact OH-CE 3.4Å; Y621-K636 PolarHBondContact OH-NZ 3.41Å; D634-K636 PolarHBondContact O-N 2.8Å; D634-K636 PolarHBondContact OD1-N 2.71Å
637	S	75.7	Confident	60.3	Low	40 Å²	40	71.5 Å²	71.5	28%	0.28	38%	0.384	S	S	.	.			trans	-77.4	146.2	-180	-59.2	0	0	0	0	110.6	A632 D634	A632-S637 PolarHBondContact N-O 2.84Å; D634-S637 PolarHBondContact OD1-N 2.96Å; D634-S637 VanDerWaalsContact OD2-CB 3.25Å; D634-S637 WeakPolarHBondContact OD2-CB 3.44Å; D634-S637 PolarHBondContact OD2-N 3.29Å; D634-S637 PolarHBondContact OD2-OG 2.99Å
638	C	71.3	Confident	62	Low	2 Å²	2	62 Å²	62	1%	0.014	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	95.7	179.9	-78.1	0	0	0	0	110.1	Q611 H612 C625 L630	Q611-C638 HydrophobicContact CB-CB 4.07Å; Q611-C638 HydrophobicContact CG-CB 4.27Å; Q611-C638 PolarHBondContact NE2-O 3.05Å; Q611-C638 PolarHBondContact OE1-O 3.24Å; H612-C638 HydrophobicContact CB-CB 4.41Å; H612-C638 WeakPolarHBondContact ND1-CB 3.45Å; H612-C638 PolarHBondContact ND1-SG 3.38Å; H612-C638 VanDerWaalsContact ND1-SG 3.4Å; C625-C638 WeakPolarHBondContact CA-SG 3.05Å; C625-C638 HydrophobicContact CB-CB 3.78Å; C625-C638 WeakPolarHBondContact CB-SG 3.08Å; C625-C638 WeakPolarHBondContact SG-CA 3.35Å; C625-C638 WeakPolarHBondContact SG-CB 3.3Å; C625-C638 CovalentContact SG-SG 2.04Å; C625-C638 PolarHBondContact SG-SG 3.36Å; L630-C638 CarbonylContact O-C 3.54Å; L630-C638 WeakPolarHBondContact O-CA 3.46Å
639	E	54	Low	64.3	Low	120 Å²	120	60 Å²	60	56%	0.561	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	141	176.1	-69.2	-179.8	-166.7	0	0	110	F629 L630 A632	F629-E639 CarbonylContact C-O 3.49Å; F629-E639 VanDerWaalsContact CA-O 3.31Å; F629-E639 WeakPolarHBondContact CA-O 3.04Å; L630-E639 PolarHBondContact N-O 3.3Å; L630-E639 PolarHBondContact O-N 3.43Å; A632-E639 HydrophobicContact CB-CG 4.21Å
640	K	45.8	Very low	65.9	Low	151 Å²	151	56.7 Å²	56.7	66%	0.657	30%	0.304	S	S	*	.			trans	-64.3	129.7	163.5	-163.2	168.5	-166.7	158.8	0	105.7	F629 G642	F629-K640 VanDerWaalsContact CD1-CA 3.48Å; F629-K640 HydrophobicContact CD1-CB 3.89Å; F629-K640 HydrophobicContact CD1-CG 4.47Å; F629-K640 VanDerWaalsContact CD1-N 3.27Å; F629-K640 HydrophobicContact CE1-CB 3.7Å; F629-K640 HydrophobicContact CE1-CG 4.21Å; F629-K640 HydrophobicContact CZ-CB 4.28Å; F629-K640 HydrophobicContact CZ-CD 4.33Å; F629-K640 HydrophobicContact CZ-CG 4.32Å; K640-G642 PolarHBondContact O-N 2.93Å
641	P	45.6	Very low	68	Low	36 Å²	36	52.9 Å²	52.9	23%	0.234	28%	0.284	C	S	.	.			trans	-55.4	114.4	-178.9	24.1	-32.3	0	0	0	107.6	G628 L630	G628-P641 WeakPolarHBondContact O-CD 3.35Å; L630-P641 HydrophobicContact CD1-CB 3.87Å; L630-P641 HydrophobicContact CG-CB 4.09Å
642	G	48.3	Very low	69.4	Low	30 Å²	30	49.5 Å²	49.5	31%	0.309	27%	0.267	S	S	.	.			trans	-62.4	-174.9	164	0	0	0	0	0	109.2	K640 H644	K640-G642 PolarHBondContact O-N 2.93Å; G642-H644 PolarHBondContact O-N 2.9Å
643	C	51.3	Low	71	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.041	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	50.7	173.5	-89.7	0	0	0	0	111.2	S678 L679 N680 C826 L829	C643-S678 WeakPolarHBondContact CB-O 3.18Å; C643-L679 HydrophobicContact CB-CD2 4Å; C643-N680 PolarHBondContact O-N 2.9Å; C643-C826 HydrophobicContact CB-CB 4.31Å; C643-C826 WeakPolarHBondContact CB-SG 3.4Å; C643-C826 PolarHBondContact N-SG 3.22Å; C643-C826 WeakPolarHBondContact SG-CA 3.07Å; C643-C826 WeakPolarHBondContact SG-CB 3.45Å; C643-C826 PolarHBondContact SG-N 3.4Å; C643-C826 CovalentContact SG-SG 2.04Å; C643-C826 PolarHBondContact SG-SG 2.04Å; C643-L829 HydrophobicContact CB-CD1 4.4Å
644	H	49	Very low	72.6	Confident	77 Å²	77	38.8 Å²	38.8	36%	0.356	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-19.1	-169.1	-59.5	-53.3	0	0	0	115.1	G642 N680	G642-H644 PolarHBondContact O-N 2.9Å; H644-N680 HydrophobicContact CB-CB 4.04Å; H644-N680 WeakPolarHBondContact O-CB 3.44Å; H644-N680 PolarHBondContact O-ND2 2.83Å
645	D	51.8	Low	73.6	Confident	94 Å²	94	34.6 Å²	34.6	50%	0.503	19%	0.191	S	C	.	.	S	Bend	trans	-114.7	-2.6	-175.5	-57.1	-77.2	0	0	0	114.8	L630	L630-D645 HydrophobicContact CD1-CB 4.44Å; L630-D645 WeakPolarHBondContact CD1-OD2 3.48Å
646	G	61.1	Low	74.5	Confident	4 Å²	4	33.1 Å²	33.1	4%	0.041	18%	0.176	C	C	.	.			trans	-86.5	116.7	177.1	0	0	0	0	0	112.2	M648 V685	G646-M648 PolarHBondContact O-N 2.88Å; G646-V685 WeakPolarHBondContact O-CG1 3.29Å
647	V	78.6	Confident	75	Confident	61 Å²	61	29.8 Å²	29.8	37%	0.37	16%	0.162	S	C	.	.			trans	-71.3	117.8	171.1	-173.3	0	0	0	0	108.9	V685 V750 P751	V647-V685 WeakPolarHBondContact CA-O 3.45Å; V647-V750 HydrophobicContact CG1-CG1 4.01Å; V647-V750 HydrophobicContact CG1-CG2 3.9Å; V647-P751 WeakPolarHBondContact O-CD 3.45Å
648	M	88.3	Confident	75.6	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	156.5	176.2	84.2	-179.7	105.5	0	0	112.7	G646 L650 L679 V685 T686 R687 R747 P751 V753 M825 L829	G646-M648 PolarHBondContact O-N 2.88Å; M648-L650 HydrophobicContact CG-CB 4.48Å; M648-L650 HydrophobicContact SD-CB 4.45Å; M648-L679 HydrophobicContact CE-CD2 3.7Å; M648-V685 PolarHBondContact N-O 3.27Å; M648-T686 HydrophobicContact CE-CG2 4.4Å; M648-T686 HydrophobicContact CG-CG2 3.87Å; M648-T686 WeakPolarHBondContact O-CA 3.38Å; M648-R687 PolarHBondContact O-N 3.29Å; M648-R747 PolarHBondContact O-NH2 3.43Å; M648-P751 WeakPolarHBondContact CA-O 3.35Å; M648-V753 HydrophobicContact SD-CB 4.48Å; M648-V753 HydrophobicContact SD-CG2 4.08Å; M648-M825 HydrophobicContact SD-CE 4.35Å; M648-L829 HydrophobicContact CB-CD2 4.14Å; M648-L829 HydrophobicContact CE-CD1 3.62Å; M648-L829 HydrophobicContact CE-CD2 3.7Å; M648-L829 HydrophobicContact CE-CG 4.19Å; M648-L829 HydrophobicContact SD-CD2 4.16Å
649	D	93.7	Very high	76.3	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.8	166	-68.7	-18.2	0	0	0	108.6	L703 F740 A746 R747 V750 P751 V753	D649-L703 HydrophobicContact CB-CD1 4Å; D649-L703 HydrophobicContact CB-CD2 4.03Å; D649-F740 HydrophobicContact CB-CE1 4.17Å; D649-A746 WeakPolarHBondContact OD2-CA 3.22Å; D649-R747 IonicContact OD1-CZ 3.57Å; D649-R747 IonicContact OD1-NE 2.75Å; D649-R747 PolarHBondContact OD1-NE 3.1Å; D649-R747 IonicContact OD1-NH2 3.88Å; D649-R747 PolarHBondContact OD1-NH2 3.45Å; D649-R747 PolarHBondContact OD2-N 2.81Å; D649-R747 IonicContact OD2-NE 3.87Å; D649-V750 HydrophobicContact CB-CG1 4.43Å; D649-P751 PolarHBondContact N-O 2.72Å; D649-V753 PolarHBondContact O-N 2.96Å
650	L	94.8	Very high	77.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	125	-174.8	177.4	62.4	0	0	0	110.8	M648 F652 L679 R687 V688 G689 L703 V753 I755 M825	M648-L650 HydrophobicContact CG-CB 4.48Å; M648-L650 HydrophobicContact SD-CB 4.45Å; L650-F652 HydrophobicContact CD2-CD2 4.5Å; L650-F652 HydrophobicContact CD2-CE2 3.67Å; L650-F652 HydrophobicContact CD2-CZ 3.87Å; L650-F652 HydrophobicContact CG-CD2 4.44Å; L650-F652 HydrophobicContact CG-CE2 4.08Å; L650-L679 HydrophobicContact CD2-CD1 3.43Å; L650-L679 VanDerWaalsContact CD2-CD1 3.43Å; L650-R687 PolarHBondContact N-O 3.43Å; L650-V688 CarbonylContact O-C 3.59Å; L650-V688 WeakPolarHBondContact O-CA 3.44Å; L650-G689 PolarHBondContact O-N 3.24Å; L650-L703 WeakPolarHBondContact O-CD2 3.39Å; L650-V753 CarbonylContact C-O 3.49Å; L650-V753 WeakPolarHBondContact CA-O 3.06Å; L650-V753 HydrophobicContact CD1-CB 3.89Å; L650-V753 HydrophobicContact CD1-CG1 3.74Å; L650-I755 HydrophobicContact CD1-CD1 3.79Å; L650-I755 HydrophobicContact CD1-CG1 3.98Å; L650-M825 HydrophobicContact CD1-CE 4.11Å; L650-M825 HydrophobicContact CD2-CE 3.99Å
651	V	97.8	Very high	79.8	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.7	173.4	178.4	0	0	0	0	110.2	V653 G689 L703 M735 F740 V753 C754 I755	V651-V653 HydrophobicContact CG1-CG2 4.36Å; V651-G689 WeakPolarHBondContact CA-O 3.38Å; V651-L703 HydrophobicContact CG2-CD1 4.17Å; V651-L703 HydrophobicContact CG2-CD2 4.12Å; V651-L703 HydrophobicContact CG2-CG 4.17Å; V651-M735 HydrophobicContact CG1-CG 4.13Å; V651-F740 HydrophobicContact CB-CE1 4.41Å; V651-F740 HydrophobicContact CB-CE2 4.03Å; V651-F740 HydrophobicContact CB-CZ 3.77Å; V651-F740 HydrophobicContact CG2-CD1 4.2Å; V651-F740 HydrophobicContact CG2-CD2 4.43Å; V651-F740 HydrophobicContact CG2-CE1 3.66Å; V651-F740 HydrophobicContact CG2-CE2 3.93Å; V651-F740 HydrophobicContact CG2-CZ 3.51Å; V651-V753 PolarHBondContact N-O 3.07Å; V651-C754 WeakPolarHBondContact O-CA 3.31Å; V651-I755 PolarHBondContact O-N 2.93Å
652	F	98.1	Very high	81.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	135.6	168.7	-70.7	-85	0	0	0	110.3	L650 I654 F671 V672 I675 V676 V688 G689 L690 I691 I755	L650-F652 HydrophobicContact CD2-CD2 4.5Å; L650-F652 HydrophobicContact CD2-CE2 3.67Å; L650-F652 HydrophobicContact CD2-CZ 3.87Å; L650-F652 HydrophobicContact CG-CD2 4.44Å; L650-F652 HydrophobicContact CG-CE2 4.08Å; F652-I654 HydrophobicContact CB-CD1 4.13Å; F652-I654 HydrophobicContact CB-CG1 4.11Å; F652-I654 HydrophobicContact CD1-CD1 4.35Å; F652-F671 HydrophobicContact CE1-CE1 4.44Å; F652-V672 HydrophobicContact CD1-CG1 4.47Å; F652-V672 HydrophobicContact CD1-CG2 4.03Å; F652-V672 HydrophobicContact CD2-CG1 4.13Å; F652-V672 HydrophobicContact CE1-CG1 4.38Å; F652-V672 HydrophobicContact CE1-CG2 4.24Å; F652-V672 HydrophobicContact CE2-CG1 4.03Å; F652-V672 HydrophobicContact CG-CG1 4.35Å; F652-V672 HydrophobicContact CG-CG2 4.41Å; F652-V672 HydrophobicContact CZ-CG1 4.16Å; F652-I675 HydrophobicContact CE1-CB 4.47Å; F652-I675 HydrophobicContact CE1-CG2 4.39Å; F652-I675 HydrophobicContact CZ-CB 4.03Å; F652-I675 HydrophobicContact CZ-CG2 3.79Å; F652-V676 HydrophobicContact CE2-CG2 4.36Å; F652-V688 HydrophobicContact CD2-CG1 3.82Å; F652-V688 HydrophobicContact CE2-CG1 3.73Å; F652-G689 PolarHBondContact N-O 3.41Å; F652-L690 HydrophobicContact CB-CB 4.27Å; F652-L690 HydrophobicContact CB-CD1 3.87Å; F652-L690 HydrophobicContact CB-CG 3.79Å; F652-L690 HydrophobicContact CG-CD1 4.43Å; F652-L690 WeakPolarHBondContact O-CA 2.97Å; F652-I691 PolarHBondContact O-N 3Å; F652-I755 HydrophobicContact CD1-CB 3.91Å; F652-I755 HydrophobicContact CD1-CD1 4.27Å; F652-I755 HydrophobicContact CD1-CG2 4.12Å; F652-I755 HydrophobicContact CE1-CB 4.14Å; F652-I755 HydrophobicContact CE1-CD1 3.65Å; F652-I755 HydrophobicContact CE1-CG1 4.47Å; F652-I755 HydrophobicContact CE1-CG2 4.24Å; F652-I755 HydrophobicContact CZ-CD1 4.1Å
653	V	97.6	Very high	83.8	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	98.9	175.9	-178.6	0	0	0	0	107.4	V651 I691 F693 A731 M735 C754 I755 V756 F757	V651-V653 HydrophobicContact CG1-CG2 4.36Å; V653-I691 HydrophobicContact CB-CD1 4.43Å; V653-I691 HydrophobicContact CB-CG1 4.15Å; V653-I691 HydrophobicContact CG1-CD1 4.04Å; V653-I691 HydrophobicContact CG1-CG1 4.04Å; V653-I691 HydrophobicContact CG2-CD1 3.89Å; V653-I691 HydrophobicContact CG2-CG1 3.88Å; V653-F693 HydrophobicContact CG1-CD1 3.83Å; V653-F693 HydrophobicContact CG1-CE1 3.85Å; V653-A731 HydrophobicContact CG1-CB 3.72Å; V653-M735 HydrophobicContact CG2-CB 4.1Å; V653-M735 HydrophobicContact CG2-CG 4.04Å; V653-C754 VanDerWaalsContact CG2-SG 3.51Å; V653-I755 PolarHBondContact N-O 3.06Å; V653-V756 HydrophobicContact CB-CB 4.49Å; V653-V756 HydrophobicContact CB-CG1 4.45Å; V653-V756 HydrophobicContact CB-CG2 4.2Å; V653-V756 HydrophobicContact CG1-CG1 4.37Å; V653-V756 WeakPolarHBondContact O-CA 3.41Å; V653-F757 PolarHBondContact O-N 3.18Å
654	I	96.6	Very high	85.6	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.7	-165.7	-57.9	-56.9	0	0	0	111.7	F652 G656 F665 V668 V672 L690 I691 Q692 F693 F757	F652-I654 HydrophobicContact CB-CD1 4.13Å; F652-I654 HydrophobicContact CB-CG1 4.11Å; F652-I654 HydrophobicContact CD1-CD1 4.35Å; I654-G656 PolarHBondContact O-N 3.27Å; I654-F665 HydrophobicContact CG2-CE2 4.2Å; I654-V668 HydrophobicContact CD1-CG1 4.2Å; I654-V668 HydrophobicContact CG2-CG1 3.57Å; I654-V672 HydrophobicContact CD1-CG2 3.93Å; I654-V672 HydrophobicContact CG1-CG2 4.35Å; I654-L690 HydrophobicContact CG1-CD1 4.14Å; I654-L690 HydrophobicContact CG1-CD2 4.39Å; I654-L690 HydrophobicContact CG1-CG 4.24Å; I654-I691 PolarHBondContact N-O 3.3Å; I654-Q692 CarbonylContact O-C 3.53Å; I654-Q692 WeakPolarHBondContact O-CA 3.36Å; I654-F693 VanDerWaalsContact C-CD1 3.46Å; I654-F693 VanDerWaalsContact C-CE1 3.44Å; I654-F693 VanDerWaalsContact O-CD1 3.25Å; I654-F693 WeakPolarHBondContact O-CD1 3.47Å; I654-F693 PolarHBondContact O-N 3.45Å; I654-F757 HydrophobicContact CD1-CB 3.77Å
655	D	93.6	Very high	87.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	126.3	170.2	-166	-24.4	0	0	0	110.6	S657 L660 F693 S726 F757 T758	D655-S657 WeakPolarHBondContact OD1-CA 3.49Å; D655-S657 WeakPolarHBondContact OD1-CB 3.45Å; D655-S657 PolarHBondContact OD1-N 3.21Å; D655-S657 PolarHBondContact OD1-OG 3.19Å; D655-L660 WeakPolarHBondContact O-CD2 3.16Å; D655-F693 HydrophobicContact CB-CE1 3.91Å; D655-F693 HydrophobicContact CB-CE2 4.11Å; D655-F693 HydrophobicContact CB-CZ 3.58Å; D655-S726 PolarHBondContact OD2-OG 3.5Å; D655-F757 WeakPolarHBondContact CB-O 3.48Å; D655-F757 PolarHBondContact N-O 3.06Å; D655-T758 PolarHBondContact OD2-OG1 2.89Å
656	G	92	Very high	89.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.173	C	C	.	.			trans	-121.2	23.4	174.8	0	0	0	0	0	112.4	I654 F693 M722 G723	I654-G656 PolarHBondContact O-N 3.27Å; G656-F693 WeakPolarHBondContact CA-O 3.35Å; G656-F693 PolarHBondContact N-O 3.22Å; G656-M722 WeakPolarHBondContact O-CB 3.42Å; G656-M722 PolarHBondContact O-N 3.18Å; G656-G723 PolarHBondContact O-N 3.28Å
657	S	91.2	Very high	91	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.007	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-69.5	170.3	-179.3	67.7	0	0	0	0	113.9	D655 S659 Y721 R724 G725 S726	D655-S657 WeakPolarHBondContact OD1-CA 3.49Å; D655-S657 WeakPolarHBondContact OD1-CB 3.45Å; D655-S657 PolarHBondContact OD1-N 3.21Å; D655-S657 PolarHBondContact OD1-OG 3.19Å; S657-S659 VanDerWaalsContact C-N 3.29Å; S657-S659 PolarHBondContact O-N 3.36Å; S657-S659 PolarHBondContact OG-OG 3.46Å; S657-S659 VanDerWaalsContact OG-OG 3.08Å; S657-Y721 VanDerWaalsContact O-CE2 3.23Å; S657-Y721 WeakPolarHBondContact O-CE2 3.31Å; S657-Y721 PolarHBondContact O-OH 3.17Å; S657-R724 CarbonylContact C-O 3.56Å; S657-R724 VanDerWaalsContact CA-O 3.25Å; S657-R724 WeakPolarHBondContact CA-O 3.31Å; S657-R724 VanDerWaalsContact CB-O 3.26Å; S657-R724 WeakPolarHBondContact CB-O 3.44Å; S657-G725 VanDerWaalsContact CB-O 3.31Å; S657-G725 WeakPolarHBondContact CB-O 3.46Å; S657-S726 WeakPolarHBondContact CB-OG 3.42Å; S657-S726 PolarHBondContact OG-OG 3.47Å; S657-S726 VanDerWaalsContact OG-OG 3.07Å
658	K	87.4	Confident	91.7	Very high	163 Å²	163	29 Å²	29	71%	0.709	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-29.1	179.3	-166.4	178.3	174.8	-175.6	0	112.9	L660 Y721 G723 R724	K658-L660 VanDerWaalsContact C-N 3.35Å; K658-Y721 WeakPolarHBondContact CA-OH 3.33Å; K658-G723 WeakPolarHBondContact CB-O 3.18Å; K658-R724 WeakPolarHBondContact CB-O 3.31Å; K658-R724 PolarHBondContact N-O 3.4Å
659	S	85.1	Confident	92	Very high	67 Å²	67	29.6 Å²	29.6	47%	0.469	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-40.4	-177.7	56.8	0	0	0	0	111.3	S657 G661 D759	S657-S659 VanDerWaalsContact C-N 3.29Å; S657-S659 PolarHBondContact O-N 3.36Å; S657-S659 PolarHBondContact OG-OG 3.46Å; S657-S659 VanDerWaalsContact OG-OG 3.08Å; S659-G661 PolarHBondContact O-N 2.94Å; S659-D759 VanDerWaalsContact C-OD2 3.24Å
660	L	87.1	Confident	91.9	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-47.3	179	-178.2	63.7	0	0	0	112	D655 K658 N664 F665 V668 F757 D759 F811	D655-L660 WeakPolarHBondContact O-CD2 3.16Å; K658-L660 VanDerWaalsContact C-N 3.35Å; L660-N664 HydrophobicContact CD1-CB 3.63Å; L660-N664 HydrophobicContact CG-CB 4.11Å; L660-N664 VanDerWaalsContact O-CB 3.3Å; L660-N664 WeakPolarHBondContact O-CB 3.12Å; L660-N664 PolarHBondContact O-ND2 3.28Å; L660-F665 HydrophobicContact CD2-CB 4.01Å; L660-F665 HydrophobicContact CD2-CD2 3.77Å; L660-F665 HydrophobicContact CD2-CG 4.4Å; L660-F665 HydrophobicContact CG-CB 4.47Å; L660-V668 HydrophobicContact CD1-CG2 4.21Å; L660-V668 HydrophobicContact CD2-CG2 4.21Å; L660-F757 HydrophobicContact CD1-CE1 4.34Å; L660-D759 WeakPolarHBondContact CA-OD2 3.41Å; L660-D759 HydrophobicContact CB-CB 4.47Å; L660-D759 HydrophobicContact CD1-CB 4.17Å; L660-D759 PolarHBondContact N-OD2 3.3Å; L660-F811 HydrophobicContact CD1-CE1 3.55Å; L660-F811 HydrophobicContact CD1-CE2 4.18Å; L660-F811 HydrophobicContact CD1-CZ 3.21Å
661	G	87.8	Confident	91.8	Very high	16 Å²	16	35.7 Å²	35.7	17%	0.165	20%	0.199	C	C	.	.	H	α-helix	trans	80.2	155	-175.3	0	0	0	0	0	113.4	S659 A663 F665 Y721	S659-G661 PolarHBondContact O-N 2.94Å; G661-A663 VanDerWaalsContact C-N 3.34Å; G661-A663 PolarHBondContact O-N 2.91Å; G661-F665 WeakPolarHBondContact O-CB 3.43Å; G661-F665 PolarHBondContact O-N 3.38Å; G661-F665 VanDerWaalsContact O-N 3.11Å; G661-Y721 WeakPolarHBondContact CA-OH 3.36Å; G661-Y721 PolarHBondContact N-OH 3.39Å; G661-Y721 VanDerWaalsContact N-OH 3.16Å
662	P	89	Confident	91.6	Very high	82 Å²	82	35.7 Å²	35.7	53%	0.532	20%	0.199	S	C	.	.	H	α-helix	trans	-67	-32.1	-175.5	26.6	-34.3	0	0	0	113.3	F665 E666 Y721	P662-F665 PolarHBondContact O-N 3.28Å; P662-E666 PolarHBondContact O-N 3.33Å; P662-Y721 HydrophobicContact CB-CD1 3.99Å; P662-Y721 HydrophobicContact CB-CE1 4.21Å; P662-Y721 HydrophobicContact CB-CG 4.35Å; P662-Y721 HydrophobicContact CG-CE1 4.48Å
663	A	88.8	Confident	91.4	Very high	73 Å²	73	36.6 Å²	36.6	60%	0.603	20%	0.204	S	C	*	.	H	α-helix	trans	-66.8	-47.9	179.2	0	0	0	0	0	112.1	G661 F665 E666	G661-A663 VanDerWaalsContact C-N 3.34Å; G661-A663 PolarHBondContact O-N 2.91Å; A663-F665 VanDerWaalsContact C-N 3.28Å; A663-F665 PolarHBondContact O-N 3.49Å; A663-E666 PolarHBondContact O-N 2.98Å
664	N	88.8	Confident	91.1	Very high	52 Å²	52	38.6 Å²	38.6	28%	0.278	22%	0.217	S	C	.	.	H	α-helix	trans	-69.6	-28.5	177.2	-59.6	-33.1	0	0	0	111.7	L660 E666 L667 V668 F811	L660-N664 HydrophobicContact CD1-CB 3.63Å; L660-N664 HydrophobicContact CG-CB 4.11Å; L660-N664 VanDerWaalsContact O-CB 3.3Å; L660-N664 WeakPolarHBondContact O-CB 3.12Å; L660-N664 PolarHBondContact O-ND2 3.28Å; N664-E666 VanDerWaalsContact C-N 3.27Å; N664-E666 PolarHBondContact O-N 3.27Å; N664-L667 WeakPolarHBondContact O-CA 3.23Å; N664-L667 WeakPolarHBondContact O-CB 3.5Å; N664-L667 PolarHBondContact O-N 3.38Å; N664-V668 WeakPolarHBondContact O-CG2 3.46Å; N664-V668 PolarHBondContact O-N 2.75Å; N664-F811 HydrophobicContact CB-CD1 4.03Å; N664-F811 HydrophobicContact CB-CD2 4.17Å; N664-F811 HydrophobicContact CB-CE1 3.89Å; N664-F811 HydrophobicContact CB-CE2 4.04Å; N664-F811 HydrophobicContact CB-CG 4.2Å; N664-F811 HydrophobicContact CB-CZ 3.94Å
665	F	92.1	Very high	90.8	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-33.3	173.9	-173.2	-108	0	0	0	112.8	I654 L660 G661 P662 A663 V668 K669 Q692 M719 Y721	I654-F665 HydrophobicContact CG2-CE2 4.2Å; L660-F665 HydrophobicContact CD2-CB 4.01Å; L660-F665 HydrophobicContact CD2-CD2 3.77Å; L660-F665 HydrophobicContact CD2-CG 4.4Å; L660-F665 HydrophobicContact CG-CB 4.47Å; G661-F665 WeakPolarHBondContact O-CB 3.43Å; G661-F665 PolarHBondContact O-N 3.38Å; G661-F665 VanDerWaalsContact O-N 3.11Å; P662-F665 PolarHBondContact O-N 3.28Å; A663-F665 VanDerWaalsContact C-N 3.28Å; A663-F665 PolarHBondContact O-N 3.49Å; F665-V668 PolarHBondContact O-N 3.48Å; F665-K669 PolarHBondContact O-N 2.84Å; F665-Q692 HydrophobicContact CE2-CG 4.39Å; F665-Q692 VanDerWaalsContact CE2-NE2 3.33Å; F665-Q692 HydrophobicContact CZ-CG 4.48Å; F665-M719 HydrophobicContact CE1-CB 4.37Å; F665-M719 HydrophobicContact CE2-CE 4.3Å; F665-M719 HydrophobicContact CZ-CB 4.25Å; F665-M719 HydrophobicContact CZ-CE 3.79Å; F665-Y721 HydrophobicContact CB-CD2 3.82Å; F665-Y721 HydrophobicContact CB-CE2 4.39Å; F665-Y721 HydrophobicContact CD1-CD2 4.15Å; F665-Y721 HydrophobicContact CD1-CG 4.42Å; F665-Y721 HydrophobicContact CD2-CD2 4.14Å; F665-Y721 AromaticContact CG-CD2 3.78Å; F665-Y721 HydrophobicContact CG-CD2 3.78Å; F665-Y721 HydrophobicContact CG-CG 4.47Å
666	E	92.8	Very high	90.7	Very high	89 Å²	89	38.6 Å²	38.6	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-67.5	-35	170.8	-65.2	-57.8	132.4	0	0	112.3	P662 A663 N664 V668 K669 Q670	P662-E666 PolarHBondContact O-N 3.33Å; A663-E666 PolarHBondContact O-N 2.98Å; N664-E666 VanDerWaalsContact C-N 3.27Å; N664-E666 PolarHBondContact O-N 3.27Å; E666-V668 VanDerWaalsContact C-N 3.32Å; E666-V668 PolarHBondContact O-N 3.08Å; E666-K669 WeakPolarHBondContact O-CB 3.12Å; E666-K669 PolarHBondContact O-N 3.47Å; E666-K669 WeakPolarHBondContact OE1-CE 3.39Å; E666-K669 IonicContact OE1-NZ 3.86Å; E666-K669 PolarHBondContact OE1-NZ 2.03Å; E666-K669 WeakPolarHBondContact OE2-CD 3.36Å; E666-K669 IonicContact OE2-NZ 3.94Å; E666-Q670 WeakPolarHBondContact O-CG 3.35Å; E666-Q670 PolarHBondContact O-N 3.26Å
667	L	90.8	Very high	90.5	Very high	58 Å²	58	42.8 Å²	42.8	30%	0.304	24%	0.24	S	C	.	.	H	α-helix	trans	-65	-36.5	171.4	-56.9	177.8	0	0	0	111.5	N664 Q670 F671 F811	N664-L667 WeakPolarHBondContact O-CA 3.23Å; N664-L667 WeakPolarHBondContact O-CB 3.5Å; N664-L667 PolarHBondContact O-N 3.38Å; L667-Q670 WeakPolarHBondContact O-CB 3.32Å; L667-Q670 PolarHBondContact O-N 3.23Å; L667-F671 PolarHBondContact O-N 3.17Å; L667-F811 HydrophobicContact CB-CD1 4.45Å; L667-F811 HydrophobicContact CD1-CB 3.7Å; L667-F811 HydrophobicContact CD1-CD1 4.46Å; L667-F811 HydrophobicContact CD1-CG 4.33Å
668	V	92.3	Very high	90.1	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-66.3	-38.3	174.3	179.5	0	0	0	0	111.9	I654 L660 N664 F665 E666 F671 V672 F757 F811 M814	I654-V668 HydrophobicContact CD1-CG1 4.2Å; I654-V668 HydrophobicContact CG2-CG1 3.57Å; L660-V668 HydrophobicContact CD1-CG2 4.21Å; L660-V668 HydrophobicContact CD2-CG2 4.21Å; N664-V668 WeakPolarHBondContact O-CG2 3.46Å; N664-V668 PolarHBondContact O-N 2.75Å; F665-V668 PolarHBondContact O-N 3.48Å; E666-V668 VanDerWaalsContact C-N 3.32Å; E666-V668 PolarHBondContact O-N 3.08Å; V668-F671 WeakPolarHBondContact O-CB 3.38Å; V668-F671 PolarHBondContact O-N 3.5Å; V668-V672 WeakPolarHBondContact O-CG2 3.45Å; V668-V672 PolarHBondContact O-N 3.26Å; V668-F757 HydrophobicContact CG1-CD1 4.03Å; V668-F757 HydrophobicContact CG1-CE1 4.33Å; V668-F757 HydrophobicContact CG1-CG 4.32Å; V668-F757 HydrophobicContact CG2-CD1 3.89Å; V668-F757 HydrophobicContact CG2-CE1 3.36Å; V668-F757 HydrophobicContact CG2-CE2 4.46Å; V668-F757 HydrophobicContact CG2-CZ 3.7Å; V668-F811 HydrophobicContact CG2-CE1 4.02Å; V668-M814 HydrophobicContact CG2-CE 4.05Å
669	K	94.4	Very high	89.9	Confident	14 Å²	14	37 Å²	37	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-60.5	-44.9	170.2	-71.1	173.9	176.6	177.3	0	111.7	F665 E666 F671 V672 N673 V716 N717 M719	F665-K669 PolarHBondContact O-N 2.84Å; E666-K669 WeakPolarHBondContact O-CB 3.12Å; E666-K669 PolarHBondContact O-N 3.47Å; E666-K669 WeakPolarHBondContact OE1-CE 3.39Å; E666-K669 IonicContact OE1-NZ 3.86Å; E666-K669 PolarHBondContact OE1-NZ 2.03Å; E666-K669 WeakPolarHBondContact OE2-CD 3.36Å; E666-K669 IonicContact OE2-NZ 3.94Å; K669-F671 VanDerWaalsContact C-N 3.31Å; K669-F671 PolarHBondContact O-N 2.84Å; K669-V672 PolarHBondContact O-N 2.95Å; K669-N673 WeakPolarHBondContact O-CB 3.22Å; K669-N673 VanDerWaalsContact O-CG 3.27Å; K669-N673 PolarHBondContact O-N 2.74Å; K669-N673 PolarHBondContact O-ND2 3.31Å; K669-V716 HydrophobicContact CB-CG1 3.91Å; K669-V716 WeakPolarHBondContact CE-O 3.47Å; K669-V716 HydrophobicContact CG-CG1 4.07Å; K669-N717 PolarHBondContact NZ-O 2.87Å; K669-M719 WeakPolarHBondContact CE-O 3.42Å; K669-M719 PolarHBondContact NZ-O 2.62Å
670	Q	92.1	Very high	89.8	Confident	123 Å²	123	36.9 Å²	36.9	58%	0.575	21%	0.213	S	C	*	.	H	α-helix	trans	-61.4	-39.3	176.1	-68.8	173.7	19.5	0	0	111.9	E666 L667 N673 S674	E666-Q670 WeakPolarHBondContact O-CG 3.35Å; E666-Q670 PolarHBondContact O-N 3.26Å; L667-Q670 WeakPolarHBondContact O-CB 3.32Å; L667-Q670 PolarHBondContact O-N 3.23Å; Q670-N673 PolarHBondContact O-N 3.39Å; Q670-S674 WeakPolarHBondContact O-CB 3.31Å; Q670-S674 PolarHBondContact O-N 2.04Å
671	F	91.9	Very high	89.9	Confident	5 Å²	5	37.4 Å²	37.4	2%	0.022	22%	0.216	C	C	.	.	H	α-helix	trans	-59.4	-52	172.6	167	-94.9	0	0	0	112.1	F652 L667 V668 K669 N673 S674 I675 I755 L783 M814 T818 L821	F652-F671 HydrophobicContact CE1-CE1 4.44Å; L667-F671 PolarHBondContact O-N 3.17Å; V668-F671 WeakPolarHBondContact O-CB 3.38Å; V668-F671 PolarHBondContact O-N 3.5Å; K669-F671 VanDerWaalsContact C-N 3.31Å; K669-F671 PolarHBondContact O-N 2.84Å; F671-N673 VanDerWaalsContact C-N 3.34Å; F671-N673 PolarHBondContact O-N 2.87Å; F671-S674 PolarHBondContact O-N 2.87Å; F671-S674 VanDerWaalsContact O-N 3.15Å; F671-I675 HydrophobicContact CE1-CG1 4.29Å; F671-I675 HydrophobicContact CE2-CD1 4.24Å; F671-I675 HydrophobicContact CE2-CG1 4.06Å; F671-I675 HydrophobicContact CZ-CD1 4.34Å; F671-I675 HydrophobicContact CZ-CG1 3.9Å; F671-I675 WeakPolarHBondContact O-CG1 3.37Å; F671-I675 PolarHBondContact O-N 3.24Å; F671-I755 HydrophobicContact CE1-CG2 4.46Å; F671-L783 HydrophobicContact CE1-CD2 3.94Å; F671-L783 HydrophobicContact CE2-CD2 3.73Å; F671-L783 HydrophobicContact CZ-CD2 3.25Å; F671-M814 HydrophobicContact CB-CE 4.35Å; F671-M814 HydrophobicContact CB-CG 4.35Å; F671-M814 HydrophobicContact CB-SD 3.66Å; F671-M814 HydrophobicContact CD2-CG 3.99Å; F671-M814 HydrophobicContact CD2-SD 4.36Å; F671-M814 HydrophobicContact CG-CG 4.45Å; F671-M814 HydrophobicContact CG-SD 4.24Å; F671-T818 VanDerWaalsContact CD2-OG1 3.3Å; F671-T818 WeakPolarHBondContact CD2-OG1 3.4Å; F671-L821 HydrophobicContact CE2-CD2 4.29Å; F671-L821 HydrophobicContact CZ-CD2 3.76Å
672	V	94.3	Very high	89.8	Confident	2 Å²	2	38 Å²	38	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-47.2	178.1	174	0	0	0	0	110.5	F652 I654 V668 K669 S674 I675 V676 L690 V716	F652-V672 HydrophobicContact CD1-CG1 4.47Å; F652-V672 HydrophobicContact CD1-CG2 4.03Å; F652-V672 HydrophobicContact CD2-CG1 4.13Å; F652-V672 HydrophobicContact CE1-CG1 4.38Å; F652-V672 HydrophobicContact CE1-CG2 4.24Å; F652-V672 HydrophobicContact CE2-CG1 4.03Å; F652-V672 HydrophobicContact CG-CG1 4.35Å; F652-V672 HydrophobicContact CG-CG2 4.41Å; F652-V672 HydrophobicContact CZ-CG1 4.16Å; I654-V672 HydrophobicContact CD1-CG2 3.93Å; I654-V672 HydrophobicContact CG1-CG2 4.35Å; V668-V672 WeakPolarHBondContact O-CG2 3.45Å; V668-V672 PolarHBondContact O-N 3.26Å; K669-V672 PolarHBondContact O-N 2.95Å; V672-S674 VanDerWaalsContact C-N 3.33Å; V672-S674 PolarHBondContact O-N 3.38Å; V672-I675 PolarHBondContact O-N 2.02Å; V672-V676 HydrophobicContact CG1-CG2 4.4Å; V672-V676 WeakPolarHBondContact O-CG2 3.22Å; V672-V676 PolarHBondContact O-N 3.2Å; V672-L690 HydrophobicContact CG1-CD1 3.98Å; V672-L690 HydrophobicContact CG2-CD1 4.37Å; V672-V716 HydrophobicContact CB-CG1 4.19Å; V672-V716 HydrophobicContact CG1-CG1 4.18Å; V672-V716 HydrophobicContact CG1-CG2 3.72Å
673	N	94.7	Very high	89.6	Confident	19 Å²	19	41.9 Å²	41.9	10%	0.102	22%	0.222	C	C	.	.	H	α-helix	trans	-58.1	-44.1	176	-72.1	-21.6	0	0	0	111.9	K669 Q670 F671 I675 V676 D677 K713 V716 N717	K669-N673 WeakPolarHBondContact O-CB 3.22Å; K669-N673 VanDerWaalsContact O-CG 3.27Å; K669-N673 PolarHBondContact O-N 2.74Å; K669-N673 PolarHBondContact O-ND2 3.31Å; Q670-N673 PolarHBondContact O-N 3.39Å; F671-N673 VanDerWaalsContact C-N 3.34Å; F671-N673 PolarHBondContact O-N 2.87Å; N673-I675 VanDerWaalsContact C-N 3.33Å; N673-I675 PolarHBondContact O-N 3.44Å; N673-V676 PolarHBondContact O-N 2.88Å; N673-V676 VanDerWaalsContact O-N 3.16Å; N673-D677 PolarHBondContact O-N 2.93Å; N673-K713 HydrophobicContact CB-CD 4.26Å; N673-K713 HydrophobicContact CB-CG 4.26Å; N673-K713 WeakPolarHBondContact OD1-CA 3.27Å; N673-K713 WeakPolarHBondContact OD1-CG 3.48Å; N673-V716 WeakPolarHBondContact OD1-CB 3.39Å; N673-V716 WeakPolarHBondContact OD1-CG1 3.43Å; N673-N717 PolarHBondContact ND2-OD1 2.94Å
674	S	90.3	Very high	88.9	Confident	41 Å²	41	45.5 Å²	45.5	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-63.7	-36.7	178.8	-164.8	0	0	0	0	112.5	Q670 F671 V672 S678 K822	Q670-S674 WeakPolarHBondContact O-CB 3.31Å; Q670-S674 PolarHBondContact O-N 2.04Å; F671-S674 PolarHBondContact O-N 2.87Å; F671-S674 VanDerWaalsContact O-N 3.15Å; V672-S674 VanDerWaalsContact C-N 3.33Å; V672-S674 PolarHBondContact O-N 3.38Å; S674-S678 PolarHBondContact O-OG 3.03Å; S674-K822 WeakPolarHBondContact O-CE 3.37Å; S674-K822 PolarHBondContact O-NZ 2.94Å; S674-K822 PolarHBondContact OG-NZ 3.3Å
675	I	89.9	Confident	88.6	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-67.2	-46.4	172.2	-61.4	-61.8	0	0	0	110.1	F652 F671 V672 N673 D677 S678 L679 T818 L821 K822 M825	F652-I675 HydrophobicContact CE1-CB 4.47Å; F652-I675 HydrophobicContact CE1-CG2 4.39Å; F652-I675 HydrophobicContact CZ-CB 4.03Å; F652-I675 HydrophobicContact CZ-CG2 3.79Å; F671-I675 HydrophobicContact CE1-CG1 4.29Å; F671-I675 HydrophobicContact CE2-CD1 4.24Å; F671-I675 HydrophobicContact CE2-CG1 4.06Å; F671-I675 HydrophobicContact CZ-CD1 4.34Å; F671-I675 HydrophobicContact CZ-CG1 3.9Å; F671-I675 WeakPolarHBondContact O-CG1 3.37Å; F671-I675 PolarHBondContact O-N 3.24Å; V672-I675 PolarHBondContact O-N 2.02Å; N673-I675 VanDerWaalsContact C-N 3.33Å; N673-I675 PolarHBondContact O-N 3.44Å; I675-D677 VanDerWaalsContact C-N 3.31Å; I675-D677 PolarHBondContact O-N 3.45Å; I675-S678 PolarHBondContact O-N 3.28Å; I675-L679 HydrophobicContact CG2-CD1 4.09Å; I675-L679 WeakPolarHBondContact O-CG 3.49Å; I675-T818 HydrophobicContact CD1-CG2 4.01Å; I675-L821 HydrophobicContact CD1-CD2 3.98Å; I675-L821 HydrophobicContact CD1-CG 4.44Å; I675-K822 HydrophobicContact CD1-CG 3.88Å; I675-M825 HydrophobicContact CG2-CE 4.47Å; I675-M825 HydrophobicContact CG2-SD 4.25Å
676	V	91.4	Very high	88.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-38.4	178	168.6	0	0	0	0	112.5	F652 V672 N673 S678 L679 V681 A709 V712 K713	F652-V676 HydrophobicContact CE2-CG2 4.36Å; V672-V676 HydrophobicContact CG1-CG2 4.4Å; V672-V676 WeakPolarHBondContact O-CG2 3.22Å; V672-V676 PolarHBondContact O-N 3.2Å; N673-V676 PolarHBondContact O-N 2.88Å; N673-V676 VanDerWaalsContact O-N 3.16Å; V676-S678 PolarHBondContact O-N 3.04Å; V676-S678 VanDerWaalsContact O-N 3.14Å; V676-L679 PolarHBondContact O-N 3.43Å; V676-V681 HydrophobicContact CG1-CG2 4.22Å; V676-A709 HydrophobicContact CG1-CB 3.9Å; V676-V712 HydrophobicContact CG1-CB 4.3Å; V676-V712 HydrophobicContact CG1-CG1 4.14Å; V676-V712 HydrophobicContact CG2-CG1 3.82Å; V676-K713 HydrophobicContact CB-CG 4.46Å; V676-K713 HydrophobicContact CG1-CD 4.5Å; V676-K713 HydrophobicContact CG1-CG 3.93Å
677	D	88.6	Confident	88.5	Confident	89 Å²	89	42.7 Å²	42.7	48%	0.476	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.6	174.5	-75.6	-35.7	0	0	0	113.7	N673 I675 K713	N673-D677 PolarHBondContact O-N 2.93Å; I675-D677 VanDerWaalsContact C-N 3.31Å; I675-D677 PolarHBondContact O-N 3.45Å; D677-K713 WeakPolarHBondContact OD1-CD 3.33Å; D677-K713 WeakPolarHBondContact OD1-CE 3.27Å; D677-K713 IonicContact OD1-NZ 2.63Å; D677-K713 PolarHBondContact OD1-NZ 3.44Å
678	S	82.6	Confident	88.8	Confident	31 Å²	31	39.9 Å²	39.9	22%	0.217	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	7.5	177.3	-54.8	0	0	0	0	113.3	C643 S674 I675 V676 K822	C643-S678 WeakPolarHBondContact CB-O 3.18Å; S674-S678 PolarHBondContact O-OG 3.03Å; I675-S678 PolarHBondContact O-N 3.28Å; V676-S678 PolarHBondContact O-N 3.04Å; V676-S678 VanDerWaalsContact O-N 3.14Å; S678-K822 WeakPolarHBondContact OG-CD 3.45Å; S678-K822 WeakPolarHBondContact OG-CE 3.24Å; S678-K822 PolarHBondContact OG-NZ 3.26Å
679	L	83.6	Confident	89	Confident	11 Å²	11	40 Å²	40	6%	0.058	20%	0.199	C	C	.	.	S	Bend	trans	-116.9	138	-177.3	-63.9	173.2	0	0	0	111.3	C643 M648 L650 I675 V676 V681 T686 M825	C643-L679 HydrophobicContact CB-CD2 4Å; M648-L679 HydrophobicContact CE-CD2 3.7Å; L650-L679 HydrophobicContact CD2-CD1 3.43Å; L650-L679 VanDerWaalsContact CD2-CD1 3.43Å; I675-L679 HydrophobicContact CG2-CD1 4.09Å; I675-L679 WeakPolarHBondContact O-CG 3.49Å; V676-L679 PolarHBondContact O-N 3.43Å; L679-V681 VanDerWaalsContact C-N 3.28Å; L679-V681 HydrophobicContact CB-CG2 3.97Å; L679-V681 PolarHBondContact O-N 3.39Å; L679-T686 HydrophobicContact CB-CG2 4.43Å; L679-T686 HydrophobicContact CD1-CG2 4.26Å; L679-M825 HydrophobicContact CD2-CE 4.44Å
680	N	83.6	Confident	89.2	Confident	65 Å²	65	39.3 Å²	39.3	35%	0.348	20%	0.196	S	C	.	.			trans	-77.1	80.7	166.3	-175.4	-0.2	0	0	0	110.5	C643 H644 S682 V685 T686	C643-N680 PolarHBondContact O-N 2.9Å; H644-N680 HydrophobicContact CB-CB 4.04Å; H644-N680 WeakPolarHBondContact O-CB 3.44Å; H644-N680 PolarHBondContact O-ND2 2.83Å; N680-S682 PolarHBondContact O-N 2.84Å; N680-V685 HydrophobicContact CB-CG1 4.26Å; N680-T686 VanDerWaalsContact O-CB 3.31Å; N680-T686 WeakPolarHBondContact O-CB 3.16Å; N680-T686 PolarHBondContact O-N 2.92Å
681	V	88.4	Confident	89.5	Confident	12 Å²	12	33.5 Å²	33.5	7%	0.073	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-74.4	110.9	179.5	-179.2	0	0	0	0	110.3	V676 L679 T686 V688 A709 V712	V676-V681 HydrophobicContact CG1-CG2 4.22Å; L679-V681 VanDerWaalsContact C-N 3.28Å; L679-V681 HydrophobicContact CB-CG2 3.97Å; L679-V681 PolarHBondContact O-N 3.39Å; V681-T686 CarbonylContact C-O 3.54Å; V681-T686 VanDerWaalsContact CA-O 3.31Å; V681-T686 WeakPolarHBondContact CA-O 3.36Å; V681-V688 HydrophobicContact CG1-CG2 4.23Å; V681-V688 HydrophobicContact CG2-CG2 3.79Å; V681-A709 HydrophobicContact CB-CB 4.03Å; V681-A709 HydrophobicContact CG2-CB 4.12Å; V681-V712 HydrophobicContact CG1-CG2 4.09Å
682	S	86.2	Confident	89.7	Confident	28 Å²	28	33.2 Å²	33.2	20%	0.196	17%	0.168	C	C	.	.	S	Bend	trans	-155.7	162.7	174.6	72.4	0	0	0	0	111.4	N680 M684 V685 T686 A707	N680-S682 PolarHBondContact O-N 2.84Å; S682-M684 PolarHBondContact O-N 2.04Å; S682-M684 PolarHBondContact OG-N 3.45Å; S682-V685 PolarHBondContact O-N 2.87Å; S682-V685 PolarHBondContact OG-N 3.37Å; S682-T686 PolarHBondContact N-O 3.4Å; S682-T686 CarbonylContact O-C 3.59Å; S682-A707 WeakPolarHBondContact CA-O 3.48Å
683	R	84.4	Confident	89.7	Confident	165 Å²	165	33.1 Å²	33.1	62%	0.623	17%	0.167	S	C	*	.	S	Bend	trans	-57.9	-21.2	175.3	-70	-178.1	175.4	173.6	1.1	113.7	R687 A707	R683-R687 PolarHBondContact O-NE 2.77Å; R683-R687 VanDerWaalsContact O-NE 3.07Å; R683-R687 PolarHBondContact O-NH2 2.93Å; R683-A707 HydrophobicContact CG-CB 3.86Å
684	M	73.8	Confident	89.6	Confident	149 Å²	149	32.3 Å²	32.3	73%	0.734	16%	0.163	S	C	*	.	S	Bend	trans	-101.3	-34.6	-175.5	-59.2	-57.2	-71.5	0	0	113.3	S682 R747	S682-M684 PolarHBondContact O-N 2.04Å; S682-M684 PolarHBondContact OG-N 3.45Å; M684-R747 VanDerWaalsContact C-NH1 3.33Å; M684-R747 PolarHBondContact O-NH1 2.88Å
685	V	83.4	Confident	89.5	Confident	28 Å²	28	33.3 Å²	33.3	17%	0.17	17%	0.168	C	C	.	.	S	Bend	trans	-103	-94.1	-175.1	-171.8	0	0	0	0	110.7	G646 V647 M648 N680 S682 R747	G646-V685 WeakPolarHBondContact O-CG1 3.29Å; V647-V685 WeakPolarHBondContact CA-O 3.45Å; M648-V685 PolarHBondContact N-O 3.27Å; N680-V685 HydrophobicContact CB-CG1 4.26Å; S682-V685 PolarHBondContact O-N 2.87Å; S682-V685 PolarHBondContact OG-N 3.37Å; V685-R747 PolarHBondContact O-NH1 3.48Å; V685-R747 VanDerWaalsContact O-NH1 3.08Å; V685-R747 PolarHBondContact O-NH2 2.92Å
686	T	88.9	Confident	89.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.7	178.4	-60.9	0	0	0	0	111.6	M648 L679 N680 V681 S682 V688	M648-T686 HydrophobicContact CE-CG2 4.4Å; M648-T686 HydrophobicContact CG-CG2 3.87Å; M648-T686 WeakPolarHBondContact O-CA 3.38Å; L679-T686 HydrophobicContact CB-CG2 4.43Å; L679-T686 HydrophobicContact CD1-CG2 4.26Å; N680-T686 VanDerWaalsContact O-CB 3.31Å; N680-T686 WeakPolarHBondContact O-CB 3.16Å; N680-T686 PolarHBondContact O-N 2.92Å; V681-T686 CarbonylContact C-O 3.54Å; V681-T686 VanDerWaalsContact CA-O 3.31Å; V681-T686 WeakPolarHBondContact CA-O 3.36Å; S682-T686 PolarHBondContact N-O 3.4Å; S682-T686 CarbonylContact O-C 3.59Å; T686-V688 HydrophobicContact CG2-CG2 4.01Å
687	R	93.8	Very high	89.7	Confident	54 Å²	54	42.7 Å²	42.7	20%	0.204	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.6	166.7	-68	-179.8	-173.5	-170.5	-1.4	109.3	M648 L650 R683 L703 G745	M648-R687 PolarHBondContact O-N 3.29Å; L650-R687 PolarHBondContact N-O 3.43Å; R683-R687 PolarHBondContact O-NE 2.77Å; R683-R687 VanDerWaalsContact O-NE 3.07Å; R683-R687 PolarHBondContact O-NH2 2.93Å; R687-L703 HydrophobicContact CB-CB 4.16Å; R687-L703 HydrophobicContact CB-CD2 3.89Å; R687-L703 WeakPolarHBondContact O-CD2 3.43Å; R687-G745 WeakPolarHBondContact CD-O 3.15Å; R687-G745 PolarHBondContact NH1-O 2.72Å
688	V	96.1	Very high	90	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	124.8	-178.4	-171.7	0	0	0	0	109.8	L650 F652 V681 T686 F701 V712	L650-V688 CarbonylContact O-C 3.59Å; L650-V688 WeakPolarHBondContact O-CA 3.44Å; F652-V688 HydrophobicContact CD2-CG1 3.82Å; F652-V688 HydrophobicContact CE2-CG1 3.73Å; V681-V688 HydrophobicContact CG1-CG2 4.23Å; V681-V688 HydrophobicContact CG2-CG2 3.79Å; T686-V688 HydrophobicContact CG2-CG2 4.01Å; V688-F701 HydrophobicContact CG1-CE2 4.25Å; V688-V712 HydrophobicContact CB-CG1 4.37Å; V688-V712 HydrophobicContact CB-CG2 4.32Å; V688-V712 HydrophobicContact CG1-CG1 4.14Å
689	G	97.3	Very high	90.6	Very high	2 Å²	2	43.7 Å²	43.7	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	159.1	168.1	0	0	0	0	0	110.4	L650 V651 F652 F701	L650-G689 PolarHBondContact O-N 3.24Å; V651-G689 WeakPolarHBondContact CA-O 3.38Å; F652-G689 PolarHBondContact N-O 3.41Å; G689-F701 WeakPolarHBondContact CA-O 3.39Å
690	L	98.4	Very high	91.2	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	132	176.8	-169.1	151.7	0	0	0	111	F652 I654 V672 E700 F701 V716 M719	F652-L690 HydrophobicContact CB-CB 4.27Å; F652-L690 HydrophobicContact CB-CD1 3.87Å; F652-L690 HydrophobicContact CB-CG 3.79Å; F652-L690 HydrophobicContact CG-CD1 4.43Å; F652-L690 WeakPolarHBondContact O-CA 2.97Å; I654-L690 HydrophobicContact CG1-CD1 4.14Å; I654-L690 HydrophobicContact CG1-CD2 4.39Å; I654-L690 HydrophobicContact CG1-CG 4.24Å; V672-L690 HydrophobicContact CG1-CD1 3.98Å; V672-L690 HydrophobicContact CG2-CD1 4.37Å; L690-E700 HydrophobicContact CD2-CB 3.86Å; L690-E700 HydrophobicContact CD2-CG 3.44Å; L690-E700 VanDerWaalsContact CD2-CG 3.44Å; L690-E700 PolarHBondContact O-N 3.25Å; L690-F701 HydrophobicContact CB-CD1 4.27Å; L690-F701 HydrophobicContact CB-CD2 4.37Å; L690-F701 HydrophobicContact CB-CE1 3.68Å; L690-F701 HydrophobicContact CB-CE2 3.79Å; L690-F701 HydrophobicContact CB-CZ 3.4Å; L690-F701 HydrophobicContact CD1-CE1 4.39Å; L690-F701 HydrophobicContact CD1-CZ 4.19Å; L690-F701 HydrophobicContact CG-CZ 4.4Å; L690-F701 PolarHBondContact N-O 3.22Å; L690-F701 PolarHBondContact O-N 3.16Å; L690-V716 HydrophobicContact CD1-CG2 4.17Å; L690-M719 HydrophobicContact CD1-CE 4.33Å; L690-M719 HydrophobicContact CD1-SD 3.83Å; L690-M719 HydrophobicContact CD2-CE 3.48Å; L690-M719 VanDerWaalsContact CD2-CE 3.48Å; L690-M719 HydrophobicContact CD2-SD 3.58Å; L690-M719 VanDerWaalsContact CD2-SD 3.58Å; L690-M719 HydrophobicContact CG-SD 4.38Å
691	I	97.6	Very high	91.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139	166.7	72.2	177.4	0	0	0	109.7	F652 V653 I654 V697 R698 T699 A731 M735 S739	F652-I691 PolarHBondContact O-N 3Å; V653-I691 HydrophobicContact CB-CD1 4.43Å; V653-I691 HydrophobicContact CB-CG1 4.15Å; V653-I691 HydrophobicContact CG1-CD1 4.04Å; V653-I691 HydrophobicContact CG1-CG1 4.04Å; V653-I691 HydrophobicContact CG2-CD1 3.89Å; V653-I691 HydrophobicContact CG2-CG1 3.88Å; I654-I691 PolarHBondContact N-O 3.3Å; I691-V697 HydrophobicContact CB-CG1 4.29Å; I691-V697 HydrophobicContact CD1-CG1 3.97Å; I691-V697 HydrophobicContact CG1-CG1 4.46Å; I691-R698 CarbonylContact C-O 3.54Å; I691-R698 VanDerWaalsContact CA-O 3.31Å; I691-R698 WeakPolarHBondContact CA-O 3.37Å; I691-T699 HydrophobicContact CG2-CG2 4.39Å; I691-A731 HydrophobicContact CD1-CB 4.46Å; I691-A731 WeakPolarHBondContact CD1-O 3.45Å; I691-M735 HydrophobicContact CD1-CB 3.88Å; I691-S739 WeakPolarHBondContact CG2-OG 3.25Å
692	Q	96.8	Very high	92.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	142.2	170.7	-168.9	-176.3	-2.6	0	0	108.7	I654 F665 R698 E700 M719 Q720 M722	I654-Q692 CarbonylContact O-C 3.53Å; I654-Q692 WeakPolarHBondContact O-CA 3.36Å; F665-Q692 HydrophobicContact CE2-CG 4.39Å; F665-Q692 VanDerWaalsContact CE2-NE2 3.33Å; F665-Q692 HydrophobicContact CZ-CG 4.48Å; Q692-R698 PolarHBondContact N-O 2.99Å; Q692-R698 PolarHBondContact O-N 3.15Å; Q692-E700 HydrophobicContact CB-CG 4.1Å; Q692-E700 WeakPolarHBondContact CB-OE1 3.35Å; Q692-E700 PolarHBondContact OE1-OE1 3.43Å; Q692-E700 VanDerWaalsContact OE1-OE1 3.08Å; Q692-M719 HydrophobicContact CB-CE 4.37Å; Q692-M719 HydrophobicContact CG-CE 4.42Å; Q692-Q720 PolarHBondContact NE2-O 3.43Å; Q692-Q720 PolarHBondContact OE1-O 2.94Å; Q692-Q720 VanDerWaalsContact OE1-O 3.06Å; Q692-M722 HydrophobicContact CB-SD 4.44Å; Q692-M722 HydrophobicContact CG-CG 4.48Å; Q692-M722 HydrophobicContact CG-SD 3.91Å
693	F	94.9	Very high	92.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.6	177.1	72.7	-87.1	0	0	0	113.5	V653 I654 D655 G656 K696 V697 T728 A731	V653-F693 HydrophobicContact CG1-CD1 3.83Å; V653-F693 HydrophobicContact CG1-CE1 3.85Å; I654-F693 VanDerWaalsContact C-CD1 3.46Å; I654-F693 VanDerWaalsContact C-CE1 3.44Å; I654-F693 VanDerWaalsContact O-CD1 3.25Å; I654-F693 WeakPolarHBondContact O-CD1 3.47Å; I654-F693 PolarHBondContact O-N 3.45Å; D655-F693 HydrophobicContact CB-CE1 3.91Å; D655-F693 HydrophobicContact CB-CE2 4.11Å; D655-F693 HydrophobicContact CB-CZ 3.58Å; G656-F693 WeakPolarHBondContact CA-O 3.35Å; G656-F693 PolarHBondContact N-O 3.22Å; F693-K696 CarbonylContact C-O 3.49Å; F693-K696 WeakPolarHBondContact CA-O 3.47Å; F693-V697 HydrophobicContact CB-CG2 4.19Å; F693-T728 HydrophobicContact CE2-CG2 4.48Å; F693-T728 WeakPolarHBondContact CE2-OG1 3.39Å; F693-T728 HydrophobicContact CZ-CG2 4.1Å; F693-A731 HydrophobicContact CB-CB 3.63Å; F693-A731 HydrophobicContact CD1-CB 3.61Å; F693-A731 HydrophobicContact CD2-CB 4.14Å; F693-A731 HydrophobicContact CE1-CB 4.27Å; F693-A731 HydrophobicContact CG-CB 3.53Å
694	S	92.3	Very high	93	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	19%	0.185	C	C	.	.	S	Bend	trans	-149.7	-118.6	165.8	57.3	0	0	0	0	108.3	K696 M722 G725 M727	S694-K696 PolarHBondContact N-O 3.31Å; S694-K696 PolarHBondContact O-N 2.86Å; S694-M722 WeakPolarHBondContact OG-CB 3.44Å; S694-M722 WeakPolarHBondContact OG-CE 3.45Å; S694-M722 PolarHBondContact OG-SD 3.27Å; S694-M722 VanDerWaalsContact OG-SD 3.37Å; S694-G725 CarbonylContact C-O 3.6Å; S694-G725 WeakPolarHBondContact CA-O 3.33Å; S694-G725 VanDerWaalsContact CB-O 3.23Å; S694-G725 WeakPolarHBondContact CB-O 3.35Å; S694-M727 VanDerWaalsContact O-CB 3.28Å; S694-M727 WeakPolarHBondContact O-CB 3.25Å; S694-M727 WeakPolarHBondContact O-CG 3.38Å; S694-M727 PolarHBondContact O-N 2.83Å
695	T	88.6	Confident	94	Very high	63 Å²	63	33.3 Å²	33.3	39%	0.387	17%	0.173	S	C	.	.	S	Bend	trans	-69.3	-12.4	162.7	42.4	0	0	0	0	113.6	R724 G725	T695-R724 HydrophobicContact CG2-CB 3.92Å; T695-R724 VanDerWaalsContact OG1-CB 3.27Å; T695-R724 WeakPolarHBondContact OG1-CB 3.33Å; T695-R724 VanDerWaalsContact OG1-CD 3.22Å; T695-R724 WeakPolarHBondContact OG1-CD 3.37Å; T695-G725 PolarHBondContact N-O 2.81Å
696	K	89.5	Confident	94.5	Very high	159 Å²	159	33.7 Å²	33.7	69%	0.691	17%	0.173	S	C	*	.	S	Bend	trans	-138.8	153.2	176.1	-66.3	-171.7	177.3	-173.5	0	108.3	F693 S694 M722	F693-K696 CarbonylContact C-O 3.49Å; F693-K696 WeakPolarHBondContact CA-O 3.47Å; S694-K696 PolarHBondContact N-O 3.31Å; S694-K696 PolarHBondContact O-N 2.86Å; K696-M722 HydrophobicContact CB-CE 4.43Å
697	V	95.1	Very high	94.5	Very high	38 Å²	38	35.4 Å²	35.4	23%	0.23	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	137.9	172.7	-170.6	0	0	0	0	108.7	I691 F693 A731 H734	I691-V697 HydrophobicContact CB-CG1 4.29Å; I691-V697 HydrophobicContact CD1-CG1 3.97Å; I691-V697 HydrophobicContact CG1-CG1 4.46Å; F693-V697 HydrophobicContact CB-CG2 4.19Å; V697-A731 HydrophobicContact CG2-CB 4.14Å; V697-H734 HydrophobicContact CB-CB 4.34Å; V697-H734 HydrophobicContact CG1-CB 3.87Å; V697-H734 HydrophobicContact CG2-CB 4.4Å
698	R	94.1	Very high	94.3	Very high	86 Å²	86	34.7 Å²	34.7	33%	0.325	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.3	173.8	-173.8	173.4	67.9	-166.9	-6.2	108.7	I691 Q692 E700 Q720	I691-R698 CarbonylContact C-O 3.54Å; I691-R698 VanDerWaalsContact CA-O 3.31Å; I691-R698 WeakPolarHBondContact CA-O 3.37Å; Q692-R698 PolarHBondContact N-O 2.99Å; Q692-R698 PolarHBondContact O-N 3.15Å; R698-E700 IonicContact CZ-OE1 2.91Å; R698-E700 IonicContact CZ-OE2 3.08Å; R698-E700 IonicContact NE-OE1 2.69Å; R698-E700 PolarHBondContact NE-OE1 3.11Å; R698-E700 IonicContact NE-OE2 2.68Å; R698-E700 IonicContact NH2-OE1 3.14Å; R698-E700 PolarHBondContact NH2-OE1 3.37Å; R698-E700 IonicContact NH2-OE2 2.65Å; R698-E700 PolarHBondContact NH2-OE2 2.95Å; R698-Q720 PolarHBondContact NH2-O 3.47Å
699	T	96.1	Very high	94	Very high	55 Å²	55	35.9 Å²	35.9	34%	0.337	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	120.8	164.3	-54.2	0	0	0	0	108.1	I691 H734	I691-T699 HydrophobicContact CG2-CG2 4.39Å; T699-H734 PolarHBondContact OG1-CE1 3.34Å; T699-H734 VanDerWaalsContact OG1-CE1 3.25Å
700	E	96.8	Very high	93.8	Very high	43 Å²	43	41.7 Å²	41.7	20%	0.201	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-42.5	172.4	-56.5	-59.6	137.3	0	0	109.8	L690 Q692 R698 M719	L690-E700 HydrophobicContact CD2-CB 3.86Å; L690-E700 HydrophobicContact CD2-CG 3.44Å; L690-E700 VanDerWaalsContact CD2-CG 3.44Å; L690-E700 PolarHBondContact O-N 3.25Å; Q692-E700 HydrophobicContact CB-CG 4.1Å; Q692-E700 WeakPolarHBondContact CB-OE1 3.35Å; Q692-E700 PolarHBondContact OE1-OE1 3.43Å; Q692-E700 VanDerWaalsContact OE1-OE1 3.08Å; R698-E700 IonicContact CZ-OE1 2.91Å; R698-E700 IonicContact CZ-OE2 3.08Å; R698-E700 IonicContact NE-OE1 2.69Å; R698-E700 PolarHBondContact NE-OE1 3.11Å; R698-E700 IonicContact NE-OE2 2.68Å; R698-E700 IonicContact NH2-OE1 3.14Å; R698-E700 PolarHBondContact NH2-OE1 3.37Å; R698-E700 IonicContact NH2-OE2 2.65Å; R698-E700 PolarHBondContact NH2-OE2 2.95Å; E700-M719 HydrophobicContact CB-CG 4.29Å; E700-M719 HydrophobicContact CG-CE 4.12Å; E700-M719 HydrophobicContact CG-CG 3.86Å; E700-M719 HydrophobicContact CG-SD 4.14Å
701	F	97.4	Very high	93.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	150.1	171.7	51.8	-91.7	0	0	0	111.9	V688 G689 L690 Q705 H706 V712 A715 V716	V688-F701 HydrophobicContact CG1-CE2 4.25Å; G689-F701 WeakPolarHBondContact CA-O 3.39Å; L690-F701 HydrophobicContact CB-CD1 4.27Å; L690-F701 HydrophobicContact CB-CD2 4.37Å; L690-F701 HydrophobicContact CB-CE1 3.68Å; L690-F701 HydrophobicContact CB-CE2 3.79Å; L690-F701 HydrophobicContact CB-CZ 3.4Å; L690-F701 HydrophobicContact CD1-CE1 4.39Å; L690-F701 HydrophobicContact CD1-CZ 4.19Å; L690-F701 HydrophobicContact CG-CZ 4.4Å; L690-F701 PolarHBondContact N-O 3.22Å; L690-F701 PolarHBondContact O-N 3.16Å; F701-Q705 HydrophobicContact CB-CB 4.3Å; F701-Q705 VanDerWaalsContact CB-CD 3.49Å; F701-Q705 HydrophobicContact CB-CG 4.29Å; F701-H706 AromaticContact CD2-CD2 3.75Å; F701-H706 AromaticContact CG-CD2 3.61Å; F701-H706 AromaticContact CG-NE2 3.93Å; F701-V712 HydrophobicContact CE2-CG1 4.01Å; F701-V712 HydrophobicContact CZ-CG1 3.81Å; F701-A715 HydrophobicContact CD1-CB 3.63Å; F701-A715 HydrophobicContact CE1-CB 3.79Å; F701-A715 HydrophobicContact CG-CB 4.47Å; F701-V716 HydrophobicContact CE1-CG2 4Å; F701-V716 HydrophobicContact CZ-CG2 3.97Å
702	S	96.8	Very high	93.6	Very high	22 Å²	22	44.2 Å²	44.2	15%	0.154	24%	0.243	C	C	.	.			trans	-94.9	166	179.4	68.5	0	0	0	0	113.3	G704 Q705 E744	S702-G704 PolarHBondContact O-N 2.95Å; S702-G704 VanDerWaalsContact O-N 3.15Å; S702-Q705 WeakPolarHBondContact O-CB 3.39Å; S702-Q705 PolarHBondContact O-N 3.28Å; S702-E744 WeakPolarHBondContact CB-O 3.41Å; S702-E744 WeakPolarHBondContact CB-OE2 3.01Å; S702-E744 PolarHBondContact OG-OE2 3.35Å
703	L	95.1	Very high	93.6	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.8	-178.4	-70.4	164.1	0	0	0	113	D649 L650 V651 R687 S739 F740 E744 A746	D649-L703 HydrophobicContact CB-CD1 4Å; D649-L703 HydrophobicContact CB-CD2 4.03Å; L650-L703 WeakPolarHBondContact O-CD2 3.39Å; V651-L703 HydrophobicContact CG2-CD1 4.17Å; V651-L703 HydrophobicContact CG2-CD2 4.12Å; V651-L703 HydrophobicContact CG2-CG 4.17Å; R687-L703 HydrophobicContact CB-CB 4.16Å; R687-L703 HydrophobicContact CB-CD2 3.89Å; R687-L703 WeakPolarHBondContact O-CD2 3.43Å; L703-S739 VanDerWaalsContact CD1-O 3.27Å; L703-S739 WeakPolarHBondContact CD1-O 3.42Å; L703-F740 HydrophobicContact CD1-CD1 4.1Å; L703-F740 HydrophobicContact CD1-CE1 4.37Å; L703-E744 WeakPolarHBondContact CB-O 3.36Å; L703-E744 PolarHBondContact N-O 2.78Å; L703-A746 HydrophobicContact CD1-CB 3.76Å
704	G	91.4	Very high	93.7	Very high	39 Å²	39	52.5 Å²	52.5	40%	0.402	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.5	177.8	0	0	0	0	0	115.2	S702 E744	S702-G704 PolarHBondContact O-N 2.95Å; S702-G704 VanDerWaalsContact O-N 3.15Å; G704-E744 PolarHBondContact N-O 2.84Å
705	Q	93.9	Very high	93.9	Very high	104 Å²	104	53.3 Å²	53.3	49%	0.486	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-43.1	-164.3	-173.5	172.3	-37.3	0	0	113.7	F701 S702	F701-Q705 HydrophobicContact CB-CB 4.3Å; F701-Q705 VanDerWaalsContact CB-CD 3.49Å; F701-Q705 HydrophobicContact CB-CG 4.29Å; S702-Q705 WeakPolarHBondContact O-CB 3.39Å; S702-Q705 PolarHBondContact O-N 3.28Å
706	H	94.6	Very high	94.3	Very high	36 Å²	36	50.3 Å²	50.3	17%	0.167	26%	0.264	C	S	.	.			trans	-113.2	132.3	-176	-64.3	-65.4	0	0	0	111.7	F701 D711 V712	F701-H706 AromaticContact CD2-CD2 3.75Å; F701-H706 AromaticContact CG-CD2 3.61Å; F701-H706 AromaticContact CG-NE2 3.93Å; H706-D711 HydrophobicContact CB-CB 4.29Å; H706-V712 HydrophobicContact CB-CG2 3.62Å
707	A	87.8	Confident	94.6	Very high	37 Å²	37	47 Å²	47	31%	0.306	25%	0.254	S	S	.	.			trans	-105.9	-4.6	-173.2	0	0	0	0	0	114.1	S682 R683	S682-A707 WeakPolarHBondContact CA-O 3.48Å; R683-A707 HydrophobicContact CG-CB 3.86Å
708	A	89.6	Confident	94.6	Very high	39 Å²	39	52 Å²	52	32%	0.322	27%	0.274	S	S	.	.	S	Bend	trans	-145.6	148.5	-177.8	0	0	0	0	0	111	Q710 D711 V712	A708-Q710 PolarHBondContact O-N 3.47Å; A708-D711 PolarHBondContact O-N 2.82Å; A708-D711 VanDerWaalsContact O-N 3.12Å; A708-V712 PolarHBondContact O-N 3.42Å
709	A	90.8	Very high	94.6	Very high	25 Å²	25	48.2 Å²	48.2	21%	0.207	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-36.1	-179	0	0	0	0	0	113.2	V676 V681 D711 V712 K713	V676-A709 HydrophobicContact CG1-CB 3.9Å; V681-A709 HydrophobicContact CB-CB 4.03Å; V681-A709 HydrophobicContact CG2-CB 4.12Å; A709-D711 VanDerWaalsContact C-N 3.33Å; A709-D711 PolarHBondContact O-N 3.44Å; A709-V712 PolarHBondContact O-N 3.36Å; A709-K713 WeakPolarHBondContact O-CG 3.36Å; A709-K713 PolarHBondContact O-N 2.78Å
710	Q	93.3	Very high	94.5	Very high	123 Å²	123	52.3 Å²	52.3	58%	0.575	28%	0.276	S	S	*	.	H	α-helix	trans	-66.1	-32.1	179.8	-64.7	-67.2	2.4	0	0	113.3	A708 K713 R714	A708-Q710 PolarHBondContact O-N 3.47Å; Q710-K713 VanDerWaalsContact OE1-CE 3.23Å; Q710-R714 WeakPolarHBondContact O-CB 3.43Å; Q710-R714 PolarHBondContact O-N 2.89Å; Q710-R714 VanDerWaalsContact O-N 3.11Å
711	D	95	Very high	94.3	Very high	54 Å²	54	53.6 Å²	53.6	29%	0.289	28%	0.279	S	S	.	.	H	α-helix	trans	-77	-38	177.2	-61.3	-40	0	0	0	111.1	H706 A708 A709 R714 A715	H706-D711 HydrophobicContact CB-CB 4.29Å; A708-D711 PolarHBondContact O-N 2.82Å; A708-D711 VanDerWaalsContact O-N 3.12Å; A709-D711 VanDerWaalsContact C-N 3.33Å; A709-D711 PolarHBondContact O-N 3.44Å; D711-R714 PolarHBondContact O-N 2.83Å; D711-R714 IonicContact OD1-CZ 3.24Å; D711-R714 IonicContact OD1-NH1 2.93Å; D711-R714 IonicContact OD1-NH2 2.84Å; D711-R714 PolarHBondContact OD1-NH2 3.37Å; D711-A715 PolarHBondContact O-N 2.87Å
712	V	96.3	Very high	94	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-57.7	-50.6	171	176.3	0	0	0	0	110.3	V676 V681 V688 F701 H706 A708 A709 R714 A715 V716	V676-V712 HydrophobicContact CG1-CB 4.3Å; V676-V712 HydrophobicContact CG1-CG1 4.14Å; V676-V712 HydrophobicContact CG2-CG1 3.82Å; V681-V712 HydrophobicContact CG1-CG2 4.09Å; V688-V712 HydrophobicContact CB-CG1 4.37Å; V688-V712 HydrophobicContact CB-CG2 4.32Å; V688-V712 HydrophobicContact CG1-CG1 4.14Å; F701-V712 HydrophobicContact CE2-CG1 4.01Å; F701-V712 HydrophobicContact CZ-CG1 3.81Å; H706-V712 HydrophobicContact CB-CG2 3.62Å; A708-V712 PolarHBondContact O-N 3.42Å; A709-V712 PolarHBondContact O-N 3.36Å; V712-R714 VanDerWaalsContact C-N 3.29Å; V712-R714 PolarHBondContact O-N 2.84Å; V712-A715 PolarHBondContact O-N 2.69Å; V712-A715 VanDerWaalsContact O-N 3.17Å; V712-V716 HydrophobicContact CG1-CG2 4.34Å; V712-V716 VanDerWaalsContact O-CG2 3.31Å; V712-V716 WeakPolarHBondContact O-CG2 3.4Å; V712-V716 PolarHBondContact O-N 2.96Å
713	K	96.9	Very high	93.5	Very high	35 Å²	35	55.8 Å²	55.8	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-36.7	178.2	-68.6	-171	-63.7	-175.7	0	112.8	N673 V676 D677 A709 Q710 V716 N717	N673-K713 HydrophobicContact CB-CD 4.26Å; N673-K713 HydrophobicContact CB-CG 4.26Å; N673-K713 WeakPolarHBondContact OD1-CA 3.27Å; N673-K713 WeakPolarHBondContact OD1-CG 3.48Å; V676-K713 HydrophobicContact CB-CG 4.46Å; V676-K713 HydrophobicContact CG1-CD 4.5Å; V676-K713 HydrophobicContact CG1-CG 3.93Å; D677-K713 WeakPolarHBondContact OD1-CD 3.33Å; D677-K713 WeakPolarHBondContact OD1-CE 3.27Å; D677-K713 IonicContact OD1-NZ 2.63Å; D677-K713 PolarHBondContact OD1-NZ 3.44Å; A709-K713 WeakPolarHBondContact O-CG 3.36Å; A709-K713 PolarHBondContact O-N 2.78Å; Q710-K713 VanDerWaalsContact OE1-CE 3.23Å; K713-V716 PolarHBondContact O-N 2.89Å; K713-N717 WeakPolarHBondContact O-CB 3.13Å; K713-N717 PolarHBondContact O-N 2.88Å; K713-N717 PolarHBondContact O-ND2 2.73Å; K713-N717 PolarHBondContact O-OD1 3.21Å
714	R	96.3	Very high	93.1	Very high	140 Å²	140	64 Å²	64	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175.1	-162.7	-175.3	-48.8	147.4	24.4	111.6	Q710 D711 V712 N717 Q718	Q710-R714 WeakPolarHBondContact O-CB 3.43Å; Q710-R714 PolarHBondContact O-N 2.89Å; Q710-R714 VanDerWaalsContact O-N 3.11Å; D711-R714 PolarHBondContact O-N 2.83Å; D711-R714 IonicContact OD1-CZ 3.24Å; D711-R714 IonicContact OD1-NH1 2.93Å; D711-R714 IonicContact OD1-NH2 2.84Å; D711-R714 PolarHBondContact OD1-NH2 3.37Å; V712-R714 VanDerWaalsContact C-N 3.29Å; V712-R714 PolarHBondContact O-N 2.84Å; R714-N717 PolarHBondContact O-N 3.05Å; R714-Q718 VanDerWaalsContact O-CG 3.31Å; R714-Q718 WeakPolarHBondContact O-CG 3.43Å; R714-Q718 PolarHBondContact O-N 2.74Å
715	A	96.6	Very high	92.8	Very high	18 Å²	18	62.8 Å²	62.8	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-44.1	176.1	0	0	0	0	0	111.8	F701 D711 V712 N717 Q718 M719	F701-A715 HydrophobicContact CD1-CB 3.63Å; F701-A715 HydrophobicContact CE1-CB 3.79Å; F701-A715 HydrophobicContact CG-CB 4.47Å; D711-A715 PolarHBondContact O-N 2.87Å; V712-A715 PolarHBondContact O-N 2.69Å; V712-A715 VanDerWaalsContact O-N 3.17Å; A715-N717 PolarHBondContact O-N 3.29Å; A715-Q718 PolarHBondContact O-N 2.94Å; A715-Q718 VanDerWaalsContact O-N 3.16Å; A715-M719 PolarHBondContact O-N 2.86Å
716	V	97.4	Very high	92.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58	-46.1	175.7	171.4	0	0	0	0	111.7	K669 V672 N673 L690 F701 V712 K713 Q718 M719	K669-V716 HydrophobicContact CB-CG1 3.91Å; K669-V716 WeakPolarHBondContact CE-O 3.47Å; K669-V716 HydrophobicContact CG-CG1 4.07Å; V672-V716 HydrophobicContact CB-CG1 4.19Å; V672-V716 HydrophobicContact CG1-CG1 4.18Å; V672-V716 HydrophobicContact CG1-CG2 3.72Å; N673-V716 WeakPolarHBondContact OD1-CB 3.39Å; N673-V716 WeakPolarHBondContact OD1-CG1 3.43Å; L690-V716 HydrophobicContact CD1-CG2 4.17Å; F701-V716 HydrophobicContact CE1-CG2 4Å; F701-V716 HydrophobicContact CZ-CG2 3.97Å; V712-V716 HydrophobicContact CG1-CG2 4.34Å; V712-V716 VanDerWaalsContact O-CG2 3.31Å; V712-V716 WeakPolarHBondContact O-CG2 3.4Å; V712-V716 PolarHBondContact O-N 2.96Å; K713-V716 PolarHBondContact O-N 2.89Å; V716-Q718 VanDerWaalsContact C-N 3.25Å; V716-Q718 PolarHBondContact O-N 3.44Å; V716-M719 HydrophobicContact CB-SD 4.35Å; V716-M719 HydrophobicContact CG1-SD 4.28Å; V716-M719 HydrophobicContact CG2-SD 4.43Å; V716-M719 WeakPolarHBondContact O-CB 3.19Å; V716-M719 WeakPolarHBondContact O-CG 3.34Å; V716-M719 PolarHBondContact O-N 2.83Å; V716-M719 VanDerWaalsContact O-N 3.16Å
717	N	95.4	Very high	92.2	Very high	90 Å²	90	58.7 Å²	58.7	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-32.9	178.8	-69.4	-11.2	0	0	0	112.5	K669 N673 K713 R714 A715 M719	K669-N717 PolarHBondContact NZ-O 2.87Å; N673-N717 PolarHBondContact ND2-OD1 2.94Å; K713-N717 WeakPolarHBondContact O-CB 3.13Å; K713-N717 PolarHBondContact O-N 2.88Å; K713-N717 PolarHBondContact O-ND2 2.73Å; K713-N717 PolarHBondContact O-OD1 3.21Å; R714-N717 PolarHBondContact O-N 3.05Å; A715-N717 PolarHBondContact O-N 3.29Å; N717-M719 VanDerWaalsContact C-N 3.32Å; N717-M719 PolarHBondContact O-N 2.87Å
718	Q	95.3	Very high	92.5	Very high	141 Å²	141	56.9 Å²	56.9	66%	0.659	28%	0.28	S	S	*	.	H	α-helix	trans	-77.9	-9.8	178.5	-71.4	174.1	-10	0	0	114.2	R714 A715 V716 Q720	R714-Q718 VanDerWaalsContact O-CG 3.31Å; R714-Q718 WeakPolarHBondContact O-CG 3.43Å; R714-Q718 PolarHBondContact O-N 2.74Å; A715-Q718 PolarHBondContact O-N 2.94Å; A715-Q718 VanDerWaalsContact O-N 3.16Å; V716-Q718 VanDerWaalsContact C-N 3.25Å; V716-Q718 PolarHBondContact O-N 3.44Å; Q718-Q720 PolarHBondContact O-N 3.25Å
719	M	94.9	Very high	92.6	Very high	8 Å²	8	55.1 Å²	55.1	4%	0.039	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-58.4	134.3	179.3	-67.3	169.7	50	0	0	112	F665 K669 L690 Q692 E700 A715 V716 N717	F665-M719 HydrophobicContact CE1-CB 4.37Å; F665-M719 HydrophobicContact CE2-CE 4.3Å; F665-M719 HydrophobicContact CZ-CB 4.25Å; F665-M719 HydrophobicContact CZ-CE 3.79Å; K669-M719 WeakPolarHBondContact CE-O 3.42Å; K669-M719 PolarHBondContact NZ-O 2.62Å; L690-M719 HydrophobicContact CD1-CE 4.33Å; L690-M719 HydrophobicContact CD1-SD 3.83Å; L690-M719 HydrophobicContact CD2-CE 3.48Å; L690-M719 VanDerWaalsContact CD2-CE 3.48Å; L690-M719 HydrophobicContact CD2-SD 3.58Å; L690-M719 VanDerWaalsContact CD2-SD 3.58Å; L690-M719 HydrophobicContact CG-SD 4.38Å; Q692-M719 HydrophobicContact CB-CE 4.37Å; Q692-M719 HydrophobicContact CG-CE 4.42Å; E700-M719 HydrophobicContact CB-CG 4.29Å; E700-M719 HydrophobicContact CG-CE 4.12Å; E700-M719 HydrophobicContact CG-CG 3.86Å; E700-M719 HydrophobicContact CG-SD 4.14Å; A715-M719 PolarHBondContact O-N 2.86Å; V716-M719 HydrophobicContact CB-SD 4.35Å; V716-M719 HydrophobicContact CG1-SD 4.28Å; V716-M719 HydrophobicContact CG2-SD 4.43Å; V716-M719 WeakPolarHBondContact O-CB 3.19Å; V716-M719 WeakPolarHBondContact O-CG 3.34Å; V716-M719 PolarHBondContact O-N 2.83Å; V716-M719 VanDerWaalsContact O-N 3.16Å; N717-M719 VanDerWaalsContact C-N 3.32Å; N717-M719 PolarHBondContact O-N 2.87Å
720	Q	93.1	Very high	92.7	Very high	141 Å²	141	56.5 Å²	56.5	66%	0.659	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-99.1	128.8	178.9	-66.3	-177.3	-7.5	0	0	111.5	Q692 R698 Q718	Q692-Q720 PolarHBondContact NE2-O 3.43Å; Q692-Q720 PolarHBondContact OE1-O 2.94Å; Q692-Q720 VanDerWaalsContact OE1-O 3.06Å; R698-Q720 PolarHBondContact NH2-O 3.47Å; Q718-Q720 PolarHBondContact O-N 3.25Å
721	Y	93.6	Very high	92.8	Very high	69 Å²	69	50.6 Å²	50.6	27%	0.271	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-60.7	135.7	175	175.4	-111.8	0	0	0	112.2	S657 K658 G661 P662 F665	S657-Y721 VanDerWaalsContact O-CE2 3.23Å; S657-Y721 WeakPolarHBondContact O-CE2 3.31Å; S657-Y721 PolarHBondContact O-OH 3.17Å; K658-Y721 WeakPolarHBondContact CA-OH 3.33Å; G661-Y721 WeakPolarHBondContact CA-OH 3.36Å; G661-Y721 PolarHBondContact N-OH 3.39Å; G661-Y721 VanDerWaalsContact N-OH 3.16Å; P662-Y721 HydrophobicContact CB-CD1 3.99Å; P662-Y721 HydrophobicContact CB-CE1 4.21Å; P662-Y721 HydrophobicContact CB-CG 4.35Å; P662-Y721 HydrophobicContact CG-CE1 4.48Å; F665-Y721 HydrophobicContact CB-CD2 3.82Å; F665-Y721 HydrophobicContact CB-CE2 4.39Å; F665-Y721 HydrophobicContact CD1-CD2 4.15Å; F665-Y721 HydrophobicContact CD1-CG 4.42Å; F665-Y721 HydrophobicContact CD2-CD2 4.14Å; F665-Y721 AromaticContact CG-CD2 3.78Å; F665-Y721 HydrophobicContact CG-CD2 3.78Å; F665-Y721 HydrophobicContact CG-CG 4.47Å
722	M	91.1	Very high	92.9	Very high	48 Å²	48	48 Å²	48	24%	0.236	23%	0.233	C	C	.	.			trans	-97	-36.7	-173.5	-61.2	174.7	89.5	0	0	113.9	G656 Q692 S694 K696 R724	G656-M722 WeakPolarHBondContact O-CB 3.42Å; G656-M722 PolarHBondContact O-N 3.18Å; Q692-M722 HydrophobicContact CB-SD 4.44Å; Q692-M722 HydrophobicContact CG-CG 4.48Å; Q692-M722 HydrophobicContact CG-SD 3.91Å; S694-M722 WeakPolarHBondContact OG-CB 3.44Å; S694-M722 WeakPolarHBondContact OG-CE 3.45Å; S694-M722 PolarHBondContact OG-SD 3.27Å; S694-M722 VanDerWaalsContact OG-SD 3.37Å; K696-M722 HydrophobicContact CB-CE 4.43Å; M722-R724 PolarHBondContact O-N 3.01Å
723	G	86.1	Confident	92.9	Very high	23 Å²	23	54 Å²	54	24%	0.237	26%	0.255	C	S	.	.			trans	65.3	31.5	170.4	0	0	0	0	0	116.8	G656 K658	G656-G723 PolarHBondContact O-N 3.28Å; K658-G723 WeakPolarHBondContact CB-O 3.18Å
724	R	85.6	Confident	92.9	Very high	173 Å²	173	54.4 Å²	54.4	65%	0.653	26%	0.258	S	S	*	.	B	Isolated β-bridge	trans	-115.8	-155.2	179.8	-62.3	-172.8	-178.4	-132	0.5	112.4	S657 K658 T695 M722	S657-R724 CarbonylContact C-O 3.56Å; S657-R724 VanDerWaalsContact CA-O 3.25Å; S657-R724 WeakPolarHBondContact CA-O 3.31Å; S657-R724 VanDerWaalsContact CB-O 3.26Å; S657-R724 WeakPolarHBondContact CB-O 3.44Å; K658-R724 WeakPolarHBondContact CB-O 3.31Å; K658-R724 PolarHBondContact N-O 3.4Å; T695-R724 HydrophobicContact CG2-CB 3.92Å; T695-R724 VanDerWaalsContact OG1-CB 3.27Å; T695-R724 WeakPolarHBondContact OG1-CB 3.33Å; T695-R724 VanDerWaalsContact OG1-CD 3.22Å; T695-R724 WeakPolarHBondContact OG1-CD 3.37Å; M722-R724 PolarHBondContact O-N 3.01Å
725	G	85.6	Confident	92.9	Very high	15 Å²	15	47.8 Å²	47.8	16%	0.155	23%	0.232	C	C	.	.			trans	-67.6	-177.2	175.8	0	0	0	0	0	113.7	S657 S694 T695	S657-G725 VanDerWaalsContact CB-O 3.31Å; S657-G725 WeakPolarHBondContact CB-O 3.46Å; S694-G725 CarbonylContact C-O 3.6Å; S694-G725 WeakPolarHBondContact CA-O 3.33Å; S694-G725 VanDerWaalsContact CB-O 3.23Å; S694-G725 WeakPolarHBondContact CB-O 3.35Å; T695-G725 PolarHBondContact N-O 2.81Å
726	S	85.9	Confident	92.9	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.042	24%	0.239	C	C	.	.			trans	-117.3	113.1	174.9	-60.4	0	0	0	0	110.3	D655 S657 S762 Q763	D655-S726 PolarHBondContact OD2-OG 3.5Å; S657-S726 WeakPolarHBondContact CB-OG 3.42Å; S657-S726 PolarHBondContact OG-OG 3.47Å; S657-S726 VanDerWaalsContact OG-OG 3.07Å; S726-S762 PolarHBondContact O-OG 2.96Å; S726-Q763 WeakPolarHBondContact O-CB 3.44Å; S726-Q763 WeakPolarHBondContact O-CG 3.45Å; S726-Q763 PolarHBondContact O-N 2.82Å
727	M	90.6	Very high	92.7	Very high	47 Å²	47	54 Å²	54	23%	0.232	26%	0.257	C	S	.	.			trans	-115	70.3	176.1	-61.7	-72	178.3	0	0	109.7	S694 S730 A731 Q763 D764	S694-M727 VanDerWaalsContact O-CB 3.28Å; S694-M727 WeakPolarHBondContact O-CB 3.25Å; S694-M727 WeakPolarHBondContact O-CG 3.38Å; S694-M727 PolarHBondContact O-N 2.83Å; M727-S730 PolarHBondContact O-N 3.1Å; M727-A731 PolarHBondContact O-N 3.02Å; M727-A731 VanDerWaalsContact O-N 3.1Å; M727-Q763 HydrophobicContact CE-CB 3.79Å; M727-Q763 HydrophobicContact SD-CB 3.81Å; M727-D764 HydrophobicContact SD-CB 4.02Å
728	T	92.5	Very high	92.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.8	-38	-175.9	-50.3	0	0	0	0	111.5	F693 A731 L732 V756 S762 D764 V766 I796	F693-T728 HydrophobicContact CE2-CG2 4.48Å; F693-T728 WeakPolarHBondContact CE2-OG1 3.39Å; F693-T728 HydrophobicContact CZ-CG2 4.1Å; T728-A731 WeakPolarHBondContact O-CB 3.14Å; T728-A731 PolarHBondContact O-N 3.25Å; T728-A731 VanDerWaalsContact O-N 3.16Å; T728-L732 HydrophobicContact CG2-CD1 4.44Å; T728-L732 WeakPolarHBondContact O-CG 3.36Å; T728-L732 PolarHBondContact O-N 3.32Å; T728-V756 HydrophobicContact CG2-CG1 4.2Å; T728-S762 WeakPolarHBondContact CB-OG 3.43Å; T728-S762 PolarHBondContact N-OG 2.93Å; T728-S762 PolarHBondContact OG1-OG 3.42Å; T728-D764 PolarHBondContact N-OD1 3.27Å; T728-V766 HydrophobicContact CG2-CG1 4.02Å; T728-I796 HydrophobicContact CG2-CD1 3.83Å
729	G	92.3	Very high	92.6	Very high	2 Å²	2	48.3 Å²	48.3	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-44.1	177.4	0	0	0	0	0	112.3	A731 L732 R733 D764 D765	G729-A731 VanDerWaalsContact C-N 3.3Å; G729-A731 PolarHBondContact O-N 2.97Å; G729-L732 PolarHBondContact O-N 3.28Å; G729-R733 WeakPolarHBondContact O-CB 3.38Å; G729-R733 PolarHBondContact O-N 3.02Å; G729-D764 WeakPolarHBondContact CA-OD1 3.49Å; G729-D764 PolarHBondContact N-OD1 2.64Å; G729-D765 VanDerWaalsContact CA-O 3.25Å; G729-D765 WeakPolarHBondContact CA-O 3.26Å
730	S	93.8	Very high	92.6	Very high	53 Å²	53	48.7 Å²	48.7	37%	0.371	23%	0.229	S	C	.	.	H	α-helix	trans	-62.1	-36.4	172.5	-63.7	0	0	0	0	112.4	M727 H734 D764	M727-S730 PolarHBondContact O-N 3.1Å; S730-H734 WeakPolarHBondContact O-CB 3.47Å; S730-H734 PolarHBondContact O-N 2.82Å; S730-D764 VanDerWaalsContact CB-OD2 3.28Å; S730-D764 WeakPolarHBondContact CB-OD2 3.49Å; S730-D764 PolarHBondContact N-OD2 2.86Å; S730-D764 PolarHBondContact OG-OD2 2.77Å
731	A	95.8	Very high	92.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.6	-43.6	174.6	0	0	0	0	0	112.1	V653 I691 F693 V697 M727 T728 G729 H734 M735	V653-A731 HydrophobicContact CG1-CB 3.72Å; I691-A731 HydrophobicContact CD1-CB 4.46Å; I691-A731 WeakPolarHBondContact CD1-O 3.45Å; F693-A731 HydrophobicContact CB-CB 3.63Å; F693-A731 HydrophobicContact CD1-CB 3.61Å; F693-A731 HydrophobicContact CD2-CB 4.14Å; F693-A731 HydrophobicContact CE1-CB 4.27Å; F693-A731 HydrophobicContact CG-CB 3.53Å; V697-A731 HydrophobicContact CG2-CB 4.14Å; M727-A731 PolarHBondContact O-N 3.02Å; M727-A731 VanDerWaalsContact O-N 3.1Å; T728-A731 WeakPolarHBondContact O-CB 3.14Å; T728-A731 PolarHBondContact O-N 3.25Å; T728-A731 VanDerWaalsContact O-N 3.16Å; G729-A731 VanDerWaalsContact C-N 3.3Å; G729-A731 PolarHBondContact O-N 2.97Å; A731-H734 PolarHBondContact O-N 2.92Å; A731-M735 WeakPolarHBondContact O-CB 3.4Å; A731-M735 PolarHBondContact O-N 3.25Å
732	L	96.9	Very high	92.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.6	-43.4	173.8	-69.7	171.4	0	0	0	111.9	T728 G729 H734 M735 F736 V756 V766 W769 A770 M780 I796	T728-L732 HydrophobicContact CG2-CD1 4.44Å; T728-L732 WeakPolarHBondContact O-CG 3.36Å; T728-L732 PolarHBondContact O-N 3.32Å; G729-L732 PolarHBondContact O-N 3.28Å; L732-H734 PolarHBondContact O-N 2.92Å; L732-M735 HydrophobicContact CD2-CE 3.8Å; L732-M735 PolarHBondContact O-N 2.61Å; L732-F736 WeakPolarHBondContact O-CB 3.48Å; L732-F736 PolarHBondContact O-N 3.49Å; L732-V756 HydrophobicContact CD2-CG2 3.89Å; L732-V766 HydrophobicContact CD1-CB 3.98Å; L732-V766 HydrophobicContact CD1-CG1 4.36Å; L732-W769 HydrophobicContact CB-CB 3.81Å; L732-A770 HydrophobicContact CD1-CB 4.25Å; L732-M780 HydrophobicContact CD2-CE 3.53Å; L732-I796 HydrophobicContact CD1-CD1 4.33Å; L732-I796 HydrophobicContact CD1-CG1 4Å; L732-I796 HydrophobicContact CD2-CG2 4.42Å
733	R	96.1	Very high	92.5	Very high	124 Å²	124	53.6 Å²	53.6	47%	0.468	26%	0.255	S	S	.	.	H	α-helix	trans	-57.4	-48.4	172.7	177.4	175.9	172.3	174.7	-1.4	111.5	G729 F736 Q737 W769	G729-R733 WeakPolarHBondContact O-CB 3.38Å; G729-R733 PolarHBondContact O-N 3.02Å; R733-F736 PolarHBondContact O-N 2.97Å; R733-Q737 HydrophobicContact CG-CG 4.34Å; R733-Q737 VanDerWaalsContact CG-OE1 3.32Å; R733-Q737 WeakPolarHBondContact O-CB 3.46Å; R733-Q737 VanDerWaalsContact O-CG 3.31Å; R733-Q737 WeakPolarHBondContact O-CG 3.3Å; R733-Q737 PolarHBondContact O-N 2.97Å; R733-W769 HydrophobicContact CB-CB 4.45Å; R733-W769 HydrophobicContact CB-CD2 3.57Å; R733-W769 HydrophobicContact CB-CE3 4.04Å; R733-W769 HydrophobicContact CB-CG 3.71Å; R733-W769 HydrophobicContact CB-CZ2 4.46Å; R733-W769 HydrophobicContact CG-CD2 3.78Å; R733-W769 HydrophobicContact CG-CE3 3.97Å; R733-W769 HydrophobicContact CG-CG 4.43Å; R733-W769 HydrophobicContact CG-CH2 3.99Å; R733-W769 HydrophobicContact CG-CZ2 3.82Å; R733-W769 HydrophobicContact CG-CZ3 4.07Å
734	H	96.6	Very high	92.9	Very high	45 Å²	45	54.8 Å²	54.8	21%	0.208	25%	0.254	C	S	.	.	H	α-helix	trans	-63.7	-43.7	179.6	-174.1	-72.8	0	0	0	112.1	V697 T699 S730 A731 L732 F736 Q737 F738 S739	V697-H734 HydrophobicContact CB-CB 4.34Å; V697-H734 HydrophobicContact CG1-CB 3.87Å; V697-H734 HydrophobicContact CG2-CB 4.4Å; T699-H734 PolarHBondContact OG1-CE1 3.34Å; T699-H734 VanDerWaalsContact OG1-CE1 3.25Å; S730-H734 WeakPolarHBondContact O-CB 3.47Å; S730-H734 PolarHBondContact O-N 2.82Å; A731-H734 PolarHBondContact O-N 2.92Å; L732-H734 PolarHBondContact O-N 2.92Å; H734-F736 VanDerWaalsContact C-N 3.34Å; H734-F736 PolarHBondContact O-N 2.84Å; H734-Q737 PolarHBondContact O-N 3.34Å; H734-F738 AromaticContact CD2-CD2 3.71Å; H734-F738 AromaticContact CG-CD2 3.98Å; H734-F738 AromaticContact NE2-CD2 3.84Å; H734-F738 WeakPolarHBondContact O-CB 3.49Å; H734-F738 PolarHBondContact O-N 2.83Å; H734-S739 PolarHBondContact O-N 2.84Å
735	M	97	Very high	93.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-57.2	-47	175.2	171.1	-84.1	-63.4	0	0	111.5	V651 V653 I691 A731 L732 S739 F740 A773 M780	V651-M735 HydrophobicContact CG1-CG 4.13Å; V653-M735 HydrophobicContact CG2-CB 4.1Å; V653-M735 HydrophobicContact CG2-CG 4.04Å; I691-M735 HydrophobicContact CD1-CB 3.88Å; A731-M735 WeakPolarHBondContact O-CB 3.4Å; A731-M735 PolarHBondContact O-N 3.25Å; L732-M735 HydrophobicContact CD2-CE 3.8Å; L732-M735 PolarHBondContact O-N 2.61Å; M735-S739 WeakPolarHBondContact O-CB 3.49Å; M735-S739 PolarHBondContact O-N 3.01Å; M735-F740 HydrophobicContact CG-CD2 4.09Å; M735-F740 HydrophobicContact CG-CE2 3.95Å; M735-F740 PolarHBondContact O-N 3.31Å; M735-F740 HydrophobicContact SD-CD2 3.53Å; M735-F740 VanDerWaalsContact SD-CD2 3.53Å; M735-F740 HydrophobicContact SD-CE2 3.5Å; M735-F740 WeakPolarHBondContact SD-CE2 3Å; M735-A773 HydrophobicContact CE-CB 3.97Å; M735-M780 HydrophobicContact CE-CE 3.75Å; M735-M780 HydrophobicContact CE-SD 3.91Å
736	F	95.1	Very high	93.4	Very high	68 Å²	68	46.7 Å²	46.7	30%	0.298	22%	0.224	S	C	.	.	I	π-helix	trans	-67.7	-44.3	-179.6	-179.6	-97.3	0	0	0	113	L732 R733 H734 W769 K772 A773 A776	L732-F736 WeakPolarHBondContact O-CB 3.48Å; L732-F736 PolarHBondContact O-N 3.49Å; R733-F736 PolarHBondContact O-N 2.97Å; H734-F736 VanDerWaalsContact C-N 3.34Å; H734-F736 PolarHBondContact O-N 2.84Å; F736-W769 HydrophobicContact CB-CE3 4.44Å; F736-W769 AromaticContact CD1-CE3 3.93Å; F736-W769 HydrophobicContact CD1-CE3 3.93Å; F736-W769 AromaticContact CD1-CZ3 3.78Å; F736-W769 HydrophobicContact CD1-CZ3 3.78Å; F736-W769 HydrophobicContact CE1-CZ3 4.25Å; F736-W769 HydrophobicContact CG-CE3 4.39Å; F736-K772 HydrophobicContact CD2-CB 4.46Å; F736-K772 HydrophobicContact CE1-CB 4.39Å; F736-K772 HydrophobicContact CE2-CB 4.07Å; F736-K772 WeakPolarHBondContact CE2-O 3.32Å; F736-K772 HydrophobicContact CZ-CB 4.03Å; F736-A773 HydrophobicContact CD2-CB 4.04Å; F736-A776 HydrophobicContact CE2-CB 3.72Å; F736-A776 HydrophobicContact CZ-CB 4.44Å
737	Q	93.6	Very high	93.6	Very high	80 Å²	80	48 Å²	48	37%	0.374	23%	0.228	S	C	.	.	I	π-helix	trans	-79.7	-31.9	-174.8	-66.8	-168.8	-57.5	0	0	113.6	R733 H734 W769	R733-Q737 HydrophobicContact CG-CG 4.34Å; R733-Q737 VanDerWaalsContact CG-OE1 3.32Å; R733-Q737 WeakPolarHBondContact O-CB 3.46Å; R733-Q737 VanDerWaalsContact O-CG 3.31Å; R733-Q737 WeakPolarHBondContact O-CG 3.3Å; R733-Q737 PolarHBondContact O-N 2.97Å; H734-Q737 PolarHBondContact O-N 3.34Å; Q737-W769 HydrophobicContact CG-CZ3 4.11Å
738	F	94.8	Very high	93.3	Very high	102 Å²	102	51.3 Å²	51.3	45%	0.447	25%	0.246	S	C	.	.	I	π-helix	trans	-122.7	-53	-171	-54.5	-71.6	0	0	0	113.3	H734 F740 S741 E744	H734-F738 AromaticContact CD2-CD2 3.71Å; H734-F738 AromaticContact CG-CD2 3.98Å; H734-F738 AromaticContact NE2-CD2 3.84Å; H734-F738 WeakPolarHBondContact O-CB 3.49Å; H734-F738 PolarHBondContact O-N 2.83Å; F738-F740 VanDerWaalsContact C-N 3.28Å; F738-F740 PolarHBondContact O-N 3.14Å; F738-S741 VanDerWaalsContact O-CB 3.24Å; F738-S741 WeakPolarHBondContact O-CB 3.31Å; F738-S741 PolarHBondContact O-N 3.1Å; F738-S741 PolarHBondContact O-OG 3.17Å; F738-E744 WeakPolarHBondContact O-CB 3.49Å; F738-E744 WeakPolarHBondContact O-CG 3.07Å
739	S	94.6	Very high	92.6	Very high	11 Å²	11	58.8 Å²	58.8	8%	0.077	29%	0.286	C	S	.	.	I	π-helix	trans	-64.7	-28	-169.1	-53.9	0	0	0	0	114.2	I691 L703 H734 M735	I691-S739 WeakPolarHBondContact CG2-OG 3.25Å; L703-S739 VanDerWaalsContact CD1-O 3.27Å; L703-S739 WeakPolarHBondContact CD1-O 3.42Å; H734-S739 PolarHBondContact O-N 2.84Å; M735-S739 WeakPolarHBondContact O-CB 3.49Å; M735-S739 PolarHBondContact O-N 3.01Å
740	F	95	Very high	92.2	Very high	15 Å²	15	59.9 Å²	59.9	7%	0.066	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	17.7	172.3	-75.5	-63.5	0	0	0	114.7	D649 V651 L703 M735 F738 A746 R752 V753 C754 V778	D649-F740 HydrophobicContact CB-CE1 4.17Å; V651-F740 HydrophobicContact CB-CE1 4.41Å; V651-F740 HydrophobicContact CB-CE2 4.03Å; V651-F740 HydrophobicContact CB-CZ 3.77Å; V651-F740 HydrophobicContact CG2-CD1 4.2Å; V651-F740 HydrophobicContact CG2-CD2 4.43Å; V651-F740 HydrophobicContact CG2-CE1 3.66Å; V651-F740 HydrophobicContact CG2-CE2 3.93Å; V651-F740 HydrophobicContact CG2-CZ 3.51Å; L703-F740 HydrophobicContact CD1-CD1 4.1Å; L703-F740 HydrophobicContact CD1-CE1 4.37Å; M735-F740 HydrophobicContact CG-CD2 4.09Å; M735-F740 HydrophobicContact CG-CE2 3.95Å; M735-F740 PolarHBondContact O-N 3.31Å; M735-F740 HydrophobicContact SD-CD2 3.53Å; M735-F740 VanDerWaalsContact SD-CD2 3.53Å; M735-F740 HydrophobicContact SD-CE2 3.5Å; M735-F740 WeakPolarHBondContact SD-CE2 3Å; F738-F740 VanDerWaalsContact C-N 3.28Å; F738-F740 PolarHBondContact O-N 3.14Å; F740-A746 VanDerWaalsContact C-CB 3.43Å; F740-A746 VanDerWaalsContact O-CB 3.22Å; F740-A746 WeakPolarHBondContact O-CB 3.38Å; F740-R752 HydrophobicContact CD1-CB 3.97Å; F740-R752 HydrophobicContact CD1-CG 3.71Å; F740-R752 HydrophobicContact CE1-CB 3.66Å; F740-R752 HydrophobicContact CE1-CG 3.86Å; F740-R752 HydrophobicContact CG-CG 4.38Å; F740-R752 HydrophobicContact CZ-CB 4Å; F740-V753 WeakPolarHBondContact CZ-O 3.26Å; F740-C754 HydrophobicContact CE2-CB 4.41Å; F740-V778 HydrophobicContact CD2-CG1 4.45Å; F740-V778 HydrophobicContact CD2-CG2 4.29Å; F740-V778 HydrophobicContact CE2-CG1 3.75Å; F740-V778 HydrophobicContact CE2-CG2 4.38Å; F740-V778 HydrophobicContact CZ-CG1 4.16Å
741	S	93.1	Very high	91.8	Very high	35 Å²	35	59.3 Å²	59.3	25%	0.245	29%	0.288	C	S	.	.	S	Bend	trans	-81.4	152.7	172.9	74.9	0	0	0	0	112.2	F738 K743 E744 G745 A746	F738-S741 VanDerWaalsContact O-CB 3.24Å; F738-S741 WeakPolarHBondContact O-CB 3.31Å; F738-S741 PolarHBondContact O-N 3.1Å; F738-S741 PolarHBondContact O-OG 3.17Å; S741-K743 PolarHBondContact O-N 3.14Å; S741-E744 PolarHBondContact O-N 2.96Å; S741-E744 VanDerWaalsContact O-N 3.13Å; S741-E744 PolarHBondContact OG-N 2.65Å; S741-G745 PolarHBondContact O-N 3.16Å; S741-A746 WeakPolarHBondContact O-CB 3.03Å; S741-A746 PolarHBondContact O-N 3.4Å; S741-A746 VanDerWaalsContact O-N 3.13Å
742	E	90.9	Very high	91.7	Very high	140 Å²	140	62.6 Å²	62.6	65%	0.654	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-60.6	-32.5	176.6	-62.4	-175.3	169.7	0	0	112.2	E744 G745	E742-E744 VanDerWaalsContact C-N 3.32Å; E742-E744 PolarHBondContact O-N 2.95Å; E742-G745 PolarHBondContact O-N 2.85Å
743	K	91.9	Very high	91.5	Very high	186 Å²	186	62.8 Å²	62.8	81%	0.809	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-60.8	-40.1	175.5	-173.8	-168	172.3	-160	0	112.2	S741 G745	S741-K743 PolarHBondContact O-N 3.14Å; K743-G745 PolarHBondContact O-N 3.41Å
744	E	93.6	Very high	91.5	Very high	48 Å²	48	56.9 Å²	56.9	22%	0.224	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-83.2	5.2	177.1	-62.5	-51	137.5	0	0	112.8	S702 L703 G704 F738 S741 E742	S702-E744 WeakPolarHBondContact CB-O 3.41Å; S702-E744 WeakPolarHBondContact CB-OE2 3.01Å; S702-E744 PolarHBondContact OG-OE2 3.35Å; L703-E744 WeakPolarHBondContact CB-O 3.36Å; L703-E744 PolarHBondContact N-O 2.78Å; G704-E744 PolarHBondContact N-O 2.84Å; F738-E744 WeakPolarHBondContact O-CB 3.49Å; F738-E744 WeakPolarHBondContact O-CG 3.07Å; S741-E744 PolarHBondContact O-N 2.96Å; S741-E744 VanDerWaalsContact O-N 3.13Å; S741-E744 PolarHBondContact OG-N 2.65Å; E742-E744 VanDerWaalsContact C-N 3.32Å; E742-E744 PolarHBondContact O-N 2.95Å
745	G	90.3	Very high	91.5	Very high	11 Å²	11	54.8 Å²	54.8	11%	0.113	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.5	11.3	172.6	0	0	0	0	0	115.5	R687 S741 E742 K743	R687-G745 WeakPolarHBondContact CD-O 3.15Å; R687-G745 PolarHBondContact NH1-O 2.72Å; S741-G745 PolarHBondContact O-N 3.16Å; E742-G745 PolarHBondContact O-N 2.85Å; K743-G745 PolarHBondContact O-N 3.41Å
746	A	92	Very high	91.4	Very high	7 Å²	7	54.8 Å²	54.8	6%	0.058	27%	0.269	C	S	.	.			trans	-66.8	149.1	169.9	0	0	0	0	0	111.6	D649 L703 F740 S741	D649-A746 WeakPolarHBondContact OD2-CA 3.22Å; L703-A746 HydrophobicContact CD1-CB 3.76Å; F740-A746 VanDerWaalsContact C-CB 3.43Å; F740-A746 VanDerWaalsContact O-CB 3.22Å; F740-A746 WeakPolarHBondContact O-CB 3.38Å; S741-A746 WeakPolarHBondContact O-CB 3.03Å; S741-A746 PolarHBondContact O-N 3.4Å; S741-A746 VanDerWaalsContact O-N 3.13Å
747	R	89.6	Confident	91.4	Very high	34 Å²	34	51.6 Å²	51.6	13%	0.128	26%	0.255	C	S	.	.			trans	-106.7	143.2	-177.3	-69.1	173.2	-76	-179.3	0.5	111.2	M648 D649 M684 V685 V750	M648-R747 PolarHBondContact O-NH2 3.43Å; D649-R747 IonicContact OD1-CZ 3.57Å; D649-R747 IonicContact OD1-NE 2.75Å; D649-R747 PolarHBondContact OD1-NE 3.1Å; D649-R747 IonicContact OD1-NH2 3.88Å; D649-R747 PolarHBondContact OD1-NH2 3.45Å; D649-R747 PolarHBondContact OD2-N 2.81Å; D649-R747 IonicContact OD2-NE 3.87Å; M684-R747 VanDerWaalsContact C-NH1 3.33Å; M684-R747 PolarHBondContact O-NH1 2.88Å; V685-R747 PolarHBondContact O-NH1 3.48Å; V685-R747 VanDerWaalsContact O-NH1 3.08Å; V685-R747 PolarHBondContact O-NH2 2.92Å; R747-V750 HydrophobicContact CB-CB 3.88Å; R747-V750 HydrophobicContact CB-CG2 3.52Å; R747-V750 HydrophobicContact CG-CG2 4.44Å
748	L	83.6	Confident	91.3	Very high	116 Å²	116	47.8 Å²	47.8	61%	0.607	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	139.6	172	-166.7	66.7	0	0	0	110.3	V750	L748-V750 PolarHBondContact O-N 3.01Å
749	N	78.1	Confident	90.8	Very high	158 Å²	158	43.5 Å²	43.5	85%	0.845	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	18.7	179.2	-55.2	-35.3	0	0	0	116.1
750	V	84.1	Confident	89.9	Confident	24 Å²	24	43.4 Å²	43.4	15%	0.145	22%	0.22	C	C	.	.	S	Bend	trans	-98.7	136.8	172	170.9	0	0	0	0	109.9	V647 D649 R747 L748 R752	V647-V750 HydrophobicContact CG1-CG1 4.01Å; V647-V750 HydrophobicContact CG1-CG2 3.9Å; D649-V750 HydrophobicContact CB-CG1 4.43Å; R747-V750 HydrophobicContact CB-CB 3.88Å; R747-V750 HydrophobicContact CB-CG2 3.52Å; R747-V750 HydrophobicContact CG-CG2 4.44Å; L748-V750 PolarHBondContact O-N 3.01Å; V750-R752 PolarHBondContact O-N 3.35Å
751	P	86.3	Confident	89.3	Confident	42 Å²	42	51.3 Å²	51.3	27%	0.273	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-52.1	125.6	172.4	-28.4	34.7	0	0	0	112.6	V647 M648 D649	V647-P751 WeakPolarHBondContact O-CD 3.45Å; M648-P751 WeakPolarHBondContact CA-O 3.35Å; D649-P751 PolarHBondContact N-O 2.72Å
752	R	92	Very high	89	Confident	68 Å²	68	50.2 Å²	50.2	26%	0.257	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.2	177.1	-64.7	176.3	-175	142.9	-2.5	109.3	F740 V750 V778 T779	F740-R752 HydrophobicContact CD1-CB 3.97Å; F740-R752 HydrophobicContact CD1-CG 3.71Å; F740-R752 HydrophobicContact CE1-CB 3.66Å; F740-R752 HydrophobicContact CE1-CG 3.86Å; F740-R752 HydrophobicContact CG-CG 4.38Å; F740-R752 HydrophobicContact CZ-CB 4Å; V750-R752 PolarHBondContact O-N 3.35Å; R752-V778 HydrophobicContact CB-CB 4.4Å; R752-V778 HydrophobicContact CB-CG1 4.23Å; R752-V778 HydrophobicContact CB-CG2 4.08Å; R752-T779 PolarHBondContact O-N 3.5Å
753	V	93.4	Very high	88.7	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129.9	-179.2	-176.4	0	0	0	0	109.2	M648 D649 L650 V651 F740 T779 Y781	M648-V753 HydrophobicContact SD-CB 4.48Å; M648-V753 HydrophobicContact SD-CG2 4.08Å; D649-V753 PolarHBondContact O-N 2.96Å; L650-V753 CarbonylContact C-O 3.49Å; L650-V753 WeakPolarHBondContact CA-O 3.06Å; L650-V753 HydrophobicContact CD1-CB 3.89Å; L650-V753 HydrophobicContact CD1-CG1 3.74Å; V651-V753 PolarHBondContact N-O 3.07Å; F740-V753 WeakPolarHBondContact CZ-O 3.26Å; V753-T779 WeakPolarHBondContact CA-O 3.05Å; V753-Y781 HydrophobicContact CG1-CD2 3.71Å; V753-Y781 HydrophobicContact CG1-CE2 3.69Å
754	C	96.2	Very high	88.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.6	175.4	-174.3	0	0	0	0	109.5	V651 V653 F740 V778 T779 M780 Y781	V651-C754 WeakPolarHBondContact O-CA 3.31Å; V653-C754 VanDerWaalsContact CG2-SG 3.51Å; F740-C754 HydrophobicContact CE2-CB 4.41Å; C754-V778 HydrophobicContact CB-CG1 3.83Å; C754-T779 PolarHBondContact N-O 3.06Å; C754-M780 HydrophobicContact CB-CE 3.86Å; C754-M780 HydrophobicContact CB-SD 3.51Å; C754-M780 VanDerWaalsContact CB-SD 3.51Å; C754-Y781 PolarHBondContact O-N 3.37Å
755	I	95.9	Very high	88.3	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.5	171.5	-62.1	170.6	0	0	0	107.6	L650 V651 F652 V653 F671 Y781 L783 L821 M825	L650-I755 HydrophobicContact CD1-CD1 3.79Å; L650-I755 HydrophobicContact CD1-CG1 3.98Å; V651-I755 PolarHBondContact O-N 2.93Å; F652-I755 HydrophobicContact CD1-CB 3.91Å; F652-I755 HydrophobicContact CD1-CD1 4.27Å; F652-I755 HydrophobicContact CD1-CG2 4.12Å; F652-I755 HydrophobicContact CE1-CB 4.14Å; F652-I755 HydrophobicContact CE1-CD1 3.65Å; F652-I755 HydrophobicContact CE1-CG1 4.47Å; F652-I755 HydrophobicContact CE1-CG2 4.24Å; F652-I755 HydrophobicContact CZ-CD1 4.1Å; V653-I755 PolarHBondContact N-O 3.06Å; F671-I755 HydrophobicContact CE1-CG2 4.46Å; I755-Y781 HydrophobicContact CG1-CD2 4.36Å; I755-L783 HydrophobicContact CG2-CD1 4.23Å; I755-L821 HydrophobicContact CD1-CD2 4.15Å; I755-M825 HydrophobicContact CD1-CE 3.99Å; I755-M825 HydrophobicContact CD1-SD 3.91Å
756	V	96.2	Very high	88.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.5	176.6	-172.4	0	0	0	0	108.8	V653 T728 L732 M780 Y781 L783 I796	V653-V756 HydrophobicContact CB-CB 4.49Å; V653-V756 HydrophobicContact CB-CG1 4.45Å; V653-V756 HydrophobicContact CB-CG2 4.2Å; V653-V756 HydrophobicContact CG1-CG1 4.37Å; V653-V756 WeakPolarHBondContact O-CA 3.41Å; T728-V756 HydrophobicContact CG2-CG1 4.2Å; L732-V756 HydrophobicContact CD2-CG2 3.89Å; V756-M780 HydrophobicContact CG2-CE 3.8Å; V756-Y781 PolarHBondContact N-O 3.3Å; V756-L783 PolarHBondContact O-N 3.22Å; V756-I796 HydrophobicContact CB-CG2 4.17Å; V756-I796 HydrophobicContact CG1-CG2 4.45Å; V756-I796 HydrophobicContact CG2-CG2 3.83Å
757	F	94.6	Very high	88.1	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.6	176.8	-174	-83.8	0	0	0	110	V653 I654 D655 L660 V668 L783 V785 F811 M814	V653-F757 PolarHBondContact O-N 3.18Å; I654-F757 HydrophobicContact CD1-CB 3.77Å; D655-F757 WeakPolarHBondContact CB-O 3.48Å; D655-F757 PolarHBondContact N-O 3.06Å; L660-F757 HydrophobicContact CD1-CE1 4.34Å; V668-F757 HydrophobicContact CG1-CD1 4.03Å; V668-F757 HydrophobicContact CG1-CE1 4.33Å; V668-F757 HydrophobicContact CG1-CG 4.32Å; V668-F757 HydrophobicContact CG2-CD1 3.89Å; V668-F757 HydrophobicContact CG2-CE1 3.36Å; V668-F757 HydrophobicContact CG2-CE2 4.46Å; V668-F757 HydrophobicContact CG2-CZ 3.7Å; F757-L783 WeakPolarHBondContact CA-O 3.27Å; F757-L783 HydrophobicContact CD2-CB 3.84Å; F757-L783 HydrophobicContact CD2-CD2 4.22Å; F757-L783 HydrophobicContact CE2-CB 4.41Å; F757-V785 HydrophobicContact CE2-CG2 3.53Å; F757-V785 HydrophobicContact CZ-CB 4.03Å; F757-V785 HydrophobicContact CZ-CG2 3.42Å; F757-V785 VanDerWaalsContact CZ-CG2 3.42Å; F757-F811 HydrophobicContact CE1-CE1 4.12Å; F757-F811 HydrophobicContact CE1-CZ 4.47Å; F757-F811 AromaticContact CZ-CE1 3.68Å; F757-F811 HydrophobicContact CZ-CE1 3.68Å; F757-F811 HydrophobicContact CZ-CZ 4.22Å; F757-M814 HydrophobicContact CD2-CE 4.49Å; F757-M814 HydrophobicContact CE2-CE 3.4Å; F757-M814 VanDerWaalsContact CE2-CE 3.4Å; F757-M814 HydrophobicContact CZ-CE 3.44Å; F757-M814 VanDerWaalsContact CZ-CE 3.44Å
758	T	92.1	Very high	88.1	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	154.4	175.2	-175.4	0	0	0	0	113.1	D655 G760 L783 G784 V785 A788 L793	D655-T758 PolarHBondContact OD2-OG1 2.89Å; T758-G760 PolarHBondContact OG1-N 2.94Å; T758-G760 PolarHBondContact OG1-O 3.07Å; T758-L783 PolarHBondContact N-O 3.42Å; T758-G784 WeakPolarHBondContact O-CA 3.36Å; T758-V785 PolarHBondContact O-N 2.96Å; T758-A788 HydrophobicContact CG2-CB 4.4Å; T758-L793 HydrophobicContact CG2-CD2 3.83Å
759	D	83.1	Confident	88.6	Confident	12 Å²	12	45 Å²	45	6%	0.064	22%	0.223	C	C	.	.	S	Bend	trans	-111.8	6.9	178.7	176.1	49.6	0	0	0	112.4	S659 L660 V785 G786 K787 A788 F811	S659-D759 VanDerWaalsContact C-OD2 3.24Å; L660-D759 WeakPolarHBondContact CA-OD2 3.41Å; L660-D759 HydrophobicContact CB-CB 4.47Å; L660-D759 HydrophobicContact CD1-CB 4.17Å; L660-D759 PolarHBondContact N-OD2 3.3Å; D759-V785 WeakPolarHBondContact CA-O 3.05Å; D759-G786 WeakPolarHBondContact OD1-CA 3.02Å; D759-K787 CarbonylContact O-C 3.57Å; D759-K787 VanDerWaalsContact O-C 3.28Å; D759-K787 WeakPolarHBondContact O-CA 3.41Å; D759-K787 WeakPolarHBondContact O-CB 3.07Å; D759-K787 PolarHBondContact O-N 2.97Å; D759-K787 PolarHBondContact OD1-N 3.34Å; D759-A788 PolarHBondContact O-N 3.28Å; D759-F811 HydrophobicContact CB-CZ 4.43Å
760	G	76.8	Confident	89.4	Confident	8 Å²	8	37.5 Å²	37.5	8%	0.082	18%	0.183	C	C	.	.	S	Bend	trans	-158.9	178.3	-172.6	0	0	0	0	0	114.9	T758	T758-G760 PolarHBondContact OG1-N 2.94Å; T758-G760 PolarHBondContact OG1-O 3.07Å
761	R	81.2	Confident	89.7	Confident	182 Å²	182	39.5 Å²	39.5	69%	0.687	20%	0.198	S	C	*	.			trans	-73.2	134.4	170.8	-173	-175.1	-178.6	161	2.6	110.2	I789 E792	R761-I789 HydrophobicContact CB-CD1 3.71Å; R761-I789 HydrophobicContact CB-CG1 4.05Å; R761-I789 HydrophobicContact CG-CD1 3.64Å; R761-I789 HydrophobicContact CG-CG1 4.37Å; R761-E792 WeakPolarHBondContact CA-OE2 3.48Å; R761-E792 WeakPolarHBondContact CG-OE2 3.36Å
762	S	86.3	Confident	90	Very high	11 Å²	11	41.2 Å²	41.2	8%	0.077	20%	0.201	C	C	.	.			trans	-67.5	152	171	-160.7	0	0	0	0	112.9	S726 T728 D764 E792	S726-S762 PolarHBondContact O-OG 2.96Å; T728-S762 WeakPolarHBondContact CB-OG 3.43Å; T728-S762 PolarHBondContact N-OG 2.93Å; T728-S762 PolarHBondContact OG1-OG 3.42Å; S762-D764 WeakPolarHBondContact CB-O 3.06Å; S762-D764 PolarHBondContact OG-N 2.66Å; S762-D764 PolarHBondContact OG-O 3.08Å; S762-D764 PolarHBondContact OG-OD1 3.42Å; S762-E792 WeakPolarHBondContact CB-OE1 3.5Å; S762-E792 PolarHBondContact N-OE1 3.46Å; S762-E792 PolarHBondContact N-OE2 3.16Å
763	Q	85.8	Confident	90.1	Very high	127 Å²	127	38 Å²	38	59%	0.593	19%	0.188	S	C	*	.	S	Bend	trans	-91.9	-5	175.6	-61.6	175.6	4.1	0	0	112.6	S726 M727	S726-Q763 WeakPolarHBondContact O-CB 3.44Å; S726-Q763 WeakPolarHBondContact O-CG 3.45Å; S726-Q763 PolarHBondContact O-N 2.82Å; M727-Q763 HydrophobicContact CE-CB 3.79Å; M727-Q763 HydrophobicContact SD-CB 3.81Å
764	D	88.7	Confident	90.1	Very high	43 Å²	43	40.7 Å²	40.7	23%	0.23	20%	0.2	C	C	.	.	S	Bend	trans	-131.5	167.4	176.9	63.1	-0.9	0	0	0	111.9	M727 T728 G729 S730 S762	M727-D764 HydrophobicContact SD-CB 4.02Å; T728-D764 PolarHBondContact N-OD1 3.27Å; G729-D764 WeakPolarHBondContact CA-OD1 3.49Å; G729-D764 PolarHBondContact N-OD1 2.64Å; S730-D764 VanDerWaalsContact CB-OD2 3.28Å; S730-D764 WeakPolarHBondContact CB-OD2 3.49Å; S730-D764 PolarHBondContact N-OD2 2.86Å; S730-D764 PolarHBondContact OG-OD2 2.77Å; S762-D764 WeakPolarHBondContact CB-O 3.06Å; S762-D764 PolarHBondContact OG-N 2.66Å; S762-D764 PolarHBondContact OG-O 3.08Å; S762-D764 PolarHBondContact OG-OD1 3.42Å
765	D	87.5	Confident	89.8	Confident	94 Å²	94	46.4 Å²	46.4	50%	0.503	24%	0.235	S	C	.	.			trans	-71.6	127.6	179.9	177.3	42.4	0	0	0	112.4	G729 S767 E768	G729-D765 VanDerWaalsContact CA-O 3.25Å; G729-D765 WeakPolarHBondContact CA-O 3.26Å; D765-S767 WeakPolarHBondContact OD1-CB 3.04Å; D765-S767 PolarHBondContact OD1-N 3.38Å; D765-E768 PolarHBondContact OD2-N 2.94Å
766	V	91.6	Very high	89.4	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.024	25%	0.253	C	S	.	.			trans	-93.6	-25.2	175.6	-60	0	0	0	0	112.8	T728 L732 E768 W769 A770 E792 E795 I796	T728-V766 HydrophobicContact CG2-CG1 4.02Å; L732-V766 HydrophobicContact CD1-CB 3.98Å; L732-V766 HydrophobicContact CD1-CG1 4.36Å; V766-E768 PolarHBondContact O-N 3.08Å; V766-W769 PolarHBondContact O-N 3.03Å; V766-A770 VanDerWaalsContact O-CB 3.25Å; V766-A770 WeakPolarHBondContact O-CB 3.4Å; V766-A770 PolarHBondContact O-N 3.03Å; V766-E792 HydrophobicContact CG1-CG 4.2Å; V766-E792 HydrophobicContact CG2-CG 3.65Å; V766-E795 HydrophobicContact CG2-CB 4.32Å; V766-I796 HydrophobicContact CB-CD1 4.24Å; V766-I796 HydrophobicContact CB-CG1 4.02Å; V766-I796 HydrophobicContact CG1-CD1 4.2Å; V766-I796 HydrophobicContact CG2-CD1 4.42Å; V766-I796 HydrophobicContact CG2-CG1 4.08Å
767	S	86.7	Confident	88.9	Confident	46 Å²	46	51 Å²	51	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-65.9	-43	-165.6	-108.6	0	0	0	0	112.3	D765 W769 S771 E795	D765-S767 WeakPolarHBondContact OD1-CB 3.04Å; D765-S767 PolarHBondContact OD1-N 3.38Å; S767-W769 PolarHBondContact O-N 3.13Å; S767-S771 VanDerWaalsContact O-CB 3.22Å; S767-S771 WeakPolarHBondContact O-CB 3.45Å; S767-S771 PolarHBondContact O-N 3.36Å; S767-E795 PolarHBondContact OG-OE2 2.86Å
768	E	90.1	Very high	88.7	Confident	91 Å²	91	51.3 Å²	51.3	43%	0.425	28%	0.28	S	S	.	.	H	α-helix	trans	-57	-51.9	179.1	-170.8	-164.6	-179.3	0	0	112.3	D765 V766 K772	D765-E768 PolarHBondContact OD2-N 2.94Å; V766-E768 PolarHBondContact O-N 3.08Å; E768-K772 HydrophobicContact CG-CD 4.45Å; E768-K772 WeakPolarHBondContact O-CG 3.38Å; E768-K772 PolarHBondContact O-N 3.06Å; E768-K772 VanDerWaalsContact O-N 3.1Å; E768-K772 WeakPolarHBondContact OE1-CE 3.19Å; E768-K772 IonicContact OE1-NZ 3.57Å; E768-K772 PolarHBondContact OE1-NZ 2.77Å
769	W	94.9	Very high	88.8	Confident	29 Å²	29	52.7 Å²	52.7	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-82	-31.1	-171.6	-64.1	95	0	0	0	112.7	L732 R733 F736 Q737 V766 S767 K772 A773	L732-W769 HydrophobicContact CB-CB 3.81Å; R733-W769 HydrophobicContact CB-CB 4.45Å; R733-W769 HydrophobicContact CB-CD2 3.57Å; R733-W769 HydrophobicContact CB-CE3 4.04Å; R733-W769 HydrophobicContact CB-CG 3.71Å; R733-W769 HydrophobicContact CB-CZ2 4.46Å; R733-W769 HydrophobicContact CG-CD2 3.78Å; R733-W769 HydrophobicContact CG-CE3 3.97Å; R733-W769 HydrophobicContact CG-CG 4.43Å; R733-W769 HydrophobicContact CG-CH2 3.99Å; R733-W769 HydrophobicContact CG-CZ2 3.82Å; R733-W769 HydrophobicContact CG-CZ3 4.07Å; F736-W769 HydrophobicContact CB-CE3 4.44Å; F736-W769 AromaticContact CD1-CE3 3.93Å; F736-W769 HydrophobicContact CD1-CE3 3.93Å; F736-W769 AromaticContact CD1-CZ3 3.78Å; F736-W769 HydrophobicContact CD1-CZ3 3.78Å; F736-W769 HydrophobicContact CE1-CZ3 4.25Å; F736-W769 HydrophobicContact CG-CE3 4.39Å; Q737-W769 HydrophobicContact CG-CZ3 4.11Å; V766-W769 PolarHBondContact O-N 3.03Å; S767-W769 PolarHBondContact O-N 3.13Å; W769-K772 HydrophobicContact CD2-CD 4.43Å; W769-K772 HydrophobicContact CE3-CD 3.87Å; W769-K772 HydrophobicContact CH2-CD 4.4Å; W769-K772 HydrophobicContact CZ3-CD 3.86Å; W769-A773 WeakPolarHBondContact O-CB 3.12Å; W769-A773 PolarHBondContact O-N 3.44Å
770	A	94.2	Very high	89.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-46.7	167.5	0	0	0	0	0	111.6	L732 V766 A773 K774 E795	L732-A770 HydrophobicContact CD1-CB 4.25Å; V766-A770 VanDerWaalsContact O-CB 3.25Å; V766-A770 WeakPolarHBondContact O-CB 3.4Å; V766-A770 PolarHBondContact O-N 3.03Å; A770-A773 PolarHBondContact O-N 3.04Å; A770-K774 WeakPolarHBondContact O-CB 3.43Å; A770-K774 WeakPolarHBondContact O-CE 3.2Å; A770-K774 WeakPolarHBondContact O-CG 3.17Å; A770-K774 PolarHBondContact O-N 3.4Å; A770-E795 WeakPolarHBondContact CB-O 3.38Å
771	S	91.1	Very high	90.2	Very high	66 Å²	66	51.9 Å²	51.9	46%	0.462	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-44.9	178.4	-175.6	0	0	0	0	112.1	S767 K774 T775	S767-S771 VanDerWaalsContact O-CB 3.22Å; S767-S771 WeakPolarHBondContact O-CB 3.45Å; S767-S771 PolarHBondContact O-N 3.36Å; S771-K774 PolarHBondContact O-N 3.49Å; S771-T775 WeakPolarHBondContact O-CB 3.41Å; S771-T775 PolarHBondContact O-N 2.95Å; S771-T775 PolarHBondContact O-OG1 2.9Å
772	K	92.6	Very high	90.8	Very high	77 Å²	77	43.2 Å²	43.2	34%	0.335	25%	0.25	S	C	.	.	H	α-helix	trans	-60.7	-44.9	175	-74	175.1	-175.1	175	0	112.7	F736 E768 W769 T775 A776	F736-K772 HydrophobicContact CD2-CB 4.46Å; F736-K772 HydrophobicContact CE1-CB 4.39Å; F736-K772 HydrophobicContact CE2-CB 4.07Å; F736-K772 WeakPolarHBondContact CE2-O 3.32Å; F736-K772 HydrophobicContact CZ-CB 4.03Å; E768-K772 HydrophobicContact CG-CD 4.45Å; E768-K772 WeakPolarHBondContact O-CG 3.38Å; E768-K772 PolarHBondContact O-N 3.06Å; E768-K772 VanDerWaalsContact O-N 3.1Å; E768-K772 WeakPolarHBondContact OE1-CE 3.19Å; E768-K772 IonicContact OE1-NZ 3.57Å; E768-K772 PolarHBondContact OE1-NZ 2.77Å; W769-K772 HydrophobicContact CD2-CD 4.43Å; W769-K772 HydrophobicContact CE3-CD 3.87Å; W769-K772 HydrophobicContact CH2-CD 4.4Å; W769-K772 HydrophobicContact CZ3-CD 3.86Å; K772-T775 PolarHBondContact O-N 3.16Å; K772-A776 WeakPolarHBondContact O-CB 3.47Å; K772-A776 PolarHBondContact O-N 3.32Å
773	A	93.8	Very high	91.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.6	-47.4	178.1	0	0	0	0	0	112.2	M735 F736 W769 A770 T775 A776 G777 V778 M780	M735-A773 HydrophobicContact CE-CB 3.97Å; F736-A773 HydrophobicContact CD2-CB 4.04Å; W769-A773 WeakPolarHBondContact O-CB 3.12Å; W769-A773 PolarHBondContact O-N 3.44Å; A770-A773 PolarHBondContact O-N 3.04Å; A773-T775 PolarHBondContact O-N 3.26Å; A773-A776 PolarHBondContact O-N 3.33Å; A773-G777 PolarHBondContact O-N 3.3Å; A773-V778 HydrophobicContact CB-CB 4.27Å; A773-V778 HydrophobicContact CB-CG2 4.42Å; A773-V778 WeakPolarHBondContact O-CB 3.36Å; A773-V778 WeakPolarHBondContact O-CG2 3.31Å; A773-V778 PolarHBondContact O-N 3.46Å; A773-M780 HydrophobicContact CB-CG 4.43Å; A773-M780 HydrophobicContact CB-SD 3.79Å
774	K	92.5	Very high	91.4	Very high	62 Å²	62	36.8 Å²	36.8	27%	0.27	22%	0.218	S	C	.	.	H	α-helix	trans	-59.3	-45.4	176.2	-72.3	-175.2	-79.4	-171.1	0	112	A770 S771 A776 G777 M780 E795 A797	A770-K774 WeakPolarHBondContact O-CB 3.43Å; A770-K774 WeakPolarHBondContact O-CE 3.2Å; A770-K774 WeakPolarHBondContact O-CG 3.17Å; A770-K774 PolarHBondContact O-N 3.4Å; S771-K774 PolarHBondContact O-N 3.49Å; K774-A776 VanDerWaalsContact C-N 3.29Å; K774-A776 PolarHBondContact O-N 3.38Å; K774-G777 PolarHBondContact O-N 3.13Å; K774-G777 VanDerWaalsContact O-N 3.08Å; K774-M780 HydrophobicContact CD-CG 4.39Å; K774-M780 HydrophobicContact CG-CB 4.23Å; K774-M780 HydrophobicContact CG-CG 3.61Å; K774-E795 WeakPolarHBondContact CE-O 3.33Å; K774-E795 PolarHBondContact NZ-O 3.28Å; K774-A797 VanDerWaalsContact CD-O 3.27Å; K774-A797 WeakPolarHBondContact CD-O 3.47Å; K774-A797 PolarHBondContact NZ-O 3.26Å
775	T	89.2	Confident	91.3	Very high	120 Å²	120	34.8 Å²	34.8	74%	0.736	21%	0.208	S	C	*	.	H	α-helix	trans	-65.8	-31.2	179.4	-53.3	0	0	0	0	112.4	S771 K772 A773 G777	S771-T775 WeakPolarHBondContact O-CB 3.41Å; S771-T775 PolarHBondContact O-N 2.95Å; S771-T775 PolarHBondContact O-OG1 2.9Å; K772-T775 PolarHBondContact O-N 3.16Å; A773-T775 PolarHBondContact O-N 3.26Å; T775-G777 PolarHBondContact O-N 3.41Å
776	A	87.8	Confident	91	Very high	46 Å²	46	31.3 Å²	31.3	38%	0.38	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	10.5	174	0	0	0	0	0	114.4	F736 K772 A773 K774	F736-A776 HydrophobicContact CE2-CB 3.72Å; F736-A776 HydrophobicContact CZ-CB 4.44Å; K772-A776 WeakPolarHBondContact O-CB 3.47Å; K772-A776 PolarHBondContact O-N 3.32Å; A773-A776 PolarHBondContact O-N 3.33Å; K774-A776 VanDerWaalsContact C-N 3.29Å; K774-A776 PolarHBondContact O-N 3.38Å
777	G	85.8	Confident	90.2	Very high	52 Å²	52	39.5 Å²	39.5	54%	0.536	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	17	177	0	0	0	0	0	115	A773 K774 T775	A773-G777 PolarHBondContact O-N 3.3Å; K774-G777 PolarHBondContact O-N 3.13Å; K774-G777 VanDerWaalsContact O-N 3.08Å; T775-G777 PolarHBondContact O-N 3.41Å
778	V	92.1	Very high	90	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.4	170.3	-170.6	0	0	0	0	109	F740 R752 C754 A773 M780	F740-V778 HydrophobicContact CD2-CG1 4.45Å; F740-V778 HydrophobicContact CD2-CG2 4.29Å; F740-V778 HydrophobicContact CE2-CG1 3.75Å; F740-V778 HydrophobicContact CE2-CG2 4.38Å; F740-V778 HydrophobicContact CZ-CG1 4.16Å; R752-V778 HydrophobicContact CB-CB 4.4Å; R752-V778 HydrophobicContact CB-CG1 4.23Å; R752-V778 HydrophobicContact CB-CG2 4.08Å; C754-V778 HydrophobicContact CB-CG1 3.83Å; A773-V778 HydrophobicContact CB-CB 4.27Å; A773-V778 HydrophobicContact CB-CG2 4.42Å; A773-V778 WeakPolarHBondContact O-CB 3.36Å; A773-V778 WeakPolarHBondContact O-CG2 3.31Å; A773-V778 PolarHBondContact O-N 3.46Å; V778-M780 HydrophobicContact CB-SD 4.18Å; V778-M780 HydrophobicContact CG1-SD 3.69Å; V778-M780 PolarHBondContact O-N 2.88Å
779	T	92.9	Very high	89.6	Confident	31 Å²	31	36.5 Å²	36.5	19%	0.19	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	111.6	172.6	-55.7	0	0	0	0	108.6	R752 V753 C754 Y781	R752-T779 PolarHBondContact O-N 3.5Å; V753-T779 WeakPolarHBondContact CA-O 3.05Å; C754-T779 PolarHBondContact N-O 3.06Å; T779-Y781 HydrophobicContact CG2-CD2 4.38Å; T779-Y781 HydrophobicContact CG2-CE2 3.85Å
780	M	94.1	Very high	88.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114.2	-174	-61.5	-61.5	-58.5	0	0	110.6	L732 M735 C754 V756 A773 K774 V778 I796 A797 S798 H804	L732-M780 HydrophobicContact CD2-CE 3.53Å; M735-M780 HydrophobicContact CE-CE 3.75Å; M735-M780 HydrophobicContact CE-SD 3.91Å; C754-M780 HydrophobicContact CB-CE 3.86Å; C754-M780 HydrophobicContact CB-SD 3.51Å; C754-M780 VanDerWaalsContact CB-SD 3.51Å; V756-M780 HydrophobicContact CG2-CE 3.8Å; A773-M780 HydrophobicContact CB-CG 4.43Å; A773-M780 HydrophobicContact CB-SD 3.79Å; K774-M780 HydrophobicContact CD-CG 4.39Å; K774-M780 HydrophobicContact CG-CB 4.23Å; K774-M780 HydrophobicContact CG-CG 3.61Å; V778-M780 HydrophobicContact CB-SD 4.18Å; V778-M780 HydrophobicContact CG1-SD 3.69Å; V778-M780 PolarHBondContact O-N 2.88Å; M780-I796 WeakPolarHBondContact CB-O 3.38Å; M780-I796 HydrophobicContact CE-CG2 4.14Å; M780-A797 WeakPolarHBondContact O-CA 3.5Å; M780-S798 PolarHBondContact N-OG 3.17Å; M780-S798 PolarHBondContact O-N 2.7Å; M780-H804 WeakPolarHBondContact O-CB 3.16Å
781	Y	94.7	Very high	88.2	Confident	3 Å²	3	45.8 Å²	45.8	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.8	167.4	-70.2	-85	0	0	0	109.8	V753 C754 I755 V756 T779 H804 Y806 L821 M825 V828	V753-Y781 HydrophobicContact CG1-CD2 3.71Å; V753-Y781 HydrophobicContact CG1-CE2 3.69Å; C754-Y781 PolarHBondContact O-N 3.37Å; I755-Y781 HydrophobicContact CG1-CD2 4.36Å; V756-Y781 PolarHBondContact N-O 3.3Å; T779-Y781 HydrophobicContact CG2-CD2 4.38Å; T779-Y781 HydrophobicContact CG2-CE2 3.85Å; Y781-H804 WeakPolarHBondContact CA-O 3.21Å; Y781-H804 HydrophobicContact CD1-CB 4.07Å; Y781-H804 AromaticContact CD1-CD2 3.92Å; Y781-H804 HydrophobicContact CE1-CB 4.37Å; Y781-H804 AromaticContact CE1-CD2 3.49Å; Y781-H804 VanDerWaalsContact CE1-CD2 3.49Å; Y781-H804 WeakPolarHBondContact CE1-CD2 3.31Å; Y781-H804 AromaticContact CZ-CD2 3.68Å; Y781-Y806 AromaticContact CD1-CE2 3.98Å; Y781-Y806 HydrophobicContact CD1-CE2 3.98Å; Y781-Y806 HydrophobicContact CE1-CE2 4.42Å; Y781-L821 HydrophobicContact CD1-CD1 3.56Å; Y781-L821 HydrophobicContact CE1-CD1 3.82Å; Y781-L821 HydrophobicContact CG-CD1 4.01Å; Y781-M825 HydrophobicContact CE2-CG 4.39Å; Y781-V828 WeakPolarHBondContact OH-CG2 3.04Å
782	A	94.4	Very high	87.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.4	178	0	0	0	0	0	110	L793 I796 A797 H804 L805 Y806	A782-L793 HydrophobicContact CB-CB 4.09Å; A782-L793 HydrophobicContact CB-CD2 4.08Å; A782-L793 VanDerWaalsContact CB-O 3.31Å; A782-L793 WeakPolarHBondContact CB-O 3.06Å; A782-I796 HydrophobicContact CB-CB 4.12Å; A782-I796 HydrophobicContact CB-CG2 3.98Å; A782-A797 HydrophobicContact CB-CB 3.99Å; A782-H804 PolarHBondContact N-O 3.39Å; A782-L805 WeakPolarHBondContact O-CA 3.09Å; A782-Y806 PolarHBondContact O-N 2.95Å
783	L	93.6	Very high	87.8	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	111.7	176.4	-84.7	66.2	0	0	0	108.9	F671 I755 V756 F757 T758 Y806 I817 L821	F671-L783 HydrophobicContact CE1-CD2 3.94Å; F671-L783 HydrophobicContact CE2-CD2 3.73Å; F671-L783 HydrophobicContact CZ-CD2 3.25Å; I755-L783 HydrophobicContact CG2-CD1 4.23Å; V756-L783 PolarHBondContact O-N 3.22Å; F757-L783 WeakPolarHBondContact CA-O 3.27Å; F757-L783 HydrophobicContact CD2-CB 3.84Å; F757-L783 HydrophobicContact CD2-CD2 4.22Å; F757-L783 HydrophobicContact CE2-CB 4.41Å; T758-L783 PolarHBondContact N-O 3.42Å; L783-Y806 WeakPolarHBondContact CA-O 3.41Å; L783-Y806 HydrophobicContact CD1-CD2 3.76Å; L783-Y806 HydrophobicContact CD1-CG 4.43Å; L783-Y806 HydrophobicContact CG-CD2 4.41Å; L783-I817 HydrophobicContact CD2-CG2 3.73Å; L783-I817 HydrophobicContact CG-CG2 4.01Å; L783-L821 HydrophobicContact CD1-CD2 4.3Å; L783-L821 HydrophobicContact CD2-CD2 4.25Å
784	G	90.6	Very high	87.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.4	166.6	0	0	0	0	0	111.3	T758 L793 Y806 Y807 A808	T758-G784 WeakPolarHBondContact O-CA 3.36Å; G784-L793 VanDerWaalsContact CA-CD1 3.49Å; G784-Y806 PolarHBondContact N-O 2.04Å; G784-Y807 CarbonylContact O-C 3.48Å; G784-Y807 WeakPolarHBondContact O-CA 3.39Å; G784-A808 PolarHBondContact O-N 3.07Å
785	V	86.6	Confident	87.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	158.3	162.4	-173	0	0	0	0	109.2	F757 T758 D759 K787 A788 A808 D810 F811 M814	F757-V785 HydrophobicContact CE2-CG2 3.53Å; F757-V785 HydrophobicContact CZ-CB 4.03Å; F757-V785 HydrophobicContact CZ-CG2 3.42Å; F757-V785 VanDerWaalsContact CZ-CG2 3.42Å; T758-V785 PolarHBondContact O-N 2.96Å; D759-V785 WeakPolarHBondContact CA-O 3.05Å; V785-K787 PolarHBondContact O-N 3.17Å; V785-A788 WeakPolarHBondContact O-CB 3.41Å; V785-A788 PolarHBondContact O-N 3.11Å; V785-A788 VanDerWaalsContact O-N 3.12Å; V785-A808 CarbonylContact C-O 3.53Å; V785-A808 VanDerWaalsContact CA-O 3.24Å; V785-A808 WeakPolarHBondContact CA-O 3.02Å; V785-A808 HydrophobicContact CG2-CB 4.45Å; V785-D810 WeakPolarHBondContact CG1-O 3.46Å; V785-F811 HydrophobicContact CB-CE1 4.17Å; V785-F811 HydrophobicContact CB-CE2 4.05Å; V785-F811 HydrophobicContact CB-CZ 3.77Å; V785-F811 HydrophobicContact CG1-CD1 4.11Å; V785-F811 HydrophobicContact CG1-CD2 3.54Å; V785-F811 HydrophobicContact CG1-CE1 3.97Å; V785-F811 HydrophobicContact CG1-CE2 3.38Å; V785-F811 HydrophobicContact CG1-CG 3.88Å; V785-F811 HydrophobicContact CG1-CZ 3.57Å; V785-F811 HydrophobicContact CG2-CE1 4.4Å; V785-F811 HydrophobicContact CG2-CZ 4.48Å; V785-M814 HydrophobicContact CG2-CE 4.4Å
786	G	81.6	Confident	87.7	Confident	21 Å²	21	38.7 Å²	38.7	22%	0.216	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	-102.4	165.8	0	0	0	0	0	113.8	D759 Y807 A808	D759-G786 WeakPolarHBondContact OD1-CA 3.02Å; G786-Y807 PolarHBondContact O-OH 3.46Å; G786-A808 PolarHBondContact N-O 3.27Å
787	K	76.1	Confident	88	Confident	176 Å²	176	36.5 Å²	36.5	77%	0.765	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	13.3	-174.9	-65.1	178.3	-176.8	170.7	0	114	D759 V785	D759-K787 CarbonylContact O-C 3.57Å; D759-K787 VanDerWaalsContact O-C 3.28Å; D759-K787 WeakPolarHBondContact O-CA 3.41Å; D759-K787 WeakPolarHBondContact O-CB 3.07Å; D759-K787 PolarHBondContact O-N 2.97Å; D759-K787 PolarHBondContact OD1-N 3.34Å; V785-K787 PolarHBondContact O-N 3.17Å
788	A	81.9	Confident	88.2	Confident	7 Å²	7	34.8 Å²	34.8	6%	0.058	17%	0.169	C	C	.	.			trans	-61.1	142.5	174.8	0	0	0	0	0	112	T758 D759 V785 L793 Y807	T758-A788 HydrophobicContact CG2-CB 4.4Å; D759-A788 PolarHBondContact O-N 3.28Å; V785-A788 WeakPolarHBondContact O-CB 3.41Å; V785-A788 PolarHBondContact O-N 3.11Å; V785-A788 VanDerWaalsContact O-N 3.12Å; A788-L793 HydrophobicContact CB-CD1 4.02Å; A788-Y807 HydrophobicContact CB-CE2 4.47Å; A788-Y807 WeakPolarHBondContact O-CE2 3.24Å
789	I	80.8	Confident	87.7	Confident	66 Å²	66	40.3 Å²	40.3	34%	0.338	19%	0.194	S	C	.	.			trans	-91.2	117.6	-178.7	-61.6	-166.8	0	0	0	110.1	R761 Q791 E792 L793	R761-I789 HydrophobicContact CB-CD1 3.71Å; R761-I789 HydrophobicContact CB-CG1 4.05Å; R761-I789 HydrophobicContact CG-CD1 3.64Å; R761-I789 HydrophobicContact CG-CG1 4.37Å; I789-Q791 VanDerWaalsContact C-N 3.26Å; I789-Q791 HydrophobicContact CG2-CB 4.08Å; I789-Q791 PolarHBondContact O-N 3.21Å; I789-E792 HydrophobicContact CB-CB 4.14Å; I789-E792 HydrophobicContact CG2-CB 4.37Å; I789-E792 WeakPolarHBondContact O-CB 3.34Å; I789-E792 PolarHBondContact O-N 3Å; I789-L793 WeakPolarHBondContact O-CG 3.06Å; I789-L793 PolarHBondContact O-N 3.47Å
790	E	80.7	Confident	87.1	Confident	107 Å²	107	41.5 Å²	41.5	50%	0.5	20%	0.202	S	C	.	.	H	α-helix	trans	-54.9	-39	-178.2	-165.9	-170.9	155.8	0	0	113.1	E792 L793 R794 L805	E790-E792 PolarHBondContact O-N 2.9Å; E790-L793 PolarHBondContact O-N 3.31Å; E790-R794 WeakPolarHBondContact O-CB 3.26Å; E790-R794 PolarHBondContact O-N 3.16Å; E790-L805 HydrophobicContact CG-CD1 4.28Å; E790-L805 HydrophobicContact CG-CD2 4.28Å
791	Q	79.1	Confident	86.2	Confident	118 Å²	118	41.6 Å²	41.6	55%	0.551	20%	0.203	S	C	*	.	H	α-helix	trans	-61.3	-43.1	177.2	-176.1	61.2	25.8	0	0	112.3	I789 R794 E795	I789-Q791 VanDerWaalsContact C-N 3.26Å; I789-Q791 HydrophobicContact CG2-CB 4.08Å; I789-Q791 PolarHBondContact O-N 3.21Å; Q791-R794 PolarHBondContact O-N 3.44Å; Q791-E795 WeakPolarHBondContact O-CG 3.45Å; Q791-E795 PolarHBondContact O-N 3.46Å
792	E	84.6	Confident	85.3	Confident	21 Å²	21	47.3 Å²	47.3	10%	0.098	23%	0.23	C	C	.	.	H	α-helix	trans	-67.1	-41.1	177.8	-166.7	-175.6	136.7	0	0	110.7	R761 S762 V766 I789 E790 R794 E795 I796	R761-E792 WeakPolarHBondContact CA-OE2 3.48Å; R761-E792 WeakPolarHBondContact CG-OE2 3.36Å; S762-E792 WeakPolarHBondContact CB-OE1 3.5Å; S762-E792 PolarHBondContact N-OE1 3.46Å; S762-E792 PolarHBondContact N-OE2 3.16Å; V766-E792 HydrophobicContact CG1-CG 4.2Å; V766-E792 HydrophobicContact CG2-CG 3.65Å; I789-E792 HydrophobicContact CB-CB 4.14Å; I789-E792 HydrophobicContact CG2-CB 4.37Å; I789-E792 WeakPolarHBondContact O-CB 3.34Å; I789-E792 PolarHBondContact O-N 3Å; E790-E792 PolarHBondContact O-N 2.9Å; E792-R794 VanDerWaalsContact C-N 3.29Å; E792-R794 PolarHBondContact O-N 3.27Å; E792-E795 PolarHBondContact O-N 3Å; E792-I796 WeakPolarHBondContact O-CG1 3.23Å; E792-I796 PolarHBondContact O-N 3.07Å; E792-I796 VanDerWaalsContact O-N 3.08Å
793	L	90.3	Very high	84.4	Confident	3 Å²	3	51 Å²	51	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-35	173.6	-61.6	168.1	0	0	0	112.2	T758 A782 G784 A788 I789 E790 I796 A797 L805 Y807	T758-L793 HydrophobicContact CG2-CD2 3.83Å; A782-L793 HydrophobicContact CB-CB 4.09Å; A782-L793 HydrophobicContact CB-CD2 4.08Å; A782-L793 VanDerWaalsContact CB-O 3.31Å; A782-L793 WeakPolarHBondContact CB-O 3.06Å; G784-L793 VanDerWaalsContact CA-CD1 3.49Å; A788-L793 HydrophobicContact CB-CD1 4.02Å; I789-L793 WeakPolarHBondContact O-CG 3.06Å; I789-L793 PolarHBondContact O-N 3.47Å; E790-L793 PolarHBondContact O-N 3.31Å; L793-I796 PolarHBondContact O-N 3.03Å; L793-A797 VanDerWaalsContact O-CB 3.3Å; L793-A797 WeakPolarHBondContact O-CB 3.49Å; L793-A797 PolarHBondContact O-N 3.15Å; L793-L805 HydrophobicContact CB-CD1 3.82Å; L793-L805 HydrophobicContact CB-CG 4.17Å; L793-Y807 HydrophobicContact CD1-CD2 4.26Å
794	R	90.2	Very high	84	Confident	87 Å²	87	51.5 Å²	51.5	33%	0.328	25%	0.251	S	S	.	.	H	α-helix	trans	-70.2	-36.2	176.5	-178.2	175.7	-77.9	-90.8	1.9	111.7	E790 Q791 E792 I796 L805	E790-R794 WeakPolarHBondContact O-CB 3.26Å; E790-R794 PolarHBondContact O-N 3.16Å; Q791-R794 PolarHBondContact O-N 3.44Å; E792-R794 VanDerWaalsContact C-N 3.29Å; E792-R794 PolarHBondContact O-N 3.27Å; R794-I796 VanDerWaalsContact C-N 3.3Å; R794-I796 PolarHBondContact O-N 3.44Å; R794-L805 HydrophobicContact CB-CD1 3.8Å
795	E	89.9	Confident	84	Confident	64 Å²	64	52.7 Å²	52.7	30%	0.299	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-35.8	171.2	-71.9	171.2	-148	0	0	112	V766 S767 A770 K774 Q791 E792	V766-E795 HydrophobicContact CG2-CB 4.32Å; S767-E795 PolarHBondContact OG-OE2 2.86Å; A770-E795 WeakPolarHBondContact CB-O 3.38Å; K774-E795 WeakPolarHBondContact CE-O 3.33Å; K774-E795 PolarHBondContact NZ-O 3.28Å; Q791-E795 WeakPolarHBondContact O-CG 3.45Å; Q791-E795 PolarHBondContact O-N 3.46Å; E792-E795 PolarHBondContact O-N 3Å
796	I	94.3	Very high	84.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-73.5	-47.9	176.7	-63.9	169.9	0	0	0	112.1	T728 L732 V756 V766 M780 A782 E792 L793 R794	T728-I796 HydrophobicContact CG2-CD1 3.83Å; L732-I796 HydrophobicContact CD1-CD1 4.33Å; L732-I796 HydrophobicContact CD1-CG1 4Å; L732-I796 HydrophobicContact CD2-CG2 4.42Å; V756-I796 HydrophobicContact CB-CG2 4.17Å; V756-I796 HydrophobicContact CG1-CG2 4.45Å; V756-I796 HydrophobicContact CG2-CG2 3.83Å; V766-I796 HydrophobicContact CB-CD1 4.24Å; V766-I796 HydrophobicContact CB-CG1 4.02Å; V766-I796 HydrophobicContact CG1-CD1 4.2Å; V766-I796 HydrophobicContact CG2-CD1 4.42Å; V766-I796 HydrophobicContact CG2-CG1 4.08Å; M780-I796 WeakPolarHBondContact CB-O 3.38Å; M780-I796 HydrophobicContact CE-CG2 4.14Å; A782-I796 HydrophobicContact CB-CB 4.12Å; A782-I796 HydrophobicContact CB-CG2 3.98Å; E792-I796 WeakPolarHBondContact O-CG1 3.23Å; E792-I796 PolarHBondContact O-N 3.07Å; E792-I796 VanDerWaalsContact O-N 3.08Å; L793-I796 PolarHBondContact O-N 3.03Å; R794-I796 VanDerWaalsContact C-N 3.3Å; R794-I796 PolarHBondContact O-N 3.44Å
797	A	94.2	Very high	84.3	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.008	27%	0.267	C	S	.	.	S	Bend	trans	-63.5	150.4	-172.1	0	0	0	0	0	113.9	K774 M780 A782 L793 H804 L805	K774-A797 VanDerWaalsContact CD-O 3.27Å; K774-A797 WeakPolarHBondContact CD-O 3.47Å; K774-A797 PolarHBondContact NZ-O 3.26Å; M780-A797 WeakPolarHBondContact O-CA 3.5Å; A782-A797 HydrophobicContact CB-CB 3.99Å; L793-A797 VanDerWaalsContact O-CB 3.3Å; L793-A797 WeakPolarHBondContact O-CB 3.49Å; L793-A797 PolarHBondContact O-N 3.15Å; A797-H804 HydrophobicContact CB-CB 4.19Å; A797-L805 HydrophobicContact CB-CB 4.13Å
798	S	90.7	Very high	84.6	Confident	15 Å²	15	48.8 Å²	48.8	11%	0.105	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-74.8	149.4	168.5	-73.1	0	0	0	0	111.5	M780 P800 H804	M780-S798 PolarHBondContact N-OG 3.17Å; M780-S798 PolarHBondContact O-N 2.7Å; S798-P800 CarbonylContact O-C 3.57Å; S798-H804 WeakPolarHBondContact O-CB 3.08Å; S798-H804 PolarHBondContact O-ND1 3.29Å
799	E	80.8	Confident	84.2	Confident	123 Å²	123	54.8 Å²	54.8	58%	0.575	26%	0.259	S	S	*	.	S	Bend	trans	-77.6	148.9	172.1	-68.4	-60.2	161.4	0	0	111.9	A801 H804	E799-A801 PolarHBondContact OE2-N 2.86Å; E799-H804 PolarHBondContact O-CE1 2.81Å
800	P	80.4	Confident	83.9	Confident	55 Å²	55	53.7 Å²	53.7	36%	0.357	25%	0.254	S	S	.	.	S	Bend	cis	-72	136.4	-7.6	30.5	-34.7	0	0	0	111.6	S798 E802 M803 H804	S798-P800 CarbonylContact O-C 3.57Å; P800-E802 PolarHBondContact O-N 3.14Å; P800-M803 HydrophobicContact CG-CB 4.27Å; P800-M803 HydrophobicContact CG-CE 3.5Å; P800-M803 VanDerWaalsContact CG-CE 3.5Å; P800-M803 HydrophobicContact CG-CG 4.02Å; P800-M803 PolarHBondContact O-N 3.29Å; P800-H804 PolarHBondContact O-ND1 3.01Å; P800-H804 VanDerWaalsContact O-ND1 3.15Å
801	A	75.8	Confident	83.5	Confident	2 Å²	2	49.9 Å²	49.9	2%	0.017	24%	0.236	C	C	.	.	H	α-helix	trans	-55.2	-34.8	-176.2	0	0	0	0	0	113.2	E799 M803 H804 L805	E799-A801 PolarHBondContact OE2-N 2.86Å; A801-M803 PolarHBondContact O-N 2.88Å; A801-H804 PolarHBondContact O-N 2.89Å; A801-H804 VanDerWaalsContact O-N 3.1Å; A801-L805 VanDerWaalsContact O-CB 3.31Å; A801-L805 WeakPolarHBondContact O-CB 3.39Å; A801-L805 PolarHBondContact O-N 3.12Å
802	E	75.1	Confident	83.1	Confident	123 Å²	123	53 Å²	53	58%	0.575	25%	0.251	S	S	*	.	H	α-helix	trans	-64.1	-18.1	-178.9	-54.6	68.5	-139.2	0	0	112.7	P800 R824	P800-E802 PolarHBondContact O-N 3.14Å; E802-R824 PolarHBondContact O-NH1 2.84Å; E802-R824 PolarHBondContact O-NH2 3.02Å
803	M	74.4	Confident	82.5	Confident	78 Å²	78	56.1 Å²	56.1	38%	0.384	26%	0.264	S	S	.	.	H	α-helix	trans	-90.8	-29.5	174.8	-71.9	-151.8	-64.9	0	0	114.2	P800 A801 Y806 R824	P800-M803 HydrophobicContact CG-CB 4.27Å; P800-M803 HydrophobicContact CG-CE 3.5Å; P800-M803 VanDerWaalsContact CG-CE 3.5Å; P800-M803 HydrophobicContact CG-CG 4.02Å; P800-M803 PolarHBondContact O-N 3.29Å; A801-M803 PolarHBondContact O-N 2.88Å; M803-Y806 PolarHBondContact O-OH 3.41Å; M803-R824 WeakPolarHBondContact O-CD 3.45Å; M803-R824 PolarHBondContact O-NH1 3.26Å; M803-R824 VanDerWaalsContact O-NH1 3.09Å
804	H	86.9	Confident	81.9	Confident	13 Å²	13	56.6 Å²	56.6	6%	0.06	27%	0.266	C	S	.	.	H	α-helix	trans	-116.9	-20.8	-167.5	-54.1	104.6	0	0	0	115	M780 Y781 A782 A797 S798 E799 P800 A801	M780-H804 WeakPolarHBondContact O-CB 3.16Å; Y781-H804 WeakPolarHBondContact CA-O 3.21Å; Y781-H804 HydrophobicContact CD1-CB 4.07Å; Y781-H804 AromaticContact CD1-CD2 3.92Å; Y781-H804 HydrophobicContact CE1-CB 4.37Å; Y781-H804 AromaticContact CE1-CD2 3.49Å; Y781-H804 VanDerWaalsContact CE1-CD2 3.49Å; Y781-H804 WeakPolarHBondContact CE1-CD2 3.31Å; Y781-H804 AromaticContact CZ-CD2 3.68Å; A782-H804 PolarHBondContact N-O 3.39Å; A797-H804 HydrophobicContact CB-CB 4.19Å; S798-H804 WeakPolarHBondContact O-CB 3.08Å; S798-H804 PolarHBondContact O-ND1 3.29Å; E799-H804 PolarHBondContact O-CE1 2.81Å; P800-H804 PolarHBondContact O-ND1 3.01Å; P800-H804 VanDerWaalsContact O-ND1 3.15Å; A801-H804 PolarHBondContact O-N 2.89Å; A801-H804 VanDerWaalsContact O-N 3.1Å
805	L	90.4	Very high	81.1	Confident	24 Å²	24	54.4 Å²	54.4	13%	0.126	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.4	172.8	-172.8	152.7	0	0	0	110	A782 E790 L793 R794 A797 A801	A782-L805 WeakPolarHBondContact O-CA 3.09Å; E790-L805 HydrophobicContact CG-CD1 4.28Å; E790-L805 HydrophobicContact CG-CD2 4.28Å; L793-L805 HydrophobicContact CB-CD1 3.82Å; L793-L805 HydrophobicContact CB-CG 4.17Å; R794-L805 HydrophobicContact CB-CD1 3.8Å; A797-L805 HydrophobicContact CB-CB 4.13Å; A801-L805 VanDerWaalsContact O-CB 3.31Å; A801-L805 WeakPolarHBondContact O-CB 3.39Å; A801-L805 PolarHBondContact O-N 3.12Å
806	Y	88.8	Confident	80.4	Confident	14 Å²	14	56.5 Å²	56.5	6%	0.055	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140	169.9	-57.6	-94.8	0	0	0	109.4	Y781 A782 L783 G784 M803 I817 K820 L821 R824	Y781-Y806 AromaticContact CD1-CE2 3.98Å; Y781-Y806 HydrophobicContact CD1-CE2 3.98Å; Y781-Y806 HydrophobicContact CE1-CE2 4.42Å; A782-Y806 PolarHBondContact O-N 2.95Å; L783-Y806 WeakPolarHBondContact CA-O 3.41Å; L783-Y806 HydrophobicContact CD1-CD2 3.76Å; L783-Y806 HydrophobicContact CD1-CG 4.43Å; L783-Y806 HydrophobicContact CG-CD2 4.41Å; G784-Y806 PolarHBondContact N-O 2.04Å; M803-Y806 PolarHBondContact O-OH 3.41Å; Y806-I817 HydrophobicContact CD1-CG2 4.11Å; Y806-I817 HydrophobicContact CG-CG2 3.98Å; Y806-K820 HydrophobicContact CE1-CB 3.89Å; Y806-L821 HydrophobicContact CD2-CD1 4.43Å; Y806-L821 HydrophobicContact CE2-CD1 3.65Å; Y806-R824 VanDerWaalsContact CE1-NH1 3.3Å; Y806-R824 VanDerWaalsContact OH-CD 3.29Å; Y806-R824 WeakPolarHBondContact OH-CD 3.4Å; Y806-R824 PolarHBondContact OH-NH1 2.95Å
807	Y	85.2	Confident	79.8	Confident	98 Å²	98	57 Å²	57	38%	0.384	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.7	175.4	178.9	-97.5	0	0	0	109.1	G784 G786 A788 L793 E809	G784-Y807 CarbonylContact O-C 3.48Å; G784-Y807 WeakPolarHBondContact O-CA 3.39Å; G786-Y807 PolarHBondContact O-OH 3.46Å; A788-Y807 HydrophobicContact CB-CE2 4.47Å; A788-Y807 WeakPolarHBondContact O-CE2 3.24Å; L793-Y807 HydrophobicContact CD1-CD2 4.26Å; Y807-E809 HydrophobicContact CE1-CG 4Å
808	A	81.8	Confident	79.1	Confident	6 Å²	6	57.6 Å²	57.6	5%	0.05	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	140.3	166.5	0	0	0	0	0	110.2	G784 V785 G786 D810 K813 I817	G784-A808 PolarHBondContact O-N 3.07Å; V785-A808 CarbonylContact C-O 3.53Å; V785-A808 VanDerWaalsContact CA-O 3.24Å; V785-A808 WeakPolarHBondContact CA-O 3.02Å; V785-A808 HydrophobicContact CG2-CB 4.45Å; G786-A808 PolarHBondContact N-O 3.27Å; A808-D810 WeakPolarHBondContact CB-O 3.06Å; A808-D810 PolarHBondContact O-N 3.47Å; A808-K813 HydrophobicContact CB-CB 4.17Å; A808-I817 HydrophobicContact CB-CD1 3.58Å
809	E	74.1	Confident	78.5	Confident	132 Å²	132	64.4 Å²	64.4	62%	0.617	31%	0.314	S	S	*	.	S	Bend	trans	-69.9	-23.3	176.4	-61.8	158.8	154	0	0	111.9	Y807 K813	Y807-E809 HydrophobicContact CE1-CG 4Å; E809-K813 IonicContact OE2-NZ 3.82Å; E809-K813 PolarHBondContact OE2-NZ 2.75Å
810	D	74.1	Confident	78.4	Confident	43 Å²	43	63.5 Å²	63.5	23%	0.23	31%	0.308	C	S	.	.	S	Bend	trans	-147	165.5	-173	55.6	64.8	0	0	0	111.5	V785 A808 E812 K813	V785-D810 WeakPolarHBondContact CG1-O 3.46Å; A808-D810 WeakPolarHBondContact CB-O 3.06Å; A808-D810 PolarHBondContact O-N 3.47Å; D810-E812 VanDerWaalsContact C-N 3.29Å; D810-E812 PolarHBondContact OD1-N 2.84Å; D810-E812 VanDerWaalsContact OD1-N 3.12Å; D810-K813 WeakPolarHBondContact OD1-CB 3.29Å; D810-K813 VanDerWaalsContact OD1-CG 3.27Å; D810-K813 WeakPolarHBondContact OD1-CG 3.45Å; D810-K813 PolarHBondContact OD1-N 2.86Å; D810-K813 VanDerWaalsContact OD2-CD 3.28Å; D810-K813 WeakPolarHBondContact OD2-CD 3.41Å; D810-K813 WeakPolarHBondContact OD2-CE 3.21Å; D810-K813 IonicContact OD2-NZ 3.24Å; D810-K813 PolarHBondContact OD2-NZ 3.09Å
811	F	73.4	Confident	78.4	Confident	28 Å²	28	60.9 Å²	60.9	12%	0.123	29%	0.291	C	S	.	.	S	Bend	trans	-79	-10.4	178	-75.1	-95	0	0	0	113.3	L660 N664 L667 V668 F757 D759 V785 M814	L660-F811 HydrophobicContact CD1-CE1 3.55Å; L660-F811 HydrophobicContact CD1-CE2 4.18Å; L660-F811 HydrophobicContact CD1-CZ 3.21Å; N664-F811 HydrophobicContact CB-CD1 4.03Å; N664-F811 HydrophobicContact CB-CD2 4.17Å; N664-F811 HydrophobicContact CB-CE1 3.89Å; N664-F811 HydrophobicContact CB-CE2 4.04Å; N664-F811 HydrophobicContact CB-CG 4.2Å; N664-F811 HydrophobicContact CB-CZ 3.94Å; L667-F811 HydrophobicContact CB-CD1 4.45Å; L667-F811 HydrophobicContact CD1-CB 3.7Å; L667-F811 HydrophobicContact CD1-CD1 4.46Å; L667-F811 HydrophobicContact CD1-CG 4.33Å; V668-F811 HydrophobicContact CG2-CE1 4.02Å; F757-F811 HydrophobicContact CE1-CE1 4.12Å; F757-F811 HydrophobicContact CE1-CZ 4.47Å; F757-F811 AromaticContact CZ-CE1 3.68Å; F757-F811 HydrophobicContact CZ-CE1 3.68Å; F757-F811 HydrophobicContact CZ-CZ 4.22Å; D759-F811 HydrophobicContact CB-CZ 4.43Å; V785-F811 HydrophobicContact CB-CE1 4.17Å; V785-F811 HydrophobicContact CB-CE2 4.05Å; V785-F811 HydrophobicContact CB-CZ 3.77Å; V785-F811 HydrophobicContact CG1-CD1 4.11Å; V785-F811 HydrophobicContact CG1-CD2 3.54Å; V785-F811 HydrophobicContact CG1-CE1 3.97Å; V785-F811 HydrophobicContact CG1-CE2 3.38Å; V785-F811 HydrophobicContact CG1-CG 3.88Å; V785-F811 HydrophobicContact CG1-CZ 3.57Å; V785-F811 HydrophobicContact CG2-CE1 4.4Å; V785-F811 HydrophobicContact CG2-CZ 4.48Å; F811-M814 HydrophobicContact CD1-CE 3.57Å; F811-M814 HydrophobicContact CD1-SD 4.47Å; F811-M814 HydrophobicContact CE1-CE 3.8Å; F811-M814 WeakPolarHBondContact O-CB 3.5Å; F811-M814 PolarHBondContact O-N 2.96Å
812	E	69.9	Low	78.5	Confident	184 Å²	184	63.1 Å²	63.1	86%	0.86	30%	0.3	S	S	*	.	S	Bend	trans	-76.1	-40.8	-179.5	-58.9	-176.5	174.9	0	0	110.8	D810 M814	D810-E812 VanDerWaalsContact C-N 3.29Å; D810-E812 PolarHBondContact OD1-N 2.84Å; D810-E812 VanDerWaalsContact OD1-N 3.12Å; E812-M814 PolarHBondContact O-N 2.03Å
813	K	72.3	Confident	78.2	Confident	86 Å²	86	60.4 Å²	60.4	37%	0.374	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-7.5	173.9	-68.7	164.7	-171.6	145.5	0	113.9	A808 E809 D810 G815 E816 I817	A808-K813 HydrophobicContact CB-CB 4.17Å; E809-K813 IonicContact OE2-NZ 3.82Å; E809-K813 PolarHBondContact OE2-NZ 2.75Å; D810-K813 WeakPolarHBondContact OD1-CB 3.29Å; D810-K813 VanDerWaalsContact OD1-CG 3.27Å; D810-K813 WeakPolarHBondContact OD1-CG 3.45Å; D810-K813 PolarHBondContact OD1-N 2.86Å; D810-K813 VanDerWaalsContact OD2-CD 3.28Å; D810-K813 WeakPolarHBondContact OD2-CD 3.41Å; D810-K813 WeakPolarHBondContact OD2-CE 3.21Å; D810-K813 IonicContact OD2-NZ 3.24Å; D810-K813 PolarHBondContact OD2-NZ 3.09Å; K813-G815 PolarHBondContact O-N 3.23Å; K813-G815 VanDerWaalsContact O-N 3.15Å; K813-E816 WeakPolarHBondContact O-CB 3.32Å; K813-E816 PolarHBondContact O-N 3.2Å; K813-I817 PolarHBondContact O-N 3.48Å
814	M	76.6	Confident	78	Confident	13 Å²	13	60.4 Å²	60.4	6%	0.064	29%	0.291	C	S	.	.	H	α-helix	trans	-56.2	-30.6	177	-174.6	-175.8	-99.1	0	0	112.6	V668 F671 F757 V785 F811 E812 E816 I817 T818	V668-M814 HydrophobicContact CG2-CE 4.05Å; F671-M814 HydrophobicContact CB-CE 4.35Å; F671-M814 HydrophobicContact CB-CG 4.35Å; F671-M814 HydrophobicContact CB-SD 3.66Å; F671-M814 HydrophobicContact CD2-CG 3.99Å; F671-M814 HydrophobicContact CD2-SD 4.36Å; F671-M814 HydrophobicContact CG-CG 4.45Å; F671-M814 HydrophobicContact CG-SD 4.24Å; F757-M814 HydrophobicContact CD2-CE 4.49Å; F757-M814 HydrophobicContact CE2-CE 3.4Å; F757-M814 VanDerWaalsContact CE2-CE 3.4Å; F757-M814 HydrophobicContact CZ-CE 3.44Å; F757-M814 VanDerWaalsContact CZ-CE 3.44Å; V785-M814 HydrophobicContact CG2-CE 4.4Å; F811-M814 HydrophobicContact CD1-CE 3.57Å; F811-M814 HydrophobicContact CD1-SD 4.47Å; F811-M814 HydrophobicContact CE1-CE 3.8Å; F811-M814 WeakPolarHBondContact O-CB 3.5Å; F811-M814 PolarHBondContact O-N 2.96Å; E812-M814 PolarHBondContact O-N 2.03Å; M814-E816 VanDerWaalsContact C-N 3.3Å; M814-E816 PolarHBondContact O-N 3.07Å; M814-I817 PolarHBondContact O-N 3.4Å; M814-T818 WeakPolarHBondContact O-CB 3.48Å; M814-T818 PolarHBondContact O-N 2.81Å; M814-T818 PolarHBondContact O-OG1 2.88Å
815	G	73.6	Confident	77	Confident	40 Å²	40	60 Å²	60	41%	0.412	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-32.6	174.6	0	0	0	0	0	113.8	K813 T818 K819	K813-G815 PolarHBondContact O-N 3.23Å; K813-G815 VanDerWaalsContact O-N 3.15Å; G815-T818 WeakPolarHBondContact O-CB 3.11Å; G815-K819 WeakPolarHBondContact O-CG 3.38Å; G815-K819 PolarHBondContact O-N 2.87Å
816	E	76.6	Confident	75.6	Confident	108 Å²	108	60.3 Å²	60.3	51%	0.505	29%	0.293	S	S	.	.	H	α-helix	trans	-74.5	-43	174.4	-68.4	-163.5	-173.9	0	0	112.6	K813 M814 T818 K819 K820	K813-E816 WeakPolarHBondContact O-CB 3.32Å; K813-E816 PolarHBondContact O-N 3.2Å; M814-E816 VanDerWaalsContact C-N 3.3Å; M814-E816 PolarHBondContact O-N 3.07Å; E816-T818 PolarHBondContact O-N 3.31Å; E816-K819 PolarHBondContact O-N 2.85Å; E816-K819 VanDerWaalsContact O-N 3.16Å; E816-K820 WeakPolarHBondContact O-CG 3.36Å; E816-K820 PolarHBondContact O-N 3.05Å; E816-K820 IonicContact OE2-NZ 2.81Å; E816-K820 PolarHBondContact OE2-NZ 2.85Å
817	I	80.5	Confident	73.7	Confident	12 Å²	12	66 Å²	66	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-57.5	-43.4	174.9	-67.9	-179.7	0	0	0	109.1	L783 Y806 A808 K813 M814 K819 K820 L821	L783-I817 HydrophobicContact CD2-CG2 3.73Å; L783-I817 HydrophobicContact CG-CG2 4.01Å; Y806-I817 HydrophobicContact CD1-CG2 4.11Å; Y806-I817 HydrophobicContact CG-CG2 3.98Å; A808-I817 HydrophobicContact CB-CD1 3.58Å; K813-I817 PolarHBondContact O-N 3.48Å; M814-I817 PolarHBondContact O-N 3.4Å; I817-K819 PolarHBondContact O-N 3.29Å; I817-K820 PolarHBondContact O-N 2.04Å; I817-L821 WeakPolarHBondContact O-CB 3.07Å; I817-L821 PolarHBondContact O-N 2.99Å
818	T	80	Confident	72.1	Confident	12 Å²	12	63.1 Å²	63.1	7%	0.074	31%	0.31	C	S	.	.	H	α-helix	trans	-54.9	-48.7	175	-55.4	0	0	0	0	111.9	F671 I675 M814 G815 E816 K822	F671-T818 VanDerWaalsContact CD2-OG1 3.3Å; F671-T818 WeakPolarHBondContact CD2-OG1 3.4Å; I675-T818 HydrophobicContact CD1-CG2 4.01Å; M814-T818 WeakPolarHBondContact O-CB 3.48Å; M814-T818 PolarHBondContact O-N 2.81Å; M814-T818 PolarHBondContact O-OG1 2.88Å; G815-T818 WeakPolarHBondContact O-CB 3.11Å; E816-T818 PolarHBondContact O-N 3.31Å; T818-K822 HydrophobicContact CG2-CD 4.17Å; T818-K822 WeakPolarHBondContact O-CB 3.45Å; T818-K822 WeakPolarHBondContact O-CG 3.03Å; T818-K822 PolarHBondContact O-N 2.7Å
819	K	77.9	Confident	70.5	Confident	159 Å²	159	63.4 Å²	63.4	69%	0.691	31%	0.311	S	S	*	.	H	α-helix	trans	-62.8	-45.3	177	-70.4	172	-177.9	176.2	0	112.3	G815 E816 I817 S823	G815-K819 WeakPolarHBondContact O-CG 3.38Å; G815-K819 PolarHBondContact O-N 2.87Å; E816-K819 PolarHBondContact O-N 2.85Å; E816-K819 VanDerWaalsContact O-N 3.16Å; I817-K819 PolarHBondContact O-N 3.29Å; K819-S823 PolarHBondContact O-N 3.37Å; K819-S823 VanDerWaalsContact O-N 3.16Å
820	K	78.5	Confident	69	Low	104 Å²	104	62.1 Å²	62.1	45%	0.452	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-47.1	179.1	-70.3	164	-178.7	156.7	0	111	Y806 E816 I817 S823 R824	Y806-K820 HydrophobicContact CE1-CB 3.89Å; E816-K820 WeakPolarHBondContact O-CG 3.36Å; E816-K820 PolarHBondContact O-N 3.05Å; E816-K820 IonicContact OE2-NZ 2.81Å; E816-K820 PolarHBondContact OE2-NZ 2.85Å; I817-K820 PolarHBondContact O-N 2.04Å; K820-S823 PolarHBondContact O-N 2.93Å; K820-R824 WeakPolarHBondContact O-CG 3.39Å; K820-R824 PolarHBondContact O-N 3.35Å
821	L	81.5	Confident	67.2	Low	0 Å²	0	67.7 Å²	67.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-47.8	179.9	-173.5	65.1	0	0	0	111.6	F671 I675 I755 Y781 L783 Y806 I817 S823 R824 M825	F671-L821 HydrophobicContact CE2-CD2 4.29Å; F671-L821 HydrophobicContact CZ-CD2 3.76Å; I675-L821 HydrophobicContact CD1-CD2 3.98Å; I675-L821 HydrophobicContact CD1-CG 4.44Å; I755-L821 HydrophobicContact CD1-CD2 4.15Å; Y781-L821 HydrophobicContact CD1-CD1 3.56Å; Y781-L821 HydrophobicContact CE1-CD1 3.82Å; Y781-L821 HydrophobicContact CG-CD1 4.01Å; L783-L821 HydrophobicContact CD1-CD2 4.3Å; L783-L821 HydrophobicContact CD2-CD2 4.25Å; Y806-L821 HydrophobicContact CD2-CD1 4.43Å; Y806-L821 HydrophobicContact CE2-CD1 3.65Å; I817-L821 WeakPolarHBondContact O-CB 3.07Å; I817-L821 PolarHBondContact O-N 2.99Å; L821-S823 VanDerWaalsContact C-N 3.35Å; L821-S823 PolarHBondContact O-N 2.69Å; L821-R824 PolarHBondContact O-N 2.79Å; L821-R824 VanDerWaalsContact O-N 3.13Å; L821-M825 HydrophobicContact CD1-CG 4.27Å; L821-M825 HydrophobicContact CD1-SD 4.35Å; L821-M825 HydrophobicContact CD2-SD 4.46Å; L821-M825 HydrophobicContact CG-CG 4.3Å; L821-M825 HydrophobicContact CG-SD 3.94Å; L821-M825 WeakPolarHBondContact O-CG 3.04Å; L821-M825 PolarHBondContact O-N 2.77Å
822	K	77.6	Confident	65.6	Low	48 Å²	48	67.9 Å²	67.9	21%	0.209	33%	0.334	C	S	.	.	H	α-helix	trans	-51.4	-52.3	172.5	-75	173.2	179.8	-165.8	0	111.5	S674 I675 S678 T818 R824 M825 C826	S674-K822 WeakPolarHBondContact O-CE 3.37Å; S674-K822 PolarHBondContact O-NZ 2.94Å; S674-K822 PolarHBondContact OG-NZ 3.3Å; I675-K822 HydrophobicContact CD1-CG 3.88Å; S678-K822 WeakPolarHBondContact OG-CD 3.45Å; S678-K822 WeakPolarHBondContact OG-CE 3.24Å; S678-K822 PolarHBondContact OG-NZ 3.26Å; T818-K822 HydrophobicContact CG2-CD 4.17Å; T818-K822 WeakPolarHBondContact O-CB 3.45Å; T818-K822 WeakPolarHBondContact O-CG 3.03Å; T818-K822 PolarHBondContact O-N 2.7Å; K822-R824 VanDerWaalsContact C-N 3.3Å; K822-R824 PolarHBondContact O-N 2.61Å; K822-M825 PolarHBondContact O-N 2.84Å; K822-C826 PolarHBondContact O-N 3.33Å; K822-C826 PolarHBondContact O-SG 3.49Å
823	S	67.6	Low	63.9	Low	67 Å²	67	63.4 Å²	63.4	47%	0.469	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-35.3	179.8	-171.8	0	0	0	0	113.6	K819 K820 L821	K819-S823 PolarHBondContact O-N 3.37Å; K819-S823 VanDerWaalsContact O-N 3.16Å; K820-S823 PolarHBondContact O-N 2.93Å; L821-S823 VanDerWaalsContact C-N 3.35Å; L821-S823 PolarHBondContact O-N 2.69Å
824	R	71	Confident	62	Low	77 Å²	77	62 Å²	62	29%	0.291	33%	0.326	S	S	.	.	H	α-helix	trans	-81.5	-37.7	179.7	-65.1	-158	-166.8	144.8	-20.8	113.3	E802 M803 Y806 K820 L821 K822 C826 K827 V828	E802-R824 PolarHBondContact O-NH1 2.84Å; E802-R824 PolarHBondContact O-NH2 3.02Å; M803-R824 WeakPolarHBondContact O-CD 3.45Å; M803-R824 PolarHBondContact O-NH1 3.26Å; M803-R824 VanDerWaalsContact O-NH1 3.09Å; Y806-R824 VanDerWaalsContact CE1-NH1 3.3Å; Y806-R824 VanDerWaalsContact OH-CD 3.29Å; Y806-R824 WeakPolarHBondContact OH-CD 3.4Å; Y806-R824 PolarHBondContact OH-NH1 2.95Å; K820-R824 WeakPolarHBondContact O-CG 3.39Å; K820-R824 PolarHBondContact O-N 3.35Å; L821-R824 PolarHBondContact O-N 2.79Å; L821-R824 VanDerWaalsContact O-N 3.13Å; K822-R824 VanDerWaalsContact C-N 3.3Å; K822-R824 PolarHBondContact O-N 2.61Å; R824-C826 VanDerWaalsContact C-N 3.28Å; R824-C826 PolarHBondContact O-N 3.01Å; R824-K827 WeakPolarHBondContact O-CB 3.48Å; R824-K827 PolarHBondContact O-N 2.79Å; R824-V828 PolarHBondContact O-N 3.31Å
825	M	66.2	Low	60.1	Low	6 Å²	6	70.5 Å²	70.5	3%	0.03	36%	0.358	C	S	.	.	H	α-helix	trans	-56.9	-43.1	174.7	-72.7	178	74.4	0	0	110.8	M648 L650 I675 L679 I755 Y781 L821 K822 K827 V828 L829	M648-M825 HydrophobicContact SD-CE 4.35Å; L650-M825 HydrophobicContact CD1-CE 4.11Å; L650-M825 HydrophobicContact CD2-CE 3.99Å; I675-M825 HydrophobicContact CG2-CE 4.47Å; I675-M825 HydrophobicContact CG2-SD 4.25Å; L679-M825 HydrophobicContact CD2-CE 4.44Å; I755-M825 HydrophobicContact CD1-CE 3.99Å; I755-M825 HydrophobicContact CD1-SD 3.91Å; Y781-M825 HydrophobicContact CE2-CG 4.39Å; L821-M825 HydrophobicContact CD1-CG 4.27Å; L821-M825 HydrophobicContact CD1-SD 4.35Å; L821-M825 HydrophobicContact CD2-SD 4.46Å; L821-M825 HydrophobicContact CG-CG 4.3Å; L821-M825 HydrophobicContact CG-SD 3.94Å; L821-M825 WeakPolarHBondContact O-CG 3.04Å; L821-M825 PolarHBondContact O-N 2.77Å; K822-M825 PolarHBondContact O-N 2.84Å; M825-K827 VanDerWaalsContact C-N 3.25Å; M825-K827 PolarHBondContact O-N 2.59Å; M825-V828 PolarHBondContact O-N 2.93Å; M825-V828 VanDerWaalsContact O-N 3.16Å; M825-L829 WeakPolarHBondContact O-CG 3.48Å; M825-L829 PolarHBondContact O-N 2.03Å
826	C	59.6	Low	58.2	Low	29 Å²	29	72.4 Å²	72.4	20%	0.196	36%	0.362	C	S	.	.	H	α-helix	trans	-68	-23.3	179.3	-43.9	0	0	0	0	113.1	C643 K822 R824	C643-C826 HydrophobicContact CB-CB 4.31Å; C643-C826 WeakPolarHBondContact CB-SG 3.4Å; C643-C826 PolarHBondContact N-SG 3.22Å; C643-C826 WeakPolarHBondContact SG-CA 3.07Å; C643-C826 WeakPolarHBondContact SG-CB 3.45Å; C643-C826 PolarHBondContact SG-N 3.4Å; C643-C826 CovalentContact SG-SG 2.04Å; C643-C826 PolarHBondContact SG-SG 2.04Å; K822-C826 PolarHBondContact O-N 3.33Å; K822-C826 PolarHBondContact O-SG 3.49Å; R824-C826 VanDerWaalsContact C-N 3.28Å; R824-C826 PolarHBondContact O-N 3.01Å
827	K	50.8	Low	56.2	Low	134 Å²	134	69.3 Å²	69.3	58%	0.583	36%	0.36	S	S	*	.	H	α-helix	trans	-75.4	-30.3	173.7	-69.9	177.6	-179.1	-177.3	0	113.3	R824 M825 L829 I830 K831	R824-K827 WeakPolarHBondContact O-CB 3.48Å; R824-K827 PolarHBondContact O-N 2.79Å; M825-K827 VanDerWaalsContact C-N 3.25Å; M825-K827 PolarHBondContact O-N 2.59Å; K827-L829 VanDerWaalsContact C-N 3.34Å; K827-I830 PolarHBondContact O-N 3.22Å; K827-K831 PolarHBondContact O-N 2.63Å
828	V	51.1	Low	54.1	Low	38 Å²	38	78.9 Å²	78.9	23%	0.23	40%	0.395	C	S	.	.	H	α-helix	trans	-66.4	-39.5	176.5	175.2	0	0	0	0	110.7	Y781 R824 M825 I830 K831 S832	Y781-V828 WeakPolarHBondContact OH-CG2 3.04Å; R824-V828 PolarHBondContact O-N 3.31Å; M825-V828 PolarHBondContact O-N 2.93Å; M825-V828 VanDerWaalsContact O-N 3.16Å; V828-I830 VanDerWaalsContact C-N 3.29Å; V828-I830 PolarHBondContact O-N 3.39Å; V828-K831 PolarHBondContact O-N 3.43Å; V828-K831 VanDerWaalsContact O-N 3.1Å; V828-S832 PolarHBondContact O-N 3.37Å; V828-S832 PolarHBondContact O-OG 3.23Å
829	L	48.1	Very low	52	Low	12 Å²	12	84.7 Å²	84.7	6%	0.063	43%	0.425	C	S	.	.	H	α-helix	trans	-64.1	-32.2	179.5	-55.6	170.7	0	0	0	112.9	C643 M648 M825 K827 S832 N833	C643-L829 HydrophobicContact CB-CD1 4.4Å; M648-L829 HydrophobicContact CB-CD2 4.14Å; M648-L829 HydrophobicContact CE-CD1 3.62Å; M648-L829 HydrophobicContact CE-CD2 3.7Å; M648-L829 HydrophobicContact CE-CG 4.19Å; M648-L829 HydrophobicContact SD-CD2 4.16Å; M825-L829 WeakPolarHBondContact O-CG 3.48Å; M825-L829 PolarHBondContact O-N 2.03Å; K827-L829 VanDerWaalsContact C-N 3.34Å; L829-S832 WeakPolarHBondContact CA-OG 3.4Å; L829-S832 PolarHBondContact O-OG 2.85Å; L829-N833 PolarHBondContact O-N 2.85Å
830	I	42	Very low	49.7	Very low	105 Å²	105	84.9 Å²	84.9	54%	0.538	43%	0.426	S	S	.	.	H	α-helix	trans	-71.6	-38.5	174.3	-62.1	167.6	0	0	0	110.7	K827 V828 N833 G834	K827-I830 PolarHBondContact O-N 3.22Å; V828-I830 VanDerWaalsContact C-N 3.29Å; V828-I830 PolarHBondContact O-N 3.39Å; I830-N833 PolarHBondContact O-N 3.2Å; I830-G834 PolarHBondContact O-N 3.28Å
831	K	36.1	Very low	47.5	Very low	159 Å²	159	85.3 Å²	85.3	69%	0.691	43%	0.429	S	S	*	.	H	α-helix	trans	-69.7	-35.1	176.4	-77.2	-169.8	173.6	-174.7	0	113.3	K827 V828 N833 G834	K827-K831 PolarHBondContact O-N 2.63Å; V828-K831 PolarHBondContact O-N 3.43Å; V828-K831 VanDerWaalsContact O-N 3.1Å; K831-N833 VanDerWaalsContact C-N 3.34Å; K831-G834 PolarHBondContact O-N 2.94Å; K831-G834 VanDerWaalsContact O-N 3.16Å
832	S	39.3	Very low	45.2	Very low	33 Å²	33	92.2 Å²	92.2	23%	0.231	46%	0.46	C	S	.	.	H	α-helix	trans	-67.1	-34.4	173.6	49.5	0	0	0	0	112.6	V828 L829 G834 Y835 T836	V828-S832 PolarHBondContact O-N 3.37Å; V828-S832 PolarHBondContact O-OG 3.23Å; L829-S832 WeakPolarHBondContact CA-OG 3.4Å; L829-S832 PolarHBondContact O-OG 2.85Å; S832-G834 PolarHBondContact O-N 2.78Å; S832-Y835 PolarHBondContact O-N 2.94Å; S832-T836 PolarHBondContact O-N 2.97Å
833	N	34.5	Very low	42.9	Very low	90 Å²	90	98.4 Å²	98.4	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-18.5	172.5	-82.7	-14.6	0	0	0	113.4	L829 I830 K831 Y835 T836 G837	L829-N833 PolarHBondContact O-N 2.85Å; I830-N833 PolarHBondContact O-N 3.2Å; K831-N833 VanDerWaalsContact C-N 3.34Å; N833-Y835 PolarHBondContact O-N 2.95Å; N833-T836 WeakPolarHBondContact CA-OG1 3.31Å; N833-T836 PolarHBondContact O-OG1 3Å; N833-T836 PolarHBondContact OD1-OG1 2.94Å; N833-G837 PolarHBondContact O-N 2.04Å
834	G	33.8	Very low	41.5	Very low	55 Å²	55	100.4 Å²	100.4	57%	0.567	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-21.6	166.2	0	0	0	0	0	114.4	I830 K831 S832	I830-G834 PolarHBondContact O-N 3.28Å; K831-G834 PolarHBondContact O-N 2.94Å; K831-G834 VanDerWaalsContact O-N 3.16Å; S832-G834 PolarHBondContact O-N 2.78Å
835	Y	36.8	Very low	39.8	Very low	192 Å²	192	103.3 Å²	103.3	75%	0.753	51%	0.51	S	S	*	.	H	α-helix	trans	-103.1	-19.2	179.4	-78.7	-89.3	0	0	0	114.1	S832 N833 G837 R838	S832-Y835 PolarHBondContact O-N 2.94Å; N833-Y835 PolarHBondContact O-N 2.95Å; Y835-G837 PolarHBondContact O-N 3.28Å; Y835-R838 PolarHBondContact O-N 2.83Å
836	T	33	Very low	38.3	Very low	81 Å²	81	106.8 Å²	106.8	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-71.9	-16.8	163.2	53.3	0	0	0	0	112.3	S832 N833 R838 L839 F840	S832-T836 PolarHBondContact O-N 2.97Å; N833-T836 WeakPolarHBondContact CA-OG1 3.31Å; N833-T836 PolarHBondContact O-OG1 3Å; N833-T836 PolarHBondContact OD1-OG1 2.94Å; T836-R838 PolarHBondContact O-N 3.44Å; T836-R838 VanDerWaalsContact O-N 3.08Å; T836-L839 PolarHBondContact O-N 3.46Å; T836-F840 PolarHBondContact O-N 2.81Å
837	G	34.2	Very low	37.1	Very low	43 Å²	43	110.6 Å²	110.6	44%	0.443	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	-9	164.5	0	0	0	0	0	115.6	N833 Y835 H841	N833-G837 PolarHBondContact O-N 2.04Å; Y835-G837 PolarHBondContact O-N 3.28Å; G837-H841 WeakPolarHBondContact O-CB 3.29Å
838	R	37	Very low	36.5	Very low	212 Å²	212	108.5 Å²	108.5	80%	0.8	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-5.4	175.5	-116.1	-179.1	-173.5	-174.2	3	116	Y835 T836	Y835-R838 PolarHBondContact O-N 2.83Å; T836-R838 PolarHBondContact O-N 3.44Å; T836-R838 VanDerWaalsContact O-N 3.08Å
839	L	34.8	Very low	35.8	Very low	134 Å²	134	111.3 Å²	111.3	70%	0.702	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	-34.4	173.1	-92.7	155.5	0	0	0	112.6	T836 F842	T836-L839 PolarHBondContact O-N 3.46Å; L839-F842 PolarHBondContact O-N 2.91Å
840	F	30	Very low	35	Very low	164 Å²	164	115.7 Å²	115.7	72%	0.719	59%	0.591	S	S	*	*	H	α-helix	trans	-72	-29.7	172.2	-117	-95.3	0	0	0	113.1	T836 F842 F843 V844	T836-F840 PolarHBondContact O-N 2.81Å; F840-F842 PolarHBondContact O-N 3.43Å; F840-F843 PolarHBondContact O-N 2.88Å; F840-V844 PolarHBondContact O-N 3.32Å
841	H	32.7	Very low	34.6	Very low	112 Å²	112	119.2 Å²	119.2	52%	0.519	60%	0.603	S	S	.	*	H	α-helix	trans	-72.7	-5.9	174.1	-146.6	-44.1	0	0	0	113.6	G837	G837-H841 WeakPolarHBondContact O-CB 3.29Å
842	F	32.1	Very low	34.5	Very low	146 Å²	146	117 Å²	117	64%	0.64	60%	0.598	S	S	*	*	H	α-helix	trans	-90.1	-22.6	172.2	-133.5	-91.4	0	0	0	113.2	L839 F840	L839-F842 PolarHBondContact O-N 2.91Å; F840-F842 PolarHBondContact O-N 3.43Å
843	F	30.6	Very low	34.2	Very low	178 Å²	178	120.5 Å²	120.5	78%	0.781	61%	0.613	S	S	*	*	H	α-helix	trans	-97.5	-14.9	-179.9	-92.6	-83.6	0	0	0	115.3	F840	F840-F843 PolarHBondContact O-N 2.88Å
844	V	36.9	Very low	33.9	Very low	109 Å²	109	123.5 Å²	123.5	66%	0.661	63%	0.628	S	S	*	*	S	Bend	trans	-99.7	-6.2	174.6	-172.8	0	0	0	0	113	F840	F840-V844 PolarHBondContact O-N 3.32Å
845	K	35.1	Very low	33.8	Very low	137 Å²	137	129 Å²	129	60%	0.596	64%	0.637	S	S	*	*	S	Bend	trans	-102.5	18.8	172.1	-92.9	-170.2	175.3	170.7	0	115.4
846	I	35.8	Very low	33.5	Very low	79 Å²	79	125.9 Å²	125.9	41%	0.405	63%	0.632	S	S	.	*	S	Bend	trans	-124.7	38	167.4	-36.3	-177.8	0	0	0	112.2	I850	I846-I850 HydrophobicContact CG2-CD1 3.61Å; I846-I850 HydrophobicContact CG2-CG1 3.72Å
847	S	35	Very low	33.4	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	65%	0.647	S	S	*	*	S	Bend	trans	-135.2	49.4	160.9	-159	0	0	0	0	110.9
848	P	36.8	Very low	33.1	Very low	89 Å²	89	132.6 Å²	132.6	58%	0.578	66%	0.662	S	S	*	*	S	Bend		-134.4	-0.7	119.2	16.4	3.8	0	0	0	114.7
849	I	36.2	Very low	32.6	Very low	98 Å²	98	129 Å²	129	50%	0.503	66%	0.664	S	S	.	*	S	Bend	trans	-83.4	-33.5	-173	-60.5	178.3	0	0	0	112.7	F851 N852 I853	I849-F851 PolarHBondContact O-N 3.16Å; I849-N852 PolarHBondContact O-N 3.3Å; I849-I853 HydrophobicContact CG2-CD1 4.33Å
850	I	32.4	Very low	32.1	Very low	103 Å²	103	126.3 Å²	126.3	53%	0.528	67%	0.668	S	S	.	*	H	α-helix	trans	-64.5	-26.3	176	-78.9	166.1	0	0	0	112.3	I846 N852 L854	I846-I850 HydrophobicContact CG2-CD1 3.61Å; I846-I850 HydrophobicContact CG2-CG1 3.72Å; I850-N852 VanDerWaalsContact C-N 3.29Å; I850-N852 PolarHBondContact O-N 3.14Å; I850-L854 HydrophobicContact CG2-CD1 4.48Å
851	F	32.5	Very low	31.9	Very low	180 Å²	180	125.6 Å²	125.6	79%	0.789	67%	0.672	S	S	*	*	H	α-helix	trans	-74.7	-14.6	-179.9	-134	-90.9	0	0	0	114.3	I849	I849-F851 PolarHBondContact O-N 3.16Å
852	N	35.2	Very low	31.6	Very low	111 Å²	111	130.9 Å²	130.9	59%	0.594	69%	0.689	S	S	*	*	H	α-helix	trans	-106.1	-18.5	-180	-85.3	-34.9	0	0	0	114.8	I849 I850	I849-N852 PolarHBondContact O-N 3.3Å; I850-N852 VanDerWaalsContact C-N 3.29Å; I850-N852 PolarHBondContact O-N 3.14Å
853	I	32.4	Very low	31.1	Very low	108 Å²	108	129 Å²	129	55%	0.554	69%	0.694	S	S	*	*	H	α-helix	trans	-81.2	-28.9	174.7	-64.3	177.9	0	0	0	111.5	I849 K855 I856	I849-I853 HydrophobicContact CG2-CD1 4.33Å; I853-K855 PolarHBondContact O-N 3.07Å; I853-K855 VanDerWaalsContact O-N 3.08Å; I853-I856 PolarHBondContact O-N 3.35Å
854	L	29.3	Very low	30.9	Very low	153 Å²	153	128 Å²	128	80%	0.801	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	0.7	172	-98.7	156.8	0	0	0	114.6	I850	I850-L854 HydrophobicContact CG2-CD1 4.48Å
855	K	29.9	Very low	30.3	Very low	171 Å²	171	131.7 Å²	131.7	74%	0.743	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-1.7	178.1	-143.4	176.4	-175.4	-179.4	0	114.4	I853	I853-K855 PolarHBondContact O-N 3.07Å; I853-K855 VanDerWaalsContact O-N 3.08Å
856	I	32.3	Very low	29.7	Very low	125 Å²	125	131 Å²	131	64%	0.641	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-22.2	-176.1	-67.1	177.3	0	0	0	112.8	I853 S858	I853-I856 PolarHBondContact O-N 3.35Å; I856-S858 PolarHBondContact O-N 3.48Å
857	L	29.4	Very low	29.1	Very low	156 Å²	156	137.3 Å²	137.3	82%	0.817	73%	0.729	S	S	*	*	S	Bend	trans	-101.9	55.5	-179.8	-67	177.3	0	0	0	113.5
858	S	28.2	Very low	28.5	Very low	110 Å²	110	142.4 Å²	142.4	77%	0.769	74%	0.737	S	S	*	*	S	Bend	trans	-134	35.6	165.7	82	0	0	0	0	114.6	I856	I856-S858 PolarHBondContact O-N 3.48Å
859	T	26.9	Very low	27.8	Very low	136 Å²	136	145.8 Å²	145.8	83%	0.834	74%	0.74	S	S	*	*	S	Bend	trans	-147	122.7	163.1	48.2	0	0	0	0	110.4
860	G	25.3	Very low	27.1	Very low	77 Å²	77	148.2 Å²	148.2	79%	0.794	75%	0.747	S	S	*	*			trans	120	79.9	163.7	0	0	0	0	0	118.1
861	N	25.5	Very low	26.6	Very low	150 Å²	150	153.4 Å²	153.4	80%	0.802	77%	0.766	S	S	*	*			trans	19	116.8	150.9	-71.1	-18.7	0	0	0	123.1
862	Y	25.9	Very low	26.1	Very low	223 Å²	223	149.3 Å²	149.3	88%	0.875	75%	0.752	S	S	*	*				44.5	150.2	119.9	-79.5	-80.2	0	0	0	124.5
863	S	22	Very low	25.5	Very low	105 Å²	105	152.1 Å²	152.1	73%	0.734	76%	0.759	S	S	*	*			trans	81.3	131.2	172.6	-73.3	0	0	0	0	116.1
864	I	25.3	Very low	25	Very low	159 Å²	159	151.6 Å²	151.6	82%	0.815	76%	0.764	S	S	*	*			cis	-147.6	158.2	8.8	-107.1	151.2	0	0	0	111.3
865	K	24	Very low	24.7	Very low	185 Å²	185	154.7 Å²	154.7	80%	0.804	77%	0.767	S	S	*	*			trans	-61.7	158.5	173.2	-59	166	177.3	168.4	0	110.8
866	T	23.6	Very low	24.4	Very low	124 Å²	124	154.4 Å²	154.4	76%	0.761	77%	0.766	S	S	*	*				-175.8	150	63.2	-57.4	0	0	0	0	112
867	R	22.8	Very low	24	Very low	211 Å²	211	154 Å²	154	80%	0.796	77%	0.765	S	S	*	*			trans	-29.2	147.2	162.8	-58.5	162.2	164.7	167.4	-8.2	115.7
868	F	22.5	Very low	23.7	Very low	216 Å²	216	157.5 Å²	157.5	95%	0.947	77%	0.768	S	S	*	*				-127.7	137.4	106.6	-121.4	-90.5	0	0	0	110.4
869	Y	22.3	Very low	23.5	Very low	160 Å²	160	158.9 Å²	158.9	63%	0.627	77%	0.766	S	S	*	*			trans	-119.6	168.9	-175.1	-163.7	-91	0	0	0	107.7
870	F	21.8	Very low	23.5	Very low	149 Å²	149	160.5 Å²	160.5	65%	0.654	76%	0.764	S	S	*	*			trans	95.8	97.4	174.8	-68.7	-89.5	0	0	0	116.9	L872	F870-L872 HydrophobicContact CD1-CD1 4.09Å; F870-L872 HydrophobicContact CD1-CG 4.22Å; F870-L872 HydrophobicContact CE1-CD1 3.65Å; F870-L872 HydrophobicContact CE1-CG 4.18Å
871	F	22.2	Very low	23.4	Very low	212 Å²	212	163.7 Å²	163.7	93%	0.93	76%	0.757	S	S	*	*				-135.3	127.7	90	-119.5	-95.2	0	0	0	110.9
872	L	21.7	Very low	23.3	Very low	94 Å²	94	165 Å²	165	49%	0.492	75%	0.752	S	S	.	*			trans	-72.4	168.7	162.8	-65.8	162.6	0	0	0	107.6	F870	F870-L872 HydrophobicContact CD1-CD1 4.09Å; F870-L872 HydrophobicContact CD1-CG 4.22Å; F870-L872 HydrophobicContact CE1-CD1 3.65Å; F870-L872 HydrophobicContact CE1-CG 4.18Å
873	K	22.2	Very low	23.1	Very low	171 Å²	171	162.8 Å²	162.8	74%	0.743	75%	0.747	S	S	*	*			cis	-166.9	162.9	11.5	-138.5	164.4	-177.2	179.7	0	107.6
874	S	21.9	Very low	23.2	Very low	96 Å²	96	162.8 Å²	162.8	67%	0.671	74%	0.742	S	S	*	*			trans	105.9	81.6	145.3	-154.2	0	0	0	0	118
875	Y	22.9	Very low	23	Very low	219 Å²	219	165.8 Å²	165.8	86%	0.859	74%	0.743	S	S	*	*				-152.4	145.8	85.5	-129.4	-98.7	0	0	0	111.4
876	F	23.4	Very low	22.9	Very low	165 Å²	165	162.2 Å²	162.2	72%	0.724	74%	0.737	S	S	*	*			trans	-68.3	135.9	-176.7	-99.2	-128.5	0	0	0	110.8
877	N	23.6	Very low	22.9	Very low	117 Å²	117	165.6 Å²	165.6	63%	0.626	74%	0.741	S	S	*	*				62.3	111.3	62.1	-179.5	25.7	0	0	0	113
878	R	23.2	Very low	23	Very low	229 Å²	229	162 Å²	162	86%	0.864	74%	0.742	S	S	*	*			trans	-155.7	110	144.3	-110.2	169.6	-160.8	-159.2	4.5	112.8
879	N	23.5	Very low	23	Very low	138 Å²	138	156.4 Å²	156.4	74%	0.738	73%	0.73	S	S	*	*			trans	77.5	82.1	143	-56.1	-7.2	0	0	0	119.6
880	Q	27.1	Very low	22.9	Very low	170 Å²	170	158.9 Å²	158.9	79%	0.794	74%	0.74	S	S	*	*			trans	-50.6	162.2	132.3	-60.1	172.8	-31.3	0	0	111.6
881	K	24.7	Very low	23	Very low	145 Å²	145	157.2 Å²	157.2	63%	0.63	74%	0.742	S	S	*	*				176.4	147.3	104.9	-102.2	165.8	170.1	-159.2	0	118.3
882	Y	23.3	Very low	23.2	Very low	178 Å²	178	152.3 Å²	152.3	70%	0.698	73%	0.734	S	S	*	*			trans	71.9	154.8	153.7	-55.8	-43.2	0	0	0	120.7
883	F	21.2	Very low	23.4	Very low	175 Å²	175	152 Å²	152	77%	0.768	75%	0.745	S	S	*	*			cis	-167.6	125.6	-43.5	-144	-125.6	0	0	0	108.7
884	V	23.5	Very low	23.6	Very low	105 Å²	105	151.8 Å²	151.8	64%	0.636	75%	0.752	S	S	*	*				46.1	121.7	128.7	175.6	0	0	0	0	120.6
885	R	21.3	Very low	23.6	Very low	223 Å²	223	156.6 Å²	156.6	84%	0.842	76%	0.761	S	S	*	*				-175.8	135.9	103.7	-128	176.5	176.7	155.9	-1.3	115.3
886	T	23.3	Very low	24.9	Very low	109 Å²	109	151.6 Å²	151.6	67%	0.669	76%	0.755	S	S	*	*			trans	6	154.7	144.9	66.4	0	0	0	0	120.8
887	K	23.3	Very low	25.1	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	75%	0.752	S	S	*	*			cis	-169.6	159.8	44.7	-148.2	169.7	-174.1	-172.6	0	112.8
888	T	23.8	Very low	25.4	Very low	134 Å²	134	149.3 Å²	149.3	82%	0.822	76%	0.762	S	S	*	*			trans	-104	164.2	177.3	45.7	0	0	0	0	113.4
889	S	23.3	Very low	25.7	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	75%	0.753	S	S	*	*			trans	-166.3	156.4	149.2	51.5	0	0	0	0	114.4
890	Y	20.5	Very low	26	Very low	213 Å²	213	144.5 Å²	144.5	84%	0.835	76%	0.758	S	S	*	*			trans	89.3	157.5	166.6	-66.2	-70.4	0	0	0	121.2
891	T	24.2	Very low	26.1	Very low	114 Å²	114	141.2 Å²	141.2	70%	0.699	75%	0.745	S	S	*	*				-149.7	147.2	-126.5	42.7	0	0	0	0	115.9
892	S	25.7	Very low	26.2	Very low	109 Å²	109	141 Å²	141	76%	0.762	76%	0.76	S	S	*	*			trans	66.3	139.3	138.8	62.8	0	0	0	0	124.8
893	A	26	Very low	26.6	Very low	88 Å²	88	140.9 Å²	140.9	73%	0.727	76%	0.758	S	S	*	*			trans	79.6	132.2	151.2	0	0	0	0	0	117.4
894	D	25	Very low	27	Very low	165 Å²	165	138.9 Å²	138.9	88%	0.882	77%	0.765	S	S	*	*			cis	-156.8	-168	32.8	-97.3	-38.5	0	0	0	114.4
895	K	22.7	Very low	27.6	Very low	198 Å²	198	140 Å²	140	86%	0.861	76%	0.763	S	S	*	*			trans	-147.2	177.5	-170.2	-102.6	-168.8	177	-173	0	110.5
896	P	50.8	Low	28.5	Very low	113 Å²	113	134.4 Å²	134.4	73%	0.734	76%	0.758	S	S	*	*			cis	-140.5	-154.3	-35.4	42.2	-22.5	0	0	0	113.2
897	A	27	Very low	29.2	Very low	80 Å²	80	134.2 Å²	134.2	66%	0.661	76%	0.757	S	S	*	*			trans	94.9	144	157.5	0	0	0	0	0	119.2
898	D	29.4	Very low	30	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	74%	0.744	S	S	*	*			cis	-178.2	165.5	-21.4	-96.4	-25.9	0	0	0	107.8
899	E	30.3	Very low	30.8	Very low	146 Å²	146	128.1 Å²	128.1	68%	0.682	73%	0.73	S	S	*	*			cis	-155	160.2	-14.1	-164	-145.1	-116.5	0	0	108	L901	E899-L901 HydrophobicContact CG-CD1 4.07Å; E899-L901 WeakPolarHBondContact OE1-CD1 3.4Å; E899-L901 WeakPolarHBondContact OE2-CD1 3.46Å
900	S	28.9	Very low	31.5	Very low	119 Å²	119	130.1 Å²	130.1	83%	0.832	73%	0.727	S	S	*	*			trans	-171.9	148.1	137.1	38.6	0	0	0	0	112.9
901	L	29.9	Very low	32.2	Very low	102 Å²	102	125.8 Å²	125.8	53%	0.534	71%	0.714	S	S	.	*			trans	-107.1	152.2	-157.8	-113	70.5	0	0	0	115.6	E899 R903	E899-L901 HydrophobicContact CG-CD1 4.07Å; E899-L901 WeakPolarHBondContact OE1-CD1 3.4Å; E899-L901 WeakPolarHBondContact OE2-CD1 3.46Å; L901-R903 HydrophobicContact CD2-CG 4.01Å
902	C	27.3	Very low	33	Very low	140 Å²	140	125.3 Å²	125.3	95%	0.946	71%	0.707	S	S	*	*				-149.6	137.9	129.5	-102.3	0	0	0	0	110
903	R	31.4	Very low	33.8	Very low	175 Å²	175	125.5 Å²	125.5	66%	0.66	70%	0.696	S	S	*	*			trans	-104.2	152.9	-169.7	-69.7	-173.5	178.4	-164.4	2	114.2	L901 E905	L901-R903 HydrophobicContact CD2-CG 4.01Å; R903-E905 WeakPolarHBondContact CD-OE2 3.48Å; R903-E905 IonicContact CZ-OE2 3.5Å; R903-E905 IonicContact NH1-OE1 2.84Å; R903-E905 IonicContact NH1-OE2 2.72Å; R903-E905 PolarHBondContact NH1-OE2 2.83Å
904	C	29.5	Very low	34.5	Very low	133 Å²	133	124.2 Å²	124.2	90%	0.899	68%	0.679	S	S	*	*			trans	-125.1	112.4	161.4	-73.5	0	0	0	0	110.2
905	E	35.4	Very low	35.2	Very low	128 Å²	128	119.7 Å²	119.7	60%	0.598	66%	0.657	S	S	*	*			trans	-120.3	-0.7	-178.4	-93.8	176.1	126.7	0	0	115.2	R903	R903-E905 WeakPolarHBondContact CD-OE2 3.48Å; R903-E905 IonicContact CZ-OE2 3.5Å; R903-E905 IonicContact NH1-OE1 2.84Å; R903-E905 IonicContact NH1-OE2 2.72Å; R903-E905 PolarHBondContact NH1-OE2 2.83Å
906	S	40.6	Very low	36.6	Very low	106 Å²	106	116.4 Å²	116.4	74%	0.741	65%	0.645	S	S	*	*	H	α-helix	trans	-82	-20.9	-168.5	-45.7	0	0	0	0	116.4
907	V	38.4	Very low	36.4	Very low	105 Å²	105	118.6 Å²	118.6	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-82.7	-39.5	-169.4	179.8	0	0	0	0	113	F910 Q911	V907-F910 PolarHBondContact O-N 2.69Å; V907-Q911 PolarHBondContact O-N 3.01Å; V907-Q911 VanDerWaalsContact O-N 3.12Å
908	I	40.8	Very low	37	Very low	116 Å²	116	119.9 Å²	119.9	60%	0.595	64%	0.638	S	S	*	*	H	α-helix	trans	-69.5	-39.4	-172.5	-61.9	174.8	0	0	0	111.3	F910 Q911 N912	I908-F910 PolarHBondContact O-N 3.39Å; I908-Q911 PolarHBondContact O-N 2.85Å; I908-N912 PolarHBondContact O-N 3Å; I908-N912 VanDerWaalsContact O-N 3.09Å; I908-N912 PolarHBondContact O-ND2 3.27Å
909	V	40.6	Very low	37.8	Very low	86 Å²	86	119.4 Å²	119.4	52%	0.521	63%	0.629	S	S	.	*	H	α-helix	trans	-63.1	-42.4	178.1	-177.5	0	0	0	0	111.2	N912 Q913	V909-N912 PolarHBondContact O-N 2.95Å; V909-Q913 WeakPolarHBondContact O-CG 3.47Å; V909-Q913 PolarHBondContact O-N 3.04Å; V909-Q913 VanDerWaalsContact O-N 3.15Å
910	F	36.4	Very low	38.9	Very low	142 Å²	142	116.6 Å²	116.6	62%	0.623	62%	0.618	S	S	*	*	H	α-helix	trans	-65.8	-44	177.8	-174.7	-103	0	0	0	112.2	V907 I908 N912 Q913 V914	V907-F910 PolarHBondContact O-N 2.69Å; I908-F910 PolarHBondContact O-N 3.39Å; F910-N912 VanDerWaalsContact C-N 3.32Å; F910-N912 PolarHBondContact O-N 2.04Å; F910-Q913 PolarHBondContact O-N 3.05Å; F910-V914 HydrophobicContact CD1-CG2 4.32Å; F910-V914 HydrophobicContact CE1-CG2 3.98Å; F910-V914 HydrophobicContact CE2-CG2 4.33Å; F910-V914 HydrophobicContact CZ-CG2 3.99Å; F910-V914 WeakPolarHBondContact O-CG2 3.1Å; F910-V914 PolarHBondContact O-N 2.89Å; F910-V914 VanDerWaalsContact O-N 3.08Å
911	Q	36	Very low	39.8	Very low	121 Å²	121	115.7 Å²	115.7	57%	0.565	60%	0.604	S	S	*	*	H	α-helix	trans	-58.7	-42.3	175.9	-109.9	-179.3	-17.3	0	0	112.4	V907 I908 T915	V907-Q911 PolarHBondContact O-N 3.01Å; V907-Q911 VanDerWaalsContact O-N 3.12Å; I908-Q911 PolarHBondContact O-N 2.85Å; Q911-T915 WeakPolarHBondContact O-CB 3.5Å; Q911-T915 PolarHBondContact O-N 3.34Å; Q911-T915 PolarHBondContact O-OG1 3.36Å
912	N	41.3	Very low	40.4	Very low	104 Å²	104	113.2 Å²	113.2	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-66	-44.7	179.4	-70.7	-20.1	0	0	0	112	I908 V909 F910 V914 T915 E916	I908-N912 PolarHBondContact O-N 3Å; I908-N912 VanDerWaalsContact O-N 3.09Å; I908-N912 PolarHBondContact O-ND2 3.27Å; V909-N912 PolarHBondContact O-N 2.95Å; F910-N912 VanDerWaalsContact C-N 3.32Å; F910-N912 PolarHBondContact O-N 2.04Å; N912-V914 PolarHBondContact O-N 3.21Å; N912-T915 PolarHBondContact O-N 3.41Å; N912-E916 PolarHBondContact O-N 2.93Å
913	Q	41.8	Very low	41.7	Very low	114 Å²	114	112.1 Å²	112.1	53%	0.533	58%	0.579	S	S	.	*	H	α-helix	trans	-63.9	-38.6	178	-72.4	-177.8	-6.6	0	0	113.5	V909 F910 K917	V909-Q913 WeakPolarHBondContact O-CG 3.47Å; V909-Q913 PolarHBondContact O-N 3.04Å; V909-Q913 VanDerWaalsContact O-N 3.15Å; F910-Q913 PolarHBondContact O-N 3.05Å; Q913-K917 PolarHBondContact O-N 3.06Å
914	V	40.3	Very low	43.1	Very low	61 Å²	61	112.7 Å²	112.7	37%	0.37	58%	0.581	S	S	.	*	H	α-helix	trans	-67.8	-41.2	176.3	172.8	0	0	0	0	110.9	F910 N912 E916 K917 L918	F910-V914 HydrophobicContact CD1-CG2 4.32Å; F910-V914 HydrophobicContact CE1-CG2 3.98Å; F910-V914 HydrophobicContact CE2-CG2 4.33Å; F910-V914 HydrophobicContact CZ-CG2 3.99Å; F910-V914 WeakPolarHBondContact O-CG2 3.1Å; F910-V914 PolarHBondContact O-N 2.89Å; F910-V914 VanDerWaalsContact O-N 3.08Å; N912-V914 PolarHBondContact O-N 3.21Å; V914-E916 PolarHBondContact O-N 2.03Å; V914-K917 PolarHBondContact O-N 3.11Å; V914-L918 HydrophobicContact CG1-CD1 4.04Å; V914-L918 PolarHBondContact O-N 2.86Å
915	T	41.5	Very low	44.3	Very low	70 Å²	70	110.6 Å²	110.6	43%	0.429	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-39.9	178.7	-54.4	0	0	0	0	111.9	Q911 N912 L918 K919	Q911-T915 WeakPolarHBondContact O-CB 3.5Å; Q911-T915 PolarHBondContact O-N 3.34Å; Q911-T915 PolarHBondContact O-OG1 3.36Å; N912-T915 PolarHBondContact O-N 3.41Å; T915-L918 PolarHBondContact O-N 3.45Å; T915-K919 PolarHBondContact O-N 3.33Å; T915-K919 VanDerWaalsContact O-N 3.1Å
916	E	50.5	Low	45	Very low	128 Å²	128	110.7 Å²	110.7	60%	0.598	56%	0.564	S	S	*	*	H	α-helix	trans	-69.5	-42.4	178.7	-157.5	-176.4	-150.1	0	0	112.3	N912 V914 L918 K919 N920	N912-E916 PolarHBondContact O-N 2.93Å; V914-E916 PolarHBondContact O-N 2.03Å; E916-L918 VanDerWaalsContact C-N 3.31Å; E916-L918 PolarHBondContact O-N 2.04Å; E916-K919 PolarHBondContact O-N 2.87Å; E916-N920 PolarHBondContact O-N 2.82Å; E916-N920 PolarHBondContact O-ND2 3.06Å
917	K	47.4	Very low	46.2	Very low	159 Å²	159	111 Å²	111	69%	0.691	55%	0.554	S	S	*	*	H	α-helix	trans	-61.4	-37.8	173.8	-76.7	-177.2	176.6	178.3	0	112.7	Q913 V914 N920 L921	Q913-K917 PolarHBondContact O-N 3.06Å; V914-K917 PolarHBondContact O-N 3.11Å; K917-N920 PolarHBondContact O-N 3.46Å; K917-L921 WeakPolarHBondContact O-CB 3.29Å; K917-L921 PolarHBondContact O-N 2.64Å
918	L	40.3	Very low	47.2	Very low	108 Å²	108	108.7 Å²	108.7	57%	0.565	55%	0.546	S	S	*	.	H	α-helix	trans	-66.8	-40.3	175.5	-82.8	164.4	0	0	0	112.7	V914 T915 E916 L921 A922	V914-L918 HydrophobicContact CG1-CD1 4.04Å; V914-L918 PolarHBondContact O-N 2.86Å; T915-L918 PolarHBondContact O-N 3.45Å; E916-L918 VanDerWaalsContact C-N 3.31Å; E916-L918 PolarHBondContact O-N 2.04Å; L918-L921 PolarHBondContact O-N 3.44Å; L918-A922 WeakPolarHBondContact O-CB 3.2Å; L918-A922 PolarHBondContact O-N 2.64Å
919	K	45.4	Very low	47.8	Very low	145 Å²	145	109.4 Å²	109.4	63%	0.63	55%	0.548	S	S	*	.	H	α-helix	trans	-61.1	-47.5	173.2	-76	-178.8	175.9	-178.3	0	111.7	T915 E916 L921 A922 Q923	T915-K919 PolarHBondContact O-N 3.33Å; T915-K919 VanDerWaalsContact O-N 3.1Å; E916-K919 PolarHBondContact O-N 2.87Å; K919-L921 VanDerWaalsContact C-N 3.29Å; K919-L921 PolarHBondContact O-N 2.82Å; K919-A922 PolarHBondContact O-N 2.8Å; K919-Q923 PolarHBondContact O-N 2.87Å
920	N	52.5	Low	48.7	Very low	86 Å²	86	108.5 Å²	108.5	46%	0.46	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-32.9	179.3	-71.1	-24.5	0	0	0	112.8	E916 K917 R924	E916-N920 PolarHBondContact O-N 2.82Å; E916-N920 PolarHBondContact O-ND2 3.06Å; K917-N920 PolarHBondContact O-N 3.46Å; N920-R924 WeakPolarHBondContact O-CG 3.42Å; N920-R924 PolarHBondContact O-N 2.03Å
921	L	48.1	Very low	50	Low	100 Å²	100	108.8 Å²	108.8	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-70.9	-45.3	173.8	-174.2	64.6	0	0	0	112	K917 L918 K919 Q923 R924 I925	K917-L921 WeakPolarHBondContact O-CB 3.29Å; K917-L921 PolarHBondContact O-N 2.64Å; L918-L921 PolarHBondContact O-N 3.44Å; K919-L921 VanDerWaalsContact C-N 3.29Å; K919-L921 PolarHBondContact O-N 2.82Å; L921-Q923 VanDerWaalsContact C-N 3.32Å; L921-Q923 PolarHBondContact O-N 3Å; L921-R924 PolarHBondContact O-N 2.82Å; L921-I925 HydrophobicContact CD1-CD1 4.49Å; L921-I925 HydrophobicContact CG-CD1 4.14Å; L921-I925 WeakPolarHBondContact O-CG1 3.37Å; L921-I925 PolarHBondContact O-N 3.18Å; L921-I925 VanDerWaalsContact O-N 3.13Å
922	A	43.4	Very low	51.5	Low	51 Å²	51	110.4 Å²	110.4	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-61.1	-40.1	178.1	0	0	0	0	0	112.2	L918 K919 I925 L926	L918-A922 WeakPolarHBondContact O-CB 3.2Å; L918-A922 PolarHBondContact O-N 2.64Å; K919-A922 PolarHBondContact O-N 2.8Å; A922-I925 PolarHBondContact O-N 2.94Å; A922-L926 PolarHBondContact O-N 2.03Å
923	Q	54.8	Low	52.2	Low	117 Å²	117	110.5 Å²	110.5	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-67	-42.1	179.4	-168.9	159.9	-18.5	0	0	112.4	K919 L921 I925 L926 E927	K919-Q923 PolarHBondContact O-N 2.87Å; L921-Q923 VanDerWaalsContact C-N 3.32Å; L921-Q923 PolarHBondContact O-N 3Å; Q923-I925 VanDerWaalsContact C-N 3.29Å; Q923-I925 PolarHBondContact O-N 2.93Å; Q923-L926 PolarHBondContact O-N 3.19Å; Q923-E927 WeakPolarHBondContact O-CG 3.23Å; Q923-E927 PolarHBondContact O-N 2.75Å
924	R	60.8	Low	53.3	Low	186 Å²	186	110 Å²	110	70%	0.702	55%	0.549	S	S	*	.	H	α-helix	trans	-61.8	-34.4	172.9	-72.6	176.3	-177.8	-166	0.7	113.2	N920 L921 A928	N920-R924 WeakPolarHBondContact O-CG 3.42Å; N920-R924 PolarHBondContact O-N 2.03Å; L921-R924 PolarHBondContact O-N 2.82Å; R924-A928 WeakPolarHBondContact O-CB 3.32Å; R924-A928 PolarHBondContact O-N 2.77Å
925	I	53.6	Low	54.6	Low	90 Å²	90	110.8 Å²	110.8	46%	0.462	55%	0.554	S	S	.	*	H	α-helix	trans	-69.7	-42.6	176.1	-68.1	167.2	0	0	0	110.5	L921 A922 Q923 A928 M929	L921-I925 HydrophobicContact CD1-CD1 4.49Å; L921-I925 HydrophobicContact CG-CD1 4.14Å; L921-I925 WeakPolarHBondContact O-CG1 3.37Å; L921-I925 PolarHBondContact O-N 3.18Å; L921-I925 VanDerWaalsContact O-N 3.13Å; A922-I925 PolarHBondContact O-N 2.94Å; Q923-I925 VanDerWaalsContact C-N 3.29Å; Q923-I925 PolarHBondContact O-N 2.93Å; I925-A928 PolarHBondContact O-N 3.32Å; I925-M929 HydrophobicContact CG2-SD 4.17Å; I925-M929 WeakPolarHBondContact O-CG 3.32Å; I925-M929 PolarHBondContact O-N 2.84Å
926	L	50.5	Low	55.3	Low	129 Å²	129	112.2 Å²	112.2	68%	0.675	56%	0.559	S	S	*	*	H	α-helix	trans	-61	-46.3	174.5	-104.8	104.7	0	0	0	112.2	A922 Q923 A928 M929 S930	A922-L926 PolarHBondContact O-N 2.03Å; Q923-L926 PolarHBondContact O-N 3.19Å; L926-A928 VanDerWaalsContact C-N 3.35Å; L926-A928 PolarHBondContact O-N 2.65Å; L926-M929 PolarHBondContact O-N 3.1Å; L926-S930 WeakPolarHBondContact O-CB 3.18Å; L926-S930 PolarHBondContact O-N 3.21Å
927	E	65.8	Low	55.9	Low	113 Å²	113	111.8 Å²	111.8	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-61	-42.3	177.4	-72.9	169.2	-170.9	0	0	111.8	Q923 S930 K931	Q923-E927 WeakPolarHBondContact O-CG 3.23Å; Q923-E927 PolarHBondContact O-N 2.75Å; E927-S930 PolarHBondContact O-N 2.9Å; E927-K931 PolarHBondContact O-N 2.88Å
928	A	58.7	Low	56.5	Low	56 Å²	56	109 Å²	109	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-66.7	-34.5	176.6	0	0	0	0	0	113.2	R924 I925 L926 K932	R924-A928 WeakPolarHBondContact O-CB 3.32Å; R924-A928 PolarHBondContact O-N 2.77Å; I925-A928 PolarHBondContact O-N 3.32Å; L926-A928 VanDerWaalsContact C-N 3.35Å; L926-A928 PolarHBondContact O-N 2.65Å; A928-K932 PolarHBondContact O-N 3.06Å
929	M	53.7	Low	57.3	Low	132 Å²	132	109.6 Å²	109.6	65%	0.65	55%	0.549	S	S	*	.	H	α-helix	trans	-71.6	-43.2	174.3	-74.6	-178.6	72.5	0	0	111.9	I925 L926 K931 K932 L933	I925-M929 HydrophobicContact CG2-SD 4.17Å; I925-M929 WeakPolarHBondContact O-CG 3.32Å; I925-M929 PolarHBondContact O-N 2.84Å; L926-M929 PolarHBondContact O-N 3.1Å; M929-K931 PolarHBondContact O-N 3.06Å; M929-K932 PolarHBondContact O-N 3.26Å; M929-L933 PolarHBondContact O-N 2.88Å
930	S	60	Low	58	Low	66 Å²	66	107.8 Å²	107.8	46%	0.462	55%	0.55	S	S	.	*	H	α-helix	trans	-59.2	-46.9	177.2	-159.4	0	0	0	0	111.3	L926 E927 K932 L933 E934	L926-S930 WeakPolarHBondContact O-CB 3.18Å; L926-S930 PolarHBondContact O-N 3.21Å; E927-S930 PolarHBondContact O-N 2.9Å; S930-K932 VanDerWaalsContact C-N 3.32Å; S930-K932 PolarHBondContact O-N 2.78Å; S930-L933 WeakPolarHBondContact O-CB 3.03Å; S930-L933 PolarHBondContact O-N 3.06Å; S930-L933 VanDerWaalsContact O-N 3.08Å; S930-E934 PolarHBondContact O-N 3.42Å
931	K	64.1	Low	58.6	Low	149 Å²	149	109.1 Å²	109.1	65%	0.648	56%	0.561	S	S	*	*	H	α-helix	trans	-60.3	-38.9	176.1	-113.6	178.1	178.4	175.1	0	113.1	E927 M929 L933 T935	E927-K931 PolarHBondContact O-N 2.88Å; M929-K931 PolarHBondContact O-N 3.06Å; K931-L933 VanDerWaalsContact C-N 3.33Å; K931-T935 WeakPolarHBondContact O-CB 3.19Å; K931-T935 PolarHBondContact O-N 3.03Å; K931-T935 PolarHBondContact O-OG1 3.23Å
932	K	66.3	Low	58.6	Low	154 Å²	154	110.7 Å²	110.7	67%	0.67	57%	0.57	S	S	*	*	H	α-helix	trans	-66.4	-35.8	174.9	-84.2	-171.5	171.8	-173.3	0	112.2	A928 M929 S930 T935 L936	A928-K932 PolarHBondContact O-N 3.06Å; M929-K932 PolarHBondContact O-N 3.26Å; S930-K932 VanDerWaalsContact C-N 3.32Å; S930-K932 PolarHBondContact O-N 2.78Å; K932-T935 PolarHBondContact O-N 2.82Å; K932-L936 WeakPolarHBondContact O-CG 3.35Å; K932-L936 PolarHBondContact O-N 2.89Å
933	L	56	Low	58.6	Low	107 Å²	107	119.9 Å²	119.9	56%	0.56	60%	0.601	S	S	*	*	H	α-helix	trans	-65.2	-49.8	175.6	-139.3	77.9	0	0	0	111	M929 S930 K931 T935 L936 E937	M929-L933 PolarHBondContact O-N 2.88Å; S930-L933 WeakPolarHBondContact O-CB 3.03Å; S930-L933 PolarHBondContact O-N 3.06Å; S930-L933 VanDerWaalsContact O-N 3.08Å; K931-L933 VanDerWaalsContact C-N 3.33Å; L933-T935 VanDerWaalsContact C-N 3.27Å; L933-T935 PolarHBondContact O-N 3.24Å; L933-L936 WeakPolarHBondContact O-CB 3.47Å; L933-L936 PolarHBondContact O-N 3.34Å; L933-E937 PolarHBondContact O-N 3.09Å
934	E	66.5	Low	58.8	Low	102 Å²	102	120.1 Å²	120.1	48%	0.477	60%	0.604	S	S	.	*	H	α-helix	trans	-58.3	-37.9	174.7	-69.3	173	161.5	0	0	112.1	S930 L936 N938	S930-E934 PolarHBondContact O-N 3.42Å; E934-L936 VanDerWaalsContact C-N 3.33Å; E934-N938 WeakPolarHBondContact O-CB 3.46Å; E934-N938 PolarHBondContact O-N 3.28Å; E934-N938 PolarHBondContact O-ND2 2.99Å
935	T	66.1	Low	58.7	Low	78 Å²	78	116.6 Å²	116.6	48%	0.479	60%	0.598	S	S	.	*	H	α-helix	trans	-67	-36.3	177.2	-47.9	0	0	0	0	111.5	K931 K932 L933 Q939	K931-T935 WeakPolarHBondContact O-CB 3.19Å; K931-T935 PolarHBondContact O-N 3.03Å; K931-T935 PolarHBondContact O-OG1 3.23Å; K932-T935 PolarHBondContact O-N 2.82Å; L933-T935 VanDerWaalsContact C-N 3.27Å; L933-T935 PolarHBondContact O-N 3.24Å; T935-Q939 WeakPolarHBondContact O-CG 3.25Å; T935-Q939 PolarHBondContact O-N 2.76Å
936	L	56.4	Low	59	Low	101 Å²	101	118.1 Å²	118.1	53%	0.529	61%	0.606	S	S	.	*	H	α-helix	trans	-73.1	-42.8	176.8	-80.9	160.9	0	0	0	112.1	K932 L933 E934 N938 Q939 V940	K932-L936 WeakPolarHBondContact O-CG 3.35Å; K932-L936 PolarHBondContact O-N 2.89Å; L933-L936 WeakPolarHBondContact O-CB 3.47Å; L933-L936 PolarHBondContact O-N 3.34Å; E934-L936 VanDerWaalsContact C-N 3.33Å; L936-N938 PolarHBondContact O-N 3.38Å; L936-Q939 PolarHBondContact O-N 2.79Å; L936-Q939 VanDerWaalsContact O-N 3.1Å; L936-V940 WeakPolarHBondContact O-CG2 3.1Å; L936-V940 PolarHBondContact O-N 3.15Å
937	E	62.9	Low	59.5	Low	119 Å²	119	117.4 Å²	117.4	56%	0.556	60%	0.602	S	S	*	*	H	α-helix	trans	-61.4	-44.3	176	-71.7	179.9	155.1	0	0	111.2	L933 Q939 V940 V941	L933-E937 PolarHBondContact O-N 3.09Å; E937-Q939 PolarHBondContact O-N 2.61Å; E937-V940 PolarHBondContact O-N 2.81Å; E937-V941 WeakPolarHBondContact O-CG2 3.33Å; E937-V941 PolarHBondContact O-N 3.43Å
938	N	59.6	Low	59.1	Low	99 Å²	99	117.7 Å²	117.7	53%	0.529	61%	0.607	S	S	.	*	H	α-helix	trans	-65.5	-22.5	174.8	-75.9	-63.1	0	0	0	113.8	E934 L936 N942	E934-N938 WeakPolarHBondContact O-CB 3.46Å; E934-N938 PolarHBondContact O-N 3.28Å; E934-N938 PolarHBondContact O-ND2 2.99Å; L936-N938 PolarHBondContact O-N 3.38Å; N938-N942 PolarHBondContact O-ND2 2.73Å
939	Q	58.9	Low	59.1	Low	121 Å²	121	121.8 Å²	121.8	57%	0.565	62%	0.616	S	S	*	*	H	α-helix	trans	-82.9	-20.8	172.1	-77.6	-180	-3	0	0	113.6	T935 L936 E937	T935-Q939 WeakPolarHBondContact O-CG 3.25Å; T935-Q939 PolarHBondContact O-N 2.76Å; L936-Q939 PolarHBondContact O-N 2.79Å; L936-Q939 VanDerWaalsContact O-N 3.1Å; E937-Q939 PolarHBondContact O-N 2.61Å
940	V	58.7	Low	59.5	Low	107 Å²	107	121.1 Å²	121.1	65%	0.648	61%	0.614	S	S	*	*	H	α-helix	trans	-87.1	-29.1	175.3	172.9	0	0	0	0	111.6	L936 E937	L936-V940 WeakPolarHBondContact O-CG2 3.1Å; L936-V940 PolarHBondContact O-N 3.15Å; E937-V940 PolarHBondContact O-N 2.81Å
941	V	65.7	Low	59.5	Low	115 Å²	115	125.3 Å²	125.3	70%	0.697	63%	0.625	S	S	*	*	H	α-helix	trans	-81.2	-18.7	177.4	174.7	0	0	0	0	113.3	E937	E937-V941 WeakPolarHBondContact O-CG2 3.33Å; E937-V941 PolarHBondContact O-N 3.43Å
942	N	48.9	Very low	59.1	Low	133 Å²	133	123.3 Å²	123.3	71%	0.711	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	25.8	177.7	-70.8	-68.5	0	0	0	113.4	N938	N938-N942 PolarHBondContact O-ND2 2.73Å
943	K	43.3	Very low	58.5	Low	244 Å²	244	120.5 Å²	120.5	100%	1.061	62%	0.619	S	S	*	*			trans	-130.8	0	172.4	-89.9	-171.8	172.4	-176.5	0	110.4

Retrieved 943 of 943 residues in 2192.5 ms (Link to these results)

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