A0A096NSL0_PAPAN Loading...

Plakophilin 4

AlphaFold DB , UniProt , Accession A0A096NSL0, Species PAPAN (Papio anubis, Olive baboon), Gene PKP4, Length 1,192 aa.

						>A0A096NSL0_PAPAN|A0A096NSL0|PKP4
MPAPEQASLVEEGQPQTRQEAASTGPGMEPETTATTILASVKEQELQFQRLTRELEVERQIVASQLERCRLGAESPSIASTSSTEKSFPWRATDVPNTGVSKPKVSDAVHPNNYLIRTEPEQGTLYSPEQTSLHESEGSLGNSRSSTQMNSYSDSGYQEAGSFHNSQNVSKADNRQQHSFIGSTNNHVVRNSRAEGQTLVQPSVANRAMRRVSSVPSRAQSPSYVISTGVSPSRGSLRTSLGSGFGSPSVTDPRPLNPSAYSSTTLPAVRAASPYSQRPASPTAIRRIGSVTSRQTSNPNGPTPQYQTTARVGSPLTLTDAQTRVASPSQGQVGSSSPKRSGMTAVPQHLGPSLQRTVHDMEQFGQQQYDIYERMVPPRPDSLTGLRSSYASQHSQLGQDLRSAVSPDLHITPIYEGRTYYSPVYRSPNHGTVELQGSQTALYRTGSVGIGNLQRTSSQRSTLTYQRNNYALNTTATYAEPYRPIQYRVQECNYNRLQHVVSADDGTTRSPSIDSIQKDPREFAWRDPELPEVIHMLQHQFPSVQANAAAYLQHLCFGDNKVKMEVCRLGGIKHLVDLLDHRVLEVQKNACGALRNLVFGKSTDENKIAMKNVGGIPALLRLLRKSIDAEIRELVTGVLWNLSSCDAVKMTIIRDALSTLTNTVIVPHSGWNNSSFDDDHKIKFQTSLVLRNTTGCLRNLSSAGEEARKQMRSCEGLVDSLLYVIHTCVNTSDYDSKTVENCVCTLRNLSYRLELEVPQARLLGLNELDDLLGKESPSKDSEPSCWGKKKKKKKRTPQEDQWDGVGPIPGLSKSPKGVEMLWHPSVVKPYLTLLAESSNPATLEGSAGSLQNLSAGNWKFAAYIRAAVRKEKGLPILVELLRMDNDRVVSSVATALRNMALDVRNKELIGKYAMRDLVNRLPGGNGPSVLSDETMAAICCALHEVTSKNMENAKALADSGGIEKLVNITKGRGDRSSLKVVKAAAQVLNTLWQYRDLRSIYKKDGWNQNHFITPVSTLERDRFKSHPSLSTTNQQMSPIIQSVGSTSSSPALLGIRDPRSEYDRTQPPMQYYNSQGDATHKGLYPGSSKPSPIYISSYSSPAREQNRRLQHQQLYYSQDDSNRKNFDAYRLYLQSPHSYEDPYFDDRVHFPASTDYSTQYGLKSTTNYVDFYSTKRPSYRAEQYPGSPDSWV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	35.2	Very low	211 Å²	211	130.2 Å²	130.2	100%	1.039	74%	0.744	S	S	*	*				0	133.3	0	-88.7	-65.3	-82.1	0	0	108.7
2	P	48.5	Very low	34.7	Very low	107 Å²	107	135 Å²	135	70%	0.695	76%	0.755	S	S	*	*			cis	-111.1	177.9	-5.3	40.6	-30.4	0	0	0	113.5
3	A	36.2	Very low	34.2	Very low	65 Å²	65	130.5 Å²	130.5	54%	0.537	76%	0.758	S	S	.	*			trans	-96.6	-139.7	155.4	0	0	0	0	0	107.3
4	P	54.1	Low	33.8	Very low	109 Å²	109	133.7 Å²	133.7	71%	0.708	76%	0.763	S	S	*	*			cis	-129	-154.9	-5.2	45.2	-25.3	0	0	0	111.1
5	E	35.9	Very low	34.4	Very low	148 Å²	148	131.6 Å²	131.6	69%	0.692	76%	0.756	S	S	*	*			cis	-145	-102.7	-4	-163.5	52.3	-95.6	0	0	112.3
6	Q	31.4	Very low	34.2	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	76%	0.758	S	S	*	*			trans	-154.8	-174.4	-157.9	-68.2	168.9	36.2	0	0	113.5
7	A	30.8	Very low	33.8	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	75%	0.754	S	S	*	*			trans	110.9	142.1	160.1	0	0	0	0	0	116.2
8	S	29.4	Very low	33.6	Very low	98 Å²	98	137 Å²	137	69%	0.685	76%	0.756	S	S	*	*			cis	-170.6	144	-14.8	49.2	0	0	0	0	113.6
9	L	29.9	Very low	33.2	Very low	159 Å²	159	136.2 Å²	136.2	83%	0.832	75%	0.746	S	S	*	*			trans	58	125.4	134.8	-62.9	171.8	0	0	0	123.4
10	V	30.2	Very low	33	Very low	111 Å²	111	137.3 Å²	137.3	67%	0.673	75%	0.746	S	S	*	*				104.3	119.3	115.2	159.5	0	0	0	0	124.1
11	E	30.6	Very low	32.8	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.762	75%	0.75	S	S	*	*			trans	75.1	140	137.4	-72.3	178.8	143.7	0	0	129.4
12	E	29.2	Very low	32.6	Very low	188 Å²	188	130.6 Å²	130.6	88%	0.879	74%	0.743	S	S	*	*			trans	58.4	158.4	144.5	-70.8	-160.7	137.2	0	0	124.8
13	G	28.2	Very low	32.1	Very low	77 Å²	77	130.5 Å²	130.5	79%	0.794	75%	0.745	S	S	*	*			trans	125.1	74.6	158.3	0	0	0	0	0	118.6
14	Q	29	Very low	31.8	Very low	175 Å²	175	134.3 Å²	134.3	82%	0.818	76%	0.762	S	S	*	*			trans	-115.1	154.8	150.3	-99.6	-167.2	2.1	0	0	107.7
15	P	43.6	Very low	31	Very low	102 Å²	102	132.4 Å²	132.4	66%	0.662	76%	0.761	S	S	*	*			cis	-152.6	-174.7	46	39.3	-16	0	0	0	118.7
16	Q	30.1	Very low	31.5	Very low	167 Å²	167	131.7 Å²	131.7	78%	0.78	77%	0.77	S	S	*	*			trans	85.4	122.5	136.9	-108.8	172.4	-17.4	0	0	124.3
17	T	28.4	Very low	31.8	Very low	114 Å²	114	127.4 Å²	127.4	70%	0.699	77%	0.77	S	S	*	*			trans	72.4	109.5	139.3	34.3	0	0	0	0	124
18	R	28.9	Very low	32.2	Very low	211 Å²	211	132 Å²	132	80%	0.796	78%	0.778	S	S	*	*				97.1	124.4	107.7	-162.8	173.3	-176.4	171.3	2.5	121.1
19	Q	27.3	Very low	32.9	Very low	121 Å²	121	134.5 Å²	134.5	57%	0.565	78%	0.778	S	S	*	*			trans	74.3	124.7	152.7	-83.9	175.6	-84.5	0	0	123.2
20	E	27.8	Very low	33.9	Very low	158 Å²	158	131.3 Å²	131.3	74%	0.738	77%	0.767	S	S	*	*			trans	69.5	111	134.4	-77.3	156.5	-143.2	0	0	123.2
21	A	29.1	Very low	34.8	Very low	101 Å²	101	133.4 Å²	133.4	84%	0.835	77%	0.769	S	S	*	*				59	102.8	126.2	0	0	0	0	0	120.7
22	A	26.6	Very low	35.9	Very low	107 Å²	107	130.2 Å²	130.2	88%	0.884	76%	0.761	S	S	*	*				-156.1	159.2	120.4	0	0	0	0	0	111.1
23	S	36.8	Very low	37.2	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	75%	0.745	S	S	*	*			trans	-91	134.4	177.2	55.4	0	0	0	0	112.6
24	T	30.9	Very low	38.6	Very low	145 Å²	145	124.3 Å²	124.3	89%	0.89	73%	0.728	S	S	*	*				-174	153.5	122.2	24.1	0	0	0	0	111.2
25	G	36.3	Very low	40.3	Very low	68 Å²	68	120.2 Å²	120.2	70%	0.701	72%	0.716	S	S	*	*			trans	-87.6	-165.2	163.3	0	0	0	0	0	111.8
26	P	47	Very low	41.4	Very low	133 Å²	133	120 Å²	120	86%	0.864	71%	0.712	S	S	*	*			cis	-136.6	169.1	16.1	41.7	-25.5	0	0	0	116.8
27	G	39	Very low	43.3	Very low	75 Å²	75	116.9 Å²	116.9	77%	0.773	70%	0.7	S	S	*	*			trans	81.2	120.8	139.6	0	0	0	0	0	119.9
28	M	37.7	Very low	45.1	Very low	194 Å²	194	117.2 Å²	117.2	96%	0.956	70%	0.697	S	S	*	*			trans	-145.7	154.4	149.1	-98.8	-165.5	175	0	0	110.6
29	E	45.3	Very low	46.9	Very low	149 Å²	149	110.1 Å²	110.1	70%	0.696	68%	0.683	S	S	*	*			trans	-76.9	155.8	-163.7	-69.7	-60	131.2	0	0	115.4	E31	E29-E31 PolarHBondContact O-N 2.72Å
30	P	49.6	Very low	49.1	Very low	93 Å²	93	107.3 Å²	107.3	60%	0.604	68%	0.677	S	S	*	*	S	Bend	trans	-79	-13.5	-174.4	31.9	-35.6	0	0	0	115.5	T32 T33	P30-T32 VanDerWaalsContact C-N 3.34Å; P30-T32 PolarHBondContact O-N 2.79Å; P30-T33 PolarHBondContact O-N 3.13Å
31	E	49.3	Very low	51.4	Low	154 Å²	154	103.5 Å²	103.5	72%	0.72	66%	0.664	S	S	*	*	H	α-helix	trans	-66.6	-30	-167	-59.2	-167.2	128.1	0	0	114.6	E29 T33 A34 T35	E29-E31 PolarHBondContact O-N 2.72Å; E31-T33 VanDerWaalsContact C-N 3.26Å; E31-T33 PolarHBondContact O-N 3.36Å; E31-A34 PolarHBondContact O-N 2.89Å; E31-T35 PolarHBondContact O-N 3.27Å; E31-T35 PolarHBondContact O-OG1 2.89Å
32	T	54.4	Low	53.4	Low	97 Å²	97	106 Å²	106	60%	0.595	66%	0.656	S	S	*	*	H	α-helix	trans	-68.2	-24.9	178.3	54.1	0	0	0	0	112.9	P30 T35 T36	P30-T32 VanDerWaalsContact C-N 3.34Å; P30-T32 PolarHBondContact O-N 2.79Å; T32-T35 WeakPolarHBondContact CA-OG1 3.48Å; T32-T35 PolarHBondContact O-OG1 3.4Å; T32-T36 PolarHBondContact O-N 2.9Å; T32-T36 PolarHBondContact O-OG1 2.97Å
33	T	56.8	Low	55.9	Low	86 Å²	86	106.4 Å²	106.4	53%	0.528	64%	0.64	S	S	.	*	H	α-helix	trans	-77.3	-40.4	179.5	-58.4	0	0	0	0	110.8	P30 E31 T36 I37	P30-T33 PolarHBondContact O-N 3.13Å; E31-T33 VanDerWaalsContact C-N 3.26Å; E31-T33 PolarHBondContact O-N 3.36Å; T33-T36 PolarHBondContact O-N 3.01Å; T33-I37 HydrophobicContact CG2-CD1 3.98Å; T33-I37 WeakPolarHBondContact O-CG1 3.44Å; T33-I37 PolarHBondContact O-N 3.4Å
34	A	56.1	Low	57.6	Low	54 Å²	54	107.3 Å²	107.3	45%	0.446	63%	0.632	S	S	.	*	H	α-helix	trans	-65.9	-42.3	-180	0	0	0	0	0	112.6	E31 I37 L38	E31-A34 PolarHBondContact O-N 2.89Å; A34-I37 PolarHBondContact O-N 3.5Å; A34-L38 WeakPolarHBondContact O-CG 3.27Å; A34-L38 PolarHBondContact O-N 2.89Å
35	T	65.1	Low	59.9	Low	90 Å²	90	105.7 Å²	105.7	55%	0.552	62%	0.615	S	S	*	*	H	α-helix	trans	-63.3	-40.2	174.4	35.8	0	0	0	0	112.2	E31 T32 L38 A39	E31-T35 PolarHBondContact O-N 3.27Å; E31-T35 PolarHBondContact O-OG1 2.89Å; T32-T35 WeakPolarHBondContact CA-OG1 3.48Å; T32-T35 PolarHBondContact O-OG1 3.4Å; T35-L38 PolarHBondContact O-N 3.03Å; T35-A39 PolarHBondContact O-N 3.1Å
36	T	66.4	Low	62.1	Low	96 Å²	96	106.1 Å²	106.1	59%	0.589	60%	0.601	S	S	*	*	H	α-helix	trans	-63.9	-42.2	175.2	-54	0	0	0	0	112.3	T32 T33 A39 S40	T32-T36 PolarHBondContact O-N 2.9Å; T32-T36 PolarHBondContact O-OG1 2.97Å; T33-T36 PolarHBondContact O-N 3.01Å; T36-A39 PolarHBondContact O-N 2.8Å; T36-S40 PolarHBondContact O-N 3.42Å; T36-S40 VanDerWaalsContact O-N 3.13Å
37	I	70.9	Confident	63.2	Low	103 Å²	103	105 Å²	105	53%	0.528	58%	0.584	S	S	.	*	H	α-helix	trans	-64.6	-43.9	176.4	-68.6	166.4	0	0	0	111	T33 A34 A39 S40 V41	T33-I37 HydrophobicContact CG2-CD1 3.98Å; T33-I37 WeakPolarHBondContact O-CG1 3.44Å; T33-I37 PolarHBondContact O-N 3.4Å; A34-I37 PolarHBondContact O-N 3.5Å; I37-A39 VanDerWaalsContact C-N 3.31Å; I37-A39 PolarHBondContact O-N 3.43Å; I37-S40 PolarHBondContact O-N 2.76Å; I37-V41 HydrophobicContact CG2-CG2 4.38Å; I37-V41 WeakPolarHBondContact O-CG2 3.37Å; I37-V41 PolarHBondContact O-N 3.39Å
38	L	65.8	Low	65.2	Low	121 Å²	121	108.4 Å²	108.4	63%	0.634	58%	0.577	S	S	*	*	H	α-helix	trans	-60.6	-38.4	176.5	-80.6	165	0	0	0	112.6	A34 T35 K42	A34-L38 WeakPolarHBondContact O-CG 3.27Å; A34-L38 PolarHBondContact O-N 2.89Å; T35-L38 PolarHBondContact O-N 3.03Å; L38-K42 VanDerWaalsContact O-CB 3.3Å; L38-K42 WeakPolarHBondContact O-CB 3.4Å; L38-K42 PolarHBondContact O-N 3.08Å; L38-K42 VanDerWaalsContact O-N 3.09Å
39	A	67.5	Low	67	Low	62 Å²	62	103 Å²	103	51%	0.512	55%	0.55	S	S	.	.	H	α-helix	trans	-63	-45.2	173.8	0	0	0	0	0	111.9	T35 T36 I37 K42 E43	T35-A39 PolarHBondContact O-N 3.1Å; T36-A39 PolarHBondContact O-N 2.8Å; I37-A39 VanDerWaalsContact C-N 3.31Å; I37-A39 PolarHBondContact O-N 3.43Å; A39-K42 PolarHBondContact O-N 2.87Å; A39-E43 PolarHBondContact O-N 3.24Å
40	S	72.3	Confident	68.6	Low	61 Å²	61	103.1 Å²	103.1	43%	0.427	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-42.5	179.5	-173.8	0	0	0	0	113	T36 I37 K42 E43 Q44	T36-S40 PolarHBondContact O-N 3.42Å; T36-S40 VanDerWaalsContact O-N 3.13Å; I37-S40 PolarHBondContact O-N 2.76Å; S40-K42 VanDerWaalsContact C-N 3.34Å; S40-K42 PolarHBondContact O-N 3.35Å; S40-E43 PolarHBondContact O-N 2.83Å; S40-Q44 WeakPolarHBondContact O-CG 3.28Å; S40-Q44 PolarHBondContact O-N 2.75Å
41	V	75.9	Confident	69.8	Low	78 Å²	78	103.5 Å²	103.5	47%	0.473	54%	0.54	S	S	.	.	H	α-helix	trans	-61.5	-43	174.9	171.9	0	0	0	0	110.9	I37 E43 Q44 E45	I37-V41 HydrophobicContact CG2-CG2 4.38Å; I37-V41 WeakPolarHBondContact O-CG2 3.37Å; I37-V41 PolarHBondContact O-N 3.39Å; V41-E43 VanDerWaalsContact C-N 3.3Å; V41-E43 PolarHBondContact O-N 3.03Å; V41-Q44 PolarHBondContact O-N 3.01Å; V41-E45 PolarHBondContact O-N 3.08Å
42	K	72	Confident	71.3	Confident	154 Å²	154	99.7 Å²	99.7	67%	0.67	53%	0.528	S	S	*	.	H	α-helix	trans	-67.2	-29.5	178.5	-166.6	171.8	-173.8	174.6	0	113	L38 A39 S40 L46	L38-K42 VanDerWaalsContact O-CB 3.3Å; L38-K42 WeakPolarHBondContact O-CB 3.4Å; L38-K42 PolarHBondContact O-N 3.08Å; L38-K42 VanDerWaalsContact O-N 3.09Å; A39-K42 PolarHBondContact O-N 2.87Å; S40-K42 VanDerWaalsContact C-N 3.34Å; S40-K42 PolarHBondContact O-N 3.35Å; K42-L46 WeakPolarHBondContact O-CB 3.36Å; K42-L46 PolarHBondContact O-N 3.23Å; K42-L46 VanDerWaalsContact O-N 3.17Å
43	E	78.5	Confident	72.6	Confident	116 Å²	116	102.5 Å²	102.5	54%	0.542	53%	0.528	S	S	.	.	H	α-helix	trans	-70.8	-43.8	170.5	-172	177.1	-178.8	0	0	111.8	A39 S40 V41 E45 L46 Q47	A39-E43 PolarHBondContact O-N 3.24Å; S40-E43 PolarHBondContact O-N 2.83Å; V41-E43 VanDerWaalsContact C-N 3.3Å; V41-E43 PolarHBondContact O-N 3.03Å; E43-E45 VanDerWaalsContact C-N 3.34Å; E43-E45 PolarHBondContact O-N 2.83Å; E43-L46 PolarHBondContact O-N 3.25Å; E43-Q47 WeakPolarHBondContact O-CG 3.31Å; E43-Q47 PolarHBondContact O-N 3.34Å
44	Q	72.3	Confident	73.9	Confident	124 Å²	124	104.6 Å²	104.6	58%	0.579	53%	0.532	S	S	*	.	H	α-helix	trans	-61.5	-41.3	175.7	-72.1	-178.7	-13.7	0	0	112.1	S40 V41 L46 Q47 F48	S40-Q44 WeakPolarHBondContact O-CG 3.28Å; S40-Q44 PolarHBondContact O-N 2.75Å; V41-Q44 PolarHBondContact O-N 3.01Å; Q44-L46 VanDerWaalsContact C-N 3.34Å; Q44-L46 PolarHBondContact O-N 2.98Å; Q44-Q47 PolarHBondContact O-N 3.23Å; Q44-F48 PolarHBondContact O-N 3.2Å
45	E	80.3	Confident	75	Confident	111 Å²	111	107.2 Å²	107.2	52%	0.519	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-42.2	174	-169.4	-176.8	176.8	0	0	111.6	V41 E43 Q47 F48 Q49	V41-E45 PolarHBondContact O-N 3.08Å; E43-E45 VanDerWaalsContact C-N 3.34Å; E43-E45 PolarHBondContact O-N 2.83Å; E45-Q47 PolarHBondContact O-N 3.22Å; E45-F48 PolarHBondContact O-N 3.05Å; E45-Q49 WeakPolarHBondContact O-CG 3.43Å; E45-Q49 PolarHBondContact O-N 2.88Å
46	L	82.4	Confident	75.9	Confident	78 Å²	78	106.2 Å²	106.2	41%	0.408	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-34.6	175.6	-175.9	63.6	0	0	0	112.7	K42 E43 Q44 R50	K42-L46 WeakPolarHBondContact O-CB 3.36Å; K42-L46 PolarHBondContact O-N 3.23Å; K42-L46 VanDerWaalsContact O-N 3.17Å; E43-L46 PolarHBondContact O-N 3.25Å; Q44-L46 VanDerWaalsContact C-N 3.34Å; Q44-L46 PolarHBondContact O-N 2.98Å; L46-R50 WeakPolarHBondContact O-CG 3.42Å; L46-R50 PolarHBondContact O-N 2.98Å
47	Q	69.5	Low	76.8	Confident	110 Å²	110	105.4 Å²	105.4	51%	0.514	52%	0.521	S	S	.	.	H	α-helix	trans	-67.6	-43	173.1	-70.6	-178.7	18.6	0	0	111.2	E43 Q44 E45 R50 L51	E43-Q47 WeakPolarHBondContact O-CG 3.31Å; E43-Q47 PolarHBondContact O-N 3.34Å; Q44-Q47 PolarHBondContact O-N 3.23Å; E45-Q47 PolarHBondContact O-N 3.22Å; Q47-R50 WeakPolarHBondContact O-CB 3.42Å; Q47-R50 PolarHBondContact O-N 3.39Å; Q47-L51 PolarHBondContact O-N 3.4Å
48	F	80.1	Confident	77.3	Confident	145 Å²	145	106.6 Å²	106.6	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-60	-49	175	-168.9	-99.9	0	0	0	111.5	Q44 E45 R50 L51 T52	Q44-F48 PolarHBondContact O-N 3.2Å; E45-F48 PolarHBondContact O-N 3.05Å; F48-R50 PolarHBondContact O-N 3.27Å; F48-R50 VanDerWaalsContact O-N 3.16Å; F48-L51 PolarHBondContact O-N 3.1Å; F48-L51 VanDerWaalsContact O-N 3.09Å; F48-T52 PolarHBondContact O-N 3.21Å; F48-T52 PolarHBondContact O-OG1 3.5Å
49	Q	76.8	Confident	78.3	Confident	81 Å²	81	108.4 Å²	108.4	38%	0.379	52%	0.523	S	S	.	.	H	α-helix	trans	-61.1	-23.3	176.2	-71.3	-176.5	22.3	0	0	114.4	E45 R53	E45-Q49 WeakPolarHBondContact O-CG 3.43Å; E45-Q49 PolarHBondContact O-N 2.88Å; Q49-R53 WeakPolarHBondContact O-CG 3.47Å; Q49-R53 PolarHBondContact O-NH1 3.03Å; Q49-R53 VanDerWaalsContact O-NH1 3.07Å
50	R	79.3	Confident	78.7	Confident	151 Å²	151	110.4 Å²	110.4	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-75.7	-49.9	171.5	-73.9	171.5	-175.2	-177.6	3.5	110.4	L46 Q47 F48 T52 R53 E54	L46-R50 WeakPolarHBondContact O-CG 3.42Å; L46-R50 PolarHBondContact O-N 2.98Å; Q47-R50 WeakPolarHBondContact O-CB 3.42Å; Q47-R50 PolarHBondContact O-N 3.39Å; F48-R50 PolarHBondContact O-N 3.27Å; F48-R50 VanDerWaalsContact O-N 3.16Å; R50-T52 VanDerWaalsContact C-N 3.32Å; R50-T52 PolarHBondContact O-N 3.2Å; R50-R53 PolarHBondContact O-N 3.13Å; R50-R53 VanDerWaalsContact O-N 3.09Å; R50-E54 PolarHBondContact O-N 3.13Å
51	L	74.6	Confident	79.4	Confident	101 Å²	101	111.5 Å²	111.5	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-57.6	-42.9	178.6	-168	69.5	0	0	0	111.7	Q47 F48 R53 E54 L55	Q47-L51 PolarHBondContact O-N 3.4Å; F48-L51 PolarHBondContact O-N 3.1Å; F48-L51 VanDerWaalsContact O-N 3.09Å; L51-R53 VanDerWaalsContact C-N 3.34Å; L51-R53 PolarHBondContact O-N 2.9Å; L51-E54 PolarHBondContact O-N 2.99Å; L51-L55 WeakPolarHBondContact O-CB 3.36Å; L51-L55 PolarHBondContact O-N 3.22Å
52	T	80.7	Confident	79.5	Confident	75 Å²	75	111.4 Å²	111.4	46%	0.46	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-38.1	176.5	-45.6	0	0	0	0	112.9	F48 R50 E56	F48-T52 PolarHBondContact O-N 3.21Å; F48-T52 PolarHBondContact O-OG1 3.5Å; R50-T52 VanDerWaalsContact C-N 3.32Å; R50-T52 PolarHBondContact O-N 3.2Å; T52-E56 WeakPolarHBondContact O-CB 3.31Å; T52-E56 PolarHBondContact O-N 2.64Å; T52-E56 VanDerWaalsContact O-N 3.11Å
53	R	82.1	Confident	79.7	Confident	155 Å²	155	106.6 Å²	106.6	59%	0.585	51%	0.511	S	S	*	.	H	α-helix	trans	-70.6	-39.7	175.7	-73.2	-170.6	-166.5	91.4	-3.1	112.1	Q49 R50 L51 E56 V57	Q49-R53 WeakPolarHBondContact O-CG 3.47Å; Q49-R53 PolarHBondContact O-NH1 3.03Å; Q49-R53 VanDerWaalsContact O-NH1 3.07Å; R50-R53 PolarHBondContact O-N 3.13Å; R50-R53 VanDerWaalsContact O-N 3.09Å; L51-R53 VanDerWaalsContact C-N 3.34Å; L51-R53 PolarHBondContact O-N 2.9Å; R53-E56 PolarHBondContact O-N 3.4Å; R53-V57 WeakPolarHBondContact O-CG2 3.31Å; R53-V57 PolarHBondContact O-N 2.97Å
54	E	83.3	Confident	79.5	Confident	131 Å²	131	103.8 Å²	103.8	61%	0.612	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-42.5	179.2	-165.4	158.8	-148.8	0	0	110.9	R50 L51 V57 E58	R50-E54 PolarHBondContact O-N 3.13Å; L51-E54 PolarHBondContact O-N 2.99Å; E54-V57 PolarHBondContact O-N 3Å; E54-E58 PolarHBondContact O-N 2.8Å
55	L	78.7	Confident	79.3	Confident	109 Å²	109	102.8 Å²	102.8	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-67	-36.8	176	-138.3	164.7	0	0	0	112.6	L51 E58 R59	L51-L55 WeakPolarHBondContact O-CB 3.36Å; L51-L55 PolarHBondContact O-N 3.22Å; L55-E58 PolarHBondContact O-N 2.72Å; L55-R59 WeakPolarHBondContact O-CB 3.5Å; L55-R59 PolarHBondContact O-N 3.35Å
56	E	85.3	Confident	78.8	Confident	68 Å²	68	103.2 Å²	103.2	32%	0.318	50%	0.504	S	S	.	.	H	α-helix	trans	-69.7	-33.9	172.7	178.3	56.9	-160.5	0	0	112.2	T52 R53 R59 Q60	T52-E56 WeakPolarHBondContact O-CB 3.31Å; T52-E56 PolarHBondContact O-N 2.64Å; T52-E56 VanDerWaalsContact O-N 3.11Å; R53-E56 PolarHBondContact O-N 3.4Å; E56-R59 PolarHBondContact O-N 2.92Å; E56-R59 IonicContact OE1-NH1 2.67Å; E56-R59 PolarHBondContact OE1-NH1 3.08Å; E56-R59 WeakPolarHBondContact OE2-CD 3.19Å; E56-R59 IonicContact OE2-CZ 3.24Å; E56-R59 IonicContact OE2-NE 3.68Å; E56-R59 IonicContact OE2-NH1 3.63Å; E56-R59 PolarHBondContact OE2-NH1 3.28Å; E56-Q60 VanDerWaalsContact O-CG 3.32Å; E56-Q60 WeakPolarHBondContact O-CG 3.49Å; E56-Q60 PolarHBondContact O-N 3.23Å; E56-Q60 PolarHBondContact OE1-NE2 2.93Å
57	V	85.3	Confident	78.4	Confident	80 Å²	80	105 Å²	105	49%	0.485	51%	0.511	S	S	.	.	H	α-helix	trans	-67.1	-43.9	172.3	167.7	0	0	0	0	111.1	R53 E54 R59 Q60 I61	R53-V57 WeakPolarHBondContact O-CG2 3.31Å; R53-V57 PolarHBondContact O-N 2.97Å; E54-V57 PolarHBondContact O-N 3Å; V57-R59 VanDerWaalsContact C-N 3.34Å; V57-R59 PolarHBondContact O-N 3.28Å; V57-Q60 PolarHBondContact O-N 3.3Å; V57-I61 HydrophobicContact CG1-CD1 3.84Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 VanDerWaalsContact O-CG1 3.3Å; V57-I61 WeakPolarHBondContact O-CG1 3.34Å; V57-I61 PolarHBondContact O-N 2.63Å
58	E	81.5	Confident	78.1	Confident	128 Å²	128	107.6 Å²	107.6	60%	0.598	52%	0.516	S	S	*	.	H	α-helix	trans	-59.4	-44.7	171.9	-74.5	-159.2	135.6	0	0	111.7	E54 L55 Q60 I61 V62	E54-E58 PolarHBondContact O-N 2.8Å; L55-E58 PolarHBondContact O-N 2.72Å; E58-Q60 VanDerWaalsContact C-N 3.3Å; E58-Q60 PolarHBondContact O-N 3.43Å; E58-I61 PolarHBondContact O-N 3.21Å; E58-I61 VanDerWaalsContact O-N 3.13Å; E58-V62 WeakPolarHBondContact O-CG2 3.42Å; E58-V62 PolarHBondContact O-N 3.49Å
59	R	86.7	Confident	77.3	Confident	158 Å²	158	105.2 Å²	105.2	60%	0.596	52%	0.516	S	S	*	.	H	α-helix	trans	-57.5	-41.7	175.6	176.1	172.7	166.2	-87.8	-10.4	112.1	L55 E56 V57 A63	L55-R59 WeakPolarHBondContact O-CB 3.5Å; L55-R59 PolarHBondContact O-N 3.35Å; E56-R59 PolarHBondContact O-N 2.92Å; E56-R59 IonicContact OE1-NH1 2.67Å; E56-R59 PolarHBondContact OE1-NH1 3.08Å; E56-R59 WeakPolarHBondContact OE2-CD 3.19Å; E56-R59 IonicContact OE2-CZ 3.24Å; E56-R59 IonicContact OE2-NE 3.68Å; E56-R59 IonicContact OE2-NH1 3.63Å; E56-R59 PolarHBondContact OE2-NH1 3.28Å; V57-R59 VanDerWaalsContact C-N 3.34Å; V57-R59 PolarHBondContact O-N 3.28Å; R59-A63 WeakPolarHBondContact O-CB 3.42Å; R59-A63 PolarHBondContact O-N 3.34Å
60	Q	76.3	Confident	76.3	Confident	104 Å²	104	108.4 Å²	108.4	49%	0.486	52%	0.524	S	S	.	.	H	α-helix	trans	-70.4	-35.4	175.8	-71.7	176	18	0	0	112.7	E56 V57 E58 S64	E56-Q60 VanDerWaalsContact O-CG 3.32Å; E56-Q60 WeakPolarHBondContact O-CG 3.49Å; E56-Q60 PolarHBondContact O-N 3.23Å; E56-Q60 PolarHBondContact OE1-NE2 2.93Å; V57-Q60 PolarHBondContact O-N 3.3Å; E58-Q60 VanDerWaalsContact C-N 3.3Å; E58-Q60 PolarHBondContact O-N 3.43Å; Q60-S64 VanDerWaalsContact O-CB 3.28Å; Q60-S64 WeakPolarHBondContact O-CB 3.27Å; Q60-S64 PolarHBondContact O-N 3.02Å; Q60-S64 PolarHBondContact O-OG 2.83Å
61	I	86	Confident	75.1	Confident	84 Å²	84	106.5 Å²	106.5	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-64.6	-45.7	173.6	-70.2	164.3	0	0	0	110.7	V57 E58 S64 Q65	V57-I61 HydrophobicContact CG1-CD1 3.84Å; V57-I61 HydrophobicContact CG1-CG1 4.49Å; V57-I61 VanDerWaalsContact O-CG1 3.3Å; V57-I61 WeakPolarHBondContact O-CG1 3.34Å; V57-I61 PolarHBondContact O-N 2.63Å; E58-I61 PolarHBondContact O-N 3.21Å; E58-I61 VanDerWaalsContact O-N 3.13Å; I61-S64 CarbonylContact O-C 3.56Å; I61-S64 PolarHBondContact O-N 3.03Å; I61-Q65 WeakPolarHBondContact O-CG 3.28Å; I61-Q65 PolarHBondContact O-N 3.13Å
62	V	78.1	Confident	73.7	Confident	76 Å²	76	105 Å²	105	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-43.3	177.8	171.2	0	0	0	0	111.1	E58 S64 Q65 L66	E58-V62 WeakPolarHBondContact O-CG2 3.42Å; E58-V62 PolarHBondContact O-N 3.49Å; V62-S64 PolarHBondContact O-N 3.35Å; V62-Q65 PolarHBondContact O-N 2.72Å; V62-Q65 VanDerWaalsContact O-N 3.16Å; V62-L66 HydrophobicContact CG1-CD1 4.14Å; V62-L66 PolarHBondContact O-N 3.31Å
63	A	76.2	Confident	72.1	Confident	54 Å²	54	105.4 Å²	105.4	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-58.7	-45.9	171.6	0	0	0	0	0	111.8	R59 Q65 L66 E67	R59-A63 WeakPolarHBondContact O-CB 3.42Å; R59-A63 PolarHBondContact O-N 3.34Å; A63-Q65 PolarHBondContact O-N 3.24Å; A63-L66 PolarHBondContact O-N 2.58Å; A63-E67 WeakPolarHBondContact O-CB 3.37Å; A63-E67 PolarHBondContact O-N 3.11Å
64	S	73.3	Confident	70	Confident	57 Å²	57	104.2 Å²	104.2	40%	0.399	55%	0.546	S	S	.	.	H	α-helix	trans	-68.1	-15.5	176.9	-55	0	0	0	0	114.1	Q60 I61 V62 R68	Q60-S64 VanDerWaalsContact O-CB 3.28Å; Q60-S64 WeakPolarHBondContact O-CB 3.27Å; Q60-S64 PolarHBondContact O-N 3.02Å; Q60-S64 PolarHBondContact O-OG 2.83Å; I61-S64 CarbonylContact O-C 3.56Å; I61-S64 PolarHBondContact O-N 3.03Å; V62-S64 PolarHBondContact O-N 3.35Å; S64-R68 PolarHBondContact O-NE 2.8Å; S64-R68 PolarHBondContact O-NH2 3.17Å
65	Q	69.4	Low	67.5	Low	103 Å²	103	103.3 Å²	103.3	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-86.6	-47.6	170.8	-76.3	176.3	-5.6	0	0	110.3	I61 V62 A63 E67 R68 C69	I61-Q65 WeakPolarHBondContact O-CG 3.28Å; I61-Q65 PolarHBondContact O-N 3.13Å; V62-Q65 PolarHBondContact O-N 2.72Å; V62-Q65 VanDerWaalsContact O-N 3.16Å; A63-Q65 PolarHBondContact O-N 3.24Å; Q65-E67 VanDerWaalsContact C-N 3.3Å; Q65-E67 PolarHBondContact O-N 2.98Å; Q65-R68 PolarHBondContact O-N 2.76Å; Q65-R68 VanDerWaalsContact O-N 3.14Å; Q65-C69 PolarHBondContact O-N 2.86Å; Q65-C69 PolarHBondContact O-SG 3.2Å; Q65-C69 VanDerWaalsContact O-SG 3.4Å
66	L	70.1	Confident	65.7	Low	119 Å²	119	104 Å²	104	62%	0.623	57%	0.565	S	S	*	*	H	α-helix	trans	-56.1	-42.4	174.3	-83.2	162	0	0	0	112.3	V62 A63 C69 R70	V62-L66 HydrophobicContact CG1-CD1 4.14Å; V62-L66 PolarHBondContact O-N 3.31Å; A63-L66 PolarHBondContact O-N 2.58Å; L66-C69 PolarHBondContact O-N 3.32Å; L66-R70 WeakPolarHBondContact O-CB 3.42Å; L66-R70 PolarHBondContact O-N 3.36Å
67	E	72.7	Confident	63.1	Low	116 Å²	116	106.2 Å²	106.2	54%	0.542	59%	0.588	S	S	.	*	H	α-helix	trans	-67.6	-37.1	177.8	-171.4	154.5	-131	0	0	112.3	A63 Q65 R70 L71	A63-E67 WeakPolarHBondContact O-CB 3.37Å; A63-E67 PolarHBondContact O-N 3.11Å; Q65-E67 VanDerWaalsContact C-N 3.3Å; Q65-E67 PolarHBondContact O-N 2.98Å; E67-R70 PolarHBondContact O-N 3Å; E67-L71 HydrophobicContact CG-CD1 4.18Å; E67-L71 WeakPolarHBondContact O-CB 3.47Å; E67-L71 VanDerWaalsContact O-CG 3.31Å; E67-L71 WeakPolarHBondContact O-CG 3.46Å; E67-L71 PolarHBondContact O-N 2.82Å
68	R	63.8	Low	60.6	Low	165 Å²	165	109.8 Å²	109.8	62%	0.623	60%	0.603	S	S	*	*	H	α-helix	trans	-66.7	-38.5	171	-86	-179.3	-74.5	176.5	-6.1	112.8	S64 Q65 R70 G72	S64-R68 PolarHBondContact O-NE 2.8Å; S64-R68 PolarHBondContact O-NH2 3.17Å; Q65-R68 PolarHBondContact O-N 2.76Å; Q65-R68 VanDerWaalsContact O-N 3.14Å; R68-R70 VanDerWaalsContact C-N 3.31Å; R68-R70 PolarHBondContact O-N 2.77Å; R68-G72 PolarHBondContact O-N 2.73Å
69	C	63.6	Low	58.1	Low	94 Å²	94	107.9 Å²	107.9	64%	0.635	61%	0.609	S	S	*	*	H	α-helix	trans	-64	-36.1	172.6	-69.5	0	0	0	0	111.9	Q65 L66	Q65-C69 PolarHBondContact O-N 2.86Å; Q65-C69 PolarHBondContact O-SG 3.2Å; Q65-C69 VanDerWaalsContact O-SG 3.4Å; L66-C69 PolarHBondContact O-N 3.32Å
70	R	55.7	Low	55.4	Low	148 Å²	148	105.4 Å²	105.4	56%	0.558	62%	0.616	S	S	*	*	H	α-helix	trans	-69.8	-46.1	176.3	-158.9	172.3	82.9	95.7	-1.9	112	L66 E67 R68 G72 A73	L66-R70 WeakPolarHBondContact O-CB 3.42Å; L66-R70 PolarHBondContact O-N 3.36Å; E67-R70 PolarHBondContact O-N 3Å; R68-R70 VanDerWaalsContact C-N 3.31Å; R68-R70 PolarHBondContact O-N 2.77Å; R70-G72 VanDerWaalsContact C-N 3.27Å; R70-G72 PolarHBondContact O-N 3.1Å; R70-A73 PolarHBondContact O-N 3.41Å; R70-A73 VanDerWaalsContact O-N 3.11Å
71	L	53.3	Low	53.1	Low	111 Å²	111	106.9 Å²	106.9	58%	0.581	63%	0.632	S	S	*	*	H	α-helix	trans	-65.4	-29.6	176.3	-69.7	168	0	0	0	112.6	E67 A73 E74	E67-L71 HydrophobicContact CG-CD1 4.18Å; E67-L71 WeakPolarHBondContact O-CB 3.47Å; E67-L71 VanDerWaalsContact O-CG 3.31Å; E67-L71 WeakPolarHBondContact O-CG 3.46Å; E67-L71 PolarHBondContact O-N 2.82Å; L71-A73 PolarHBondContact O-N 3.4Å; L71-E74 PolarHBondContact O-N 3.09Å
72	G	46.6	Very low	50.2	Low	71 Å²	71	108.5 Å²	108.5	73%	0.732	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-12.1	172.6	0	0	0	0	0	115.1	R68 R70	R68-G72 PolarHBondContact O-N 2.73Å; R70-G72 VanDerWaalsContact C-N 3.27Å; R70-G72 PolarHBondContact O-N 3.1Å
73	A	46.8	Very low	48.4	Very low	82 Å²	82	110.2 Å²	110.2	68%	0.678	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-12	179	0	0	0	0	0	114	R70 L71	R70-A73 PolarHBondContact O-N 3.41Å; R70-A73 VanDerWaalsContact O-N 3.11Å; L71-A73 PolarHBondContact O-N 3.4Å
74	E	36.7	Very low	46	Very low	131 Å²	131	113.6 Å²	113.6	61%	0.612	68%	0.681	S	S	*	*	S	Bend	trans	-115.2	67.2	-173.2	-69.7	-176.9	-174	0	0	112	L71	L71-E74 PolarHBondContact O-N 3.09Å
75	S	31.5	Very low	44	Very low	112 Å²	112	119.4 Å²	119.4	78%	0.783	70%	0.702	S	S	*	*			trans	-155.9	119.1	167.4	-80.7	0	0	0	0	112.6
76	P	41	Very low	41.9	Very low	122 Å²	122	123.5 Å²	123.5	79%	0.792	72%	0.718	S	S	*	*			trans	-104	128.2	-177.9	35.3	-29.5	0	0	0	113.6
77	S	31.6	Very low	39.8	Very low	115 Å²	115	122.3 Å²	122.3	80%	0.804	72%	0.72	S	S	*	*			trans	178.3	127.7	138.6	-87.2	0	0	0	0	116.5
78	I	31.8	Very low	37.6	Very low	156 Å²	156	126.1 Å²	126.1	80%	0.8	74%	0.735	S	S	*	*			trans	12.9	117.2	143.3	43.5	175.1	0	0	0	122.4
79	A	29.6	Very low	36.5	Very low	88 Å²	88	123.1 Å²	123.1	73%	0.727	74%	0.737	S	S	*	*				82.6	127	117.7	0	0	0	0	0	123.6
80	S	28.8	Very low	34.8	Very low	105 Å²	105	128.9 Å²	128.9	73%	0.734	75%	0.746	S	S	*	*			trans	91.3	106.1	138.7	-63.1	0	0	0	0	122.5
81	T	28.1	Very low	33.5	Very low	136 Å²	136	130.5 Å²	130.5	83%	0.834	75%	0.752	S	S	*	*			trans	56.7	115.9	131.7	61.4	0	0	0	0	121.2
82	S	25.8	Very low	32.5	Very low	118 Å²	118	127.8 Å²	127.8	83%	0.825	75%	0.745	S	S	*	*				-158.9	151.5	115.1	-169	0	0	0	0	110.4
83	S	39.5	Very low	31.7	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	74%	0.742	S	S	*	*			trans	-127.5	147.8	163.7	67	0	0	0	0	109
84	T	25.7	Very low	30.8	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	74%	0.742	S	S	*	*			trans	-157.1	131.8	155	-22.3	0	0	0	0	110.9
85	E	32.1	Very low	30.6	Very low	180 Å²	180	131.8 Å²	131.8	84%	0.841	75%	0.751	S	S	*	*			trans	-75.2	161.4	169.3	-48.9	158.8	122	0	0	110.1
86	K	26	Very low	31.1	Very low	188 Å²	188	131.9 Å²	131.9	82%	0.817	75%	0.75	S	S	*	*			trans	-171.1	122.2	139.9	-108.8	151.6	-170.3	173.2	0	116.5
87	S	25.6	Very low	30.8	Very low	94 Å²	94	133 Å²	133	66%	0.657	75%	0.749	S	S	*	*			trans	53.1	133.6	141.5	51.3	0	0	0	0	121.9
88	F	26.6	Very low	30.8	Very low	197 Å²	197	133.8 Å²	133.8	86%	0.864	75%	0.749	S	S	*	*			cis	73.4	158.6	39.4	-70.1	-57.9	0	0	0	115.5
89	P	40.6	Very low	30.8	Very low	102 Å²	102	129.5 Å²	129.5	66%	0.662	74%	0.743	S	S	*	*			cis	-102.5	-159.9	-2.4	44	-36.2	0	0	0	111.6
90	W	28.1	Very low	30.9	Very low	214 Å²	214	132.3 Å²	132.3	81%	0.811	75%	0.751	S	S	*	*			cis	-151.4	178.7	2.4	-117.4	148.2	0	0	0	106.7
91	R	28.1	Very low	30.8	Very low	182 Å²	182	132.1 Å²	132.1	69%	0.687	75%	0.749	S	S	*	*			cis	-144.9	157.5	2.2	-116.6	-159.3	166.8	-103.1	-1.4	106	T93	R91-T93 VanDerWaalsContact NH1-CG2 3.31Å
92	A	33.2	Very low	30.9	Very low	54 Å²	54	135.2 Å²	135.2	45%	0.446	75%	0.751	S	S	.	*				64.5	124.3	59.5	0	0	0	0	0	113.9
93	T	28.6	Very low	31.8	Very low	107 Å²	107	135.2 Å²	135.2	66%	0.656	75%	0.749	S	S	*	*			cis	-153.3	162.8	34.9	53.5	0	0	0	0	112.1	R91	R91-T93 VanDerWaalsContact NH1-CG2 3.31Å
94	D	29	Very low	31.3	Very low	129 Å²	129	138.4 Å²	138.4	69%	0.69	75%	0.748	S	S	*	*			cis	-176.5	156	-20.8	-95	-30.9	0	0	0	111.6
95	V	32.3	Very low	31.4	Very low	132 Å²	132	137.9 Å²	137.9	80%	0.8	75%	0.745	S	S	*	*			trans	67.5	151.9	138.3	159.4	0	0	0	0	120.8
96	P	41	Very low	31.3	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	74%	0.737	S	S	*	*			cis	-132	-157.6	-27.7	35	-13.8	0	0	0	114
97	N	35.6	Very low	31.4	Very low	145 Å²	145	132.2 Å²	132.2	78%	0.775	74%	0.737	S	S	*	*				176.8	178.1	-61.7	-162.9	5	0	0	0	110.9
98	T	31.2	Very low	31.4	Very low	131 Å²	131	132.1 Å²	132.1	80%	0.804	74%	0.742	S	S	*	*			trans	88.9	138.7	164.8	73.4	0	0	0	0	119.3
99	G	31.6	Very low	31.4	Very low	66 Å²	66	129.2 Å²	129.2	68%	0.68	74%	0.74	S	S	*	*			cis	165.9	-173.8	-11.2	0	0	0	0	0	116.2
100	V	31.2	Very low	30.9	Very low	147 Å²	147	132.1 Å²	132.1	89%	0.891	74%	0.744	S	S	*	*			trans	78.6	137.8	159.2	-173.4	0	0	0	0	118.4
101	S	27.9	Very low	31.9	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	74%	0.74	S	S	*	*			cis	-170.7	149.4	-28.1	63	0	0	0	0	114.6
102	K	28.9	Very low	32	Very low	201 Å²	201	123.6 Å²	123.6	87%	0.874	73%	0.734	S	S	*	*			trans	13.1	162.2	145.6	-68.1	-176.1	178	179.9	0	122.5
103	P	44.4	Very low	31.7	Very low	118 Å²	118	128.6 Å²	128.6	77%	0.766	75%	0.753	S	S	*	*			cis	-140.3	-147.3	25.2	39.8	-14.9	0	0	0	114
104	K	30.6	Very low	31.7	Very low	178 Å²	178	132.3 Å²	132.3	77%	0.774	76%	0.757	S	S	*	*			cis	-165.4	157.2	-6.1	-141.8	-162.6	175.6	-166.6	0	111.8
105	V	27.4	Very low	31.8	Very low	115 Å²	115	132 Å²	132	70%	0.697	75%	0.754	S	S	*	*			trans	42.7	147.8	135.8	156.1	0	0	0	0	122.5
106	S	29.3	Very low	31.6	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	76%	0.758	S	S	*	*			cis	-171	177.4	-20.5	-86.8	0	0	0	0	111.4
107	D	27.4	Very low	30.9	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	76%	0.76	S	S	*	*			trans	-52.8	158	-174.6	-42.4	-89.5	0	0	0	119.3
108	A	27.4	Very low	30.6	Very low	92 Å²	92	138.1 Å²	138.1	76%	0.76	76%	0.764	S	S	*	*				173.8	166.4	109.9	0	0	0	0	0	115.8
109	V	26.3	Very low	30.3	Very low	136 Å²	136	139.4 Å²	139.4	82%	0.824	76%	0.761	S	S	*	*			trans	90.9	126.9	160.6	-168.4	0	0	0	0	119.2
110	H	28.8	Very low	30.5	Very low	163 Å²	163	141.1 Å²	141.1	76%	0.755	76%	0.76	S	S	*	*			trans	-123.9	162.6	175.1	-107.9	55	0	0	0	107.1
111	P	49.5	Very low	30.3	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	75%	0.749	S	S	*	*				-157.3	146.2	88.5	39.3	-18.6	0	0	0	119.1
112	N	30.9	Very low	30.2	Very low	108 Å²	108	143.7 Å²	143.7	58%	0.578	75%	0.751	S	S	*	*				51.2	133.2	129.1	-55.6	-10.2	0	0	0	120.6
113	N	26.3	Very low	30	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	74%	0.738	S	S	*	*				-147.7	125.1	64.7	-114.1	-14.2	0	0	0	117.3
114	Y	29.3	Very low	29.1	Very low	186 Å²	186	137.4 Å²	137.4	73%	0.729	74%	0.739	S	S	*	*			trans	-61.3	175.3	152.7	-71.3	-71.9	0	0	0	111.9
115	L	30	Very low	28.9	Very low	121 Å²	121	134.9 Å²	134.9	63%	0.634	73%	0.733	S	S	*	*			cis	176.5	156	-19.7	169.9	136	0	0	0	106.8	R117	L115-R117 HydrophobicContact CD2-CB 4.01Å
116	I	27.9	Very low	28.8	Very low	173 Å²	173	139.3 Å²	139.3	89%	0.887	74%	0.739	S	S	*	*			trans	-154.3	155.3	145.5	-107.5	155.5	0	0	0	109.3
117	R	27.5	Very low	28.8	Very low	210 Å²	210	139 Å²	139	79%	0.792	74%	0.737	S	S	*	*			trans	-150.5	126.1	-151.8	168.4	-156.8	-173.6	-157.9	5.2	111.3	L115	L115-R117 HydrophobicContact CD2-CB 4.01Å
118	T	29.4	Very low	29.6	Very low	139 Å²	139	136.6 Å²	136.6	85%	0.853	73%	0.73	S	S	*	*			trans	-151.5	114.2	161.1	41.4	0	0	0	0	111.5
119	E	24.5	Very low	29.5	Very low	158 Å²	158	140.9 Å²	140.9	74%	0.738	73%	0.734	S	S	*	*			trans	-56.9	167.3	143.7	-77.5	-75.1	150.1	0	0	109.7
120	P	35.4	Very low	29.7	Very low	101 Å²	101	143.2 Å²	143.2	66%	0.656	74%	0.736	S	S	*	*			cis	-149	170	31.8	45.9	-26.5	0	0	0	119.7
121	E	27.1	Very low	29.5	Very low	140 Å²	140	141.6 Å²	141.6	65%	0.654	74%	0.738	S	S	*	*			trans	61.9	138.8	132.6	-78.1	-175.2	123.8	0	0	125.2
122	Q	24.9	Very low	28.5	Very low	162 Å²	162	141 Å²	141	76%	0.757	74%	0.736	S	S	*	*			trans	59.2	146.5	140.7	-60.8	176.9	35.8	0	0	120.3
123	G	25.7	Very low	28.3	Very low	58 Å²	58	142.5 Å²	142.5	60%	0.598	74%	0.743	S	S	*	*			cis	135.9	151.6	-7	0	0	0	0	0	113.6
124	T	25.7	Very low	28.3	Very low	130 Å²	130	141.8 Å²	141.8	80%	0.798	73%	0.734	S	S	*	*			trans	62.7	163.8	163.7	61.7	0	0	0	0	117
125	L	26	Very low	28.2	Very low	124 Å²	124	140.7 Å²	140.7	65%	0.649	74%	0.736	S	S	*	*			cis	-154.9	169.9	-23.4	-106.4	165.4	0	0	0	105.1
126	Y	25.3	Very low	28	Very low	209 Å²	209	139.4 Å²	139.4	82%	0.82	74%	0.737	S	S	*	*				-163.8	156.9	56.5	-116.7	-80.4	0	0	0	112.7
127	S	29.5	Very low	27.8	Very low	88 Å²	88	140.7 Å²	140.7	62%	0.615	74%	0.74	S	S	*	*			trans	-83.1	177.7	163.5	-173.7	0	0	0	0	110.2
128	P	44.4	Very low	27.8	Very low	104 Å²	104	134.2 Å²	134.2	68%	0.675	74%	0.738	S	S	*	*				-142.2	168.8	98.4	40.2	-28.2	0	0	0	116.6
129	E	25.4	Very low	27.6	Very low	182 Å²	182	132.8 Å²	132.8	85%	0.85	73%	0.734	S	S	*	*			trans	81.1	127.2	150.2	-80.3	156.3	-160.6	0	0	122.1
130	Q	29.5	Very low	27.6	Very low	185 Å²	185	133.5 Å²	133.5	86%	0.864	74%	0.741	S	S	*	*			trans	-121.8	147.2	167.8	-63.5	176.3	-16.7	0	0	108.4
131	T	26.3	Very low	27.1	Very low	129 Å²	129	132.5 Å²	132.5	79%	0.791	75%	0.75	S	S	*	*			trans	-173.4	123.9	148.1	22.9	0	0	0	0	104.8
132	S	27	Very low	27.2	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	76%	0.76	S	S	*	*				63.9	141.1	65.4	84.2	0	0	0	0	112.1
133	L	27.7	Very low	27.1	Very low	140 Å²	140	131.8 Å²	131.8	73%	0.733	77%	0.765	S	S	*	*			cis	-149.1	163.6	22.3	-77.5	164	0	0	0	112.5
134	H	26.2	Very low	27.4	Very low	142 Å²	142	140.4 Å²	140.4	66%	0.657	78%	0.78	S	S	*	*			trans	65.6	160.1	137.8	-81.6	-145.6	0	0	0	120.9
135	E	26	Very low	27.5	Very low	163 Å²	163	138.2 Å²	138.2	76%	0.762	77%	0.77	S	S	*	*			cis	-141.7	180	-6.4	-144.9	150.2	172.1	0	0	114.2
136	S	26.5	Very low	27.6	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	76%	0.762	S	S	*	*			trans	-85.2	173.4	-161.4	-43.3	0	0	0	0	118.1
137	E	25	Very low	27.7	Very low	200 Å²	200	131.5 Å²	131.5	94%	0.935	76%	0.759	S	S	*	*			trans	66.9	149.4	152.3	-71.3	-176.3	166.4	0	0	119.9
138	G	26	Very low	27.5	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	77%	0.769	S	S	*	*			trans	172.8	-9.3	176.7	0	0	0	0	0	123.1
139	S	24.7	Very low	26.5	Very low	109 Å²	109	137.9 Å²	137.9	76%	0.762	77%	0.772	S	S	*	*			trans	68.3	143.1	165.3	-152.4	0	0	0	0	121
140	L	25.7	Very low	26.4	Very low	173 Å²	173	135.1 Å²	135.1	91%	0.906	76%	0.763	S	S	*	*			trans	24.3	123.3	148.8	-61.3	169.5	0	0	0	121.7
141	G	25.5	Very low	26.2	Very low	80 Å²	80	129.9 Å²	129.9	83%	0.825	75%	0.746	S	S	*	*			trans	179.4	116.1	157.9	0	0	0	0	0	116.1
142	N	27.2	Very low	26.1	Very low	164 Å²	164	134.1 Å²	134.1	88%	0.877	75%	0.749	S	S	*	*			trans	-76.6	143.4	166.3	-81	-32.8	0	0	0	110.9
143	S	24.2	Very low	26.1	Very low	123 Å²	123	134.2 Å²	134.2	86%	0.86	75%	0.75	S	S	*	*				175.1	160.2	112.8	-80.1	0	0	0	0	114.5
144	R	31.1	Very low	25.8	Very low	239 Å²	239	134.6 Å²	134.6	90%	0.902	75%	0.753	S	S	*	*			trans	-94.2	158	173.9	-60.3	167.9	168.5	174.1	-5.3	110.8
145	S	28.5	Very low	25.7	Very low	84 Å²	84	133.1 Å²	133.1	59%	0.587	76%	0.759	S	S	*	*				171	157.2	125.3	44.9	0	0	0	0	114.4
146	S	27.3	Very low	25.8	Very low	71 Å²	71	128.5 Å²	128.5	50%	0.497	75%	0.754	S	S	.	*			trans	53.1	120.3	157.8	55.2	0	0	0	0	119.8
147	T	27.5	Very low	25.7	Very low	122 Å²	122	134.5 Å²	134.5	75%	0.748	76%	0.764	S	S	*	*			cis	80.5	137.7	40.6	71.8	0	0	0	0	116.4
148	Q	26.2	Very low	25.6	Very low	178 Å²	178	132.2 Å²	132.2	83%	0.832	75%	0.753	S	S	*	*			trans	70.5	159.6	175.2	-51.1	-176.4	-7.1	0	0	113.6
149	M	22.2	Very low	25.4	Very low	148 Å²	148	136.8 Å²	136.8	73%	0.729	76%	0.755	S	S	*	*			cis	-155.7	167.6	9.8	-155.2	179.5	53.1	0	0	109.8
150	N	24.4	Very low	25.4	Very low	124 Å²	124	136.4 Å²	136.4	66%	0.663	76%	0.759	S	S	*	*			trans	120.3	150.5	147.9	-54.8	-4.8	0	0	0	115.7
151	S	25.3	Very low	25.3	Very low	74 Å²	74	131.4 Å²	131.4	52%	0.517	75%	0.749	S	S	.	*			trans	-155.6	163.3	-140.7	-70.4	0	0	0	0	112.4
152	Y	24.2	Very low	25.3	Very low	218 Å²	218	132.8 Å²	132.8	86%	0.855	75%	0.746	S	S	*	*			trans	61.6	150.5	162.4	-58.4	-60.5	0	0	0	116.5
153	S	25.9	Very low	25.2	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	74%	0.742	S	S	*	*			cis	-159.5	-159.7	-22.6	-75.3	0	0	0	0	105.6
154	D	21.6	Very low	25.3	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	74%	0.738	S	S	*	*			cis	-162	166	4.4	-166.6	29.3	0	0	0	111.8
155	S	25.5	Very low	25	Very low	112 Å²	112	131 Å²	131	78%	0.783	73%	0.731	S	S	*	*			trans	67.7	172.7	154.2	-157.7	0	0	0	0	119.9
156	G	26.6	Very low	25	Very low	65 Å²	65	130.9 Å²	130.9	67%	0.67	73%	0.73	S	S	*	*			trans	87.5	114.2	-177.1	0	0	0	0	0	113.6
157	Y	24.4	Very low	25	Very low	222 Å²	222	135.1 Å²	135.1	87%	0.871	74%	0.742	S	S	*	*			cis	76.7	125.6	19.9	-117.3	-95.7	0	0	0	116.1
158	Q	23.6	Very low	24.9	Very low	151 Å²	151	136.9 Å²	136.9	71%	0.706	75%	0.747	S	S	*	*			trans	73.1	131.6	175.1	-70.1	-172.8	-67.9	0	0	117.3
159	E	22.7	Very low	25.2	Very low	169 Å²	169	133.2 Å²	133.2	79%	0.79	74%	0.736	S	S	*	*				64	133.7	68	-60.9	-176.7	126.7	0	0	112.5
160	A	24.6	Very low	25.4	Very low	101 Å²	101	131 Å²	131	84%	0.835	74%	0.735	S	S	*	*			cis	-136	-173.8	-3.7	0	0	0	0	0	108.2
161	G	23.8	Very low	25.8	Very low	68 Å²	68	134.5 Å²	134.5	70%	0.701	74%	0.744	S	S	*	*			cis	102.6	135.7	40.7	0	0	0	0	0	111.6
162	S	25.1	Very low	26	Very low	110 Å²	110	134.4 Å²	134.4	77%	0.769	75%	0.749	S	S	*	*			trans	82.9	114.4	160.6	-64.7	0	0	0	0	122.7
163	F	24.6	Very low	26.3	Very low	180 Å²	180	130.9 Å²	130.9	79%	0.789	74%	0.744	S	S	*	*				63.7	113.5	128	-69.9	-72.4	0	0	0	124.5
164	H	25.4	Very low	26.4	Very low	167 Å²	167	131.5 Å²	131.5	77%	0.773	74%	0.74	S	S	*	*				76.1	109.2	125.5	-85.2	20.1	0	0	0	123.2
165	N	26.4	Very low	27	Very low	142 Å²	142	134.7 Å²	134.7	76%	0.759	74%	0.741	S	S	*	*				94.5	148.4	109.6	-162.5	33.6	0	0	0	121.2
166	S	27.3	Very low	27.3	Very low	81 Å²	81	136.4 Å²	136.4	57%	0.566	74%	0.737	S	S	*	*			trans	93.9	128.2	150.2	-9.6	0	0	0	0	122.3
167	Q	28.6	Very low	27.4	Very low	160 Å²	160	139.5 Å²	139.5	75%	0.748	73%	0.734	S	S	*	*			trans	73.9	119.6	138.8	-70.5	177.8	-16.4	0	0	123	V169	Q167-V169 HydrophobicContact CB-CG2 4.14Å; Q167-V169 HydrophobicContact CG-CG2 3.94Å
168	N	25.2	Very low	27.6	Very low	158 Å²	158	136.5 Å²	136.5	85%	0.845	73%	0.727	S	S	*	*				-160.2	134.7	103.7	-84.8	-41.3	0	0	0	108.1
169	V	30.9	Very low	27.7	Very low	102 Å²	102	133.9 Å²	133.9	62%	0.618	73%	0.726	S	S	*	*			cis	97.9	102	13.5	-175.6	0	0	0	0	115.7	Q167	Q167-V169 HydrophobicContact CB-CG2 4.14Å; Q167-V169 HydrophobicContact CG-CG2 3.94Å
170	S	27.7	Very low	28	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	73%	0.726	S	S	*	*			trans	160.2	119.9	147.2	-79.6	0	0	0	0	111.1
171	K	32.7	Very low	28.2	Very low	198 Å²	198	137.2 Å²	137.2	86%	0.861	73%	0.725	S	S	*	*				89.8	145.1	79.4	-79.6	-177.6	174.7	-178.2	0	113.9
172	A	29.9	Very low	28.3	Very low	73 Å²	73	137 Å²	137	60%	0.603	72%	0.722	S	S	*	*			cis	-169.7	164.3	-13.2	0	0	0	0	0	112.8
173	D	30.2	Very low	28.4	Very low	143 Å²	143	137 Å²	137	77%	0.765	72%	0.722	S	S	*	*			trans	65.9	156.8	147.3	-70.3	3.3	0	0	0	121.3
174	N	28	Very low	28.6	Very low	113 Å²	113	134.5 Å²	134.5	60%	0.604	72%	0.722	S	S	*	*			cis	-157.5	144	1.4	-133.7	-49.2	0	0	0	114.4
175	R	34.3	Very low	28.7	Very low	214 Å²	214	133.2 Å²	133.2	81%	0.808	72%	0.721	S	S	*	*			trans	51.3	155.3	151.1	-77.8	167.6	-179	-170.2	-0.4	121.3
176	Q	30.9	Very low	28.8	Very low	147 Å²	147	132.9 Å²	132.9	69%	0.687	72%	0.719	S	S	*	*			cis	-141.5	-155.2	1.5	-132.8	175.7	9.3	0	0	108.2
177	Q	28.8	Very low	28.9	Very low	131 Å²	131	137 Å²	137	61%	0.612	73%	0.729	S	S	*	*			cis	-159.6	150.3	3.2	-141.4	174.1	59.1	0	0	110.8
178	H	28.9	Very low	28.8	Very low	158 Å²	158	135.5 Å²	135.5	73%	0.731	73%	0.731	S	S	*	*			trans	52.2	144.1	165.2	-61.8	-56.1	0	0	0	119.9
179	S	26.4	Very low	28.9	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	73%	0.726	S	S	*	*			cis	-164.5	135.4	-3.5	41	0	0	0	0	113.7
180	F	27.8	Very low	28.7	Very low	183 Å²	183	140 Å²	140	80%	0.803	74%	0.738	S	S	*	*			trans	60.8	112	150.2	-75.5	-108	0	0	0	120.2
181	I	28.7	Very low	28.7	Very low	158 Å²	158	142.3 Å²	142.3	81%	0.81	74%	0.742	S	S	*	*				88.3	133.6	79.1	-81.6	-176.2	0	0	0	113.3
182	G	26.8	Very low	28.5	Very low	62 Å²	62	138.7 Å²	138.7	64%	0.639	74%	0.742	S	S	*	*			cis	-161.3	155.9	1.7	0	0	0	0	0	112
183	S	27.7	Very low	28.4	Very low	110 Å²	110	146.7 Å²	146.7	77%	0.769	76%	0.757	S	S	*	*				91.2	128.6	79.9	-150.6	0	0	0	0	112.1
184	T	27.3	Very low	28.4	Very low	128 Å²	128	143.2 Å²	143.2	79%	0.785	75%	0.747	S	S	*	*			cis	-162.1	158.1	1.1	-0.5	0	0	0	0	111.2
185	N	28.7	Very low	28.5	Very low	140 Å²	140	147.2 Å²	147.2	75%	0.749	76%	0.763	S	S	*	*			trans	-88.7	152.1	165.6	-68.3	-31	0	0	0	111.7
186	N	28.6	Very low	28.3	Very low	135 Å²	135	140 Å²	140	72%	0.722	76%	0.755	S	S	*	*				153.9	153	113.4	-87.3	-31	0	0	0	117.5
187	H	28.1	Very low	28.4	Very low	167 Å²	167	141.9 Å²	141.9	77%	0.773	76%	0.764	S	S	*	*			trans	75.8	167.1	147.4	-72.3	-41	0	0	0	122.7
188	V	27.4	Very low	28.5	Very low	130 Å²	130	140.9 Å²	140.9	79%	0.788	77%	0.767	S	S	*	*			trans	75	115.3	176.9	-166.9	0	0	0	0	113.7
189	V	27.3	Very low	28.5	Very low	122 Å²	122	140.9 Å²	140.9	74%	0.739	77%	0.772	S	S	*	*			cis	90.9	134.1	36.2	176.5	0	0	0	0	114.2
190	R	26.2	Very low	28.7	Very low	231 Å²	231	142.7 Å²	142.7	87%	0.872	78%	0.778	S	S	*	*			trans	80.3	137.3	167.2	-87.2	171.9	176.8	163.2	-1	120.9
191	N	27.5	Very low	28.7	Very low	149 Å²	149	141.9 Å²	141.9	80%	0.797	78%	0.777	S	S	*	*			trans	-38.6	152.5	166.3	-41.7	-22.1	0	0	0	116.5
192	S	29.1	Very low	29.8	Very low	122 Å²	122	139.6 Å²	139.6	85%	0.853	77%	0.772	S	S	*	*				-174.1	168.9	116.4	-86.5	0	0	0	0	116.4
193	R	27.2	Very low	30	Very low	242 Å²	242	141.1 Å²	141.1	91%	0.913	77%	0.773	S	S	*	*			trans	-49.5	172.1	158.1	-83.5	-178.4	155.4	107.8	-9	113.6
194	A	31.5	Very low	30.2	Very low	69 Å²	69	142 Å²	142	57%	0.57	77%	0.774	S	S	*	*			cis	-177.6	175.2	-21	0	0	0	0	0	108.8
195	E	28.9	Very low	30.6	Very low	197 Å²	197	139.7 Å²	139.7	92%	0.921	77%	0.768	S	S	*	*			trans	65.3	149.9	166.1	-67.4	159.2	-149	0	0	116.6
196	G	30.5	Very low	30.9	Very low	64 Å²	64	140 Å²	140	66%	0.66	77%	0.769	S	S	*	*			cis	175.1	179.7	-8.2	0	0	0	0	0	112.4
197	Q	33.6	Very low	31.3	Very low	186 Å²	186	144.7 Å²	144.7	87%	0.869	78%	0.777	S	S	*	*			trans	72.5	150.6	165.9	-51.2	-173	18.3	0	0	116.4
198	T	30.6	Very low	31.6	Very low	110 Å²	110	141 Å²	141	68%	0.675	78%	0.776	S	S	*	*			cis	-155.8	147	5.9	-11.2	0	0	0	0	112.8
199	L	28.9	Very low	31.7	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	78%	0.776	S	S	*	*			trans	53.7	150.3	145.7	-109.3	57	0	0	0	120.4
200	V	29.9	Very low	32.1	Very low	134 Å²	134	146.2 Å²	146.2	81%	0.812	78%	0.777	S	S	*	*			cis	-140.5	162.3	27.7	175.5	0	0	0	0	112.1
201	Q	28.3	Very low	32.7	Very low	165 Å²	165	146.4 Å²	146.4	77%	0.771	78%	0.777	S	S	*	*			trans	-121	-162.5	-178.2	-131.5	-155.4	15.3	0	0	111
202	P	52.1	Low	32.8	Very low	110 Å²	110	145.9 Å²	145.9	71%	0.714	78%	0.779	S	S	*	*			cis	-90.3	-150.2	1.5	42.8	-39.6	0	0	0	111.5
203	S	31.4	Very low	32.8	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	78%	0.775	S	S	*	*			cis	-157.9	-177.8	-0.1	61.2	0	0	0	0	108
204	V	32.2	Very low	32.9	Very low	128 Å²	128	138.5 Å²	138.5	78%	0.776	77%	0.765	S	S	*	*			cis	-141.7	144.4	-7	-110.6	0	0	0	0	105.6
205	A	35.5	Very low	32.9	Very low	80 Å²	80	141.7 Å²	141.7	66%	0.661	78%	0.777	S	S	*	*				68.3	120.4	73	0	0	0	0	0	115.4
206	N	34.2	Very low	33.5	Very low	147 Å²	147	138 Å²	138	79%	0.786	77%	0.77	S	S	*	*			cis	-164.5	164.3	-0.7	-139.6	-26.8	0	0	0	115.6
207	R	36.6	Very low	33.6	Very low	233 Å²	233	140.4 Å²	140.4	88%	0.879	78%	0.777	S	S	*	*			trans	66.9	147.4	171.5	-60.7	174.8	-179.8	166.1	0.1	116.3
208	A	34.1	Very low	33.5	Very low	91 Å²	91	143 Å²	143	75%	0.752	78%	0.779	S	S	*	*			cis	-171.4	171	-14.9	0	0	0	0	0	108
209	M	29.8	Very low	33.5	Very low	160 Å²	160	142.2 Å²	142.2	79%	0.788	78%	0.783	S	S	*	*			cis	-143.9	-109.9	-2.9	-135.3	-68.3	-89	0	0	112.9
210	R	35.7	Very low	33.6	Very low	201 Å²	201	143.7 Å²	143.7	76%	0.758	79%	0.786	S	S	*	*			trans	-154.4	135.7	-163.5	-80.7	-176.7	-178.8	-171.6	-0.4	112
211	R	38.3	Very low	33.5	Very low	234 Å²	234	142.7 Å²	142.7	88%	0.883	79%	0.785	S	S	*	*				72.6	153.3	79.5	-72.3	-171.6	-179.1	-172	1.2	114.5
212	V	30.6	Very low	34.6	Very low	138 Å²	138	140.3 Å²	140.3	84%	0.836	78%	0.783	S	S	*	*			cis	-82.2	-167.1	2.3	-68.2	0	0	0	0	112.2
213	S	28.8	Very low	33.5	Very low	110 Å²	110	140 Å²	140	77%	0.769	78%	0.784	S	S	*	*			cis	-151.4	-173.5	5.8	-146.1	0	0	0	0	108.8
214	S	28.6	Very low	33.4	Very low	99 Å²	99	146 Å²	146	69%	0.692	79%	0.794	S	S	*	*			cis	-153.1	-171.8	5.2	61.3	0	0	0	0	110.9
215	V	32.8	Very low	33.3	Very low	137 Å²	137	145.7 Å²	145.7	83%	0.83	79%	0.792	S	S	*	*			trans	-156.5	168.3	178.9	-99.4	0	0	0	0	109.9
216	P	41.4	Very low	32.9	Very low	118 Å²	118	149.4 Å²	149.4	77%	0.766	80%	0.799	S	S	*	*			cis	-131	174.6	11.2	40.3	-23.4	0	0	0	117.1
217	S	31.3	Very low	32.7	Very low	115 Å²	115	147.9 Å²	147.9	80%	0.804	80%	0.8	S	S	*	*			trans	-83	-179.9	162.9	-39.2	0	0	0	0	111.2
218	R	33.3	Very low	32.3	Very low	242 Å²	242	143.1 Å²	143.1	91%	0.913	80%	0.797	S	S	*	*				172.6	162.3	67.4	-178.3	176.1	176.6	160.4	0.2	111.1
219	A	29.6	Very low	31.9	Very low	93 Å²	93	141.9 Å²	141.9	77%	0.769	79%	0.793	S	S	*	*			trans	116.8	147.7	145.6	0	0	0	0	0	118.9
220	Q	30.8	Very low	31.9	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	80%	0.798	S	S	*	*			trans	-126	145.2	170.3	-61.2	163.7	-45.4	0	0	105.4
221	S	28.7	Very low	31.7	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	80%	0.798	S	S	*	*				169.8	170.3	86.3	-82.8	0	0	0	0	109.6
222	P	50.9	Low	31.4	Very low	115 Å²	115	131.7 Å²	131.7	75%	0.747	80%	0.795	S	S	*	*			trans	-109.8	168.6	-161.3	40.6	-35.2	0	0	0	116.2
223	S	28.3	Very low	31.4	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	79%	0.794	S	S	*	*				172.6	161	122.3	-74.7	0	0	0	0	115.1
224	Y	30	Very low	32	Very low	219 Å²	219	137.1 Å²	137.1	86%	0.859	80%	0.801	S	S	*	*			trans	74.6	157.8	170.2	-76.3	-82.3	0	0	0	119.9
225	V	29.7	Very low	32	Very low	122 Å²	122	136 Å²	136	74%	0.739	81%	0.806	S	S	*	*			trans	-148.7	173.1	-140.2	-75.8	0	0	0	0	110.5
226	I	28.2	Very low	32	Very low	158 Å²	158	135 Å²	135	81%	0.81	81%	0.805	S	S	*	*			cis	-149.8	161.4	21.1	-17.1	166.9	0	0	0	110.6
227	S	28.2	Very low	31.4	Very low	115 Å²	115	137.5 Å²	137.5	80%	0.804	81%	0.811	S	S	*	*			trans	-158.7	168.6	136.4	-158.3	0	0	0	0	113
228	T	28.4	Very low	31.3	Very low	133 Å²	133	143 Å²	143	82%	0.816	81%	0.814	S	S	*	*			trans	-70.2	152.5	-167.7	54.5	0	0	0	0	116.6
229	G	27.5	Very low	31.1	Very low	65 Å²	65	138.3 Å²	138.3	67%	0.67	81%	0.812	S	S	*	*				107.6	108.2	112.2	0	0	0	0	0	119.9
230	V	29.2	Very low	31.3	Very low	147 Å²	147	139.2 Å²	139.2	89%	0.891	81%	0.813	S	S	*	*			trans	68.1	127.9	145.8	-166.5	0	0	0	0	119
231	S	31.2	Very low	31.4	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-78.4	138.4	177.2	-45.9	0	0	0	0	113.8
232	P	32.6	Very low	31.5	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-92.5	130.2	159.6	33.3	-29.5	0	0	0	111.4
233	S	29.9	Very low	30.8	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-89	120.7	173.5	-73.5	0	0	0	0	112.2
234	R	41.3	Very low	30.8	Very low	244 Å²	244	136 Å²	136	92%	0.921	82%	0.821	S	S	*	*			trans	49.3	107.2	155.4	-69.3	179.7	164.9	169	-4.2	119.5
235	G	27.8	Very low	30.8	Very low	76 Å²	76	136 Å²	136	78%	0.784	83%	0.827	S	S	*	*				-117.2	131.1	128.4	0	0	0	0	0	107.6
236	S	33	Very low	30.7	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	83%	0.831	S	S	*	*			cis	81.5	109.3	31.7	-162	0	0	0	0	114
237	L	29.5	Very low	31	Very low	170 Å²	170	132.3 Å²	132.3	89%	0.89	83%	0.832	S	S	*	*			trans	-128.7	123	167.5	-76.9	176.6	0	0	0	110.4
238	R	30.1	Very low	31.8	Very low	230 Å²	230	132.6 Å²	132.6	87%	0.868	83%	0.832	S	S	*	*			trans	-1	144.8	146.7	-67.4	179.8	179.9	-151.6	-1.8	116.8
239	T	28.3	Very low	31.7	Very low	145 Å²	145	131.3 Å²	131.3	89%	0.89	83%	0.828	S	S	*	*				-134.3	156.4	55.4	48	0	0	0	0	116.7
240	S	34.8	Very low	31.8	Very low	112 Å²	112	134.5 Å²	134.5	78%	0.783	83%	0.834	S	S	*	*			trans	-157.2	159.4	171.4	59.8	0	0	0	0	111.2
241	L	31.3	Very low	31.8	Very low	181 Å²	181	133.6 Å²	133.6	95%	0.948	83%	0.829	S	S	*	*			trans	-143	139	165.5	-71.6	168.2	0	0	0	105
242	G	31	Very low	31.5	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	83%	0.831	S	S	*	*			cis	161.6	166.4	0.1	0	0	0	0	0	106.8
243	S	35.6	Very low	32	Very low	128 Å²	128	134.8 Å²	134.8	90%	0.895	83%	0.826	S	S	*	*			cis	-163.1	158.1	-10.4	-176.4	0	0	0	0	107.2
244	G	29.3	Very low	31.8	Very low	67 Å²	67	140 Å²	140	69%	0.691	83%	0.828	S	S	*	*			trans	176.8	84.3	179.1	0	0	0	0	0	117.1
245	F	30.2	Very low	32.1	Very low	220 Å²	220	133.3 Å²	133.3	97%	0.965	82%	0.816	S	S	*	*			trans	15.7	132.6	156.9	-71.2	-91.8	0	0	0	122.2
246	G	27.4	Very low	32	Very low	81 Å²	81	137.5 Å²	137.5	84%	0.835	82%	0.82	S	S	*	*			trans	149.8	96.9	151.1	0	0	0	0	0	117
247	S	33.6	Very low	32	Very low	120 Å²	120	139.3 Å²	139.3	84%	0.839	82%	0.821	S	S	*	*			trans	-97.8	173.5	166.7	-56.3	0	0	0	0	109.9
248	P	45.9	Very low	32.3	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	82%	0.816	S	S	*	*			cis	-140.1	-168.8	13.9	43.4	-23	0	0	0	117
249	S	26.9	Very low	32.2	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	81%	0.813	S	S	*	*			trans	-77.7	166.3	178.6	53.2	0	0	0	0	116.4
250	V	29.7	Very low	32.1	Very low	131 Å²	131	129 Å²	129	79%	0.794	81%	0.806	S	S	*	*			trans	-168.6	134.6	135.2	131.3	0	0	0	0	114.5
251	T	29.3	Very low	31.7	Very low	128 Å²	128	134 Å²	134	79%	0.785	81%	0.809	S	S	*	*			trans	36.4	138.8	157.7	67.9	0	0	0	0	126.8
252	D	24.2	Very low	31.5	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	80%	0.795	S	S	*	*			trans	-44.9	176.6	140.8	-95	-65.5	0	0	0	115.4
253	P	42.4	Very low	31.2	Very low	113 Å²	113	131.1 Å²	131.1	73%	0.734	79%	0.792	S	S	*	*			cis	-136.9	-179.6	12.4	30.6	-6.2	0	0	0	118
254	R	26.4	Very low	30.9	Very low	228 Å²	228	131 Å²	131	86%	0.86	79%	0.786	S	S	*	*			trans	-12	167.5	141.8	-79.3	-173.6	-171.7	-169.8	4.2	119.4
255	P	47.3	Very low	31.1	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	79%	0.787	S	S	*	*			cis	-142.9	-162.7	-13.6	32.3	-7.4	0	0	0	115.3
256	L	24.9	Very low	31.5	Very low	164 Å²	164	130.3 Å²	130.3	86%	0.859	78%	0.78	S	S	*	*			trans	90.9	136.6	151	-70.5	166.1	0	0	0	121.5
257	N	33.1	Very low	32.1	Very low	154 Å²	154	133 Å²	133	82%	0.824	78%	0.783	S	S	*	*			trans	-61.4	153.7	158.1	-99.6	-4	0	0	0	110.6
258	P	36.4	Very low	32	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	78%	0.779	S	S	*	*				-151.1	-177.2	78.8	42	-23.2	0	0	0	117
259	S	29.1	Very low	31.3	Very low	113 Å²	113	132.1 Å²	132.1	79%	0.79	78%	0.779	S	S	*	*			trans	-72.6	136.4	175.8	52.2	0	0	0	0	115.2
260	A	25.8	Very low	31.4	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	79%	0.789	S	S	*	*			trans	-151.4	118.8	148.5	0	0	0	0	0	107.1
261	Y	26.9	Very low	31.4	Very low	217 Å²	217	137.2 Å²	137.2	85%	0.851	79%	0.789	S	S	*	*				65.9	123.4	81	-90.4	-67.4	0	0	0	115.9
262	S	25.6	Very low	31.2	Very low	92 Å²	92	135 Å²	135	64%	0.643	78%	0.784	S	S	*	*			trans	67.9	112.2	142.4	-61.3	0	0	0	0	121.4
263	S	25.8	Very low	31.4	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	78%	0.784	S	S	*	*				74.5	166.2	121.2	-50.2	0	0	0	0	118
264	T	27.7	Very low	31.4	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	78%	0.781	S	S	*	*			cis	-145.5	174.4	-0.6	-18.8	0	0	0	0	111
265	T	34.5	Very low	31.5	Very low	114 Å²	114	132.4 Å²	132.4	70%	0.699	78%	0.78	S	S	*	*			trans	-42.9	147.7	164.5	50.4	0	0	0	0	116.4
266	L	38.8	Very low	31	Very low	160 Å²	160	132.7 Å²	132.7	84%	0.838	79%	0.785	S	S	*	*			trans	22	134.6	136.1	-54.8	174.1	0	0	0	118.8
267	P	39.8	Very low	31.2	Very low	137 Å²	137	132.8 Å²	132.8	89%	0.89	78%	0.781	S	S	*	*				-137.3	-168.3	98.4	39.1	-28.1	0	0	0	114.1
268	A	31.8	Very low	30.9	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	79%	0.786	S	S	*	*			trans	-121.9	155.3	-156.1	0	0	0	0	0	116.1
269	V	31.3	Very low	31.1	Very low	131 Å²	131	136.1 Å²	136.1	79%	0.794	78%	0.779	S	S	*	*			trans	62.2	107.9	148.1	171.4	0	0	0	0	119
270	R	28.7	Very low	31.3	Very low	248 Å²	248	134.8 Å²	134.8	94%	0.936	77%	0.774	S	S	*	*				-166.9	175.4	117	-110.2	164	-172.8	174.8	2.8	114.6
271	A	29.3	Very low	31.9	Very low	97 Å²	97	135.9 Å²	135.9	80%	0.802	78%	0.777	S	S	*	*			trans	-70.1	174.4	-168.1	0	0	0	0	0	114.1
272	A	25.6	Very low	33.5	Very low	82 Å²	82	131.1 Å²	131.1	68%	0.678	77%	0.772	S	S	*	*			cis	-155.8	157.3	16.9	0	0	0	0	0	114.7
273	S	29.3	Very low	33.7	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	78%	0.783	S	S	*	*			trans	49.7	151.6	136.7	-68.6	0	0	0	0	123.2
274	P	42	Very low	34.4	Very low	102 Å²	102	132.6 Å²	132.6	66%	0.662	78%	0.782	S	S	*	*			cis	-141.9	-177.4	-23.1	39.4	-20.7	0	0	0	115.2
275	Y	28.3	Very low	34.7	Very low	218 Å²	218	133.6 Å²	133.6	86%	0.855	78%	0.781	S	S	*	*			trans	60.1	80.2	158.4	-73.4	-65	0	0	0	120.3
276	S	35.8	Very low	34.7	Very low	108 Å²	108	139.3 Å²	139.3	76%	0.755	79%	0.79	S	S	*	*				-70.4	145.1	120	-76.1	0	0	0	0	110.1
277	Q	30	Very low	34.6	Very low	167 Å²	167	142.5 Å²	142.5	78%	0.78	79%	0.791	S	S	*	*				166.1	141.7	120.8	-92.8	-169	35.2	0	0	113.6
278	R	26	Very low	34.1	Very low	249 Å²	249	141.3 Å²	141.3	94%	0.94	78%	0.776	S	S	*	*			trans	-150.8	134.5	130.2	-123.9	-178.4	-175.6	-157.8	-0.2	111.4
279	P	41.6	Very low	33.9	Very low	99 Å²	99	138.6 Å²	138.6	64%	0.643	76%	0.757	S	S	*	*			trans	-110.3	168.6	-174.7	40.7	-35.4	0	0	0	115.1
280	A	32.4	Very low	33.9	Very low	84 Å²	84	136.8 Å²	136.8	69%	0.694	75%	0.75	S	S	*	*			trans	47.1	118.4	145.8	0	0	0	0	0	122.3
281	S	38.5	Very low	34.1	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	74%	0.737	S	S	*	*				45.1	158.6	114.1	-50.3	0	0	0	0	122.5
282	P	59.9	Low	34.3	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	74%	0.735	S	S	*	*			cis	-136.1	-146.1	-35.1	40.6	-21.7	0	0	0	111.4
283	T	31.5	Very low	34.5	Very low	141 Å²	141	132.8 Å²	132.8	87%	0.865	74%	0.74	S	S	*	*			trans	108.5	157.4	165.4	-41.7	0	0	0	0	115.6
284	A	38.9	Very low	34.7	Very low	87 Å²	87	137.3 Å²	137.3	72%	0.719	74%	0.739	S	S	*	*			trans	-141.8	176.2	-158.1	0	0	0	0	0	115.7
285	I	33.7	Very low	34.2	Very low	147 Å²	147	140 Å²	140	75%	0.754	74%	0.743	S	S	*	*			trans	108.4	98.9	163.7	-58	179.5	0	0	0	117.2
286	R	34.8	Very low	34.2	Very low	234 Å²	234	135.9 Å²	135.9	88%	0.883	74%	0.741	S	S	*	*			trans	59.4	147.9	143.2	-61.8	174.4	-176.4	-176.6	0.1	120.9
287	R	38.3	Very low	34.1	Very low	226 Å²	226	135.8 Å²	135.8	85%	0.853	74%	0.74	S	S	*	*			cis	-172.9	161.8	-23	-168.1	-177.1	-116.9	-166.1	-1.2	108.8
288	I	28.5	Very low	34	Very low	112 Å²	112	135.1 Å²	135.1	57%	0.574	74%	0.742	S	S	*	*			trans	99.4	141.9	165.8	-57.4	172.3	0	0	0	114.7	Q305	I288-Q305 WeakPolarHBondContact O-CG 3.45Å
289	G	27.4	Very low	34.7	Very low	36 Å²	36	127.7 Å²	127.7	37%	0.371	73%	0.726	S	S	.	*			trans	135.4	137	166.8	0	0	0	0	0	118.2	T303 Q305	G289-T303 WeakPolarHBondContact CA-OG1 3.09Å; G289-Q305 VanDerWaalsContact CA-OE1 3.23Å
290	S	32	Very low	34.3	Very low	92 Å²	92	130.7 Å²	130.7	64%	0.643	74%	0.736	S	S	*	*			trans	-170.1	-170.6	-172.6	-167.4	0	0	0	0	114.1	T303	S290-T303 PolarHBondContact N-OG1 3.48Å; S290-T303 WeakPolarHBondContact O-CG2 3.21Å; S290-T303 PolarHBondContact O-OG1 3.4Å
291	V	31.9	Very low	34.3	Very low	110 Å²	110	130.2 Å²	130.2	67%	0.667	74%	0.74	S	S	*	*			trans	91.6	130.9	163.2	174.9	0	0	0	0	117.4	T303	V291-T303 HydrophobicContact CB-CG2 4.38Å; V291-T303 HydrophobicContact CG2-CG2 3.77Å
292	T	33.4	Very low	33.9	Very low	122 Å²	122	130.6 Å²	130.6	75%	0.748	74%	0.74	S	S	*	*			cis	-162.8	156.7	-15.3	28.6	0	0	0	0	112.6
293	S	30.6	Very low	32.6	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	72%	0.718	S	S	*	*	S	Bend	trans	-155.5	124.9	135.7	178.3	0	0	0	0	108.1
294	R	33.6	Very low	33.1	Very low	208 Å²	208	125.1 Å²	125.1	79%	0.785	71%	0.706	S	S	*	*			cis	-147	158.9	0.1	-120.7	-178	-177.3	-174.7	-0.1	109.7
295	Q	30.9	Very low	32.8	Very low	157 Å²	157	126.3 Å²	126.3	73%	0.734	70%	0.697	S	S	*	*			trans	10.7	134.8	147.7	-72.2	162.8	-35.7	0	0	119
296	T	29.2	Very low	32.6	Very low	133 Å²	133	128.9 Å²	128.9	82%	0.816	70%	0.698	S	S	*	*			cis	-161.4	152.6	0.6	34.9	0	0	0	0	105.9
297	S	31.8	Very low	32.4	Very low	106 Å²	106	124.7 Å²	124.7	74%	0.741	69%	0.689	S	S	*	*			cis	-156.4	131.2	22.3	45.7	0	0	0	0	108.7
298	N	29.2	Very low	32.1	Very low	152 Å²	152	119.2 Å²	119.2	81%	0.813	68%	0.68	S	S	*	*				70.5	137.8	81.1	-140.4	33.9	0	0	0	114.4
299	P	41.1	Very low	32.2	Very low	94 Å²	94	119.7 Å²	119.7	61%	0.61	69%	0.689	S	S	*	*			cis	-122.5	179.7	-1.4	45.2	-31.4	0	0	0	113
300	N	32	Very low	32.6	Very low	161 Å²	161	122.3 Å²	122.3	86%	0.861	71%	0.707	S	S	*	*			cis	-149.5	148.5	17	-92	-56.5	0	0	0	111.5
301	G	32.3	Very low	32.8	Very low	75 Å²	75	128.9 Å²	128.9	77%	0.773	72%	0.718	S	S	*	*			trans	112	148.3	155.4	0	0	0	0	0	118.9
302	P	31.9	Very low	32.8	Very low	121 Å²	121	130.6 Å²	130.6	79%	0.786	73%	0.728	S	S	*	*			trans	-126.7	-140	-154.1	43.3	-25.7	0	0	0	119.5
303	T	31.6	Very low	32.6	Very low	48 Å²	48	128.2 Å²	128.2	29%	0.294	73%	0.728	S	S	.	*			trans	-137.8	174.9	-145.7	-161.9	0	0	0	0	110.6	G289 S290 V291	G289-T303 WeakPolarHBondContact CA-OG1 3.09Å; S290-T303 PolarHBondContact N-OG1 3.48Å; S290-T303 WeakPolarHBondContact O-CG2 3.21Å; S290-T303 PolarHBondContact O-OG1 3.4Å; V291-T303 HydrophobicContact CB-CG2 4.38Å; V291-T303 HydrophobicContact CG2-CG2 3.77Å
304	P	43	Very low	32.8	Very low	95 Å²	95	128.6 Å²	128.6	62%	0.617	73%	0.73	S	S	*	*			cis	-138.3	-150.1	13.9	45.4	-22.9	0	0	0	116.2
305	Q	31.1	Very low	33.9	Very low	112 Å²	112	124 Å²	124	52%	0.523	73%	0.727	S	S	.	*			trans	-142.4	170.6	-175.1	-19.7	77.1	-101.8	0	0	113.5	I288 G289	I288-Q305 WeakPolarHBondContact O-CG 3.45Å; G289-Q305 VanDerWaalsContact CA-OE1 3.23Å
306	Y	29.7	Very low	34.1	Very low	200 Å²	200	124.4 Å²	124.4	78%	0.784	73%	0.734	S	S	*	*			trans	-178.6	-172.5	131.8	-115.8	-94.5	0	0	0	115.8
307	Q	31	Very low	34.1	Very low	147 Å²	147	125.1 Å²	125.1	69%	0.687	74%	0.738	S	S	*	*			trans	-85.9	-167.2	-163	-58.9	163.4	-16.8	0	0	114.6
308	T	31.6	Very low	34	Very low	110 Å²	110	127.3 Å²	127.3	68%	0.675	74%	0.741	S	S	*	*			cis	-168.1	167.5	24.1	-22	0	0	0	0	114.9
309	T	32	Very low	34.1	Very low	123 Å²	123	125.9 Å²	125.9	76%	0.755	74%	0.738	S	S	*	*			trans	63.4	98.2	150.5	41.5	0	0	0	0	124.9
310	A	35.9	Very low	33.5	Very low	91 Å²	91	128.5 Å²	128.5	75%	0.752	75%	0.746	S	S	*	*				78.7	128.5	102	0	0	0	0	0	125.7
311	R	34.8	Very low	33.4	Very low	230 Å²	230	124.3 Å²	124.3	87%	0.868	73%	0.734	S	S	*	*				107.6	124	123.3	-117.5	-177.5	-174.2	176.4	1.7	120.8
312	V	33	Very low	33.4	Very low	146 Å²	146	129.3 Å²	129.3	89%	0.885	74%	0.737	S	S	*	*			trans	51.7	148.6	160.4	-81.1	0	0	0	0	119.6
313	G	28.5	Very low	33.4	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	74%	0.735	S	S	*	*			cis	-174.2	162.6	-2.8	0	0	0	0	0	112.5
314	S	34.1	Very low	33.3	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	76%	0.763	S	S	*	*			trans	-76.3	-178.6	-176.9	-37.8	0	0	0	0	113.5
315	P	57.9	Low	32.6	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	77%	0.771	S	S	*	*			cis	-144.2	171.7	6.6	43.1	-23.3	0	0	0	119.5
316	L	33.6	Very low	32.5	Very low	166 Å²	166	139 Å²	139	87%	0.869	78%	0.784	S	S	*	*			trans	28.9	126.3	143.8	-62.8	169	0	0	0	123.2
317	T	31.1	Very low	32.6	Very low	148 Å²	148	135 Å²	135	91%	0.908	79%	0.785	S	S	*	*			trans	-147	172.5	145.9	47.9	0	0	0	0	111.6
318	L	28.9	Very low	33.5	Very low	153 Å²	153	133.9 Å²	133.9	80%	0.801	79%	0.791	S	S	*	*			trans	-123.1	147.7	-175.6	-92.7	160.2	0	0	0	111.5
319	T	30.8	Very low	33.3	Very low	122 Å²	122	133.5 Å²	133.5	75%	0.748	79%	0.792	S	S	*	*			trans	57.7	147.6	157.7	49.4	0	0	0	0	117.7
320	D	29.4	Very low	33.5	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	80%	0.801	S	S	*	*			cis	-161.1	176.6	12.4	-139.4	-37.4	0	0	0	112.5
321	A	30	Very low	33.4	Very low	73 Å²	73	136.5 Å²	136.5	60%	0.603	80%	0.802	S	S	*	*			trans	40.4	113.1	152.2	0	0	0	0	0	123.9
322	Q	31.4	Very low	33.2	Very low	180 Å²	180	134.5 Å²	134.5	84%	0.841	80%	0.803	S	S	*	*				45.1	142.4	120.1	-60.5	-177.9	2.1	0	0	121
323	T	31.8	Very low	33.1	Very low	119 Å²	119	134 Å²	134	73%	0.73	80%	0.8	S	S	*	*			cis	-172.6	174.1	37.1	-14.9	0	0	0	0	113
324	R	29.4	Very low	33.1	Very low	235 Å²	235	134.3 Å²	134.3	89%	0.887	80%	0.803	S	S	*	*			trans	82.9	149.5	165.8	-59.3	-176.8	179.9	170.1	0.1	117.9
325	V	29.1	Very low	32.9	Very low	129 Å²	129	133.9 Å²	133.9	78%	0.782	80%	0.8	S	S	*	*			cis	-160.3	149.3	-22	131.1	0	0	0	0	108.9
326	A	28.2	Very low	31.9	Very low	97 Å²	97	133.4 Å²	133.4	80%	0.802	80%	0.799	S	S	*	*			trans	69.1	160	165.6	0	0	0	0	0	120
327	S	31.5	Very low	31.6	Very low	115 Å²	115	131.4 Å²	131.4	80%	0.804	80%	0.799	S	S	*	*			trans	-140.6	-179.1	-164.1	-39.6	0	0	0	0	109.9
328	P	51.6	Low	32.8	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	79%	0.794	S	S	*	*			cis	-124.7	-160.4	-5.9	46.9	-31.2	0	0	0	110.8
329	S	27.3	Very low	32.7	Very low	102 Å²	102	133 Å²	133	71%	0.713	80%	0.8	S	S	*	*			cis	-155.3	148.1	4	58.5	0	0	0	0	111.3
330	Q	34.8	Very low	32.6	Very low	202 Å²	202	138.5 Å²	138.5	94%	0.944	81%	0.807	S	S	*	*			trans	174.5	160.2	137.9	-97.2	178.7	14.4	0	0	109.5
331	G	34.8	Very low	32.5	Very low	75 Å²	75	137 Å²	137	77%	0.773	81%	0.808	S	S	*	*			trans	-116.6	161.2	-160.3	0	0	0	0	0	116.8
332	Q	30.1	Very low	32.4	Very low	188 Å²	188	137.3 Å²	137.3	88%	0.879	82%	0.818	S	S	*	*			trans	-153.8	178.2	168.6	-125.4	-169	14.2	0	0	113
333	V	31.1	Very low	32.2	Very low	136 Å²	136	137 Å²	137	82%	0.824	82%	0.819	S	S	*	*			trans	-43.5	158	177.8	-75.8	0	0	0	0	117.2
334	G	27.5	Very low	32.1	Very low	79 Å²	79	137.8 Å²	137.8	81%	0.814	82%	0.824	S	S	*	*			trans	166.5	109.8	154	0	0	0	0	0	117.8
335	S	30.5	Very low	32	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	82%	0.817	S	S	*	*			trans	-58.7	146.6	174.5	-175.5	0	0	0	0	116.3
336	S	37.4	Very low	32.1	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	82%	0.819	S	S	*	*			trans	53.8	130.1	141.8	61.7	0	0	0	0	122.2
337	S	26.1	Very low	32.7	Very low	124 Å²	124	131.9 Å²	131.9	87%	0.867	82%	0.815	S	S	*	*			trans	-159.3	136.3	153.8	-82.5	0	0	0	0	111.9
338	P	56.6	Low	32.7	Very low	123 Å²	123	135.3 Å²	135.3	80%	0.799	82%	0.818	S	S	*	*			trans	-125.4	123.9	176.5	36.5	-22.9	0	0	0	115
339	K	26.8	Very low	31.7	Very low	212 Å²	212	138 Å²	138	92%	0.922	82%	0.82	S	S	*	*			trans	-148.2	127.6	160.4	-75.2	-165.1	178.5	176.8	0	113.8
340	R	29.4	Very low	31.8	Very low	237 Å²	237	141.7 Å²	141.7	89%	0.894	83%	0.831	S	S	*	*			trans	26.2	128	153.4	-81.3	-169.7	171.8	-154.8	-2	123.5
341	S	27.9	Very low	31.5	Very low	117 Å²	117	135.5 Å²	135.5	82%	0.818	82%	0.821	S	S	*	*				63.8	120.5	123.4	-53.5	0	0	0	0	122.5
342	G	27.9	Very low	31.9	Very low	79 Å²	79	137.9 Å²	137.9	81%	0.814	82%	0.823	S	S	*	*			trans	170.3	136	159.1	0	0	0	0	0	113.1
343	M	27.5	Very low	31.8	Very low	173 Å²	173	134.4 Å²	134.4	85%	0.852	82%	0.819	S	S	*	*			trans	-91.5	154.9	-178.1	-56.1	113.9	62.7	0	0	113.6
344	T	29.4	Very low	31.7	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	82%	0.819	S	S	*	*				163.4	159.3	117.8	38.7	0	0	0	0	114.3
345	A	26.9	Very low	31.7	Very low	90 Å²	90	140.1 Å²	140.1	74%	0.744	82%	0.82	S	S	*	*			trans	64.3	136.3	171.9	0	0	0	0	0	118.8
346	V	29.9	Very low	31.5	Very low	136 Å²	136	145.6 Å²	145.6	82%	0.824	82%	0.824	S	S	*	*			cis	85.8	128.6	9.2	-170.8	0	0	0	0	115.6
347	P	41.9	Very low	31	Very low	110 Å²	110	147.5 Å²	147.5	71%	0.714	83%	0.831	S	S	*	*			cis	-140.1	177.4	-29.9	39.6	-21	0	0	0	115.3
348	Q	31.5	Very low	31.1	Very low	187 Å²	187	146.8 Å²	146.8	87%	0.874	82%	0.822	S	S	*	*			trans	156.6	169.1	136.7	-84.3	-165	4	0	0	113
349	H	30.6	Very low	29.7	Very low	180 Å²	180	149.3 Å²	149.3	83%	0.833	82%	0.822	S	S	*	*			trans	-112.3	140.9	-157.3	-69.5	-108	0	0	0	116
350	L	28.6	Very low	29.7	Very low	181 Å²	181	146.3 Å²	146.3	95%	0.948	82%	0.816	S	S	*	*				-160.1	154.9	116.8	-125.4	68.4	0	0	0	109.5
351	G	29.9	Very low	29.5	Very low	72 Å²	72	143.3 Å²	143.3	74%	0.742	82%	0.815	S	S	*	*			trans	-104.1	-152.8	-171	0	0	0	0	0	114.8
352	P	41.7	Very low	29.4	Very low	124 Å²	124	147.4 Å²	147.4	81%	0.805	82%	0.821	S	S	*	*			cis	-139.7	-166.9	2.5	43.7	-25.6	0	0	0	115.7
353	S	27.8	Very low	29.4	Very low	115 Å²	115	151.7 Å²	151.7	80%	0.804	82%	0.819	S	S	*	*			trans	81.5	113.5	164.3	75.8	0	0	0	0	119.1
354	L	29.4	Very low	29.5	Very low	155 Å²	155	153.7 Å²	153.7	81%	0.812	82%	0.824	S	S	*	*			trans	-150.7	138.1	161.2	-117.7	176.5	0	0	0	111.2
355	Q	28.6	Very low	29.4	Very low	180 Å²	180	150.7 Å²	150.7	84%	0.841	82%	0.82	S	S	*	*			trans	-16.5	136.8	171.3	-61.3	162.1	2.1	0	0	119.8
356	R	26.7	Very low	29.5	Very low	226 Å²	226	154.8 Å²	154.8	85%	0.853	82%	0.824	S	S	*	*				174.1	134.6	99.7	179.3	-177	-70.9	-164.2	-2	111.1
357	T	25.9	Very low	29.5	Very low	140 Å²	140	155.7 Å²	155.7	86%	0.859	82%	0.819	S	S	*	*			trans	-138.2	155.3	168.5	-33.8	0	0	0	0	110.5
358	V	28.8	Very low	28.7	Very low	109 Å²	109	156.2 Å²	156.2	66%	0.661	81%	0.812	S	S	*	*			trans	-135.1	140.5	-177.1	169.8	0	0	0	0	109.6
359	H	27.6	Very low	28.5	Very low	176 Å²	176	156.7 Å²	156.7	82%	0.815	81%	0.807	S	S	*	*			trans	66.3	149.5	170.5	-78.8	-49.9	0	0	0	120.4
360	D	26.1	Very low	28.3	Very low	149 Å²	149	153 Å²	153	80%	0.797	79%	0.793	S	S	*	*			trans	-65.7	147.8	168.2	-51.9	-91.3	0	0	0	112.5
361	M	25	Very low	28.4	Very low	174 Å²	174	150 Å²	150	86%	0.857	78%	0.777	S	S	*	*				-167.1	120.6	118.3	-111.6	173.6	59.2	0	0	110.4
362	E	26.8	Very low	28.4	Very low	202 Å²	202	156.4 Å²	156.4	94%	0.944	78%	0.78	S	S	*	*			trans	-122.6	127.5	158.3	-78.5	-156.8	146.9	0	0	110.2
363	Q	26.7	Very low	27.7	Very low	169 Å²	169	156.3 Å²	156.3	79%	0.79	77%	0.769	S	S	*	*			trans	-142.9	119	167.1	-168.1	174.4	21.5	0	0	107.1
364	F	29.1	Very low	27.9	Very low	216 Å²	216	159.5 Å²	159.5	95%	0.947	76%	0.764	S	S	*	*			trans	8.8	116.2	171.5	-72.5	-94.7	0	0	0	118.3
365	G	27.8	Very low	27.8	Very low	73 Å²	73	159.2 Å²	159.2	75%	0.753	76%	0.76	S	S	*	*			trans	-107	-177.2	-178.1	0	0	0	0	0	116.6
366	Q	29.3	Very low	27.8	Very low	177 Å²	177	156.5 Å²	156.5	83%	0.827	76%	0.755	S	S	*	*			trans	64.3	136.9	163.7	-66.2	-168.5	11	0	0	117.4
367	Q	29.5	Very low	29.1	Very low	155 Å²	155	151 Å²	151	72%	0.724	75%	0.749	S	S	*	*			cis	-158.8	170.4	3.2	-101.2	165.9	56	0	0	106.1
368	Q	25.7	Very low	29.9	Very low	121 Å²	121	149.6 Å²	149.6	57%	0.565	74%	0.742	S	S	*	*			cis	-168.6	148.3	-22.9	170	160.2	-8.8	0	0	105.2	D370	Q368-D370 PolarHBondContact NE2-OD1 3.4Å
369	Y	26.4	Very low	29.8	Very low	197 Å²	197	155.8 Å²	155.8	77%	0.773	75%	0.754	S	S	*	*				-179.4	126.1	100.9	-100.2	-81.5	0	0	0	112
370	D	27.7	Very low	30.7	Very low	101 Å²	101	151.9 Å²	151.9	54%	0.54	74%	0.744	S	S	.	*			trans	48.5	115.6	136.2	-59.7	11.6	0	0	0	121.2	Q368	Q368-D370 PolarHBondContact NE2-OD1 3.4Å
371	I	30.4	Very low	30.7	Very low	120 Å²	120	151.8 Å²	151.8	62%	0.615	74%	0.744	S	S	*	*				73	120.1	96	-62.8	160.8	0	0	0	111.8
372	Y	28.9	Very low	30.8	Very low	206 Å²	206	148.7 Å²	148.7	81%	0.808	74%	0.739	S	S	*	*				-119.2	-119.5	53.2	-73.5	-93.2	0	0	0	119.1
373	E	28.4	Very low	30.9	Very low	122 Å²	122	146.4 Å²	146.4	57%	0.57	73%	0.732	S	S	*	*			trans	-154.1	-165.1	-139.6	-60.7	-177.6	70.6	0	0	113.5
374	R	31.8	Very low	30.9	Very low	182 Å²	182	144.7 Å²	144.7	69%	0.687	73%	0.734	S	S	*	*			cis	-164.6	172.8	12.5	-134.3	170.3	-129.4	-178.1	12.7	107.1
375	M	27.5	Very low	30.8	Very low	148 Å²	148	137.8 Å²	137.8	73%	0.729	72%	0.723	S	S	*	*			cis	-158.1	139.2	-1.5	-155.8	159.4	-167.8	0	0	111.8
376	V	27.7	Very low	30.7	Very low	123 Å²	123	142.2 Å²	142.2	75%	0.745	73%	0.729	S	S	*	*			trans	33.8	133.7	144	-176.2	0	0	0	0	123.3
377	P	53.7	Low	30.5	Very low	110 Å²	110	144.2 Å²	144.2	71%	0.714	73%	0.729	S	S	*	*			trans	-101.4	-170.1	174.5	44.1	-38.2	0	0	0	113.7
378	P	42.7	Very low	30.3	Very low	112 Å²	112	141.8 Å²	141.8	73%	0.727	73%	0.729	S	S	*	*				-163.8	147	90.4	41	-19.3	0	0	0	120.8
379	R	27.3	Very low	30.6	Very low	238 Å²	238	141.3 Å²	141.3	90%	0.898	74%	0.739	S	S	*	*			trans	56.5	-177	137.6	-73.5	-166.5	174.2	-178.1	-0.6	120.3
380	P	46.7	Very low	30.6	Very low	95 Å²	95	142.4 Å²	142.4	62%	0.617	74%	0.743	S	S	*	*				-140.5	-176.2	-67	45.9	-29.6	0	0	0	116.2
381	D	25.4	Very low	30.5	Very low	147 Å²	147	142.1 Å²	142.1	79%	0.786	76%	0.755	S	S	*	*			trans	67.4	139.5	145.3	-61	-31.2	0	0	0	124.9
382	S	27.3	Very low	30.4	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	75%	0.751	S	S	*	*			trans	97.1	139	134.4	-80.4	0	0	0	0	124.8
383	L	28.3	Very low	30.5	Very low	154 Å²	154	137.1 Å²	137.1	81%	0.806	75%	0.745	S	S	*	*			trans	84.6	150	147.8	-72.5	162.6	0	0	0	122.7
384	T	26.9	Very low	30.5	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	75%	0.754	S	S	*	*			trans	-15.1	147.1	164.4	52.8	0	0	0	0	117.7
385	G	26.3	Very low	30.3	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	75%	0.754	S	S	*	*			cis	130.3	178.7	28.7	0	0	0	0	0	109.8
386	L	26.7	Very low	30.4	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	76%	0.758	S	S	*	*			trans	72.2	137.1	174.3	-74.7	160.9	0	0	0	120.8
387	R	24.9	Very low	30.6	Very low	220 Å²	220	138 Å²	138	83%	0.83	76%	0.761	S	S	*	*			trans	54.2	121	142.3	-81.4	-177.3	170.4	-123.9	-0.9	123.7
388	S	24.9	Very low	29.4	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	76%	0.76	S	S	*	*				53.9	119.3	116	-53.6	0	0	0	0	122.2
389	S	32.6	Very low	28.8	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	77%	0.768	S	S	*	*			trans	-29.6	155.2	151.3	-27.5	0	0	0	0	118.2
390	Y	26.1	Very low	29	Very low	220 Å²	220	134.2 Å²	134.2	86%	0.863	76%	0.757	S	S	*	*				-170.8	129.9	124.7	-114.1	-70.7	0	0	0	115.5
391	A	26.2	Very low	28.4	Very low	96 Å²	96	138 Å²	138	79%	0.793	77%	0.771	S	S	*	*			trans	174.5	117.8	152.4	0	0	0	0	0	107.4
392	S	28.9	Very low	28.5	Very low	77 Å²	77	141.2 Å²	141.2	54%	0.538	77%	0.772	S	S	.	*			cis	79.4	139.3	15.6	-162.1	0	0	0	0	115.4
393	Q	29.9	Very low	28.5	Very low	143 Å²	143	141.6 Å²	141.6	67%	0.668	78%	0.775	S	S	*	*			cis	-93.8	-160.4	-2.5	-69.8	67.3	-108.6	0	0	110.4
394	H	28.8	Very low	28.6	Very low	164 Å²	164	138.7 Å²	138.7	76%	0.759	77%	0.773	S	S	*	*			cis	-139.2	164.4	5.6	-82.4	-83.8	0	0	0	108.1
395	S	28.4	Very low	28.6	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	77%	0.773	S	S	*	*			cis	77.6	122.7	36.1	-155.5	0	0	0	0	113.8
396	Q	29.3	Very low	28.8	Very low	172 Å²	172	141 Å²	141	80%	0.804	78%	0.778	S	S	*	*			cis	-113.9	-177.2	10.6	-54.4	179.7	4.3	0	0	110.6
397	L	31.2	Very low	29.8	Very low	157 Å²	157	138.9 Å²	138.9	82%	0.822	77%	0.774	S	S	*	*			cis	-150.7	175.1	15.4	-171.1	62.1	0	0	0	109.6
398	G	29.6	Very low	30.3	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	77%	0.773	S	S	*	*			trans	-73.5	-174.1	-179.2	0	0	0	0	0	116.2
399	Q	29.8	Very low	30.8	Very low	188 Å²	188	138.4 Å²	138.4	88%	0.879	78%	0.779	S	S	*	*			cis	-155.9	171.7	18.4	-154.2	162.3	-3	0	0	114.1
400	D	31	Very low	30.6	Very low	126 Å²	126	141.1 Å²	141.1	67%	0.674	78%	0.779	S	S	*	*			trans	-64.8	159	-163.2	-53.1	-103.3	0	0	0	119.3
401	L	32.8	Very low	30.7	Very low	175 Å²	175	138.6 Å²	138.6	92%	0.916	78%	0.778	S	S	*	*				-158.1	147.8	112.5	-107.8	167.6	0	0	0	113.6
402	R	28.1	Very low	30.8	Very low	215 Å²	215	140.2 Å²	140.2	81%	0.811	78%	0.779	S	S	*	*			trans	-94.3	173	174	-58.6	-176.2	-178.1	-173.1	1.1	109.2
403	S	28.1	Very low	31.3	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	79%	0.789	S	S	*	*			cis	-158.9	168.7	33.6	-66.2	0	0	0	0	112.8
404	A	29.7	Very low	31.3	Very low	93 Å²	93	143.9 Å²	143.9	77%	0.769	80%	0.802	S	S	*	*			trans	-88.1	166.6	167.4	0	0	0	0	0	112.3
405	V	28.3	Very low	31.2	Very low	135 Å²	135	145.6 Å²	145.6	82%	0.818	80%	0.803	S	S	*	*			trans	176.5	143.1	135.3	146.1	0	0	0	0	109.6
406	S	30.5	Very low	31.3	Very low	118 Å²	118	146.4 Å²	146.4	83%	0.825	80%	0.795	S	S	*	*			trans	-120.1	149.4	164.2	-57.9	0	0	0	0	109.4
407	P	46.8	Very low	31.3	Very low	120 Å²	120	142.2 Å²	142.2	78%	0.779	80%	0.798	S	S	*	*			trans	-138.8	153.8	136.8	37.1	-25.1	0	0	0	113.7
408	D	35.5	Very low	31.1	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	79%	0.789	S	S	*	*			trans	-81.3	157.7	165.9	-64.9	-71.7	0	0	0	111.8
409	L	34.6	Very low	31	Very low	161 Å²	161	145.9 Å²	145.9	84%	0.843	80%	0.795	S	S	*	*				173.5	160.3	123.7	-88.7	164.9	0	0	0	112.6
410	H	28	Very low	30.9	Very low	167 Å²	167	145.8 Å²	145.8	77%	0.773	79%	0.789	S	S	*	*			trans	-66.6	153.9	-162.7	-48.7	-95.6	0	0	0	118.2
411	I	28.7	Very low	30.5	Very low	167 Å²	167	150.2 Å²	150.2	86%	0.856	80%	0.797	S	S	*	*				-177.6	166.4	112.7	-91.7	160.1	0	0	0	110.7
412	T	28.4	Very low	30.1	Very low	130 Å²	130	147 Å²	147	80%	0.798	79%	0.789	S	S	*	*			trans	-103.4	-167.3	-165.9	58.9	0	0	0	0	113.7
413	P	39.2	Very low	30.2	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	78%	0.783	S	S	*	*				-118.3	164.7	-99.7	37	-19.9	0	0	0	115.4
414	I	30.6	Very low	30.1	Very low	181 Å²	181	142.8 Å²	142.8	93%	0.928	78%	0.784	S	S	*	*			trans	-127.7	162.5	172.4	-63.1	-177.7	0	0	0	110.1
415	Y	27.1	Very low	29.9	Very low	200 Å²	200	148.3 Å²	148.3	78%	0.784	79%	0.787	S	S	*	*			trans	-96.5	155.5	-144.1	-149.6	-112.4	0	0	0	117.3
416	E	29.5	Very low	29.8	Very low	116 Å²	116	153.8 Å²	153.8	54%	0.542	79%	0.792	S	S	.	*			trans	16.4	137.1	169.3	-75.6	-168.2	130.8	0	0	123.8	R418	E416-R418 IonicContact OE1-CZ 2.63Å; E416-R418 IonicContact OE1-NE 2.87Å; E416-R418 PolarHBondContact OE1-NE 3.27Å; E416-R418 IonicContact OE1-NH2 3.31Å; E416-R418 PolarHBondContact OE1-NH2 3.4Å
417	G	28.9	Very low	29.5	Very low	84 Å²	84	153.2 Å²	153.2	87%	0.866	79%	0.788	S	S	*	*			trans	-154	91.8	152.5	0	0	0	0	0	110.8
418	R	28.9	Very low	28.8	Very low	166 Å²	166	152.6 Å²	152.6	63%	0.626	78%	0.784	S	S	*	*			trans	-84.7	144.8	-177.2	-61.1	-174.1	-171.4	-164.3	4.8	112.7	E416	E416-R418 IonicContact OE1-CZ 2.63Å; E416-R418 IonicContact OE1-NE 2.87Å; E416-R418 PolarHBondContact OE1-NE 3.27Å; E416-R418 IonicContact OE1-NH2 3.31Å; E416-R418 PolarHBondContact OE1-NH2 3.4Å
419	T	26.9	Very low	28.3	Very low	135 Å²	135	152.5 Å²	152.5	83%	0.828	78%	0.784	S	S	*	*			trans	166.2	156.4	132	32.9	0	0	0	0	110.7
420	Y	27.2	Very low	28.1	Very low	187 Å²	187	154 Å²	154	73%	0.733	79%	0.786	S	S	*	*				-150.6	155.2	-53.9	-127.2	-77.5	0	0	0	107
421	Y	23.6	Very low	28	Very low	219 Å²	219	149.8 Å²	149.8	86%	0.859	79%	0.788	S	S	*	*			trans	-106.6	173.5	-176.9	-141.1	-92.4	0	0	0	112.1
422	S	24.4	Very low	28.1	Very low	106 Å²	106	148 Å²	148	74%	0.741	79%	0.785	S	S	*	*			trans	88.3	154.1	165.6	-141.9	0	0	0	0	116.1
423	P	29.9	Very low	28.1	Very low	104 Å²	104	149 Å²	149	68%	0.675	79%	0.791	S	S	*	*			cis	-120	156.9	-0.6	39.5	-26.2	0	0	0	115.8
424	V	26.1	Very low	27.6	Very low	139 Å²	139	151.7 Å²	151.7	84%	0.842	79%	0.793	S	S	*	*			trans	-89.5	130.2	164.1	173.8	0	0	0	0	109
425	Y	25.5	Very low	27.5	Very low	210 Å²	210	151.3 Å²	151.3	82%	0.824	79%	0.792	S	S	*	*			trans	-65.4	138.2	174.8	-91.8	-102.2	0	0	0	112
426	R	25.5	Very low	27.4	Very low	249 Å²	249	150.6 Å²	150.6	94%	0.94	80%	0.796	S	S	*	*			trans	-135.1	117.6	160.6	-133.4	-173.7	-165.2	-143	4.8	108.4
427	S	24.1	Very low	27.3	Very low	106 Å²	106	148.8 Å²	148.8	74%	0.741	81%	0.809	S	S	*	*			trans	-134	159.7	175.5	-84.5	0	0	0	0	110.1
428	P	31.8	Very low	27.3	Very low	107 Å²	107	149.5 Å²	149.5	70%	0.695	80%	0.8	S	S	*	*			trans	-109.2	165.8	-144.5	39.9	-35.4	0	0	0	114.7
429	N	25	Very low	27.3	Very low	152 Å²	152	149.3 Å²	149.3	81%	0.813	81%	0.807	S	S	*	*				-170.1	123	118.8	-98.4	-14.2	0	0	0	112.8
430	H	30	Very low	27.4	Very low	191 Å²	191	148.6 Å²	148.6	88%	0.884	80%	0.802	S	S	*	*			trans	-149.2	115.5	148.9	-114.5	-72.3	0	0	0	106.3
431	G	26.9	Very low	27.5	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.2	131.4	177.8	0	0	0	0	0	111.2
432	T	30.6	Very low	27.7	Very low	130 Å²	130	140 Å²	140	80%	0.798	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-102	143.7	173.1	46	0	0	0	0	111
433	V	28.5	Very low	27.8	Very low	150 Å²	150	144.3 Å²	144.3	91%	0.909	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.6	144.5	158.1	175.8	0	0	0	0	108.6
434	E	28.4	Very low	27.5	Very low	174 Å²	174	151.2 Å²	151.2	81%	0.813	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-79.6	149.2	-172.3	-55.4	176	122.6	0	0	113.6
435	L	28.2	Very low	27.6	Very low	174 Å²	174	150.9 Å²	150.9	91%	0.911	81%	0.807	S	S	*	*				-166.4	167.5	127.2	-105.5	160.1	0	0	0	111.1
436	Q	26.1	Very low	27.7	Very low	184 Å²	184	144 Å²	144	86%	0.86	80%	0.8	S	S	*	*			trans	-128.6	140.5	-141.9	-169.9	178	12.3	0	0	113.9
437	G	25.7	Very low	28	Very low	79 Å²	79	137.3 Å²	137.3	81%	0.814	79%	0.792	S	S	*	*			trans	-174.6	94.5	178.6	0	0	0	0	0	116
438	S	29.4	Very low	28.2	Very low	98 Å²	98	137.8 Å²	137.8	69%	0.685	79%	0.79	S	S	*	*			trans	-68.3	162.6	177.2	-64.5	0	0	0	0	114.5
439	Q	28.9	Very low	28	Very low	162 Å²	162	136.3 Å²	136.3	76%	0.757	79%	0.794	S	S	*	*			cis	-178.8	-179	-10.6	-109.9	-167.9	66.1	0	0	110
440	T	28.8	Very low	28.2	Very low	121 Å²	121	136.5 Å²	136.5	74%	0.742	79%	0.793	S	S	*	*			cis	-120.1	-98.9	-6.9	-45.5	0	0	0	0	111.5
441	A	29.2	Very low	28.2	Very low	83 Å²	83	130.5 Å²	130.5	69%	0.686	78%	0.783	S	S	*	*			cis	-161.8	162.3	-6.4	0	0	0	0	0	114.9
442	L	27.7	Very low	28.3	Very low	143 Å²	143	132.9 Å²	132.9	75%	0.749	78%	0.778	S	S	*	*			trans	58.8	81	162.9	-49.1	-168.8	0	0	0	123
443	Y	26.6	Very low	28.1	Very low	196 Å²	196	132.9 Å²	132.9	77%	0.769	77%	0.772	S	S	*	*				53.7	126.8	126.3	-54.8	-60.4	0	0	0	124.6
444	R	25.3	Very low	28.1	Very low	249 Å²	249	132 Å²	132	94%	0.94	76%	0.758	S	S	*	*				-161.3	169.3	88.1	-105.4	-173.8	-171	-120.6	-0	112.9
445	T	26.6	Very low	27.9	Very low	132 Å²	132	133.5 Å²	133.5	81%	0.81	76%	0.756	S	S	*	*			trans	-144.7	149.5	-155.4	-52.3	0	0	0	0	113.9
446	G	27.5	Very low	27.8	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	75%	0.745	S	S	*	*			trans	109.5	164.6	144.8	0	0	0	0	0	118.1
447	S	31.7	Very low	27.7	Very low	108 Å²	108	127 Å²	127	76%	0.755	74%	0.741	S	S	*	*			cis	-166.7	134.7	-19.3	-123.3	0	0	0	0	113.8
448	V	30	Very low	27.9	Very low	115 Å²	115	127.9 Å²	127.9	70%	0.697	74%	0.735	S	S	*	*			trans	50.2	123.9	130.8	-179.9	0	0	0	0	121.1	I450	V448-I450 HydrophobicContact CG1-CD1 3.64Å; V448-I450 HydrophobicContact CG1-CG1 3.81Å
449	G	27.6	Very low	27.9	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	74%	0.739	S	S	*	*			trans	-125.2	157.6	152.8	0	0	0	0	0	110.2
450	I	28.2	Very low	27.8	Very low	155 Å²	155	133.8 Å²	133.8	80%	0.795	74%	0.742	S	S	*	*			trans	-143.3	144.9	-162.9	-85.5	167.4	0	0	0	113.1	V448	V448-I450 HydrophobicContact CG1-CD1 3.64Å; V448-I450 HydrophobicContact CG1-CG1 3.81Å
451	G	30.2	Very low	27.8	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	74%	0.737	S	S	*	*			trans	129.6	141.8	154.8	0	0	0	0	0	116
452	N	28.3	Very low	27.8	Very low	130 Å²	130	134.2 Å²	134.2	70%	0.695	74%	0.74	S	S	*	*			cis	-165.6	134.7	-9.6	-120.5	-5.4	0	0	0	112.4
453	L	27.3	Very low	27.8	Very low	129 Å²	129	134.5 Å²	134.5	68%	0.675	74%	0.742	S	S	*	*			trans	59.9	170.2	160.6	-78.1	73	0	0	0	117.1
454	Q	27.8	Very low	28	Very low	133 Å²	133	130.8 Å²	130.8	62%	0.621	74%	0.739	S	S	*	*			cis	-164.6	163.8	-41.7	-104.8	-172.2	112.3	0	0	104.5
455	R	25.8	Very low	27.9	Very low	204 Å²	204	129.8 Å²	129.8	77%	0.77	74%	0.737	S	S	*	*			cis	-162.2	177.4	7.6	-111.6	-177.6	-162.3	174.7	7	105.1
456	T	25.6	Very low	27.9	Very low	112 Å²	112	132.1 Å²	132.1	69%	0.687	74%	0.739	S	S	*	*			cis	-161.8	160.7	-2	-0.1	0	0	0	0	107.9
457	S	24.1	Very low	27.8	Very low	109 Å²	109	140.4 Å²	140.4	76%	0.762	75%	0.75	S	S	*	*			trans	58.8	150.1	154.7	51.4	0	0	0	0	120.2
458	S	28.6	Very low	27.5	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	75%	0.751	S	S	*	*			cis	-173.4	145	-12.3	49.5	0	0	0	0	112.2
459	Q	30.3	Very low	27.4	Very low	168 Å²	168	143.8 Å²	143.8	79%	0.785	76%	0.755	S	S	*	*			trans	57.8	150.1	146.2	-67.5	-169.3	22.2	0	0	123.4
460	R	26.7	Very low	27.4	Very low	217 Å²	217	151.5 Å²	151.5	82%	0.819	76%	0.762	S	S	*	*			trans	73.3	92.9	153.3	-76.4	175.7	179.1	-127.1	-3.9	121.2
461	S	28.9	Very low	27.3	Very low	91 Å²	91	148.4 Å²	148.4	64%	0.636	76%	0.76	S	S	*	*				24.2	131.2	112.3	64	0	0	0	0	121.6
462	T	28.7	Very low	27.3	Very low	121 Å²	121	154 Å²	154	74%	0.742	77%	0.773	S	S	*	*			trans	69.2	135.2	135.3	56.8	0	0	0	0	122.8
463	L	27.6	Very low	27.2	Very low	150 Å²	150	155.1 Å²	155.1	79%	0.785	78%	0.779	S	S	*	*			trans	80.5	112.6	148.3	-72.5	164.4	0	0	0	120.8
464	T	30.6	Very low	27.2	Very low	117 Å²	117	154.9 Å²	154.9	72%	0.718	78%	0.783	S	S	*	*			trans	25.1	122	136.4	56.2	0	0	0	0	120
465	Y	23.6	Very low	27.2	Very low	228 Å²	228	154.3 Å²	154.3	89%	0.894	79%	0.789	S	S	*	*			trans	-147.1	136.4	144.5	-114	-78.9	0	0	0	112.2
466	Q	27.1	Very low	27.4	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	79%	0.787	S	S	*	*			trans	-78.2	148.3	158.4	-62.8	172.3	-49.8	0	0	109.1
467	R	24.8	Very low	27.5	Very low	240 Å²	240	149.2 Å²	149.2	91%	0.906	79%	0.79	S	S	*	*			trans	-155.5	142	150	-129.4	172.7	-171.6	162.4	4.1	113.6
468	N	25.6	Very low	27.7	Very low	148 Å²	148	154.6 Å²	154.6	79%	0.791	80%	0.795	S	S	*	*			trans	-87	155.9	173	-75.3	-28.2	0	0	0	111.8
469	N	27	Very low	27.6	Very low	146 Å²	146	154.2 Å²	154.2	78%	0.781	80%	0.798	S	S	*	*			trans	6.3	135.6	154	-58.1	-4.6	0	0	0	119.7
470	Y	27.7	Very low	27.3	Very low	238 Å²	238	155 Å²	155	93%	0.933	80%	0.802	S	S	*	*			trans	-112.9	150.9	133	-93.5	-93.1	0	0	0	109.2
471	A	27.5	Very low	28.1	Very low	90 Å²	90	149.6 Å²	149.6	74%	0.744	79%	0.794	S	S	*	*			trans	-122.3	149	177.9	0	0	0	0	0	110.7
472	L	29.6	Very low	28	Very low	183 Å²	183	155.8 Å²	155.8	96%	0.958	81%	0.805	S	S	*	*			trans	-131.7	152	163	-79.1	173.4	0	0	0	108.5
473	N	27.1	Very low	28	Very low	153 Å²	153	159.9 Å²	159.9	82%	0.818	81%	0.807	S	S	*	*			trans	-150.9	128.9	-160	-176.9	17.5	0	0	0	110.7
474	T	27.2	Very low	28.5	Very low	124 Å²	124	158.2 Å²	158.2	76%	0.761	81%	0.805	S	S	*	*			trans	-152.9	111.2	177.3	-2.3	0	0	0	0	114.3
475	T	27.9	Very low	28.4	Very low	121 Å²	121	158.5 Å²	158.5	74%	0.742	80%	0.801	S	S	*	*			trans	54.6	96.2	137.8	55.9	0	0	0	0	122.4
476	A	29.8	Very low	28.6	Very low	88 Å²	88	154.4 Å²	154.4	73%	0.727	79%	0.79	S	S	*	*				87.1	134.8	98.9	0	0	0	0	0	124.3
477	T	27.8	Very low	28.5	Very low	122 Å²	122	153.4 Å²	153.4	75%	0.748	78%	0.78	S	S	*	*			trans	103.1	132.7	134.9	5.1	0	0	0	0	123.5
478	Y	26.8	Very low	28.6	Very low	222 Å²	222	151.9 Å²	151.9	87%	0.871	77%	0.774	S	S	*	*			trans	95.2	128.4	149.1	-93	-74.5	0	0	0	123.9
479	A	27.1	Very low	28.5	Very low	90 Å²	90	150.1 Å²	150.1	74%	0.744	77%	0.768	S	S	*	*			trans	77.9	91.3	150.5	0	0	0	0	0	122.1
480	E	23.4	Very low	28.5	Very low	185 Å²	185	150.4 Å²	150.4	86%	0.864	77%	0.765	S	S	*	*			trans	-63.1	177.7	137.2	-94.4	-169.6	139.2	0	0	111.7
481	P	45	Very low	28.3	Very low	102 Å²	102	146 Å²	146	66%	0.662	75%	0.753	S	S	*	*			cis	-150.8	-179.2	30.6	30.9	-3.2	0	0	0	120.8
482	Y	25.4	Very low	28.2	Very low	221 Å²	221	146.9 Å²	146.9	87%	0.867	75%	0.752	S	S	*	*			trans	103	125	152.6	-77.5	-68.6	0	0	0	123.3
483	R	28.3	Very low	28	Very low	208 Å²	208	144.3 Å²	144.3	79%	0.785	74%	0.74	S	S	*	*			trans	-103	169.1	164.7	-63	178.7	165.6	-164.4	-2.1	110.7
484	P	39.4	Very low	28.1	Very low	115 Å²	115	146 Å²	146	75%	0.747	74%	0.736	S	S	*	*				-125.2	157.1	86.1	2	21.2	0	0	0	113.6
485	I	27.8	Very low	28.2	Very low	122 Å²	122	146.6 Å²	146.6	63%	0.626	73%	0.734	S	S	*	*				73.7	128.9	55.2	-85.2	166.9	0	0	0	111.6
486	Q	27.6	Very low	28.2	Very low	143 Å²	143	152.3 Å²	152.3	67%	0.668	74%	0.742	S	S	*	*			cis	-168.2	178	15.8	-131.8	167.6	13.5	0	0	114.7
487	Y	25.6	Very low	28.3	Very low	161 Å²	161	155.2 Å²	155.2	63%	0.631	75%	0.745	S	S	*	*			trans	95.9	114.2	143	-90.5	-57.9	0	0	0	126.3
488	R	26.5	Very low	28.2	Very low	207 Å²	207	157 Å²	157	78%	0.781	75%	0.745	S	S	*	*			trans	53.4	148.8	136.9	-90.1	177.4	-177.8	150	2.8	122.2
489	V	24.5	Very low	28.3	Very low	111 Å²	111	153.3 Å²	153.3	67%	0.673	74%	0.735	S	S	*	*			cis	171.3	160.9	-11	112.3	0	0	0	0	109.8
490	Q	25.6	Very low	28.3	Very low	152 Å²	152	154.8 Å²	154.8	71%	0.71	73%	0.734	S	S	*	*			trans	81.1	127.7	156.4	-94.9	166.8	-62.5	0	0	125
491	E	24.5	Very low	28.8	Very low	146 Å²	146	152.1 Å²	152.1	68%	0.682	73%	0.73	S	S	*	*			trans	72.6	102.9	134.7	-83	163.3	-139.5	0	0	124.6
492	C	25.8	Very low	27.8	Very low	108 Å²	108	153.2 Å²	153.2	73%	0.73	74%	0.74	S	S	*	*				63	134.1	108.1	-64.7	0	0	0	0	123.6
493	N	25.7	Very low	28.3	Very low	130 Å²	130	147 Å²	147	70%	0.695	74%	0.735	S	S	*	*				105.6	134	128.8	-87.5	-18.1	0	0	0	123.1
494	Y	27.3	Very low	28.4	Very low	189 Å²	189	145 Å²	145	74%	0.741	74%	0.74	S	S	*	*			trans	62.7	110.4	151.7	-68.7	-58.8	0	0	0	123.6
495	N	30.2	Very low	27.9	Very low	136 Å²	136	146 Å²	146	73%	0.727	74%	0.739	S	S	*	*				40.9	124.1	122.8	-65.4	-1.9	0	0	0	120.9
496	R	28.4	Very low	28.7	Very low	241 Å²	241	143.6 Å²	143.6	91%	0.909	74%	0.744	S	S	*	*			trans	-153.7	136.8	130.9	-146.1	166.1	-70.7	-129.9	-0.6	112.7
497	L	30.6	Very low	29	Very low	149 Å²	149	142.5 Å²	142.5	78%	0.78	75%	0.747	S	S	*	*			trans	-82.4	151.9	159.9	-77.5	70.8	0	0	0	108.6
498	Q	27.6	Very low	29.8	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	76%	0.758	S	S	*	*				173.5	155.6	110.7	-101.9	173.6	-56.8	0	0	115.8
499	H	28.1	Very low	30.1	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.667	76%	0.764	S	S	*	*			trans	68.2	98.1	150.8	-72.3	-58.3	0	0	0	123.4
500	V	26.3	Very low	30.5	Very low	120 Å²	120	142.7 Å²	142.7	73%	0.727	77%	0.766	S	S	*	*				62.3	108.1	102.6	173.7	0	0	0	0	119.7
501	V	34.1	Very low	31.3	Very low	129 Å²	129	141 Å²	141	78%	0.782	77%	0.768	S	S	*	*			trans	56.1	124.5	134.1	-176.1	0	0	0	0	120.8
502	S	24.7	Very low	31.8	Very low	125 Å²	125	137.3 Å²	137.3	87%	0.874	76%	0.759	S	S	*	*			trans	-151.3	160.9	137.1	-76.5	0	0	0	0	109
503	A	36.1	Very low	32.9	Very low	90 Å²	90	138.7 Å²	138.7	74%	0.744	76%	0.757	S	S	*	*			trans	-142.6	129.8	-173.9	0	0	0	0	0	112.2
504	D	30.7	Very low	33.7	Very low	167 Å²	167	138.5 Å²	138.5	89%	0.893	76%	0.756	S	S	*	*			trans	170.9	159.3	165.3	-102.6	-5.1	0	0	0	106.1
505	D	29	Very low	34.6	Very low	137 Å²	137	132.9 Å²	132.9	73%	0.733	75%	0.745	S	S	*	*			cis	-147.6	162.6	-12.4	175.1	33.2	0	0	0	107.6	T507	D505-T507 PolarHBondContact O-N 2.91Å
506	G	43.3	Very low	35.2	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	74%	0.743	S	S	*	*			trans	-77.4	99.1	-174	0	0	0	0	0	114.6
507	T	35.1	Very low	36	Very low	121 Å²	121	130.3 Å²	130.3	74%	0.742	74%	0.742	S	S	*	*			trans	-116.3	123.1	162.8	46.5	0	0	0	0	112.2	D505 R509	D505-T507 PolarHBondContact O-N 2.91Å; T507-R509 PolarHBondContact O-N 2.96Å
508	T	42.5	Very low	37	Very low	141 Å²	141	129.4 Å²	129.4	87%	0.865	73%	0.731	S	S	*	*			trans	-70.1	100	177	48.4	0	0	0	0	110.7	S510	T508-S510 PolarHBondContact O-N 3.22Å; T508-S510 VanDerWaalsContact O-N 3.09Å
509	R	32.1	Very low	37.8	Very low	239 Å²	239	124.7 Å²	124.7	90%	0.902	71%	0.712	S	S	*	*			trans	-71	99.9	163.9	-77.3	-170.8	174.5	-172	-1.4	109.8	T507	T507-R509 PolarHBondContact O-N 2.96Å
510	S	33.2	Very low	38.9	Very low	102 Å²	102	122.9 Å²	122.9	71%	0.713	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-52.4	135.3	154.5	-52.2	0	0	0	0	108.7	T508 S512	T508-S510 PolarHBondContact O-N 3.22Å; T508-S510 VanDerWaalsContact O-N 3.09Å; S510-S512 PolarHBondContact O-N 2.86Å
511	P	41.1	Very low	40.3	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-60.3	134	173.8	25.8	-33.2	0	0	0	109.1
512	S	36.6	Very low	41.2	Very low	69 Å²	69	126.9 Å²	126.9	48%	0.483	71%	0.706	S	S	.	*	P	Polyproline II helix	trans	-70.2	150	-175.1	79.8	0	0	0	0	111.4	S510 D514 S515	S510-S512 PolarHBondContact O-N 2.86Å; S512-D514 VanDerWaalsContact CB-OD2 3.31Å; S512-D514 WeakPolarHBondContact CB-OD2 3.43Å; S512-D514 PolarHBondContact O-N 3.08Å; S512-D514 VanDerWaalsContact O-N 3.07Å; S512-D514 PolarHBondContact OG-OD2 3.18Å; S512-S515 PolarHBondContact O-N 3.35Å; S512-S515 PolarHBondContact O-OG 2.81Å
513	I	48	Very low	42.4	Very low	136 Å²	136	127.7 Å²	127.7	70%	0.697	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-66.3	-13.4	-171.7	-151.4	162.1	0	0	0	112.9	S515 I516	I513-S515 PolarHBondContact O-N 3.43Å; I513-I516 HydrophobicContact CG1-CD1 3.67Å; I513-I516 WeakPolarHBondContact O-CB 3.48Å; I513-I516 WeakPolarHBondContact O-CG1 3.37Å; I513-I516 PolarHBondContact O-N 3.43Å
514	D	42.8	Very low	43.5	Very low	126 Å²	126	126.2 Å²	126.2	67%	0.674	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-67	-15.9	175.8	-40.8	-73.3	0	0	0	113.3	S512 I516	S512-D514 VanDerWaalsContact CB-OD2 3.31Å; S512-D514 WeakPolarHBondContact CB-OD2 3.43Å; S512-D514 PolarHBondContact O-N 3.08Å; S512-D514 VanDerWaalsContact O-N 3.07Å; S512-D514 PolarHBondContact OG-OD2 3.18Å; D514-I516 PolarHBondContact O-N 3.01Å
515	S	45.8	Very low	45.2	Very low	72 Å²	72	129.3 Å²	129.3	50%	0.503	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-69.4	-10.5	177	-53.6	0	0	0	0	113.5	S512 I513 Q517	S512-S515 PolarHBondContact O-N 3.35Å; S512-S515 PolarHBondContact O-OG 2.81Å; I513-S515 PolarHBondContact O-N 3.43Å; S515-Q517 VanDerWaalsContact C-N 3.3Å; S515-Q517 PolarHBondContact O-N 3.12Å
516	I	43.9	Very low	48	Very low	133 Å²	133	130.2 Å²	130.2	68%	0.682	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-78	-9.9	-173.1	-63	177.4	0	0	0	112.9	I513 D514	I513-I516 HydrophobicContact CG1-CD1 3.67Å; I513-I516 WeakPolarHBondContact O-CB 3.48Å; I513-I516 WeakPolarHBondContact O-CG1 3.37Å; I513-I516 PolarHBondContact O-N 3.43Å; D514-I516 PolarHBondContact O-N 3.01Å
517	Q	45.4	Very low	49.9	Very low	189 Å²	189	132.3 Å²	132.3	88%	0.883	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-101.7	18.4	179.9	-69.7	-167.4	-7.8	0	0	115.5	S515	S515-Q517 VanDerWaalsContact C-N 3.3Å; S515-Q517 PolarHBondContact O-N 3.12Å
518	K	50.3	Low	52.5	Low	130 Å²	130	128.2 Å²	128.2	57%	0.565	65%	0.645	S	S	*	*	S	Bend	trans	-96.5	147.8	163.9	-71.6	-166.9	169.5	-164.3	0	110.7	P520 F523	K518-P520 WeakPolarHBondContact O-CD 3.48Å; K518-F523 HydrophobicContact CB-CD2 4.49Å; K518-F523 HydrophobicContact CB-CE2 4.13Å; K518-F523 HydrophobicContact CD-CE2 3.99Å
519	D	44.2	Very low	54.8	Low	62 Å²	62	126.4 Å²	126.4	33%	0.332	63%	0.627	S	S	.	*			trans	-59.3	125.3	-178.3	-168.8	-47.1	0	0	0	109.5	R521 E522	D519-R521 PolarHBondContact O-N 3.35Å; D519-R521 VanDerWaalsContact OD1-CB 3.24Å; D519-R521 WeakPolarHBondContact OD1-CB 3.37Å; D519-R521 WeakPolarHBondContact OD1-CG 3.49Å; D519-R521 IonicContact OD1-CZ 3.97Å; D519-R521 PolarHBondContact OD1-N 3.19Å; D519-R521 IonicContact OD1-NE 2.88Å; D519-R521 PolarHBondContact OD1-NE 2.81Å; D519-R521 IonicContact OD1-NH2 3.18Å; D519-R521 IonicContact OD2-CZ 2.99Å; D519-R521 IonicContact OD2-NE 2.66Å; D519-R521 PolarHBondContact OD2-NE 2.77Å; D519-R521 IonicContact OD2-NH2 2.66Å; D519-R521 PolarHBondContact OD2-NH2 3.4Å; D519-E522 PolarHBondContact O-N 3.13Å
520	P	51.5	Low	57.8	Low	105 Å²	105	116.4 Å²	116.4	68%	0.682	59%	0.591	S	S	*	*	H	α-helix	trans	-52.3	-24.6	178.7	-29.4	36.3	0	0	0	113.9	K518 F523 A524	K518-P520 WeakPolarHBondContact O-CD 3.48Å; P520-F523 PolarHBondContact O-N 3.2Å; P520-A524 WeakPolarHBondContact O-CB 3.3Å; P520-A524 PolarHBondContact O-N 3.18Å; P520-A524 VanDerWaalsContact O-N 3.08Å
521	R	56.3	Low	60.8	Low	188 Å²	188	115 Å²	115	71%	0.709	58%	0.58	S	S	*	*	H	α-helix	trans	-74.1	-21.6	179.4	-64.1	169.8	-74.7	-164.3	1.2	114.2	D519	D519-R521 PolarHBondContact O-N 3.35Å; D519-R521 VanDerWaalsContact OD1-CB 3.24Å; D519-R521 WeakPolarHBondContact OD1-CB 3.37Å; D519-R521 WeakPolarHBondContact OD1-CG 3.49Å; D519-R521 IonicContact OD1-CZ 3.97Å; D519-R521 PolarHBondContact OD1-N 3.19Å; D519-R521 IonicContact OD1-NE 2.88Å; D519-R521 PolarHBondContact OD1-NE 2.81Å; D519-R521 IonicContact OD1-NH2 3.18Å; D519-R521 IonicContact OD2-CZ 2.99Å; D519-R521 IonicContact OD2-NE 2.66Å; D519-R521 PolarHBondContact OD2-NE 2.77Å; D519-R521 IonicContact OD2-NH2 2.66Å; D519-R521 PolarHBondContact OD2-NH2 3.4Å
522	E	51.8	Low	63.4	Low	145 Å²	145	113.4 Å²	113.4	68%	0.678	56%	0.562	S	S	*	*	H	α-helix	trans	-76.3	-26.4	173.6	-69.5	-166.9	150	0	0	112.6	D519	D519-E522 PolarHBondContact O-N 3.13Å
523	F	51.3	Low	66.3	Low	142 Å²	142	110.2 Å²	110.2	62%	0.623	54%	0.539	S	S	*	.	H	α-helix	trans	-94.8	-23.2	177.1	-84.6	-86.7	0	0	0	114	K518 P520 W525	K518-F523 HydrophobicContact CB-CD2 4.49Å; K518-F523 HydrophobicContact CB-CE2 4.13Å; K518-F523 HydrophobicContact CD-CE2 3.99Å; P520-F523 PolarHBondContact O-N 3.2Å; F523-W525 PolarHBondContact O-N 3.2Å; F523-W525 VanDerWaalsContact O-N 3.1Å
524	A	59.3	Low	68.6	Low	60 Å²	60	104.2 Å²	104.2	50%	0.496	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-18.6	-171	0	0	0	0	0	115.9	P520	P520-A524 WeakPolarHBondContact O-CB 3.3Å; P520-A524 PolarHBondContact O-N 3.18Å; P520-A524 VanDerWaalsContact O-N 3.08Å
525	W	66.6	Low	71.2	Confident	231 Å²	231	104.4 Å²	104.4	88%	0.875	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135	30.1	-171.1	-56.4	107.6	0	0	0	113.9	F523	F523-W525 PolarHBondContact O-N 3.2Å; F523-W525 VanDerWaalsContact O-N 3.1Å
526	R	86.4	Confident	73.7	Confident	157 Å²	157	104.2 Å²	104.2	59%	0.592	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-76.9	127.1	165.9	-170.6	-154.3	160.6	107.6	4.6	109.2	P528 E529	R526-P528 WeakPolarHBondContact O-CD 3.33Å; R526-E529 IonicContact NH2-OE1 2.68Å; R526-E529 PolarHBondContact NH2-OE1 3.11Å
527	D	83.1	Confident	76.2	Confident	114 Å²	114	98 Å²	98	61%	0.61	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-62.2	122.8	163.6	-79.3	-63.6	0	0	0	110.2	Y551	D527-Y551 PolarHBondContact OD1-OH 3.28Å
528	P	89.7	Confident	78.7	Confident	34 Å²	34	94.1 Å²	94.1	22%	0.221	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-73.4	140.8	177.8	29.2	-34.6	0	0	0	111.4	R526 E532 V533 M536 Y551	R526-P528 WeakPolarHBondContact O-CD 3.33Å; P528-E532 WeakPolarHBondContact CA-OE2 3.21Å; P528-E532 HydrophobicContact CB-CB 4.45Å; P528-V533 HydrophobicContact CB-CG2 3.85Å; P528-V533 HydrophobicContact CG-CG2 3.6Å; P528-M536 HydrophobicContact CB-CE 4.08Å; P528-Y551 HydrophobicContact CG-CD1 4.26Å; P528-Y551 HydrophobicContact CG-CE1 3.75Å
529	E	92.5	Very high	80.9	Confident	103 Å²	103	91.7 Å²	91.7	48%	0.481	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-66.3	147.7	179.2	-61.6	-64.7	159	0	0	110.8	R526 P531 E532 V533	R526-E529 IonicContact NH2-OE1 2.68Å; R526-E529 PolarHBondContact NH2-OE1 3.11Å; E529-P531 VanDerWaalsContact C-CD 3.41Å; E529-P531 VanDerWaalsContact C-N 3.32Å; E529-P531 VanDerWaalsContact O-N 3.12Å; E529-E532 HydrophobicContact CB-CG 4.02Å; E529-E532 PolarHBondContact N-OE2 2.82Å; E529-E532 WeakPolarHBondContact O-CA 3.38Å; E529-E532 VanDerWaalsContact O-CB 3.26Å; E529-E532 WeakPolarHBondContact O-CB 3.32Å; E529-E532 PolarHBondContact O-N 3.02Å; E529-V533 PolarHBondContact O-N 2.8Å; E529-V533 VanDerWaalsContact O-N 3.1Å
530	L	94.5	Very high	83.3	Confident	29 Å²	29	97.4 Å²	97.4	15%	0.152	46%	0.462	C	S	.	.	H	α-helix	trans	-53.3	-37.6	-174.5	-168.3	62.7	0	0	0	114.9	I534 L552 L555 V562 E565 V566 L569	L530-I534 HydrophobicContact CG-CD1 4.41Å; L530-I534 WeakPolarHBondContact O-CG1 3.42Å; L530-I534 PolarHBondContact O-N 2.83Å; L530-I534 VanDerWaalsContact O-N 3.16Å; L530-L552 HydrophobicContact CD1-CD2 3.5Å; L530-L555 HydrophobicContact CD1-CD1 4.06Å; L530-V562 HydrophobicContact CD1-CG1 4.39Å; L530-V562 HydrophobicContact CD2-CG1 4.24Å; L530-E565 HydrophobicContact CD2-CB 3.97Å; L530-E565 HydrophobicContact CD2-CG 3.66Å; L530-V566 HydrophobicContact CD1-CG2 3.81Å; L530-V566 HydrophobicContact CD2-CG2 3.99Å; L530-V566 HydrophobicContact CG-CG2 4.19Å; L530-L569 HydrophobicContact CD2-CD1 4.42Å; L530-L569 HydrophobicContact CG-CD1 4.33Å
531	P	96.4	Very high	85.5	Confident	73 Å²	73	98.4 Å²	98.4	47%	0.474	46%	0.456	S	S	.	.	H	α-helix	trans	-66.1	-34.4	171.9	-20.1	33.9	0	0	0	114	E529 I534 H535 L569	E529-P531 VanDerWaalsContact C-CD 3.41Å; E529-P531 VanDerWaalsContact C-N 3.32Å; E529-P531 VanDerWaalsContact O-N 3.12Å; P531-I534 PolarHBondContact O-N 3.3Å; P531-H535 PolarHBondContact O-N 3.24Å; P531-L569 HydrophobicContact CB-CD1 4.49Å; P531-L569 HydrophobicContact CG-CD1 4Å
532	E	95.6	Very high	87.4	Confident	84 Å²	84	91.8 Å²	91.8	39%	0.393	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-45.8	176.7	-59.3	170.3	179.6	0	0	110	P528 E529 I534 H535 M536	P528-E532 WeakPolarHBondContact CA-OE2 3.21Å; P528-E532 HydrophobicContact CB-CB 4.45Å; E529-E532 HydrophobicContact CB-CG 4.02Å; E529-E532 PolarHBondContact N-OE2 2.82Å; E529-E532 WeakPolarHBondContact O-CA 3.38Å; E529-E532 VanDerWaalsContact O-CB 3.26Å; E529-E532 WeakPolarHBondContact O-CB 3.32Å; E529-E532 PolarHBondContact O-N 3.02Å; E532-I534 VanDerWaalsContact C-N 3.32Å; E532-I534 PolarHBondContact O-N 3.34Å; E532-H535 CarbonylContact O-C 3.5Å; E532-H535 WeakPolarHBondContact O-CB 3.38Å; E532-H535 PolarHBondContact O-N 2.63Å; E532-H535 VanDerWaalsContact O-N 3.1Å; E532-M536 HydrophobicContact CB-CE 4.35Å; E532-M536 WeakPolarHBondContact O-CG 3.48Å; E532-M536 PolarHBondContact O-N 2.75Å
533	V	97	Very high	89.6	Confident	1 Å²	1	88.2 Å²	88.2	1%	0.006	43%	0.429	C	S	.	.	H	α-helix	trans	-60.5	-41.8	176.8	-172.7	0	0	0	0	111.4	P528 E529 H535 M536 L537 A548 Y551 L552	P528-V533 HydrophobicContact CB-CG2 3.85Å; P528-V533 HydrophobicContact CG-CG2 3.6Å; E529-V533 PolarHBondContact O-N 2.8Å; E529-V533 VanDerWaalsContact O-N 3.1Å; V533-H535 VanDerWaalsContact C-N 3.29Å; V533-H535 PolarHBondContact O-N 2.97Å; V533-M536 WeakPolarHBondContact O-CB 3.11Å; V533-M536 PolarHBondContact O-N 2.64Å; V533-L537 PolarHBondContact O-N 2.96Å; V533-A548 HydrophobicContact CG1-CB 4.05Å; V533-Y551 HydrophobicContact CG1-CD1 3.97Å; V533-Y551 HydrophobicContact CG2-CD1 3.69Å; V533-Y551 HydrophobicContact CG2-CE1 3.81Å; V533-L552 HydrophobicContact CB-CD2 4.2Å; V533-L552 HydrophobicContact CG1-CD1 4.3Å; V533-L552 HydrophobicContact CG1-CD2 3.71Å; V533-L552 HydrophobicContact CG1-CG 3.61Å
534	I	97	Very high	91.8	Very high	10 Å²	10	83.5 Å²	83.5	5%	0.051	41%	0.411	C	S	.	.	H	α-helix	trans	-65.3	-34.5	176.9	-70	170.1	0	0	0	111.2	L530 P531 E532 L537 L552 V566 L569	L530-I534 HydrophobicContact CG-CD1 4.41Å; L530-I534 WeakPolarHBondContact O-CG1 3.42Å; L530-I534 PolarHBondContact O-N 2.83Å; L530-I534 VanDerWaalsContact O-N 3.16Å; P531-I534 PolarHBondContact O-N 3.3Å; E532-I534 VanDerWaalsContact C-N 3.32Å; E532-I534 PolarHBondContact O-N 3.34Å; I534-L537 WeakPolarHBondContact O-CB 3.2Å; I534-L552 HydrophobicContact CG1-CD1 4.22Å; I534-L552 HydrophobicContact CG1-CD2 4.41Å; I534-V566 HydrophobicContact CD1-CB 4.44Å; I534-V566 HydrophobicContact CD1-CG1 4.27Å; I534-V566 HydrophobicContact CD1-CG2 4.36Å; I534-L569 HydrophobicContact CD1-CB 3.53Å; I534-L569 HydrophobicContact CD1-CD1 3.79Å; I534-L569 HydrophobicContact CD1-CG 4.32Å
535	H	97.1	Very high	93.6	Very high	130 Å²	130	81.7 Å²	81.7	60%	0.602	39%	0.393	S	S	*	.	H	α-helix	trans	-70.2	-37.4	172.5	-171.5	54.7	0	0	0	112.4	P531 E532 V533 L537 Q538	P531-H535 PolarHBondContact O-N 3.24Å; E532-H535 CarbonylContact O-C 3.5Å; E532-H535 WeakPolarHBondContact O-CB 3.38Å; E532-H535 PolarHBondContact O-N 2.63Å; E532-H535 VanDerWaalsContact O-N 3.1Å; V533-H535 VanDerWaalsContact C-N 3.29Å; V533-H535 PolarHBondContact O-N 2.97Å; H535-L537 PolarHBondContact O-N 3.17Å; H535-Q538 WeakPolarHBondContact O-CB 3.41Å; H535-Q538 PolarHBondContact O-N 2.82Å
536	M	97.3	Very high	95.1	Very high	69 Å²	69	70.7 Å²	70.7	34%	0.34	35%	0.351	S	S	.	.	H	α-helix	trans	-60.7	-23.9	176	-70.4	174.2	-166.7	0	0	113.5	P528 E532 V533 Q538 H539 V544 A548	P528-M536 HydrophobicContact CB-CE 4.08Å; E532-M536 HydrophobicContact CB-CE 4.35Å; E532-M536 WeakPolarHBondContact O-CG 3.48Å; E532-M536 PolarHBondContact O-N 2.75Å; V533-M536 WeakPolarHBondContact O-CB 3.11Å; V533-M536 PolarHBondContact O-N 2.64Å; M536-Q538 PolarHBondContact O-N 2.99Å; M536-H539 VanDerWaalsContact O-CB 3.26Å; M536-H539 WeakPolarHBondContact O-CB 3.4Å; M536-H539 PolarHBondContact O-N 3.48Å; M536-H539 VanDerWaalsContact O-N 3.09Å; M536-V544 HydrophobicContact CB-CG1 4Å; M536-V544 HydrophobicContact CG-CG1 4.27Å; M536-A548 HydrophobicContact CB-CB 3.64Å
537	L	97.5	Very high	95.6	Very high	2 Å²	2	68.2 Å²	68.2	1%	0.01	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26	169.8	-60.6	177.8	0	0	0	113	V533 I534 H535 Q545 A548 A549 L552 H574 L575 L578	V533-L537 PolarHBondContact O-N 2.96Å; I534-L537 WeakPolarHBondContact O-CB 3.2Å; H535-L537 PolarHBondContact O-N 3.17Å; L537-Q545 WeakPolarHBondContact O-CG 3.39Å; L537-Q545 PolarHBondContact O-NE2 2.97Å; L537-A548 HydrophobicContact CD2-CB 3.95Å; L537-A549 HydrophobicContact CD2-CB 4.02Å; L537-L552 HydrophobicContact CD1-CD1 3.77Å; L537-L552 HydrophobicContact CD2-CD1 4.16Å; L537-L552 HydrophobicContact CG-CD1 4.22Å; L537-H574 HydrophobicContact CB-CB 4.15Å; L537-H574 HydrophobicContact CD1-CB 3.8Å; L537-L575 HydrophobicContact CD1-CD2 3.81Å; L537-L575 HydrophobicContact CD1-CG 3.81Å; L537-L575 HydrophobicContact CD2-CD2 3.75Å; L537-L575 HydrophobicContact CG-CD2 4.45Å; L537-L578 HydrophobicContact CB-CD1 4.18Å; L537-L578 HydrophobicContact CD2-CD1 3.99Å
538	Q	96.8	Very high	96.3	Very high	108 Å²	108	63 Å²	63	51%	0.505	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	3.9	180	-51.7	-173.7	-80.7	0	0	112.9	H535 M536 H574	H535-Q538 WeakPolarHBondContact O-CB 3.41Å; H535-Q538 PolarHBondContact O-N 2.82Å; M536-Q538 PolarHBondContact O-N 2.99Å; Q538-H574 PolarHBondContact NE2-NE2 2.89Å
539	H	96.7	Very high	96.8	Very high	79 Å²	79	61.4 Å²	61.4	37%	0.366	31%	0.312	S	S	.	.			trans	-66.7	147.4	-176.1	-157.8	-84.7	0	0	0	112.7	M536 F541 V544 Q545	M536-H539 VanDerWaalsContact O-CB 3.26Å; M536-H539 WeakPolarHBondContact O-CB 3.4Å; M536-H539 PolarHBondContact O-N 3.48Å; M536-H539 VanDerWaalsContact O-N 3.09Å; H539-F541 AromaticContact CE1-CD2 3.32Å; H539-F541 WeakPolarHBondContact CE1-CD2 3.31Å; H539-F541 AromaticContact CE1-CE2 3.79Å; H539-F541 AromaticContact ND1-CD2 3.54Å; H539-F541 AromaticContact ND1-CG 3.82Å; H539-F541 PolarHBondContact ND1-N 3.27Å; H539-F541 PolarHBondContact O-N 3.34Å; H539-V544 HydrophobicContact CB-CB 3.97Å; H539-V544 HydrophobicContact CB-CG1 3.62Å; H539-Q545 VanDerWaalsContact O-CG 3.27Å; H539-Q545 WeakPolarHBondContact O-CG 3.12Å; H539-Q545 PolarHBondContact O-NE2 3.09Å
540	Q	95.7	Very high	97	Very high	181 Å²	181	58.2 Å²	58.2	85%	0.846	30%	0.303	S	S	*	.	S	Bend	trans	-67.3	-4.9	-179	-57.6	-177.1	36.1	0	0	114.7
541	F	96.7	Very high	97.2	Very high	126 Å²	126	59.7 Å²	59.7	55%	0.553	31%	0.307	S	S	*	.	S	Bend	trans	-113.4	117.1	-175.9	-64.9	-39.9	0	0	0	110.3	H539 S543 V544 Q545	H539-F541 AromaticContact CE1-CD2 3.32Å; H539-F541 WeakPolarHBondContact CE1-CD2 3.31Å; H539-F541 AromaticContact CE1-CE2 3.79Å; H539-F541 AromaticContact ND1-CD2 3.54Å; H539-F541 AromaticContact ND1-CG 3.82Å; H539-F541 PolarHBondContact ND1-N 3.27Å; H539-F541 PolarHBondContact O-N 3.34Å; F541-S543 PolarHBondContact O-N 3.42Å; F541-S543 VanDerWaalsContact O-N 3.11Å; F541-V544 HydrophobicContact CB-CB 4.37Å; F541-V544 HydrophobicContact CB-CG2 3.98Å; F541-V544 HydrophobicContact CD2-CG2 4.42Å; F541-V544 WeakPolarHBondContact O-CB 3.05Å; F541-V544 PolarHBondContact O-N 3.05Å; F541-Q545 PolarHBondContact O-N 3.03Å; F541-Q545 VanDerWaalsContact O-N 3.17Å
542	P	97	Very high	97.2	Very high	49 Å²	49	56.2 Å²	56.2	32%	0.318	29%	0.285	S	S	.	.	H	α-helix	trans	-54.3	-31.6	-179.7	-32.3	38.3	0	0	0	115.1	Q545 A546 V583 V586	P542-Q545 PolarHBondContact O-N 3.33Å; P542-A546 VanDerWaalsContact O-CB 3.26Å; P542-A546 WeakPolarHBondContact O-CB 2.89Å; P542-A546 PolarHBondContact O-N 3.23Å; P542-V583 HydrophobicContact CB-CB 4.34Å; P542-V583 HydrophobicContact CB-CG2 3.93Å; P542-V583 HydrophobicContact CG-CG2 4.12Å; P542-V586 HydrophobicContact CB-CG2 4Å; P542-V586 VanDerWaalsContact O-CG2 3.26Å; P542-V586 WeakPolarHBondContact O-CG2 3.13Å
543	S	97.1	Very high	97.3	Very high	71 Å²	71	55 Å²	55	50%	0.497	28%	0.279	S	S	.	.	H	α-helix	trans	-65	-40.9	175.3	48.5	0	0	0	0	112.7	F541 A546 N547	F541-S543 PolarHBondContact O-N 3.42Å; F541-S543 VanDerWaalsContact O-N 3.11Å; S543-A546 PolarHBondContact O-N 2.92Å; S543-N547 WeakPolarHBondContact O-CB 3.35Å; S543-N547 VanDerWaalsContact O-CG 3.28Å; S543-N547 PolarHBondContact O-N 3.01Å; S543-N547 PolarHBondContact O-ND2 3.29Å
544	V	97.1	Very high	97.3	Very high	42 Å²	42	61.4 Å²	61.4	26%	0.255	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-42.8	175.2	178.7	0	0	0	0	110.1	M536 H539 F541 N547 A548	M536-V544 HydrophobicContact CB-CG1 4Å; M536-V544 HydrophobicContact CG-CG1 4.27Å; H539-V544 HydrophobicContact CB-CB 3.97Å; H539-V544 HydrophobicContact CB-CG1 3.62Å; F541-V544 HydrophobicContact CB-CB 4.37Å; F541-V544 HydrophobicContact CB-CG2 3.98Å; F541-V544 HydrophobicContact CD2-CG2 4.42Å; F541-V544 WeakPolarHBondContact O-CB 3.05Å; F541-V544 PolarHBondContact O-N 3.05Å; V544-N547 PolarHBondContact O-N 3.28Å; V544-A548 VanDerWaalsContact O-CB 3.25Å; V544-A548 WeakPolarHBondContact O-CB 3.26Å; V544-A548 PolarHBondContact O-N 2.93Å
545	Q	98.1	Very high	97.2	Very high	22 Å²	22	63.3 Å²	63.3	10%	0.103	32%	0.318	C	S	.	.	H	α-helix	trans	-64.1	-43	176.7	-58	-179.5	-62.8	0	0	112.2	L537 H539 F541 P542 A549 L578 V586	L537-Q545 WeakPolarHBondContact O-CG 3.39Å; L537-Q545 PolarHBondContact O-NE2 2.97Å; H539-Q545 VanDerWaalsContact O-CG 3.27Å; H539-Q545 WeakPolarHBondContact O-CG 3.12Å; H539-Q545 PolarHBondContact O-NE2 3.09Å; F541-Q545 PolarHBondContact O-N 3.03Å; F541-Q545 VanDerWaalsContact O-N 3.17Å; P542-Q545 PolarHBondContact O-N 3.33Å; Q545-A549 VanDerWaalsContact O-CB 3.29Å; Q545-A549 WeakPolarHBondContact O-CB 3.33Å; Q545-A549 PolarHBondContact O-N 2.9Å; Q545-L578 HydrophobicContact CB-CD2 4.5Å; Q545-V586 HydrophobicContact CB-CG1 4.26Å; Q545-V586 HydrophobicContact CB-CG2 4.36Å
546	A	97.9	Very high	97.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-45.1	177.3	0	0	0	0	0	111.9	P542 S543 A549 A550 E585 V586 N589	P542-A546 VanDerWaalsContact O-CB 3.26Å; P542-A546 WeakPolarHBondContact O-CB 2.89Å; P542-A546 PolarHBondContact O-N 3.23Å; S543-A546 PolarHBondContact O-N 2.92Å; A546-A549 PolarHBondContact O-N 3.15Å; A546-A550 WeakPolarHBondContact O-CB 3.5Å; A546-A550 PolarHBondContact O-N 3.32Å; A546-E585 HydrophobicContact CB-CG 4.05Å; A546-V586 HydrophobicContact CB-CG2 3.96Å; A546-N589 PolarHBondContact O-ND2 2.63Å
547	N	97.4	Very high	96.9	Very high	106 Å²	106	61.2 Å²	61.2	57%	0.567	31%	0.306	S	S	*	.	H	α-helix	trans	-66.9	-44.7	177.8	-74.8	-24.2	0	0	0	111.9	S543 V544 A549 A550 Y551	S543-N547 WeakPolarHBondContact O-CB 3.35Å; S543-N547 VanDerWaalsContact O-CG 3.28Å; S543-N547 PolarHBondContact O-N 3.01Å; S543-N547 PolarHBondContact O-ND2 3.29Å; V544-N547 PolarHBondContact O-N 3.28Å; N547-A549 VanDerWaalsContact C-N 3.34Å; N547-A549 PolarHBondContact O-N 3.12Å; N547-A550 PolarHBondContact O-N 2.72Å; N547-Y551 WeakPolarHBondContact O-CB 3.4Å; N547-Y551 PolarHBondContact O-N 3.04Å
548	A	98.1	Very high	96.4	Very high	5 Å²	5	64 Å²	64	4%	0.041	34%	0.335	C	S	.	.	H	α-helix	trans	-61.6	-41.3	176.1	0	0	0	0	0	112	V533 M536 L537 V544 Y551 L552	V533-A548 HydrophobicContact CG1-CB 4.05Å; M536-A548 HydrophobicContact CB-CB 3.64Å; L537-A548 HydrophobicContact CD2-CB 3.95Å; V544-A548 VanDerWaalsContact O-CB 3.25Å; V544-A548 WeakPolarHBondContact O-CB 3.26Å; V544-A548 PolarHBondContact O-N 2.93Å; A548-Y551 PolarHBondContact O-N 3.48Å; A548-L552 WeakPolarHBondContact O-CG 3.43Å; A548-L552 PolarHBondContact O-N 3.36Å
549	A	98.4	Very high	96.3	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-41.1	174.5	0	0	0	0	0	112.5	L537 Q545 A546 N547 L552 Q553 L575 N589 A590	L537-A549 HydrophobicContact CD2-CB 4.02Å; Q545-A549 VanDerWaalsContact O-CB 3.29Å; Q545-A549 WeakPolarHBondContact O-CB 3.33Å; Q545-A549 PolarHBondContact O-N 2.9Å; A546-A549 PolarHBondContact O-N 3.15Å; N547-A549 VanDerWaalsContact C-N 3.34Å; N547-A549 PolarHBondContact O-N 3.12Å; A549-L552 PolarHBondContact O-N 3.28Å; A549-Q553 WeakPolarHBondContact O-CB 3.48Å; A549-Q553 PolarHBondContact O-N 3.46Å; A549-L575 HydrophobicContact CB-CD2 4.07Å; A549-N589 HydrophobicContact CB-CB 3.81Å; A549-A590 HydrophobicContact CB-CB 4.45Å
550	A	98.1	Very high	96.2	Very high	35 Å²	35	61.5 Å²	61.5	29%	0.289	33%	0.328	S	S	.	.	H	α-helix	trans	-65.5	-39.2	175.5	0	0	0	0	0	112.5	A546 N547 Q553 H554 N589	A546-A550 WeakPolarHBondContact O-CB 3.5Å; A546-A550 PolarHBondContact O-N 3.32Å; N547-A550 PolarHBondContact O-N 2.72Å; A550-Q553 WeakPolarHBondContact O-CB 3.47Å; A550-Q553 PolarHBondContact O-N 2.8Å; A550-H554 PolarHBondContact O-N 2.93Å; A550-N589 HydrophobicContact CB-CB 4.35Å
551	Y	97.4	Very high	96.1	Very high	60 Å²	60	61.2 Å²	61.2	24%	0.235	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-43.6	175.6	-168.9	-108.5	0	0	0	111.1	D527 P528 V533 N547 A548 Q553 H554 L555	D527-Y551 PolarHBondContact OD1-OH 3.28Å; P528-Y551 HydrophobicContact CG-CD1 4.26Å; P528-Y551 HydrophobicContact CG-CE1 3.75Å; V533-Y551 HydrophobicContact CG1-CD1 3.97Å; V533-Y551 HydrophobicContact CG2-CD1 3.69Å; V533-Y551 HydrophobicContact CG2-CE1 3.81Å; N547-Y551 WeakPolarHBondContact O-CB 3.4Å; N547-Y551 PolarHBondContact O-N 3.04Å; A548-Y551 PolarHBondContact O-N 3.48Å; Y551-Q553 VanDerWaalsContact C-N 3.32Å; Y551-Q553 PolarHBondContact O-N 3.15Å; Y551-H554 PolarHBondContact O-N 2.84Å; Y551-L555 HydrophobicContact CD1-CD1 3.76Å; Y551-L555 HydrophobicContact CD1-CG 4.2Å; Y551-L555 HydrophobicContact CE1-CD1 3.47Å; Y551-L555 VanDerWaalsContact CE1-CD1 3.47Å; Y551-L555 HydrophobicContact CE1-CD2 4.45Å; Y551-L555 HydrophobicContact CE1-CG 4.06Å; Y551-L555 WeakPolarHBondContact O-CG 3.44Å; Y551-L555 PolarHBondContact O-N 3.15Å
552	L	97.6	Very high	96.1	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-38.2	170.3	-70.3	-179.4	0	0	0	112.7	L530 V533 I534 L537 A548 A549 H554 C556 V566 L575 A593	L530-L552 HydrophobicContact CD1-CD2 3.5Å; V533-L552 HydrophobicContact CB-CD2 4.2Å; V533-L552 HydrophobicContact CG1-CD1 4.3Å; V533-L552 HydrophobicContact CG1-CD2 3.71Å; V533-L552 HydrophobicContact CG1-CG 3.61Å; I534-L552 HydrophobicContact CG1-CD1 4.22Å; I534-L552 HydrophobicContact CG1-CD2 4.41Å; L537-L552 HydrophobicContact CD1-CD1 3.77Å; L537-L552 HydrophobicContact CD2-CD1 4.16Å; L537-L552 HydrophobicContact CG-CD1 4.22Å; A548-L552 WeakPolarHBondContact O-CG 3.43Å; A548-L552 PolarHBondContact O-N 3.36Å; A549-L552 PolarHBondContact O-N 3.28Å; L552-H554 VanDerWaalsContact C-N 3.31Å; L552-H554 PolarHBondContact O-N 3.39Å; L552-C556 WeakPolarHBondContact O-CB 3.26Å; L552-C556 PolarHBondContact O-N 3.4Å; L552-C556 PolarHBondContact O-SG 2.9Å; L552-V566 HydrophobicContact CD2-CG2 4.05Å; L552-L575 HydrophobicContact CD1-CD1 4.29Å; L552-L575 HydrophobicContact CD1-CD2 4.41Å; L552-A593 HydrophobicContact CB-CB 4.4Å
553	Q	97.3	Very high	96.1	Very high	59 Å²	59	54.7 Å²	54.7	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-60.9	-41.3	174.9	-178.1	177.1	-10.6	0	0	111.6	A549 A550 Y551 F557 G592 A593 N596	A549-Q553 WeakPolarHBondContact O-CB 3.48Å; A549-Q553 PolarHBondContact O-N 3.46Å; A550-Q553 WeakPolarHBondContact O-CB 3.47Å; A550-Q553 PolarHBondContact O-N 2.8Å; Y551-Q553 VanDerWaalsContact C-N 3.32Å; Y551-Q553 PolarHBondContact O-N 3.15Å; Q553-F557 PolarHBondContact O-N 3.24Å; Q553-G592 VanDerWaalsContact CD-C 3.46Å; Q553-A593 HydrophobicContact CB-CB 3.97Å; Q553-N596 PolarHBondContact O-ND2 2.73Å
554	H	96.6	Very high	96	Very high	135 Å²	135	54.2 Å²	54.2	63%	0.625	28%	0.283	S	S	*	.	H	α-helix	trans	-67.2	-52.9	175.3	178.8	66	0	0	0	112	A550 Y551 L552 C556 F557	A550-H554 PolarHBondContact O-N 2.93Å; Y551-H554 PolarHBondContact O-N 2.84Å; L552-H554 VanDerWaalsContact C-N 3.31Å; L552-H554 PolarHBondContact O-N 3.39Å; H554-C556 PolarHBondContact O-N 3.27Å; H554-F557 WeakPolarHBondContact O-CB 3.44Å; H554-F557 PolarHBondContact O-N 2.89Å
555	L	95.1	Very high	96	Very high	50 Å²	50	55.2 Å²	55.2	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-28.7	179.7	-65.4	-177.2	0	0	0	113.1	L530 Y551 F557 V562	L530-L555 HydrophobicContact CD1-CD1 4.06Å; Y551-L555 HydrophobicContact CD1-CD1 3.76Å; Y551-L555 HydrophobicContact CD1-CG 4.2Å; Y551-L555 HydrophobicContact CE1-CD1 3.47Å; Y551-L555 VanDerWaalsContact CE1-CD1 3.47Å; Y551-L555 HydrophobicContact CE1-CD2 4.45Å; Y551-L555 HydrophobicContact CE1-CG 4.06Å; Y551-L555 WeakPolarHBondContact O-CG 3.44Å; Y551-L555 PolarHBondContact O-N 3.15Å; L555-F557 VanDerWaalsContact C-N 3.3Å; L555-V562 HydrophobicContact CB-CG1 3.96Å
556	C	95.2	Very high	95.9	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.007	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	3.5	174.7	-64.7	0	0	0	0	113.9	L552 H554 K563 N596 L597	L552-C556 WeakPolarHBondContact O-CB 3.26Å; L552-C556 PolarHBondContact O-N 3.4Å; L552-C556 PolarHBondContact O-SG 2.9Å; H554-C556 PolarHBondContact O-N 3.27Å; C556-K563 HydrophobicContact CB-CG 3.88Å; C556-K563 WeakPolarHBondContact O-CE 3.24Å; C556-N596 HydrophobicContact CB-CB 4.01Å; C556-L597 HydrophobicContact CB-CD2 4.44Å; C556-L597 HydrophobicContact CB-CG 4.36Å; C556-L597 WeakPolarHBondContact SG-CD2 3.32Å
557	F	93.6	Very high	95.9	Very high	155 Å²	155	55.5 Å²	55.5	68%	0.68	29%	0.289	S	S	*	.	S	Bend	trans	-83.4	123.4	175.1	-170.5	-99.4	0	0	0	110.2	Q553 H554 L555 D559	Q553-F557 PolarHBondContact O-N 3.24Å; H554-F557 WeakPolarHBondContact O-CB 3.44Å; H554-F557 PolarHBondContact O-N 2.89Å; L555-F557 VanDerWaalsContact C-N 3.3Å; F557-D559 PolarHBondContact O-N 3.17Å
558	G	87.4	Confident	95.8	Very high	59 Å²	59	58.8 Å²	58.8	61%	0.608	29%	0.294	S	S	*	.	S	Bend	trans	74.1	-52.6	-176	0	0	0	0	0	114.6	N560	G558-N560 PolarHBondContact O-N 3.34Å
559	D	93.3	Very high	95.8	Very high	69 Å²	69	60.9 Å²	60.9	37%	0.369	30%	0.304	S	S	.	.			trans	-70.9	120.9	-173.6	-165.2	-52.8	0	0	0	112.4	F557 K561 V562 K563	F557-D559 PolarHBondContact O-N 3.17Å; D559-K561 VanDerWaalsContact OD1-CA 3.3Å; D559-K561 WeakPolarHBondContact OD1-CA 3.4Å; D559-K561 VanDerWaalsContact OD1-CB 3.3Å; D559-K561 WeakPolarHBondContact OD1-CB 3.44Å; D559-K561 PolarHBondContact OD1-N 3.37Å; D559-V562 HydrophobicContact CB-CB 4.24Å; D559-V562 HydrophobicContact CB-CG2 4.08Å; D559-V562 PolarHBondContact OD1-N 3.03Å; D559-K563 WeakPolarHBondContact O-CE 3.49Å; D559-K563 VanDerWaalsContact O-CG 3.25Å; D559-K563 WeakPolarHBondContact O-CG 3.46Å
560	N	94.5	Very high	95.7	Very high	66 Å²	66	62.2 Å²	62.2	35%	0.353	32%	0.318	S	S	.	.	H	α-helix	trans	-89.1	-22.1	176.8	-69.4	-42.5	0	0	0	113.8	G558 K563 M564 S602	G558-N560 PolarHBondContact O-N 3.34Å; N560-K563 PolarHBondContact OD1-NZ 3Å; N560-M564 VanDerWaalsContact O-CG 3.26Å; N560-M564 WeakPolarHBondContact O-CG 3.48Å; N560-M564 PolarHBondContact O-N 2.98Å; N560-S602 PolarHBondContact ND2-OG 2.84Å
561	K	94.8	Very high	95.7	Very high	176 Å²	176	60.6 Å²	60.6	77%	0.765	31%	0.305	S	S	*	.	H	α-helix	trans	-68.3	-48	175	-60.7	176.5	-179.6	174.6	0	110.1	D559 K563 M564 E565	D559-K561 VanDerWaalsContact OD1-CA 3.3Å; D559-K561 WeakPolarHBondContact OD1-CA 3.4Å; D559-K561 VanDerWaalsContact OD1-CB 3.3Å; D559-K561 WeakPolarHBondContact OD1-CB 3.44Å; D559-K561 PolarHBondContact OD1-N 3.37Å; K561-K563 VanDerWaalsContact C-N 3.32Å; K561-K563 PolarHBondContact O-N 3.16Å; K561-M564 PolarHBondContact O-N 2.99Å; K561-E565 PolarHBondContact O-N 3.04Å
562	V	95.9	Very high	95.7	Very high	32 Å²	32	57.9 Å²	57.9	19%	0.194	29%	0.294	C	S	.	.	H	α-helix	trans	-57.2	-46.8	175.8	174.3	0	0	0	0	110.5	L530 L555 D559 M564 E565 V566	L530-V562 HydrophobicContact CD1-CG1 4.39Å; L530-V562 HydrophobicContact CD2-CG1 4.24Å; L555-V562 HydrophobicContact CB-CG1 3.96Å; D559-V562 HydrophobicContact CB-CB 4.24Å; D559-V562 HydrophobicContact CB-CG2 4.08Å; D559-V562 PolarHBondContact OD1-N 3.03Å; V562-M564 VanDerWaalsContact C-N 3.3Å; V562-M564 PolarHBondContact O-N 3.1Å; V562-E565 PolarHBondContact O-N 2.97Å; V562-E565 VanDerWaalsContact O-N 3.15Å; V562-V566 HydrophobicContact CG1-CG2 4.25Å; V562-V566 WeakPolarHBondContact O-CG2 3.44Å; V562-V566 PolarHBondContact O-N 3.13Å
563	K	96.6	Very high	95.7	Very high	5 Å²	5	62.6 Å²	62.6	2%	0.022	32%	0.315	C	S	.	.	H	α-helix	trans	-56.6	-42.5	177.4	-70.5	175	-158	166	0	112.9	C556 D559 N560 K561 C567 N596 L597 F599 T603 N606	C556-K563 HydrophobicContact CB-CG 3.88Å; C556-K563 WeakPolarHBondContact O-CE 3.24Å; D559-K563 WeakPolarHBondContact O-CE 3.49Å; D559-K563 VanDerWaalsContact O-CG 3.25Å; D559-K563 WeakPolarHBondContact O-CG 3.46Å; N560-K563 PolarHBondContact OD1-NZ 3Å; K561-K563 VanDerWaalsContact C-N 3.32Å; K561-K563 PolarHBondContact O-N 3.16Å; K563-C567 PolarHBondContact O-N 3.17Å; K563-N596 WeakPolarHBondContact CD-O 3.5Å; K563-N596 VanDerWaalsContact CE-O 3.3Å; K563-N596 WeakPolarHBondContact CE-O 3.44Å; K563-L597 HydrophobicContact CB-CD2 4.21Å; K563-L597 HydrophobicContact CG-CD2 4.35Å; K563-F599 PolarHBondContact NZ-O 3.25Å; K563-F599 VanDerWaalsContact NZ-O 3.13Å; K563-T603 HydrophobicContact CB-CG2 4.28Å; K563-T603 HydrophobicContact CD-CG2 3.66Å; K563-N606 PolarHBondContact O-ND2 3.45Å
564	M	95.6	Very high	95.8	Very high	61 Å²	61	61.5 Å²	61.5	30%	0.3	31%	0.309	S	S	.	.	H	α-helix	trans	-70.3	-38.1	178.4	-66.6	-64.4	-64	0	0	111.2	N560 K561 V562 C567 R568 E605	N560-M564 VanDerWaalsContact O-CG 3.26Å; N560-M564 WeakPolarHBondContact O-CG 3.48Å; N560-M564 PolarHBondContact O-N 2.98Å; K561-M564 PolarHBondContact O-N 2.99Å; V562-M564 VanDerWaalsContact C-N 3.3Å; V562-M564 PolarHBondContact O-N 3.1Å; M564-C567 WeakPolarHBondContact O-CB 3.27Å; M564-C567 PolarHBondContact O-N 2.9Å; M564-R568 PolarHBondContact O-N 3.35Å; M564-E605 HydrophobicContact CE-CB 3.98Å; M564-E605 HydrophobicContact CE-CG 4.27Å; M564-E605 VanDerWaalsContact CE-OE2 3.29Å; M564-E605 WeakPolarHBondContact CE-OE2 3.22Å
565	E	96.6	Very high	95.9	Very high	63 Å²	63	55 Å²	55	29%	0.294	28%	0.28	S	S	.	.	H	α-helix	trans	-67.9	-40.5	178	-175	60.4	-167.9	0	0	112.4	L530 K561 V562 C567 R568 L569	L530-E565 HydrophobicContact CD2-CB 3.97Å; L530-E565 HydrophobicContact CD2-CG 3.66Å; K561-E565 PolarHBondContact O-N 3.04Å; V562-E565 PolarHBondContact O-N 2.97Å; V562-E565 VanDerWaalsContact O-N 3.15Å; E565-C567 PolarHBondContact O-N 3.31Å; E565-R568 PolarHBondContact O-N 3.13Å; E565-R568 VanDerWaalsContact O-N 3.13Å; E565-R568 IonicContact OE1-CZ 3.36Å; E565-R568 IonicContact OE1-NE 2.93Å; E565-R568 PolarHBondContact OE1-NE 2.83Å; E565-R568 IonicContact OE1-NH2 3.71Å; E565-R568 PolarHBondContact OE1-NH2 3.41Å; E565-R568 WeakPolarHBondContact OE2-CD 3.45Å; E565-R568 IonicContact OE2-CZ 3.52Å; E565-R568 IonicContact OE2-NE 3.72Å; E565-R568 PolarHBondContact OE2-NE 2.85Å; E565-R568 IonicContact OE2-NH2 3.18Å; E565-L569 HydrophobicContact CG-CD1 3.93Å; E565-L569 HydrophobicContact CG-CG 4.37Å; E565-L569 WeakPolarHBondContact O-CB 3.39Å; E565-L569 WeakPolarHBondContact O-CG 3.33Å; E565-L569 PolarHBondContact O-N 3.34Å
566	V	97.3	Very high	96	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-34.3	171.2	174.6	0	0	0	0	111.6	L530 I534 L552 V562 G570 G571 L597	L530-V566 HydrophobicContact CD1-CG2 3.81Å; L530-V566 HydrophobicContact CD2-CG2 3.99Å; L530-V566 HydrophobicContact CG-CG2 4.19Å; I534-V566 HydrophobicContact CD1-CB 4.44Å; I534-V566 HydrophobicContact CD1-CG1 4.27Å; I534-V566 HydrophobicContact CD1-CG2 4.36Å; L552-V566 HydrophobicContact CD2-CG2 4.05Å; V562-V566 HydrophobicContact CG1-CG2 4.25Å; V562-V566 WeakPolarHBondContact O-CG2 3.44Å; V562-V566 PolarHBondContact O-N 3.13Å; V566-G570 PolarHBondContact O-N 3.12Å; V566-G571 PolarHBondContact O-N 3.12Å; V566-L597 HydrophobicContact CB-CD2 3.71Å; V566-L597 HydrophobicContact CG1-CD1 3.95Å; V566-L597 HydrophobicContact CG1-CD2 3.68Å; V566-L597 HydrophobicContact CG1-CG 4.47Å; V566-L597 HydrophobicContact CG2-CD2 4.37Å
567	C	96.6	Very high	96.2	Very high	28 Å²	28	57 Å²	57	19%	0.189	29%	0.29	C	S	.	.	H	α-helix	trans	-69.1	-46.4	172.6	-173.9	0	0	0	0	111.8	K563 M564 E565 L569 G570 I572 N606 A609	K563-C567 PolarHBondContact O-N 3.17Å; M564-C567 WeakPolarHBondContact O-CB 3.27Å; M564-C567 PolarHBondContact O-N 2.9Å; E565-C567 PolarHBondContact O-N 3.31Å; C567-L569 VanDerWaalsContact C-N 3.3Å; C567-L569 PolarHBondContact O-N 3.15Å; C567-G570 PolarHBondContact O-N 3.26Å; C567-I572 HydrophobicContact CB-CD1 3.74Å; C567-I572 HydrophobicContact CB-CG1 4.47Å; C567-N606 WeakPolarHBondContact CB-OD1 3.4Å; C567-A609 WeakPolarHBondContact SG-CB 3.21Å
568	R	96.8	Very high	96.4	Very high	175 Å²	175	50.1 Å²	50.1	66%	0.66	26%	0.261	S	S	*	.	H	α-helix	trans	-59.7	-38	178	-164.7	-169.4	71.8	79.7	-0.7	112.6	M564 E565 G570	M564-R568 PolarHBondContact O-N 3.35Å; E565-R568 PolarHBondContact O-N 3.13Å; E565-R568 VanDerWaalsContact O-N 3.13Å; E565-R568 IonicContact OE1-CZ 3.36Å; E565-R568 IonicContact OE1-NE 2.93Å; E565-R568 PolarHBondContact OE1-NE 2.83Å; E565-R568 IonicContact OE1-NH2 3.71Å; E565-R568 PolarHBondContact OE1-NH2 3.41Å; E565-R568 WeakPolarHBondContact OE2-CD 3.45Å; E565-R568 IonicContact OE2-CZ 3.52Å; E565-R568 IonicContact OE2-NE 3.72Å; E565-R568 PolarHBondContact OE2-NE 2.85Å; E565-R568 IonicContact OE2-NH2 3.18Å; R568-G570 PolarHBondContact O-N 3.47Å
569	L	96.7	Very high	96.9	Very high	49 Å²	49	47.3 Å²	47.3	26%	0.257	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	4.4	176	-65	173.3	0	0	0	113.5	L530 P531 I534 E565 C567 G571	L530-L569 HydrophobicContact CD2-CD1 4.42Å; L530-L569 HydrophobicContact CG-CD1 4.33Å; P531-L569 HydrophobicContact CB-CD1 4.49Å; P531-L569 HydrophobicContact CG-CD1 4Å; I534-L569 HydrophobicContact CD1-CB 3.53Å; I534-L569 HydrophobicContact CD1-CD1 3.79Å; I534-L569 HydrophobicContact CD1-CG 4.32Å; E565-L569 HydrophobicContact CG-CD1 3.93Å; E565-L569 HydrophobicContact CG-CG 4.37Å; E565-L569 WeakPolarHBondContact O-CB 3.39Å; E565-L569 WeakPolarHBondContact O-CG 3.33Å; E565-L569 PolarHBondContact O-N 3.34Å; C567-L569 VanDerWaalsContact C-N 3.3Å; C567-L569 PolarHBondContact O-N 3.15Å; L569-G571 VanDerWaalsContact C-N 3.26Å; L569-G571 PolarHBondContact O-N 3.09Å
570	G	96.2	Very high	97	Very high	29 Å²	29	47 Å²	47	30%	0.299	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	8.1	176.1	0	0	0	0	0	115.5	V566 C567 R568 I572 K573	V566-G570 PolarHBondContact O-N 3.12Å; C567-G570 PolarHBondContact O-N 3.26Å; R568-G570 PolarHBondContact O-N 3.47Å; G570-I572 PolarHBondContact O-N 3.13Å; G570-I572 VanDerWaalsContact O-N 3.15Å; G570-K573 WeakPolarHBondContact O-CB 3.46Å; G570-K573 PolarHBondContact O-N 3.26Å
571	G	97.9	Very high	97.1	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.7	-28.8	-176.6	0	0	0	0	0	114.3	V566 L569 K573 H574 L575	V566-G571 PolarHBondContact O-N 3.12Å; L569-G571 VanDerWaalsContact C-N 3.26Å; L569-G571 PolarHBondContact O-N 3.09Å; G571-K573 PolarHBondContact O-N 3.34Å; G571-H574 PolarHBondContact O-N 3.07Å; G571-L575 WeakPolarHBondContact O-CG 3.43Å; G571-L575 PolarHBondContact O-N 2.8Å
572	I	98.4	Very high	97	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-55.8	-39.2	173.4	-64.6	-180	0	0	0	111.5	C567 G570 V576 L594 L597 N606 A609 M610 V613	C567-I572 HydrophobicContact CB-CD1 3.74Å; C567-I572 HydrophobicContact CB-CG1 4.47Å; G570-I572 PolarHBondContact O-N 3.13Å; G570-I572 VanDerWaalsContact O-N 3.15Å; I572-V576 WeakPolarHBondContact O-CG2 3.48Å; I572-V576 PolarHBondContact O-N 3.41Å; I572-L594 HydrophobicContact CG2-CD2 4.09Å; I572-L597 HydrophobicContact CG1-CD1 4.3Å; I572-N606 HydrophobicContact CD1-CB 3.91Å; I572-A609 HydrophobicContact CD1-CB 4.17Å; I572-M610 HydrophobicContact CG2-CB 4.04Å; I572-M610 HydrophobicContact CG2-SD 3.94Å; I572-V613 HydrophobicContact CG2-CG2 4.22Å
573	K	98.1	Very high	97.1	Very high	98 Å²	98	49.8 Å²	49.8	43%	0.426	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-49.2	178.6	-170.4	-142.4	165.5	-145.5	0	110.8	G570 G571 L575 V576 D577 V613	G570-K573 WeakPolarHBondContact O-CB 3.46Å; G570-K573 PolarHBondContact O-N 3.26Å; G571-K573 PolarHBondContact O-N 3.34Å; K573-L575 VanDerWaalsContact C-N 3.34Å; K573-L575 PolarHBondContact O-N 3.29Å; K573-V576 WeakPolarHBondContact O-CA 3.34Å; K573-V576 WeakPolarHBondContact O-CB 3.31Å; K573-V576 PolarHBondContact O-N 3.2Å; K573-V576 VanDerWaalsContact O-N 3.07Å; K573-D577 VanDerWaalsContact CE-OD2 3.28Å; K573-D577 WeakPolarHBondContact CE-OD2 3.39Å; K573-D577 IonicContact NZ-OD2 2.74Å; K573-D577 PolarHBondContact NZ-OD2 2.91Å; K573-D577 PolarHBondContact O-N 3.34Å; K573-V613 HydrophobicContact CB-CG1 4.06Å; K573-V613 HydrophobicContact CG-CB 4.37Å; K573-V613 HydrophobicContact CG-CG1 4.21Å
574	H	98.3	Very high	97	Very high	36 Å²	36	53.3 Å²	53.3	17%	0.167	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-40	-179.7	-57.5	125.4	0	0	0	111.9	L537 Q538 G571 V576 D577 L578	L537-H574 HydrophobicContact CB-CB 4.15Å; L537-H574 HydrophobicContact CD1-CB 3.8Å; Q538-H574 PolarHBondContact NE2-NE2 2.89Å; G571-H574 PolarHBondContact O-N 3.07Å; H574-V576 VanDerWaalsContact C-N 3.32Å; H574-V576 PolarHBondContact O-N 3.26Å; H574-D577 PolarHBondContact O-N 2.95Å; H574-L578 WeakPolarHBondContact O-CG 3.43Å; H574-L578 PolarHBondContact O-N 3.46Å; H574-L578 VanDerWaalsContact O-N 3.08Å
575	L	98.6	Very high	97.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-31.9	173.4	-66.8	169.6	0	0	0	113.1	L537 A549 L552 G571 K573 A590 A593 L594 L597	L537-L575 HydrophobicContact CD1-CD2 3.81Å; L537-L575 HydrophobicContact CD1-CG 3.81Å; L537-L575 HydrophobicContact CD2-CD2 3.75Å; L537-L575 HydrophobicContact CG-CD2 4.45Å; A549-L575 HydrophobicContact CB-CD2 4.07Å; L552-L575 HydrophobicContact CD1-CD1 4.29Å; L552-L575 HydrophobicContact CD1-CD2 4.41Å; G571-L575 WeakPolarHBondContact O-CG 3.43Å; G571-L575 PolarHBondContact O-N 2.8Å; K573-L575 VanDerWaalsContact C-N 3.34Å; K573-L575 PolarHBondContact O-N 3.29Å; L575-A590 HydrophobicContact CD2-CB 4.18Å; L575-A593 HydrophobicContact CD1-CB 3.87Å; L575-A593 HydrophobicContact CD2-CB 4.03Å; L575-L594 HydrophobicContact CB-CD1 4.1Å; L575-L594 HydrophobicContact CB-CD2 3.81Å; L575-L594 HydrophobicContact CB-CG 3.78Å; L575-L594 HydrophobicContact CD1-CD2 4.3Å; L575-L594 HydrophobicContact CD1-CG 4.43Å; L575-L597 HydrophobicContact CD1-CD1 3.34Å
576	V	98.6	Very high	97.1	Very high	6 Å²	6	52.4 Å²	52.4	4%	0.036	25%	0.249	C	C	.	.	H	α-helix	trans	-70.1	-42.9	172.4	164.9	0	0	0	0	111.7	I572 K573 H574 L578 L579 L594 M610 V613 A618	I572-V576 WeakPolarHBondContact O-CG2 3.48Å; I572-V576 PolarHBondContact O-N 3.41Å; K573-V576 WeakPolarHBondContact O-CA 3.34Å; K573-V576 WeakPolarHBondContact O-CB 3.31Å; K573-V576 PolarHBondContact O-N 3.2Å; K573-V576 VanDerWaalsContact O-N 3.07Å; H574-V576 VanDerWaalsContact C-N 3.32Å; H574-V576 PolarHBondContact O-N 3.26Å; V576-L578 PolarHBondContact O-N 3.07Å; V576-L579 WeakPolarHBondContact O-CB 3.37Å; V576-L579 PolarHBondContact O-N 3.27Å; V576-L594 HydrophobicContact CG2-CD1 4.09Å; V576-L594 HydrophobicContact CG2-CD2 4.32Å; V576-M610 HydrophobicContact CG2-CE 3.74Å; V576-M610 HydrophobicContact CG2-SD 3.31Å; V576-M610 WeakPolarHBondContact CG2-SD 3.41Å; V576-V613 HydrophobicContact CB-CG2 4.28Å; V576-V613 HydrophobicContact CG1-CG2 4.41Å; V576-V613 HydrophobicContact CG2-CG2 3.92Å; V576-A618 HydrophobicContact CG1-CB 3.88Å
577	D	97.7	Very high	97.1	Very high	85 Å²	85	53 Å²	53	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-34.9	176.3	-66.4	-28.9	0	0	0	110.8	K573 H574 L579	K573-D577 VanDerWaalsContact CE-OD2 3.28Å; K573-D577 WeakPolarHBondContact CE-OD2 3.39Å; K573-D577 IonicContact NZ-OD2 2.74Å; K573-D577 PolarHBondContact NZ-OD2 2.91Å; K573-D577 PolarHBondContact O-N 3.34Å; H574-D577 PolarHBondContact O-N 2.95Å; D577-L579 VanDerWaalsContact C-N 3.31Å; D577-L579 PolarHBondContact O-N 3.4Å
578	L	98.1	Very high	97.2	Very high	11 Å²	11	53.2 Å²	53.2	6%	0.058	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-70.3	-14.5	175.3	-68.5	179.7	0	0	0	115.2	L537 Q545 H574 V576 D580 H581 V586 A590	L537-L578 HydrophobicContact CB-CD1 4.18Å; L537-L578 HydrophobicContact CD2-CD1 3.99Å; Q545-L578 HydrophobicContact CB-CD2 4.5Å; H574-L578 WeakPolarHBondContact O-CG 3.43Å; H574-L578 PolarHBondContact O-N 3.46Å; H574-L578 VanDerWaalsContact O-N 3.08Å; V576-L578 PolarHBondContact O-N 3.07Å; L578-D580 VanDerWaalsContact C-N 3.29Å; L578-D580 PolarHBondContact O-N 2.76Å; L578-H581 WeakPolarHBondContact O-CB 3.45Å; L578-H581 PolarHBondContact O-N 2.84Å; L578-H581 VanDerWaalsContact O-N 3.16Å; L578-V586 HydrophobicContact CB-CG1 4.11Å; L578-V586 HydrophobicContact CD1-CG1 4.19Å; L578-V586 HydrophobicContact CD2-CG1 3.85Å; L578-V586 HydrophobicContact CG-CG1 4.26Å; L578-A590 HydrophobicContact CB-CB 3.78Å; L578-A590 HydrophobicContact CD1-CB 4.33Å
579	L	97.8	Very high	97.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-66.8	-29	178.8	-65.4	177.2	0	0	0	113	V576 D577 H581 Q587 C591 L594 A618 L619 L622	V576-L579 WeakPolarHBondContact O-CB 3.37Å; V576-L579 PolarHBondContact O-N 3.27Å; D577-L579 VanDerWaalsContact C-N 3.31Å; D577-L579 PolarHBondContact O-N 3.4Å; L579-H581 VanDerWaalsContact C-N 3.32Å; L579-Q587 PolarHBondContact O-NE2 2.94Å; L579-C591 HydrophobicContact CD2-CB 3.78Å; L579-L594 HydrophobicContact CD1-CD1 3.92Å; L579-L594 HydrophobicContact CD2-CD1 4.08Å; L579-L594 HydrophobicContact CG-CD1 4.13Å; L579-A618 HydrophobicContact CD1-CB 3.99Å; L579-L619 HydrophobicContact CD1-CD2 3.97Å; L579-L619 HydrophobicContact CD1-CG 4.18Å; L579-L622 HydrophobicContact CB-CD2 4.25Å; L579-L622 HydrophobicContact CD2-CD2 3.88Å
580	D	95.4	Very high	97.3	Very high	62 Å²	62	44 Å²	44	33%	0.332	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-88	2.9	176.4	-79.7	-56.2	0	0	0	113.3	L578 R621	L578-D580 VanDerWaalsContact C-N 3.29Å; L578-D580 PolarHBondContact O-N 2.76Å; D580-R621 IonicContact OD1-NE 3.64Å; D580-R621 PolarHBondContact OD1-NE 3.34Å; D580-R621 IonicContact OD2-CZ 3.7Å; D580-R621 IonicContact OD2-NE 3.19Å; D580-R621 PolarHBondContact OD2-NE 2.93Å; D580-R621 IonicContact OD2-NH2 2.71Å; D580-R621 PolarHBondContact OD2-NH2 3.12Å
581	H	96.3	Very high	97.5	Very high	46 Å²	46	42.6 Å²	42.6	21%	0.213	20%	0.199	C	C	.	.			trans	-60.7	159.1	-179	-168.6	-113.8	0	0	0	113.4	L578 L579 V583 V586 Q587	L578-H581 WeakPolarHBondContact O-CB 3.45Å; L578-H581 PolarHBondContact O-N 2.84Å; L578-H581 VanDerWaalsContact O-N 3.16Å; L579-H581 VanDerWaalsContact C-N 3.32Å; H581-V583 PolarHBondContact ND1-N 2.83Å; H581-V586 HydrophobicContact CB-CG1 4.07Å; H581-V586 WeakPolarHBondContact ND1-CB 3.21Å; H581-Q587 HydrophobicContact CB-CG 4.41Å; H581-Q587 PolarHBondContact O-NE2 2.89Å
582	R	94.4	Very high	97.5	Very high	233 Å²	233	42.6 Å²	42.6	88%	0.879	20%	0.199	S	C	*	.	S	Bend	trans	-84.6	-23.1	-174.7	-62.4	-173.8	-175.8	-171.6	2.8	114.3
583	V	96.1	Very high	97.5	Very high	55 Å²	55	42.4 Å²	42.4	33%	0.333	20%	0.198	S	C	.	.	S	Bend	trans	-94.6	121.8	-178.5	178.4	0	0	0	0	109.8	P542 H581 E585 V586 Q587	P542-V583 HydrophobicContact CB-CB 4.34Å; P542-V583 HydrophobicContact CB-CG2 3.93Å; P542-V583 HydrophobicContact CG-CG2 4.12Å; H581-V583 PolarHBondContact ND1-N 2.83Å; V583-E585 VanDerWaalsContact C-N 3.29Å; V583-E585 HydrophobicContact CG1-CB 4.2Å; V583-E585 PolarHBondContact O-N 2.9Å; V583-V586 HydrophobicContact CB-CG2 4.11Å; V583-V586 HydrophobicContact CG1-CG2 4.26Å; V583-V586 WeakPolarHBondContact O-CB 3.49Å; V583-V586 PolarHBondContact O-N 2.8Å; V583-Q587 PolarHBondContact O-N 2.72Å
584	L	95.7	Very high	97.5	Very high	78 Å²	78	37.7 Å²	37.7	41%	0.408	18%	0.178	S	C	.	.	H	α-helix	trans	-55.7	-40.4	-174.6	-166.9	79	0	0	0	113.2	Q587 K588 D628 I631	L584-Q587 WeakPolarHBondContact O-CB 3.41Å; L584-Q587 PolarHBondContact O-N 3.17Å; L584-K588 HydrophobicContact CG-CD 4.45Å; L584-K588 WeakPolarHBondContact O-CG 3.22Å; L584-K588 PolarHBondContact O-N 3.47Å; L584-D628 HydrophobicContact CD1-CB 4.24Å; L584-I631 HydrophobicContact CD1-CD1 3.43Å; L584-I631 VanDerWaalsContact CD1-CD1 3.43Å; L584-I631 HydrophobicContact CG-CD1 4.08Å
585	E	96.9	Very high	97.5	Very high	105 Å²	105	39.4 Å²	39.4	49%	0.491	18%	0.183	S	C	.	.	H	α-helix	trans	-62.1	-44.8	179.8	-170.3	-177.1	176.3	0	0	112.3	A546 V583 Q587 K588 N589	A546-E585 HydrophobicContact CB-CG 4.05Å; V583-E585 VanDerWaalsContact C-N 3.29Å; V583-E585 HydrophobicContact CG1-CB 4.2Å; V583-E585 PolarHBondContact O-N 2.9Å; E585-Q587 VanDerWaalsContact C-N 3.3Å; E585-Q587 PolarHBondContact O-N 3.47Å; E585-K588 PolarHBondContact O-N 3.28Å; E585-N589 WeakPolarHBondContact O-CB 3.35Å; E585-N589 VanDerWaalsContact O-CG 3.26Å; E585-N589 PolarHBondContact O-N 3.28Å; E585-N589 PolarHBondContact O-OD1 3.49Å
586	V	98	Very high	97.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-42.4	174.3	178.1	0	0	0	0	110.6	P542 Q545 A546 L578 H581 V583 A590	P542-V586 HydrophobicContact CB-CG2 4Å; P542-V586 VanDerWaalsContact O-CG2 3.26Å; P542-V586 WeakPolarHBondContact O-CG2 3.13Å; Q545-V586 HydrophobicContact CB-CG1 4.26Å; Q545-V586 HydrophobicContact CB-CG2 4.36Å; A546-V586 HydrophobicContact CB-CG2 3.96Å; L578-V586 HydrophobicContact CB-CG1 4.11Å; L578-V586 HydrophobicContact CD1-CG1 4.19Å; L578-V586 HydrophobicContact CD2-CG1 3.85Å; L578-V586 HydrophobicContact CG-CG1 4.26Å; H581-V586 HydrophobicContact CB-CG1 4.07Å; H581-V586 WeakPolarHBondContact ND1-CB 3.21Å; V583-V586 HydrophobicContact CB-CG2 4.11Å; V583-V586 HydrophobicContact CG1-CG2 4.26Å; V583-V586 WeakPolarHBondContact O-CB 3.49Å; V583-V586 PolarHBondContact O-N 2.8Å; V586-A590 WeakPolarHBondContact O-CB 3.46Å; V586-A590 PolarHBondContact O-N 3.33Å
587	Q	97.4	Very high	97.4	Very high	14 Å²	14	40.5 Å²	40.5	7%	0.065	19%	0.188	C	C	.	.	H	α-helix	trans	-65.8	-41.2	177.5	-59.4	-178.2	-68.1	0	0	112.2	L579 H581 V583 L584 E585 C591 I631	L579-Q587 PolarHBondContact O-NE2 2.94Å; H581-Q587 HydrophobicContact CB-CG 4.41Å; H581-Q587 PolarHBondContact O-NE2 2.89Å; V583-Q587 PolarHBondContact O-N 2.72Å; L584-Q587 WeakPolarHBondContact O-CB 3.41Å; L584-Q587 PolarHBondContact O-N 3.17Å; E585-Q587 VanDerWaalsContact C-N 3.3Å; E585-Q587 PolarHBondContact O-N 3.47Å; Q587-C591 WeakPolarHBondContact O-CB 3.42Å; Q587-C591 PolarHBondContact O-N 2.98Å; Q587-I631 HydrophobicContact CB-CD1 3.97Å
588	K	97.6	Very high	97.4	Very high	31 Å²	31	36.5 Å²	36.5	14%	0.135	17%	0.167	C	C	.	.	H	α-helix	trans	-63.2	-53.6	176.9	-76.6	-178.6	177.7	-169	0	111.1	L584 E585 A590 C591 G592 D628 E630 I631 L634	L584-K588 HydrophobicContact CG-CD 4.45Å; L584-K588 WeakPolarHBondContact O-CG 3.22Å; L584-K588 PolarHBondContact O-N 3.47Å; E585-K588 PolarHBondContact O-N 3.28Å; K588-A590 PolarHBondContact O-N 2.82Å; K588-C591 PolarHBondContact O-N 3.1Å; K588-G592 PolarHBondContact O-N 3.44Å; K588-D628 VanDerWaalsContact CE-CG 3.43Å; K588-D628 WeakPolarHBondContact CE-OD1 3.46Å; K588-D628 VanDerWaalsContact CE-OD2 3.28Å; K588-D628 WeakPolarHBondContact CE-OD2 3.27Å; K588-D628 IonicContact NZ-OD1 2.74Å; K588-D628 PolarHBondContact NZ-OD1 3.29Å; K588-D628 IonicContact NZ-OD2 2.84Å; K588-D628 PolarHBondContact NZ-OD2 3.07Å; K588-E630 HydrophobicContact CD-CG 4.43Å; K588-E630 WeakPolarHBondContact CD-OE2 3.27Å; K588-E630 VanDerWaalsContact CE-OE2 3.29Å; K588-E630 WeakPolarHBondContact CE-OE2 3.32Å; K588-E630 IonicContact NZ-OE2 3.96Å; K588-E630 PolarHBondContact NZ-OE2 2.81Å; K588-I631 HydrophobicContact CD-CG1 4.37Å; K588-I631 HydrophobicContact CG-CD1 3.97Å; K588-I631 HydrophobicContact CG-CG1 3.5Å; K588-L634 HydrophobicContact CB-CD1 4.44Å
589	N	98.3	Very high	97.4	Very high	30 Å²	30	40.7 Å²	40.7	16%	0.16	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-39.8	-176.5	-61	1.7	0	0	0	111.1	A546 A549 A550 E585 G592 A593	A546-N589 PolarHBondContact O-ND2 2.63Å; A549-N589 HydrophobicContact CB-CB 3.81Å; A550-N589 HydrophobicContact CB-CB 4.35Å; E585-N589 WeakPolarHBondContact O-CB 3.35Å; E585-N589 VanDerWaalsContact O-CG 3.26Å; E585-N589 PolarHBondContact O-N 3.28Å; E585-N589 PolarHBondContact O-OD1 3.49Å; N589-G592 PolarHBondContact O-N 3.43Å; N589-A593 WeakPolarHBondContact O-CB 3.24Å; N589-A593 PolarHBondContact O-N 2.76Å
590	A	98.5	Very high	97	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-42.7	174.9	0	0	0	0	0	112.4	A549 L575 L578 V586 K588 G592 A593 L594	A549-A590 HydrophobicContact CB-CB 4.45Å; L575-A590 HydrophobicContact CD2-CB 4.18Å; L578-A590 HydrophobicContact CB-CB 3.78Å; L578-A590 HydrophobicContact CD1-CB 4.33Å; V586-A590 WeakPolarHBondContact O-CB 3.46Å; V586-A590 PolarHBondContact O-N 3.33Å; K588-A590 PolarHBondContact O-N 2.82Å; A590-G592 VanDerWaalsContact C-N 3.34Å; A590-A593 PolarHBondContact O-N 3.47Å; A590-L594 WeakPolarHBondContact O-CB 3.09Å; A590-L594 VanDerWaalsContact O-CG 3.3Å; A590-L594 WeakPolarHBondContact O-CG 3.27Å; A590-L594 PolarHBondContact O-N 3.25Å
591	C	98.4	Very high	96.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-32	176.5	-163.9	0	0	0	0	112.6	L579 Q587 K588 R595 L634	L579-C591 HydrophobicContact CD2-CB 3.78Å; Q587-C591 WeakPolarHBondContact O-CB 3.42Å; Q587-C591 PolarHBondContact O-N 2.98Å; K588-C591 PolarHBondContact O-N 3.1Å; C591-R595 WeakPolarHBondContact O-CB 3.46Å; C591-R595 PolarHBondContact O-N 3.09Å; C591-L634 HydrophobicContact CB-CB 4.23Å
592	G	98.3	Very high	96.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-46.2	172.5	0	0	0	0	0	112.6	Q553 K588 N589 A590 L594 R595 N596	Q553-G592 VanDerWaalsContact CD-C 3.46Å; K588-G592 PolarHBondContact O-N 3.44Å; N589-G592 PolarHBondContact O-N 3.43Å; A590-G592 VanDerWaalsContact C-N 3.34Å; G592-L594 PolarHBondContact O-N 3.17Å; G592-R595 WeakPolarHBondContact O-CB 3.26Å; G592-R595 PolarHBondContact O-N 3.23Å; G592-N596 PolarHBondContact O-N 2.92Å; G592-N596 VanDerWaalsContact O-N 3.15Å
593	A	98.5	Very high	96.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.5	-47.8	172.6	0	0	0	0	0	111.6	L552 Q553 L575 N589 A590 R595 N596 L597	L552-A593 HydrophobicContact CB-CB 4.4Å; Q553-A593 HydrophobicContact CB-CB 3.97Å; L575-A593 HydrophobicContact CD1-CB 3.87Å; L575-A593 HydrophobicContact CD2-CB 4.03Å; N589-A593 WeakPolarHBondContact O-CB 3.24Å; N589-A593 PolarHBondContact O-N 2.76Å; A590-A593 PolarHBondContact O-N 3.47Å; A593-R595 VanDerWaalsContact C-N 3.33Å; A593-R595 PolarHBondContact O-N 2.69Å; A593-N596 PolarHBondContact O-N 2.9Å; A593-L597 WeakPolarHBondContact O-CB 3.46Å; A593-L597 WeakPolarHBondContact O-CG 3.42Å; A593-L597 PolarHBondContact O-N 2.89Å
594	L	98.6	Very high	96.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-41.9	175.2	-73	169	0	0	0	112.2	I572 L575 V576 L579 A590 G592 N596 L597 V598 M610 V638	I572-L594 HydrophobicContact CG2-CD2 4.09Å; L575-L594 HydrophobicContact CB-CD1 4.1Å; L575-L594 HydrophobicContact CB-CD2 3.81Å; L575-L594 HydrophobicContact CB-CG 3.78Å; L575-L594 HydrophobicContact CD1-CD2 4.3Å; L575-L594 HydrophobicContact CD1-CG 4.43Å; V576-L594 HydrophobicContact CG2-CD1 4.09Å; V576-L594 HydrophobicContact CG2-CD2 4.32Å; L579-L594 HydrophobicContact CD1-CD1 3.92Å; L579-L594 HydrophobicContact CD2-CD1 4.08Å; L579-L594 HydrophobicContact CG-CD1 4.13Å; A590-L594 WeakPolarHBondContact O-CB 3.09Å; A590-L594 VanDerWaalsContact O-CG 3.3Å; A590-L594 WeakPolarHBondContact O-CG 3.27Å; A590-L594 PolarHBondContact O-N 3.25Å; G592-L594 PolarHBondContact O-N 3.17Å; L594-N596 VanDerWaalsContact C-N 3.32Å; L594-N596 PolarHBondContact O-N 3.4Å; L594-L597 HydrophobicContact CD2-CD1 4.45Å; L594-L597 PolarHBondContact O-N 3.44Å; L594-V598 VanDerWaalsContact O-CG2 3.31Å; L594-V598 WeakPolarHBondContact O-CG2 3.49Å; L594-V598 PolarHBondContact O-N 2.89Å; L594-M610 HydrophobicContact CD1-CE 3.94Å; L594-M610 HydrophobicContact CD1-SD 4.49Å; L594-M610 HydrophobicContact CD2-CE 4.25Å; L594-M610 HydrophobicContact CD2-SD 3.83Å; L594-V638 HydrophobicContact CB-CG2 4.42Å
595	R	98.2	Very high	96.1	Very high	72 Å²	72	39.1 Å²	39.1	27%	0.272	19%	0.194	S	C	.	.	H	α-helix	trans	-57.8	-44	177.5	-174.8	-178.4	172	-177.1	-0.6	111.7	C591 G592 A593 F599 E633 V638 N641	C591-R595 WeakPolarHBondContact O-CB 3.46Å; C591-R595 PolarHBondContact O-N 3.09Å; G592-R595 WeakPolarHBondContact O-CB 3.26Å; G592-R595 PolarHBondContact O-N 3.23Å; A593-R595 VanDerWaalsContact C-N 3.33Å; A593-R595 PolarHBondContact O-N 2.69Å; R595-F599 PolarHBondContact O-N 3.48Å; R595-E633 IonicContact NH1-OE1 2.81Å; R595-V638 HydrophobicContact CB-CG2 3.74Å; R595-V638 HydrophobicContact CG-CG2 4.43Å; R595-N641 PolarHBondContact O-ND2 3.33Å
596	N	98.1	Very high	96.1	Very high	29 Å²	29	34.1 Å²	34.1	16%	0.155	17%	0.17	C	C	.	.	H	α-helix	trans	-71.6	-41.1	177.9	-72.7	4.3	0	0	0	111.9	Q553 C556 K563 G592 A593 L594 V598 F599	Q553-N596 PolarHBondContact O-ND2 2.73Å; C556-N596 HydrophobicContact CB-CB 4.01Å; K563-N596 WeakPolarHBondContact CD-O 3.5Å; K563-N596 VanDerWaalsContact CE-O 3.3Å; K563-N596 WeakPolarHBondContact CE-O 3.44Å; G592-N596 PolarHBondContact O-N 2.92Å; G592-N596 VanDerWaalsContact O-N 3.15Å; A593-N596 PolarHBondContact O-N 2.9Å; L594-N596 VanDerWaalsContact C-N 3.32Å; L594-N596 PolarHBondContact O-N 3.4Å; N596-V598 VanDerWaalsContact C-N 3.3Å; N596-V598 PolarHBondContact O-N 2.97Å; N596-F599 WeakPolarHBondContact O-CB 3.43Å; N596-F599 PolarHBondContact O-N 3.41Å; N596-F599 VanDerWaalsContact O-N 3.11Å
597	L	97.8	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-36.2	177.3	-80.4	162.8	0	0	0	113.9	C556 K563 V566 I572 L575 A593 L594 N606	C556-L597 HydrophobicContact CB-CD2 4.44Å; C556-L597 HydrophobicContact CB-CG 4.36Å; C556-L597 WeakPolarHBondContact SG-CD2 3.32Å; K563-L597 HydrophobicContact CB-CD2 4.21Å; K563-L597 HydrophobicContact CG-CD2 4.35Å; V566-L597 HydrophobicContact CB-CD2 3.71Å; V566-L597 HydrophobicContact CG1-CD1 3.95Å; V566-L597 HydrophobicContact CG1-CD2 3.68Å; V566-L597 HydrophobicContact CG1-CG 4.47Å; V566-L597 HydrophobicContact CG2-CD2 4.37Å; I572-L597 HydrophobicContact CG1-CD1 4.3Å; L575-L597 HydrophobicContact CD1-CD1 3.34Å; A593-L597 WeakPolarHBondContact O-CB 3.46Å; A593-L597 WeakPolarHBondContact O-CG 3.42Å; A593-L597 PolarHBondContact O-N 2.89Å; L594-L597 HydrophobicContact CD2-CD1 4.45Å; L594-L597 PolarHBondContact O-N 3.44Å; L597-N606 PolarHBondContact O-ND2 2.99Å
598	V	97.6	Very high	96.2	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	2.8	177.7	-58.7	0	0	0	0	113.9	L594 N596 T603 K607 M610 V638 N641 L642	L594-V598 VanDerWaalsContact O-CG2 3.31Å; L594-V598 WeakPolarHBondContact O-CG2 3.49Å; L594-V598 PolarHBondContact O-N 2.89Å; N596-V598 VanDerWaalsContact C-N 3.3Å; N596-V598 PolarHBondContact O-N 2.97Å; V598-T603 PolarHBondContact O-OG1 3.37Å; V598-K607 HydrophobicContact CB-CG 4.02Å; V598-K607 HydrophobicContact CG1-CG 4.34Å; V598-K607 WeakPolarHBondContact O-CE 3.25Å; V598-M610 HydrophobicContact CG1-CB 4.2Å; V598-M610 HydrophobicContact CG1-CG 4.25Å; V598-V638 HydrophobicContact CG2-CG1 4.05Å; V598-N641 HydrophobicContact CB-CB 4.36Å; V598-N641 HydrophobicContact CG2-CB 3.48Å; V598-N641 VanDerWaalsContact CG2-CB 3.48Å; V598-L642 HydrophobicContact CB-CD2 4.3Å; V598-L642 HydrophobicContact CG1-CD2 3.88Å; V598-L642 HydrophobicContact CG1-CG 4.48Å; V598-L642 HydrophobicContact CG2-CG 4.43Å
599	F	96.4	Very high	96.2	Very high	99 Å²	99	35.9 Å²	35.9	43%	0.434	19%	0.185	S	C	.	.			trans	-84.4	144.4	-179.4	-174.5	-104.4	0	0	0	112.7	K563 R595 N596 T603	K563-F599 PolarHBondContact NZ-O 3.25Å; K563-F599 VanDerWaalsContact NZ-O 3.13Å; R595-F599 PolarHBondContact O-N 3.48Å; N596-F599 WeakPolarHBondContact O-CB 3.43Å; N596-F599 PolarHBondContact O-N 3.41Å; N596-F599 VanDerWaalsContact O-N 3.11Å; F599-T603 WeakPolarHBondContact O-CG2 3.33Å; F599-T603 PolarHBondContact O-OG1 2.69Å
600	G	91.1	Very high	96.2	Very high	27 Å²	27	34.4 Å²	34.4	28%	0.278	18%	0.177	S	C	.	.	S	Bend	trans	96.1	161.5	-177.8	0	0	0	0	0	114	T603 K607	G600-T603 PolarHBondContact O-OG1 3.01Å; G600-K607 PolarHBondContact O-NZ 2.89Å
601	K	85.6	Confident	96.2	Very high	161 Å²	161	37 Å²	37	70%	0.7	19%	0.188	S	C	*	.	S	Bend	trans	-78.3	-25.2	179.4	-171.4	178.2	177.9	-175.9	0	113.3	T603	K601-T603 VanDerWaalsContact C-N 3.31Å; K601-T603 PolarHBondContact O-N 2.93Å
602	S	88.9	Confident	96.1	Very high	69 Å²	69	42.4 Å²	42.4	48%	0.483	22%	0.217	S	C	.	.	S	Bend	trans	-74	-15.6	179.4	41	0	0	0	0	114.3	N560 D604	N560-S602 PolarHBondContact ND2-OG 2.84Å; S602-D604 PolarHBondContact O-N 3.18Å
603	T	92.3	Very high	96.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.			trans	-97.7	28.7	-171.7	57.3	0	0	0	0	113.4	K563 V598 F599 G600 K601 E605 N606 K607	K563-T603 HydrophobicContact CB-CG2 4.28Å; K563-T603 HydrophobicContact CD-CG2 3.66Å; V598-T603 PolarHBondContact O-OG1 3.37Å; F599-T603 WeakPolarHBondContact O-CG2 3.33Å; F599-T603 PolarHBondContact O-OG1 2.69Å; G600-T603 PolarHBondContact O-OG1 3.01Å; K601-T603 VanDerWaalsContact C-N 3.31Å; K601-T603 PolarHBondContact O-N 2.93Å; T603-E605 VanDerWaalsContact C-N 3.29Å; T603-E605 PolarHBondContact O-N 2.88Å; T603-N606 WeakPolarHBondContact O-CB 3.27Å; T603-N606 PolarHBondContact O-N 2.91Å; T603-N606 VanDerWaalsContact O-N 3.17Å; T603-K607 VanDerWaalsContact C-NZ 3.35Å; T603-K607 WeakPolarHBondContact O-CG 3.49Å; T603-K607 PolarHBondContact O-N 3.29Å; T603-K607 VanDerWaalsContact O-N 3.11Å; T603-K607 PolarHBondContact O-NZ 3.23Å; T603-K607 PolarHBondContact OG1-NZ 3.13Å
604	D	95.4	Very high	96.1	Very high	51 Å²	51	46.5 Å²	46.5	27%	0.273	25%	0.248	S	C	.	.	H	α-helix	trans	-67.9	-28.6	-177.3	-88.6	23.1	0	0	0	112.8	S602 K607 I608 C645	S602-D604 PolarHBondContact O-N 3.18Å; D604-K607 PolarHBondContact O-N 3.27Å; D604-K607 WeakPolarHBondContact OD1-CD 3.41Å; D604-K607 WeakPolarHBondContact OD1-CE 3.24Å; D604-K607 IonicContact OD1-NZ 2.77Å; D604-K607 PolarHBondContact OD1-NZ 3.02Å; D604-I608 VanDerWaalsContact O-CG1 3.31Å; D604-I608 WeakPolarHBondContact O-CG1 3.23Å; D604-I608 PolarHBondContact O-N 3.39Å; D604-C645 VanDerWaalsContact CG-SG 3.57Å; D604-C645 WeakPolarHBondContact OD2-CB 3.03Å; D604-C645 PolarHBondContact OD2-SG 3.05Å
605	E	96.1	Very high	96.1	Very high	132 Å²	132	46.5 Å²	46.5	62%	0.617	25%	0.248	S	C	*	.	H	α-helix	trans	-61.7	-44.3	168.5	-66	-173.1	-169.9	0	0	111.7	M564 T603 K607 I608 A609	M564-E605 HydrophobicContact CE-CB 3.98Å; M564-E605 HydrophobicContact CE-CG 4.27Å; M564-E605 VanDerWaalsContact CE-OE2 3.29Å; M564-E605 WeakPolarHBondContact CE-OE2 3.22Å; T603-E605 VanDerWaalsContact C-N 3.29Å; T603-E605 PolarHBondContact O-N 2.88Å; E605-K607 VanDerWaalsContact C-N 3.3Å; E605-K607 PolarHBondContact O-N 3.23Å; E605-I608 CarbonylContact O-C 3.58Å; E605-I608 PolarHBondContact O-N 2.85Å; E605-I608 VanDerWaalsContact O-N 3.12Å; E605-A609 WeakPolarHBondContact O-CB 3.13Å; E605-A609 PolarHBondContact O-N 3.16Å
606	N	97.7	Very high	96.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-39.3	174.5	-66.4	14.6	0	0	0	112.1	K563 C567 I572 L597 T603 A609 M610	K563-N606 PolarHBondContact O-ND2 3.45Å; C567-N606 WeakPolarHBondContact CB-OD1 3.4Å; I572-N606 HydrophobicContact CD1-CB 3.91Å; L597-N606 PolarHBondContact O-ND2 2.99Å; T603-N606 WeakPolarHBondContact O-CB 3.27Å; T603-N606 PolarHBondContact O-N 2.91Å; T603-N606 VanDerWaalsContact O-N 3.17Å; N606-A609 PolarHBondContact O-N 3.49Å; N606-M610 WeakPolarHBondContact O-CB 3.36Å; N606-M610 PolarHBondContact O-N 3.22Å
607	K	98.2	Very high	96.1	Very high	1 Å²	1	44.3 Å²	44.3	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-38.8	176.1	-62.3	175.9	-166.7	76.6	0	111.6	V598 G600 T603 D604 E605 K611 N641 L642 S644 C645 V648	V598-K607 HydrophobicContact CB-CG 4.02Å; V598-K607 HydrophobicContact CG1-CG 4.34Å; V598-K607 WeakPolarHBondContact O-CE 3.25Å; G600-K607 PolarHBondContact O-NZ 2.89Å; T603-K607 VanDerWaalsContact C-NZ 3.35Å; T603-K607 WeakPolarHBondContact O-CG 3.49Å; T603-K607 PolarHBondContact O-N 3.29Å; T603-K607 VanDerWaalsContact O-N 3.11Å; T603-K607 PolarHBondContact O-NZ 3.23Å; T603-K607 PolarHBondContact OG1-NZ 3.13Å; D604-K607 PolarHBondContact O-N 3.27Å; D604-K607 WeakPolarHBondContact OD1-CD 3.41Å; D604-K607 WeakPolarHBondContact OD1-CE 3.24Å; D604-K607 IonicContact OD1-NZ 2.77Å; D604-K607 PolarHBondContact OD1-NZ 3.02Å; E605-K607 VanDerWaalsContact C-N 3.3Å; E605-K607 PolarHBondContact O-N 3.23Å; K607-K611 PolarHBondContact O-N 3.02Å; K607-N641 VanDerWaalsContact CE-O 3.27Å; K607-N641 WeakPolarHBondContact CE-O 3.41Å; K607-L642 HydrophobicContact CB-CD2 3.83Å; K607-L642 HydrophobicContact CG-CD2 4.05Å; K607-S644 WeakPolarHBondContact CE-OG 3.38Å; K607-C645 HydrophobicContact CB-CB 4.3Å; K607-C645 HydrophobicContact CD-CB 3.58Å; K607-V648 HydrophobicContact CB-CG2 4.16Å
608	I	97.9	Very high	96.1	Very high	56 Å²	56	44.3 Å²	44.3	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-69.3	-42.7	175.6	-68.9	164.4	0	0	0	110.8	D604 E605 K611 N612 A647 V648	D604-I608 VanDerWaalsContact O-CG1 3.31Å; D604-I608 WeakPolarHBondContact O-CG1 3.23Å; D604-I608 PolarHBondContact O-N 3.39Å; E605-I608 CarbonylContact O-C 3.58Å; E605-I608 PolarHBondContact O-N 2.85Å; E605-I608 VanDerWaalsContact O-N 3.12Å; I608-K611 WeakPolarHBondContact O-CB 3.5Å; I608-K611 PolarHBondContact O-N 3.04Å; I608-N612 WeakPolarHBondContact O-CB 3.46Å; I608-N612 PolarHBondContact O-N 2.99Å; I608-N612 PolarHBondContact O-ND2 3.32Å; I608-N612 PolarHBondContact O-OD1 3.33Å; I608-A647 HydrophobicContact CD1-CB 4Å; I608-A647 HydrophobicContact CG1-CB 4.11Å; I608-V648 HydrophobicContact CG1-CG2 4.26Å
609	A	98.2	Very high	96.1	Very high	25 Å²	25	44.2 Å²	44.2	21%	0.207	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-47.3	174.2	0	0	0	0	0	111.5	C567 I572 E605 N606 K611 N612 V613	C567-A609 WeakPolarHBondContact SG-CB 3.21Å; I572-A609 HydrophobicContact CD1-CB 4.17Å; E605-A609 WeakPolarHBondContact O-CB 3.13Å; E605-A609 PolarHBondContact O-N 3.16Å; N606-A609 PolarHBondContact O-N 3.49Å; A609-K611 VanDerWaalsContact C-N 3.29Å; A609-K611 PolarHBondContact O-N 3.27Å; A609-N612 PolarHBondContact O-N 3.3Å; A609-V613 PolarHBondContact O-N 3.02Å
610	M	98.1	Very high	96.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58	-37.7	175.3	179.9	58.1	177.6	0	0	112.8	I572 V576 L594 V598 N606 G615 L619 V638 L642	I572-M610 HydrophobicContact CG2-CB 4.04Å; I572-M610 HydrophobicContact CG2-SD 3.94Å; V576-M610 HydrophobicContact CG2-CE 3.74Å; V576-M610 HydrophobicContact CG2-SD 3.31Å; V576-M610 WeakPolarHBondContact CG2-SD 3.41Å; L594-M610 HydrophobicContact CD1-CE 3.94Å; L594-M610 HydrophobicContact CD1-SD 4.49Å; L594-M610 HydrophobicContact CD2-CE 4.25Å; L594-M610 HydrophobicContact CD2-SD 3.83Å; V598-M610 HydrophobicContact CG1-CB 4.2Å; V598-M610 HydrophobicContact CG1-CG 4.25Å; N606-M610 WeakPolarHBondContact O-CB 3.36Å; N606-M610 PolarHBondContact O-N 3.22Å; M610-G615 VanDerWaalsContact O-CA 3.3Å; M610-G615 WeakPolarHBondContact O-CA 3.47Å; M610-G615 PolarHBondContact O-N 3.49Å; M610-L619 HydrophobicContact CE-CD1 3.6Å; M610-L619 HydrophobicContact CE-CD2 4.43Å; M610-L619 HydrophobicContact CE-CG 3.95Å; M610-V638 HydrophobicContact CE-CG1 4.24Å; M610-L642 HydrophobicContact CB-CD2 4Å; M610-L642 HydrophobicContact CG-CD1 4.03Å; M610-L642 HydrophobicContact CG-CD2 3.8Å; M610-L642 HydrophobicContact CG-CG 4.47Å
611	K	97.9	Very high	96.4	Very high	53 Å²	53	43.7 Å²	43.7	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-51	169.1	177	-170	65.7	174.7	0	111.2	K607 I608 A609 V613 G614 I616 A647 V648 T651	K607-K611 PolarHBondContact O-N 3.02Å; I608-K611 WeakPolarHBondContact O-CB 3.5Å; I608-K611 PolarHBondContact O-N 3.04Å; A609-K611 VanDerWaalsContact C-N 3.29Å; A609-K611 PolarHBondContact O-N 3.27Å; K611-V613 VanDerWaalsContact C-N 3.35Å; K611-V613 PolarHBondContact O-N 3.17Å; K611-G614 PolarHBondContact O-N 3.39Å; K611-I616 HydrophobicContact CB-CD1 4.3Å; K611-I616 HydrophobicContact CG-CD1 4.24Å; K611-A647 PolarHBondContact NZ-O 3.49Å; K611-V648 HydrophobicContact CB-CG1 4.33Å; K611-V648 HydrophobicContact CB-CG2 4.47Å; K611-V648 HydrophobicContact CD-CG1 4.49Å; K611-V648 HydrophobicContact CD-CG2 4.42Å; K611-T651 HydrophobicContact CD-CG2 4.26Å; K611-T651 HydrophobicContact CG-CG2 4.14Å
612	N	98	Very high	97	Very high	114 Å²	114	36.1 Å²	36.1	61%	0.61	20%	0.198	S	C	*	.	H	α-helix	trans	-66.3	-31.4	-171	-67.3	-6.3	0	0	0	113.3	I608 A609 G614	I608-N612 WeakPolarHBondContact O-CB 3.46Å; I608-N612 PolarHBondContact O-N 2.99Å; I608-N612 PolarHBondContact O-ND2 3.32Å; I608-N612 PolarHBondContact O-OD1 3.33Å; A609-N612 PolarHBondContact O-N 3.3Å; N612-G614 PolarHBondContact O-N 3.28Å
613	V	97.7	Very high	97.3	Very high	59 Å²	59	32.8 Å²	32.8	36%	0.358	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	6.4	174	-56.6	0	0	0	0	113.9	I572 K573 V576 A609 K611	I572-V613 HydrophobicContact CG2-CG2 4.22Å; K573-V613 HydrophobicContact CB-CG1 4.06Å; K573-V613 HydrophobicContact CG-CB 4.37Å; K573-V613 HydrophobicContact CG-CG1 4.21Å; V576-V613 HydrophobicContact CB-CG2 4.28Å; V576-V613 HydrophobicContact CG1-CG2 4.41Å; V576-V613 HydrophobicContact CG2-CG2 3.92Å; A609-V613 PolarHBondContact O-N 3.02Å; K611-V613 VanDerWaalsContact C-N 3.35Å; K611-V613 PolarHBondContact O-N 3.17Å
614	G	97.6	Very high	97.4	Very high	28 Å²	28	39.3 Å²	39.3	29%	0.289	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	19.3	-178.7	0	0	0	0	0	114.5	K611 N612 I616 P617 A618	K611-G614 PolarHBondContact O-N 3.39Å; N612-G614 PolarHBondContact O-N 3.28Å; G614-I616 VanDerWaalsContact C-N 3.31Å; G614-I616 PolarHBondContact O-N 2.66Å; G614-P617 VanDerWaalsContact O-CD 3.25Å; G614-P617 WeakPolarHBondContact O-CD 3.47Å; G614-A618 PolarHBondContact O-N 3.06Å; G614-A618 VanDerWaalsContact O-N 3.14Å
615	G	98.3	Very high	97.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-33	-178	0	0	0	0	0	114.1	M610 A618 L619	M610-G615 VanDerWaalsContact O-CA 3.3Å; M610-G615 WeakPolarHBondContact O-CA 3.47Å; M610-G615 PolarHBondContact O-N 3.49Å; G615-A618 PolarHBondContact O-N 3.38Å; G615-L619 WeakPolarHBondContact O-CB 3.4Å; G615-L619 VanDerWaalsContact O-CG 3.22Å; G615-L619 WeakPolarHBondContact O-CG 3.3Å; G615-L619 PolarHBondContact O-N 2.95Å
616	I	98.3	Very high	97	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-54.3	175.3	-67.4	163.9	0	0	0	111	K611 G614 A618 L619 L620 L642 V648 T651 I652 D655	K611-I616 HydrophobicContact CB-CD1 4.3Å; K611-I616 HydrophobicContact CG-CD1 4.24Å; G614-I616 VanDerWaalsContact C-N 3.31Å; G614-I616 PolarHBondContact O-N 2.66Å; I616-A618 VanDerWaalsContact C-N 3.29Å; I616-A618 PolarHBondContact O-N 3.45Å; I616-L619 PolarHBondContact O-N 2.71Å; I616-L620 HydrophobicContact CG2-CD1 3.93Å; I616-L620 VanDerWaalsContact O-CG 3.26Å; I616-L620 WeakPolarHBondContact O-CG 3.46Å; I616-L620 PolarHBondContact O-N 3.09Å; I616-L642 HydrophobicContact CG1-CD1 4.02Å; I616-V648 HydrophobicContact CD1-CG1 3.77Å; I616-T651 HydrophobicContact CD1-CG2 4.08Å; I616-I652 HydrophobicContact CD1-CG1 3.71Å; I616-I652 HydrophobicContact CG1-CG1 4.39Å; I616-D655 HydrophobicContact CG2-CB 4.24Å
617	P	97.9	Very high	96.6	Very high	53 Å²	53	45.5 Å²	45.5	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-50.8	-40.3	168.6	-31.6	34.1	0	0	0	115.3	G614 L620 R621	G614-P617 VanDerWaalsContact O-CD 3.25Å; G614-P617 WeakPolarHBondContact O-CD 3.47Å; P617-L620 PolarHBondContact O-N 3.12Å; P617-R621 WeakPolarHBondContact O-CG 3.45Å; P617-R621 PolarHBondContact O-N 3.23Å
618	A	98.3	Very high	96.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-48.6	179.1	0	0	0	0	0	112.6	V576 L579 G614 G615 I616 L620 R621 L622	V576-A618 HydrophobicContact CG1-CB 3.88Å; L579-A618 HydrophobicContact CD1-CB 3.99Å; G614-A618 PolarHBondContact O-N 3.06Å; G614-A618 VanDerWaalsContact O-N 3.14Å; G615-A618 PolarHBondContact O-N 3.38Å; I616-A618 VanDerWaalsContact C-N 3.29Å; I616-A618 PolarHBondContact O-N 3.45Å; A618-L620 PolarHBondContact O-N 2.79Å; A618-R621 WeakPolarHBondContact O-CB 3.36Å; A618-R621 PolarHBondContact O-N 3.34Å; A618-R621 VanDerWaalsContact O-N 3.12Å; A618-L622 PolarHBondContact O-N 3.42Å
619	L	98.4	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54	-41.5	172.2	-72.1	168.3	0	0	0	111.5	L579 M610 G615 I616 L622 L623 V635 V638 L639 L642	L579-L619 HydrophobicContact CD1-CD2 3.97Å; L579-L619 HydrophobicContact CD1-CG 4.18Å; M610-L619 HydrophobicContact CE-CD1 3.6Å; M610-L619 HydrophobicContact CE-CD2 4.43Å; M610-L619 HydrophobicContact CE-CG 3.95Å; G615-L619 WeakPolarHBondContact O-CB 3.4Å; G615-L619 VanDerWaalsContact O-CG 3.22Å; G615-L619 WeakPolarHBondContact O-CG 3.3Å; G615-L619 PolarHBondContact O-N 2.95Å; I616-L619 PolarHBondContact O-N 2.71Å; L619-L622 PolarHBondContact O-N 3.22Å; L619-L623 WeakPolarHBondContact O-CB 3.16Å; L619-L623 PolarHBondContact O-N 3Å; L619-V635 HydrophobicContact CB-CG1 4Å; L619-V635 HydrophobicContact CD2-CB 4.36Å; L619-V635 HydrophobicContact CD2-CG1 4.12Å; L619-V635 HydrophobicContact CD2-CG2 4.03Å; L619-V635 WeakPolarHBondContact O-CG1 3.48Å; L619-V638 HydrophobicContact CD1-CB 4.09Å; L619-V638 HydrophobicContact CD1-CG1 3.53Å; L619-V638 HydrophobicContact CD2-CB 4.11Å; L619-V638 HydrophobicContact CD2-CG1 4.14Å; L619-V638 HydrophobicContact CD2-CG2 4.33Å; L619-V638 HydrophobicContact CG-CG1 4.48Å; L619-L639 HydrophobicContact CB-CD2 4.48Å; L619-L639 HydrophobicContact CD1-CD2 3.89Å; L619-L639 HydrophobicContact CD1-CG 4.19Å; L619-L642 HydrophobicContact CD1-CD1 3.94Å
620	L	97.7	Very high	95.7	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-73	-30.3	179.1	-64.9	168.3	0	0	0	113.6	I616 P617 A618 R624 L639 D655 A656 T659	I616-L620 HydrophobicContact CG2-CD1 3.93Å; I616-L620 VanDerWaalsContact O-CG 3.26Å; I616-L620 WeakPolarHBondContact O-CG 3.46Å; I616-L620 PolarHBondContact O-N 3.09Å; P617-L620 PolarHBondContact O-N 3.12Å; A618-L620 PolarHBondContact O-N 2.79Å; L620-R624 VanDerWaalsContact O-CG 3.29Å; L620-R624 WeakPolarHBondContact O-CG 3.38Å; L620-R624 PolarHBondContact O-N 3.04Å; L620-L639 HydrophobicContact CD2-CD1 4.21Å; L620-D655 HydrophobicContact CD1-CB 4.39Å; L620-D655 VanDerWaalsContact CD1-O 3.31Å; L620-D655 WeakPolarHBondContact CD1-O 3.48Å; L620-A656 HydrophobicContact CD1-CB 3.8Å; L620-A656 HydrophobicContact CD2-CB 3.76Å; L620-A656 HydrophobicContact CG-CB 4.32Å; L620-T659 HydrophobicContact CD2-CG2 3.94Å
621	R	96.5	Very high	95.5	Very high	111 Å²	111	51.8 Å²	51.8	42%	0.419	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-49.1	167.1	-72.3	-170	-62.8	-87.6	9.1	110.1	D580 P617 A618 L623 R624 K625	D580-R621 IonicContact OD1-NE 3.64Å; D580-R621 PolarHBondContact OD1-NE 3.34Å; D580-R621 IonicContact OD2-CZ 3.7Å; D580-R621 IonicContact OD2-NE 3.19Å; D580-R621 PolarHBondContact OD2-NE 2.93Å; D580-R621 IonicContact OD2-NH2 2.71Å; D580-R621 PolarHBondContact OD2-NH2 3.12Å; P617-R621 WeakPolarHBondContact O-CG 3.45Å; P617-R621 PolarHBondContact O-N 3.23Å; A618-R621 WeakPolarHBondContact O-CB 3.36Å; A618-R621 PolarHBondContact O-N 3.34Å; A618-R621 VanDerWaalsContact O-N 3.12Å; R621-L623 PolarHBondContact O-N 3.34Å; R621-R624 PolarHBondContact O-N 3.4Å; R621-K625 WeakPolarHBondContact O-CB 3.23Å; R621-K625 PolarHBondContact O-N 2.95Å
622	L	96.8	Very high	95.4	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-42.4	-178.8	-174.5	54	0	0	0	112.4	L579 A618 L619 R624 K625 S626 I631 V635	L579-L622 HydrophobicContact CB-CD2 4.25Å; L579-L622 HydrophobicContact CD2-CD2 3.88Å; A618-L622 PolarHBondContact O-N 3.42Å; L619-L622 PolarHBondContact O-N 3.22Å; L622-R624 VanDerWaalsContact C-N 3.33Å; L622-R624 PolarHBondContact O-N 3.49Å; L622-K625 PolarHBondContact O-N 3.39Å; L622-S626 VanDerWaalsContact O-CB 3.23Å; L622-S626 WeakPolarHBondContact O-CB 3.49Å; L622-S626 PolarHBondContact O-N 3.34Å; L622-I631 HydrophobicContact CD1-CG2 3.84Å; L622-I631 HydrophobicContact CD2-CG2 3.84Å; L622-I631 HydrophobicContact CG-CG2 3.59Å; L622-V635 HydrophobicContact CB-CG2 4.33Å; L622-V635 HydrophobicContact CD2-CG2 3.78Å; L622-V635 HydrophobicContact CG-CG2 4Å
623	L	96	Very high	95.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.6	-36.9	176.8	-173.5	61.9	0	0	0	113.4	L619 R621 R632 V635 T636 L660 V664	L619-L623 WeakPolarHBondContact O-CB 3.16Å; L619-L623 PolarHBondContact O-N 3Å; R621-L623 PolarHBondContact O-N 3.34Å; L623-R632 HydrophobicContact CD1-CB 4.3Å; L623-R632 HydrophobicContact CD1-CG 4.21Å; L623-R632 PolarHBondContact O-NH1 2.89Å; L623-V635 HydrophobicContact CB-CG1 3.96Å; L623-V635 HydrophobicContact CD1-CG1 4.37Å; L623-T636 HydrophobicContact CD1-CG2 4.15Å; L623-T636 HydrophobicContact CD2-CG2 4.5Å; L623-L660 HydrophobicContact CD2-CD2 3.66Å; L623-V664 HydrophobicContact CD1-CG2 4.47Å; L623-V664 HydrophobicContact CD2-CG2 4.4Å
624	R	94.3	Very high	95.3	Very high	137 Å²	137	45.8 Å²	45.8	52%	0.517	23%	0.23	S	C	.	.	H	α-helix	trans	-78.2	-32.9	177.7	-66.4	176.6	-156.3	128.8	1	112.6	L620 R621 L622 T659 T663	L620-R624 VanDerWaalsContact O-CG 3.29Å; L620-R624 WeakPolarHBondContact O-CG 3.38Å; L620-R624 PolarHBondContact O-N 3.04Å; R621-R624 PolarHBondContact O-N 3.4Å; L622-R624 VanDerWaalsContact C-N 3.33Å; L622-R624 PolarHBondContact O-N 3.49Å; R624-T659 HydrophobicContact CG-CG2 3.98Å; R624-T659 PolarHBondContact NE-OG1 3.49Å; R624-T659 PolarHBondContact NH2-OG1 3.35Å; R624-T663 HydrophobicContact CG-CG2 4.44Å
625	K	93.3	Very high	95.3	Very high	133 Å²	133	44.5 Å²	44.5	58%	0.578	22%	0.217	S	C	*	.	H	α-helix	trans	-81.8	-31.9	-178.2	-175.2	-175.9	174.7	-167.6	0	112.8	R621 L622	R621-K625 WeakPolarHBondContact O-CB 3.23Å; R621-K625 PolarHBondContact O-N 2.95Å; L622-K625 PolarHBondContact O-N 3.39Å
626	S	90.8	Very high	95.3	Very high	12 Å²	12	44.5 Å²	44.5	8%	0.084	22%	0.217	C	C	.	.			trans	-91.8	130.2	-172.5	-168	0	0	0	0	113.7	L622 D628 R632	L622-S626 VanDerWaalsContact O-CB 3.23Å; L622-S626 WeakPolarHBondContact O-CB 3.49Å; L622-S626 PolarHBondContact O-N 3.34Å; S626-D628 PolarHBondContact OG-N 3.42Å; S626-D628 VanDerWaalsContact OG-N 3.13Å; S626-R632 WeakPolarHBondContact O-CD 3.49Å; S626-R632 PolarHBondContact O-NH1 3.36Å
627	I	88.7	Confident	95.3	Very high	168 Å²	168	44.6 Å²	44.6	86%	0.862	22%	0.218	S	C	*	.			trans	-94.4	-12	164.9	61.5	171.3	0	0	0	112.5	A629	I627-A629 PolarHBondContact O-N 3.08Å
628	D	91.3	Very high	95.3	Very high	40 Å²	40	42 Å²	42	21%	0.214	20%	0.201	C	C	.	.			trans	-68.7	123.8	179.3	174.2	-80.1	0	0	0	110.3	L584 K588 S626 E630 I631 R632	L584-D628 HydrophobicContact CD1-CB 4.24Å; K588-D628 VanDerWaalsContact CE-CG 3.43Å; K588-D628 WeakPolarHBondContact CE-OD1 3.46Å; K588-D628 VanDerWaalsContact CE-OD2 3.28Å; K588-D628 WeakPolarHBondContact CE-OD2 3.27Å; K588-D628 IonicContact NZ-OD1 2.74Å; K588-D628 PolarHBondContact NZ-OD1 3.29Å; K588-D628 IonicContact NZ-OD2 2.84Å; K588-D628 PolarHBondContact NZ-OD2 3.07Å; S626-D628 PolarHBondContact OG-N 3.42Å; S626-D628 VanDerWaalsContact OG-N 3.13Å; D628-E630 VanDerWaalsContact C-N 3.32Å; D628-E630 PolarHBondContact O-N 3.25Å; D628-E630 WeakPolarHBondContact OD1-CB 3.23Å; D628-E630 PolarHBondContact OD1-N 3.05Å; D628-E630 VanDerWaalsContact OD1-N 3.09Å; D628-I631 HydrophobicContact CB-CB 4.39Å; D628-I631 PolarHBondContact O-N 2.69Å; D628-I631 PolarHBondContact OD1-N 2.97Å; D628-R632 VanDerWaalsContact O-CG 3.27Å; D628-R632 WeakPolarHBondContact O-CG 3.45Å; D628-R632 PolarHBondContact O-N 3.05Å; D628-R632 VanDerWaalsContact O-N 3.08Å
629	A	90.2	Very high	95.4	Very high	69 Å²	69	42.1 Å²	42.1	57%	0.57	20%	0.202	S	C	*	.	H	α-helix	trans	-66.1	-33.9	-172.1	0	0	0	0	0	113	I627 R632 E633	I627-A629 PolarHBondContact O-N 3.08Å; A629-R632 PolarHBondContact O-N 3.39Å; A629-E633 PolarHBondContact O-N 3.29Å
630	E	93.4	Very high	95.3	Very high	104 Å²	104	45 Å²	45	49%	0.486	21%	0.213	S	C	.	.	H	α-helix	trans	-71.9	-44.3	-179.2	-178.8	179.9	-167.3	0	0	111	K588 D628 R632 E633 L634	K588-E630 HydrophobicContact CD-CG 4.43Å; K588-E630 WeakPolarHBondContact CD-OE2 3.27Å; K588-E630 VanDerWaalsContact CE-OE2 3.29Å; K588-E630 WeakPolarHBondContact CE-OE2 3.32Å; K588-E630 IonicContact NZ-OE2 3.96Å; K588-E630 PolarHBondContact NZ-OE2 2.81Å; D628-E630 VanDerWaalsContact C-N 3.32Å; D628-E630 PolarHBondContact O-N 3.25Å; D628-E630 WeakPolarHBondContact OD1-CB 3.23Å; D628-E630 PolarHBondContact OD1-N 3.05Å; D628-E630 VanDerWaalsContact OD1-N 3.09Å; E630-R632 VanDerWaalsContact C-N 3.32Å; E630-R632 PolarHBondContact O-N 3.47Å; E630-E633 PolarHBondContact O-N 3.32Å; E630-L634 HydrophobicContact CG-CD1 4.25Å; E630-L634 WeakPolarHBondContact O-CB 3.36Å; E630-L634 VanDerWaalsContact O-CG 3.3Å; E630-L634 WeakPolarHBondContact O-CG 3.06Å; E630-L634 PolarHBondContact O-N 3.47Å
631	I	95.3	Very high	95.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-43.6	170.7	-73	-175.1	0	0	0	110.7	L584 Q587 K588 L622 D628 E633 L634 V635	L584-I631 HydrophobicContact CD1-CD1 3.43Å; L584-I631 VanDerWaalsContact CD1-CD1 3.43Å; L584-I631 HydrophobicContact CG-CD1 4.08Å; Q587-I631 HydrophobicContact CB-CD1 3.97Å; K588-I631 HydrophobicContact CD-CG1 4.37Å; K588-I631 HydrophobicContact CG-CD1 3.97Å; K588-I631 HydrophobicContact CG-CG1 3.5Å; L622-I631 HydrophobicContact CD1-CG2 3.84Å; L622-I631 HydrophobicContact CD2-CG2 3.84Å; L622-I631 HydrophobicContact CG-CG2 3.59Å; D628-I631 HydrophobicContact CB-CB 4.39Å; D628-I631 PolarHBondContact O-N 2.69Å; D628-I631 PolarHBondContact OD1-N 2.97Å; I631-E633 VanDerWaalsContact C-N 3.31Å; I631-E633 PolarHBondContact O-N 2.96Å; I631-L634 PolarHBondContact O-N 3.49Å; I631-V635 HydrophobicContact CG2-CG2 4.19Å; I631-V635 WeakPolarHBondContact O-CB 3.18Å; I631-V635 VanDerWaalsContact O-CG2 3.25Å; I631-V635 WeakPolarHBondContact O-CG2 3.4Å; I631-V635 PolarHBondContact O-N 2.85Å
632	R	95.3	Very high	95.5	Very high	42 Å²	42	40.9 Å²	40.9	16%	0.158	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-37.7	177.5	-68.5	169.9	68.8	85.3	0.4	111.6	L623 S626 D628 A629 E630 T636 T663 H668 V689	L623-R632 HydrophobicContact CD1-CB 4.3Å; L623-R632 HydrophobicContact CD1-CG 4.21Å; L623-R632 PolarHBondContact O-NH1 2.89Å; S626-R632 WeakPolarHBondContact O-CD 3.49Å; S626-R632 PolarHBondContact O-NH1 3.36Å; D628-R632 VanDerWaalsContact O-CG 3.27Å; D628-R632 WeakPolarHBondContact O-CG 3.45Å; D628-R632 PolarHBondContact O-N 3.05Å; D628-R632 VanDerWaalsContact O-N 3.08Å; A629-R632 PolarHBondContact O-N 3.39Å; E630-R632 VanDerWaalsContact C-N 3.32Å; E630-R632 PolarHBondContact O-N 3.47Å; R632-T636 WeakPolarHBondContact O-CB 3.32Å; R632-T636 VanDerWaalsContact O-CG2 3.32Å; R632-T636 WeakPolarHBondContact O-CG2 3.3Å; R632-T636 PolarHBondContact O-N 2.99Å; R632-T636 VanDerWaalsContact O-N 3.16Å; R632-T636 PolarHBondContact O-OG1 3.05Å; R632-T663 PolarHBondContact NH2-O 3.29Å; R632-H668 PolarHBondContact NH2-NE2 3.22Å; R632-V689 HydrophobicContact CB-CG1 4.12Å; R632-V689 HydrophobicContact CB-CG2 4.01Å
633	E	95.6	Very high	95.5	Very high	42 Å²	42	40.8 Å²	40.8	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-49.4	174	-168.2	-162.9	141.5	0	0	111.9	R595 A629 E630 I631 V635 T636 G637 L688 V689 N692	R595-E633 IonicContact NH1-OE1 2.81Å; A629-E633 PolarHBondContact O-N 3.29Å; E630-E633 PolarHBondContact O-N 3.32Å; I631-E633 VanDerWaalsContact C-N 3.31Å; I631-E633 PolarHBondContact O-N 2.96Å; E633-V635 PolarHBondContact O-N 3.31Å; E633-T636 PolarHBondContact O-N 3.23Å; E633-T636 PolarHBondContact O-OG1 3.4Å; E633-T636 VanDerWaalsContact O-OG1 3.04Å; E633-G637 PolarHBondContact O-N 2.84Å; E633-L688 HydrophobicContact CG-CB 3.8Å; E633-L688 WeakPolarHBondContact OE2-CD1 3.17Å; E633-V689 HydrophobicContact CB-CG2 4.27Å; E633-N692 WeakPolarHBondContact CG-ND2 3.39Å; E633-N692 PolarHBondContact O-ND2 2.88Å
634	L	97.6	Very high	95.6	Very high	17 Å²	17	43.4 Å²	43.4	9%	0.089	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-49.6	179.4	-72.6	172.4	0	0	0	110.6	K588 C591 E630 I631 T636 G637 V638	K588-L634 HydrophobicContact CB-CD1 4.44Å; C591-L634 HydrophobicContact CB-CB 4.23Å; E630-L634 HydrophobicContact CG-CD1 4.25Å; E630-L634 WeakPolarHBondContact O-CB 3.36Å; E630-L634 VanDerWaalsContact O-CG 3.3Å; E630-L634 WeakPolarHBondContact O-CG 3.06Å; E630-L634 PolarHBondContact O-N 3.47Å; I631-L634 PolarHBondContact O-N 3.49Å; L634-T636 PolarHBondContact O-N 3.23Å; L634-G637 CarbonylContact O-C 3.6Å; L634-G637 WeakPolarHBondContact O-CA 3.45Å; L634-G637 PolarHBondContact O-N 2.92Å; L634-G637 VanDerWaalsContact O-N 3.16Å; L634-V638 WeakPolarHBondContact O-CG2 3.48Å; L634-V638 PolarHBondContact O-N 3.29Å
635	V	98.3	Very high	95.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-45.7	178.8	168	0	0	0	0	111.9	L619 L622 L623 I631 E633 G637 V638 L639	L619-V635 HydrophobicContact CB-CG1 4Å; L619-V635 HydrophobicContact CD2-CB 4.36Å; L619-V635 HydrophobicContact CD2-CG1 4.12Å; L619-V635 HydrophobicContact CD2-CG2 4.03Å; L619-V635 WeakPolarHBondContact O-CG1 3.48Å; L622-V635 HydrophobicContact CB-CG2 4.33Å; L622-V635 HydrophobicContact CD2-CG2 3.78Å; L622-V635 HydrophobicContact CG-CG2 4Å; L623-V635 HydrophobicContact CB-CG1 3.96Å; L623-V635 HydrophobicContact CD1-CG1 4.37Å; I631-V635 HydrophobicContact CG2-CG2 4.19Å; I631-V635 WeakPolarHBondContact O-CB 3.18Å; I631-V635 VanDerWaalsContact O-CG2 3.25Å; I631-V635 WeakPolarHBondContact O-CG2 3.4Å; I631-V635 PolarHBondContact O-N 2.85Å; E633-V635 PolarHBondContact O-N 3.31Å; V635-G637 VanDerWaalsContact C-N 3.3Å; V635-G637 PolarHBondContact O-N 3.41Å; V635-V638 PolarHBondContact O-N 3.42Å; V635-L639 HydrophobicContact CG1-CD1 4.23Å; V635-L639 WeakPolarHBondContact O-CG 3.47Å; V635-L639 PolarHBondContact O-N 2.86Å
636	T	97.9	Very high	95.8	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-69.8	-29.1	177.8	52.5	0	0	0	0	112.3	L623 R632 E633 L634 L639 W640 V664 V689 T693	L623-T636 HydrophobicContact CD1-CG2 4.15Å; L623-T636 HydrophobicContact CD2-CG2 4.5Å; R632-T636 WeakPolarHBondContact O-CB 3.32Å; R632-T636 VanDerWaalsContact O-CG2 3.32Å; R632-T636 WeakPolarHBondContact O-CG2 3.3Å; R632-T636 PolarHBondContact O-N 2.99Å; R632-T636 VanDerWaalsContact O-N 3.16Å; R632-T636 PolarHBondContact O-OG1 3.05Å; E633-T636 PolarHBondContact O-N 3.23Å; E633-T636 PolarHBondContact O-OG1 3.4Å; E633-T636 VanDerWaalsContact O-OG1 3.04Å; L634-T636 PolarHBondContact O-N 3.23Å; T636-L639 PolarHBondContact O-N 3.38Å; T636-W640 WeakPolarHBondContact O-CB 3.5Å; T636-W640 PolarHBondContact O-N 3.05Å; T636-V664 HydrophobicContact CG2-CG2 4.44Å; T636-V689 HydrophobicContact CG2-CG1 3.86Å; T636-T693 WeakPolarHBondContact CG2-OG1 3.38Å
637	G	98.1	Very high	96.1	Very high	2 Å²	2	36.8 Å²	36.8	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-67.1	-42.5	170	0	0	0	0	0	113.3	E633 L634 V635 L639 W640 N641	E633-G637 PolarHBondContact O-N 2.84Å; L634-G637 CarbonylContact O-C 3.6Å; L634-G637 WeakPolarHBondContact O-CA 3.45Å; L634-G637 PolarHBondContact O-N 2.92Å; L634-G637 VanDerWaalsContact O-N 3.16Å; V635-G637 VanDerWaalsContact C-N 3.3Å; V635-G637 PolarHBondContact O-N 3.41Å; G637-L639 VanDerWaalsContact C-N 3.35Å; G637-W640 PolarHBondContact O-N 3.39Å; G637-N641 PolarHBondContact O-N 2.83Å
638	V	98.6	Very high	96.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-44.8	172.4	-179.3	0	0	0	0	110.3	L594 R595 V598 M610 L619 L634 V635 W640 N641 L642	L594-V638 HydrophobicContact CB-CG2 4.42Å; R595-V638 HydrophobicContact CB-CG2 3.74Å; R595-V638 HydrophobicContact CG-CG2 4.43Å; V598-V638 HydrophobicContact CG2-CG1 4.05Å; M610-V638 HydrophobicContact CE-CG1 4.24Å; L619-V638 HydrophobicContact CD1-CB 4.09Å; L619-V638 HydrophobicContact CD1-CG1 3.53Å; L619-V638 HydrophobicContact CD2-CB 4.11Å; L619-V638 HydrophobicContact CD2-CG1 4.14Å; L619-V638 HydrophobicContact CD2-CG2 4.33Å; L619-V638 HydrophobicContact CG-CG1 4.48Å; L634-V638 WeakPolarHBondContact O-CG2 3.48Å; L634-V638 PolarHBondContact O-N 3.29Å; V635-V638 PolarHBondContact O-N 3.42Å; V638-W640 VanDerWaalsContact C-N 3.33Å; V638-W640 PolarHBondContact O-N 2.91Å; V638-N641 PolarHBondContact O-N 2.81Å; V638-L642 HydrophobicContact CG1-CD1 3.89Å; V638-L642 HydrophobicContact CG1-CG 4.24Å; V638-L642 WeakPolarHBondContact O-CB 3.44Å; V638-L642 VanDerWaalsContact O-CG 3.31Å; V638-L642 WeakPolarHBondContact O-CG 3.43Å; V638-L642 PolarHBondContact O-N 3.47Å
639	L	98.6	Very high	96.8	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-33.1	177.8	-69	171.7	0	0	0	112.7	L619 L620 V635 T636 G637 L642 S643 L660 C696	L619-L639 HydrophobicContact CB-CD2 4.48Å; L619-L639 HydrophobicContact CD1-CD2 3.89Å; L619-L639 HydrophobicContact CD1-CG 4.19Å; L620-L639 HydrophobicContact CD2-CD1 4.21Å; V635-L639 HydrophobicContact CG1-CD1 4.23Å; V635-L639 WeakPolarHBondContact O-CG 3.47Å; V635-L639 PolarHBondContact O-N 2.86Å; T636-L639 PolarHBondContact O-N 3.38Å; G637-L639 VanDerWaalsContact C-N 3.35Å; L639-L642 HydrophobicContact CD2-CD1 4.38Å; L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.43Å; L639-S643 PolarHBondContact O-N 3.02Å; L639-S643 PolarHBondContact O-OG 3.44Å; L639-L660 HydrophobicContact CD1-CD2 3.93Å; L639-C696 PolarHBondContact O-SG 2.74Å
640	W	98.4	Very high	97.2	Very high	62 Å²	62	27.3 Å²	27.3	24%	0.235	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-47.9	171.4	-169.8	8.7	0	0	0	111.4	T636 G637 V638 L642 S643 N692 G695 C696	T636-W640 WeakPolarHBondContact O-CB 3.5Å; T636-W640 PolarHBondContact O-N 3.05Å; G637-W640 PolarHBondContact O-N 3.39Å; V638-W640 VanDerWaalsContact C-N 3.33Å; V638-W640 PolarHBondContact O-N 2.91Å; W640-L642 PolarHBondContact O-N 3.22Å; W640-S643 PolarHBondContact O-N 2.83Å; W640-S643 PolarHBondContact O-OG 3.36Å; W640-N692 HydrophobicContact CE3-CB 4.03Å; W640-G695 PolarHBondContact NE1-O 3.26Å; W640-C696 HydrophobicContact CB-CB 4.26Å
641	N	98.3	Very high	97.4	Very high	26 Å²	26	24 Å²	24	14%	0.139	13%	0.131	C	C	.	.	H	α-helix	trans	-60.9	-43.4	176.5	-70.7	-1.3	0	0	0	112.2	R595 V598 K607 G637 V638 S643 S644	R595-N641 PolarHBondContact O-ND2 3.33Å; V598-N641 HydrophobicContact CB-CB 4.36Å; V598-N641 HydrophobicContact CG2-CB 3.48Å; V598-N641 VanDerWaalsContact CG2-CB 3.48Å; K607-N641 VanDerWaalsContact CE-O 3.27Å; K607-N641 WeakPolarHBondContact CE-O 3.41Å; G637-N641 PolarHBondContact O-N 2.83Å; V638-N641 PolarHBondContact O-N 2.81Å; N641-S643 VanDerWaalsContact C-N 3.32Å; N641-S643 PolarHBondContact O-N 2.93Å; N641-S644 PolarHBondContact O-N 3.44Å; N641-S644 PolarHBondContact O-OG 3.42Å
642	L	98.4	Very high	97.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-37.3	175.5	-74.8	171.9	0	0	0	112.5	V598 K607 M610 I616 L619 V638 L639 W640 S644 C645 V648 I652	V598-L642 HydrophobicContact CB-CD2 4.3Å; V598-L642 HydrophobicContact CG1-CD2 3.88Å; V598-L642 HydrophobicContact CG1-CG 4.48Å; V598-L642 HydrophobicContact CG2-CG 4.43Å; K607-L642 HydrophobicContact CB-CD2 3.83Å; K607-L642 HydrophobicContact CG-CD2 4.05Å; M610-L642 HydrophobicContact CB-CD2 4Å; M610-L642 HydrophobicContact CG-CD1 4.03Å; M610-L642 HydrophobicContact CG-CD2 3.8Å; M610-L642 HydrophobicContact CG-CG 4.47Å; I616-L642 HydrophobicContact CG1-CD1 4.02Å; L619-L642 HydrophobicContact CD1-CD1 3.94Å; V638-L642 HydrophobicContact CG1-CD1 3.89Å; V638-L642 HydrophobicContact CG1-CG 4.24Å; V638-L642 WeakPolarHBondContact O-CB 3.44Å; V638-L642 VanDerWaalsContact O-CG 3.31Å; V638-L642 WeakPolarHBondContact O-CG 3.43Å; V638-L642 PolarHBondContact O-N 3.47Å; L639-L642 HydrophobicContact CD2-CD1 4.38Å; W640-L642 PolarHBondContact O-N 3.22Å; L642-S644 PolarHBondContact O-N 3.27Å; L642-C645 PolarHBondContact O-N 2.82Å; L642-V648 HydrophobicContact CB-CG1 4.33Å; L642-I652 HydrophobicContact CB-CD1 3.9Å
643	S	98.1	Very high	97.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.6	-177.2	71.1	0	0	0	0	114.8	L639 W640 N641 C645 K649 N699	L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.43Å; L639-S643 PolarHBondContact O-N 3.02Å; L639-S643 PolarHBondContact O-OG 3.44Å; W640-S643 PolarHBondContact O-N 2.83Å; W640-S643 PolarHBondContact O-OG 3.36Å; N641-S643 VanDerWaalsContact C-N 3.32Å; N641-S643 PolarHBondContact O-N 2.93Å; S643-C645 VanDerWaalsContact C-N 3.28Å; S643-C645 PolarHBondContact O-N 3.4Å; S643-K649 WeakPolarHBondContact O-CE 3.4Å; S643-K649 WeakPolarHBondContact O-CG 3.32Å; S643-N699 WeakPolarHBondContact O-CB 3.49Å; S643-N699 WeakPolarHBondContact OG-CB 3.41Å; S643-N699 PolarHBondContact OG-ND2 3.44Å; S643-N699 VanDerWaalsContact OG-ND2 3.07Å
644	S	96.9	Very high	97.8	Very high	56 Å²	56	28.6 Å²	28.6	39%	0.392	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.6	175.6	76.1	0	0	0	0	112.7	K607 N641 L642	K607-S644 WeakPolarHBondContact CE-OG 3.38Å; N641-S644 PolarHBondContact O-N 3.44Å; N641-S644 PolarHBondContact O-OG 3.42Å; L642-S644 PolarHBondContact O-N 3.27Å
645	C	96.9	Very high	97.7	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.027	15%	0.154	C	C	.	.	S	Bend	trans	-89.4	121.6	-175.7	178.7	0	0	0	0	112.4	D604 K607 L642 S643 A647 V648 K649	D604-C645 VanDerWaalsContact CG-SG 3.57Å; D604-C645 WeakPolarHBondContact OD2-CB 3.03Å; D604-C645 PolarHBondContact OD2-SG 3.05Å; K607-C645 HydrophobicContact CB-CB 4.3Å; K607-C645 HydrophobicContact CD-CB 3.58Å; L642-C645 PolarHBondContact O-N 2.82Å; S643-C645 VanDerWaalsContact C-N 3.28Å; S643-C645 PolarHBondContact O-N 3.4Å; C645-A647 PolarHBondContact O-N 2.98Å; C645-V648 HydrophobicContact CB-CB 4.42Å; C645-V648 HydrophobicContact CB-CG2 4.14Å; C645-V648 PolarHBondContact O-N 3.32Å; C645-K649 PolarHBondContact O-N 2.91Å; C645-K649 VanDerWaalsContact O-N 3.1Å
646	D	95.8	Very high	97.7	Very high	87 Å²	87	29.9 Å²	29.9	47%	0.465	15%	0.154	S	C	.	.	H	α-helix	trans	-58.6	-33.6	-177.7	-69.2	-45.4	0	0	0	113	V648 K649 S1135	D646-V648 PolarHBondContact O-N 3.03Å; D646-V648 VanDerWaalsContact O-N 3.14Å; D646-K649 WeakPolarHBondContact OD1-CD 3.34Å; D646-K649 VanDerWaalsContact OD1-CE 3.24Å; D646-K649 WeakPolarHBondContact OD1-CE 3.27Å; D646-K649 IonicContact OD1-NZ 2.75Å; D646-K649 PolarHBondContact OD1-NZ 3.2Å; D646-S1135 PolarHBondContact OD2-OG 2.9Å
647	A	96.3	Very high	97.7	Very high	52 Å²	52	30.3 Å²	30.3	43%	0.43	16%	0.156	S	C	.	.	H	α-helix	trans	-70.9	-2.3	176.2	0	0	0	0	0	114.6	I608 K611 C645	I608-A647 HydrophobicContact CD1-CB 4Å; I608-A647 HydrophobicContact CG1-CB 4.11Å; K611-A647 PolarHBondContact NZ-O 3.49Å; C645-A647 PolarHBondContact O-N 2.98Å
648	V	97.9	Very high	97.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-122	-29.5	-178.9	-172.9	0	0	0	0	112.1	K607 I608 K611 I616 L642 C645 D646 M650 T651 I652	K607-V648 HydrophobicContact CB-CG2 4.16Å; I608-V648 HydrophobicContact CG1-CG2 4.26Å; K611-V648 HydrophobicContact CB-CG1 4.33Å; K611-V648 HydrophobicContact CB-CG2 4.47Å; K611-V648 HydrophobicContact CD-CG1 4.49Å; K611-V648 HydrophobicContact CD-CG2 4.42Å; I616-V648 HydrophobicContact CD1-CG1 3.77Å; L642-V648 HydrophobicContact CB-CG1 4.33Å; C645-V648 HydrophobicContact CB-CB 4.42Å; C645-V648 HydrophobicContact CB-CG2 4.14Å; C645-V648 PolarHBondContact O-N 3.32Å; D646-V648 PolarHBondContact O-N 3.03Å; D646-V648 VanDerWaalsContact O-N 3.14Å; V648-M650 PolarHBondContact O-N 3.48Å; V648-T651 WeakPolarHBondContact O-CB 3.43Å; V648-T651 PolarHBondContact O-N 2.98Å; V648-I652 HydrophobicContact CG1-CD1 3.95Å; V648-I652 HydrophobicContact CG1-CG1 4.08Å; V648-I652 PolarHBondContact O-N 3.4Å
649	K	97.9	Very high	97.5	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.035	18%	0.184	C	C	.	.	H	α-helix	trans	-46.7	-53.6	-178.2	-73.1	177.5	-169.5	170.7	0	113.8	S643 C645 D646 T651 I652 I653 L700 S702 A703	S643-K649 WeakPolarHBondContact O-CE 3.4Å; S643-K649 WeakPolarHBondContact O-CG 3.32Å; C645-K649 PolarHBondContact O-N 2.91Å; C645-K649 VanDerWaalsContact O-N 3.1Å; D646-K649 WeakPolarHBondContact OD1-CD 3.34Å; D646-K649 VanDerWaalsContact OD1-CE 3.24Å; D646-K649 WeakPolarHBondContact OD1-CE 3.27Å; D646-K649 IonicContact OD1-NZ 2.75Å; D646-K649 PolarHBondContact OD1-NZ 3.2Å; K649-T651 VanDerWaalsContact C-N 3.28Å; K649-T651 PolarHBondContact O-N 3.18Å; K649-I652 PolarHBondContact O-N 3.08Å; K649-I652 VanDerWaalsContact O-N 3.14Å; K649-I653 WeakPolarHBondContact O-CG1 3.42Å; K649-I653 PolarHBondContact O-N 3.06Å; K649-L700 HydrophobicContact CB-CD2 4.08Å; K649-L700 HydrophobicContact CG-CD2 4.14Å; K649-S702 PolarHBondContact NZ-OG 2.75Å; K649-A703 HydrophobicContact CB-CB 3.74Å; K649-A703 HydrophobicContact CD-CB 3.74Å; K649-A703 HydrophobicContact CG-CB 4.33Å
650	M	97.8	Very high	97.4	Very high	70 Å²	70	34.5 Å²	34.5	35%	0.345	18%	0.184	S	C	.	.	H	α-helix	trans	-64.4	-29	-177.5	-71.6	-55	-57	0	0	113.8	V648 I653 R654 A703 E706 A707	V648-M650 PolarHBondContact O-N 3.48Å; M650-I653 PolarHBondContact O-N 3.28Å; M650-I653 HydrophobicContact SD-CD1 3.81Å; M650-R654 WeakPolarHBondContact O-CB 3.48Å; M650-R654 PolarHBondContact O-N 3.47Å; M650-A703 HydrophobicContact SD-CB 4.3Å; M650-E706 HydrophobicContact CE-CB 4.31Å; M650-E706 HydrophobicContact CE-CG 3.93Å; M650-A707 HydrophobicContact SD-CB 4.02Å
651	T	97.9	Very high	97.3	Very high	34 Å²	34	31.5 Å²	31.5	21%	0.209	17%	0.173	C	C	.	.	H	α-helix	trans	-70.1	-41.9	173.9	-53.1	0	0	0	0	111	K611 I616 V648 K649 I653 R654 D655	K611-T651 HydrophobicContact CD-CG2 4.26Å; K611-T651 HydrophobicContact CG-CG2 4.14Å; I616-T651 HydrophobicContact CD1-CG2 4.08Å; V648-T651 WeakPolarHBondContact O-CB 3.43Å; V648-T651 PolarHBondContact O-N 2.98Å; K649-T651 VanDerWaalsContact C-N 3.28Å; K649-T651 PolarHBondContact O-N 3.18Å; T651-I653 VanDerWaalsContact C-N 3.33Å; T651-I653 PolarHBondContact O-N 3.42Å; T651-R654 PolarHBondContact O-N 3.23Å; T651-D655 WeakPolarHBondContact CG2-OD2 3.49Å; T651-D655 VanDerWaalsContact O-CB 3.28Å; T651-D655 WeakPolarHBondContact O-CB 3.38Å; T651-D655 PolarHBondContact O-N 2.9Å
652	I	98.4	Very high	97.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-39.2	174.1	-56.7	170	0	0	0	110.5	I616 L642 V648 K649 A656 L657 L700	I616-I652 HydrophobicContact CD1-CG1 3.71Å; I616-I652 HydrophobicContact CG1-CG1 4.39Å; L642-I652 HydrophobicContact CB-CD1 3.9Å; V648-I652 HydrophobicContact CG1-CD1 3.95Å; V648-I652 HydrophobicContact CG1-CG1 4.08Å; V648-I652 PolarHBondContact O-N 3.4Å; K649-I652 PolarHBondContact O-N 3.08Å; K649-I652 VanDerWaalsContact O-N 3.14Å; I652-A656 HydrophobicContact CG2-CB 3.67Å; I652-A656 VanDerWaalsContact O-CA 3.31Å; I652-A656 WeakPolarHBondContact O-CA 3.46Å; I652-A656 WeakPolarHBondContact O-CB 3.23Å; I652-A656 PolarHBondContact O-N 3.42Å; I652-L657 PolarHBondContact O-N 3.38Å; I652-L700 HydrophobicContact CB-CD1 4.24Å; I652-L700 HydrophobicContact CB-CD2 3.84Å; I652-L700 HydrophobicContact CD1-CD2 4.22Å; I652-L700 HydrophobicContact CG2-CD1 3.64Å; I652-L700 HydrophobicContact CG2-CD2 3.98Å; I652-L700 HydrophobicContact CG2-CG 4.4Å
653	I	98.3	Very high	96.8	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-50.9	176.6	-67.2	167.9	0	0	0	110.6	K649 M650 T651 D655 L657 L700 A703 A707 Q710	K649-I653 WeakPolarHBondContact O-CG1 3.42Å; K649-I653 PolarHBondContact O-N 3.06Å; M650-I653 PolarHBondContact O-N 3.28Å; M650-I653 HydrophobicContact SD-CD1 3.81Å; T651-I653 VanDerWaalsContact C-N 3.33Å; T651-I653 PolarHBondContact O-N 3.42Å; I653-D655 PolarHBondContact O-N 3.45Å; I653-L657 HydrophobicContact CG2-CD2 4.13Å; I653-L657 WeakPolarHBondContact O-CB 3.31Å; I653-L657 PolarHBondContact O-N 3.29Å; I653-L700 HydrophobicContact CD1-CB 4Å; I653-L700 HydrophobicContact CG1-CB 3.8Å; I653-L700 HydrophobicContact CG1-CD1 3.86Å; I653-L700 HydrophobicContact CG1-CD2 4.12Å; I653-L700 HydrophobicContact CG1-CG 4.1Å; I653-A703 HydrophobicContact CD1-CB 4.29Å; I653-A707 HydrophobicContact CD1-CB 3.37Å; I653-Q710 HydrophobicContact CG2-CB 3.94Å
654	R	96.9	Very high	96.5	Very high	177 Å²	177	36.2 Å²	36.2	67%	0.668	20%	0.199	S	C	*	.	H	α-helix	trans	-63.2	-42.9	179.9	-169.2	-165.9	66.5	178.2	-2.6	112.8	M650 T651	M650-R654 WeakPolarHBondContact O-CB 3.48Å; M650-R654 PolarHBondContact O-N 3.47Å; T651-R654 PolarHBondContact O-N 3.23Å
655	D	96.3	Very high	96.4	Very high	45 Å²	45	33.6 Å²	33.6	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-97.2	-31	-167.3	-60.6	-13.3	0	0	0	113.5	I616 L620 T651 I653	I616-D655 HydrophobicContact CG2-CB 4.24Å; L620-D655 HydrophobicContact CD1-CB 4.39Å; L620-D655 VanDerWaalsContact CD1-O 3.31Å; L620-D655 WeakPolarHBondContact CD1-O 3.48Å; T651-D655 WeakPolarHBondContact CG2-OD2 3.49Å; T651-D655 VanDerWaalsContact O-CB 3.28Å; T651-D655 WeakPolarHBondContact O-CB 3.38Å; T651-D655 PolarHBondContact O-N 2.9Å; I653-D655 PolarHBondContact O-N 3.45Å
656	A	97.6	Very high	96.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-108	-31.7	-171.3	0	0	0	0	0	114.7	L620 I652 S658 T659 L660	L620-A656 HydrophobicContact CD1-CB 3.8Å; L620-A656 HydrophobicContact CD2-CB 3.76Å; L620-A656 HydrophobicContact CG-CB 4.32Å; I652-A656 HydrophobicContact CG2-CB 3.67Å; I652-A656 VanDerWaalsContact O-CA 3.31Å; I652-A656 WeakPolarHBondContact O-CA 3.46Å; I652-A656 WeakPolarHBondContact O-CB 3.23Å; I652-A656 PolarHBondContact O-N 3.42Å; A656-S658 PolarHBondContact O-N 3.4Å; A656-T659 CarbonylContact O-C 3.58Å; A656-T659 WeakPolarHBondContact O-CA 3.38Å; A656-T659 WeakPolarHBondContact O-CB 3.46Å; A656-T659 PolarHBondContact O-N 3.36Å; A656-L660 HydrophobicContact CB-CD1 3.94Å; A656-L660 HydrophobicContact CB-CG 4.14Å; A656-L660 PolarHBondContact O-N 3.15Å
657	L	98.1	Very high	95.8	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-50.4	-52	-165.7	176.6	62.2	0	0	0	114	I652 I653 T659 L660 T661 L697 Q710 M711 C714 L717	I652-L657 PolarHBondContact O-N 3.38Å; I653-L657 HydrophobicContact CG2-CD2 4.13Å; I653-L657 WeakPolarHBondContact O-CB 3.31Å; I653-L657 PolarHBondContact O-N 3.29Å; L657-T659 VanDerWaalsContact C-N 3.34Å; L657-T659 PolarHBondContact O-N 3.1Å; L657-L660 PolarHBondContact O-N 2.97Å; L657-T661 WeakPolarHBondContact O-CB 3.33Å; L657-T661 PolarHBondContact O-N 2.86Å; L657-T661 PolarHBondContact O-OG1 2.96Å; L657-L697 HydrophobicContact CD1-CD2 3.62Å; L657-Q710 HydrophobicContact CD2-CB 4.33Å; L657-M711 HydrophobicContact CD1-CG 3.93Å; L657-M711 HydrophobicContact CD2-CG 3.93Å; L657-C714 HydrophobicContact CD2-CB 4.12Å; L657-C714 HydrophobicContact CG-CB 4.23Å; L657-L717 HydrophobicContact CD1-CD2 3.81Å
658	S	96.3	Very high	95.3	Very high	71 Å²	71	33.2 Å²	33.2	50%	0.497	17%	0.174	S	C	.	.	H	α-helix	trans	-64.8	-36.6	177.9	172.2	0	0	0	0	112.2	A656 N662	A656-S658 PolarHBondContact O-N 3.4Å; S658-N662 VanDerWaalsContact O-CB 3.3Å; S658-N662 WeakPolarHBondContact O-CB 3.43Å; S658-N662 VanDerWaalsContact O-CG 3.29Å; S658-N662 PolarHBondContact O-N 3.21Å; S658-N662 PolarHBondContact O-ND2 2.94Å; S658-N662 VanDerWaalsContact O-ND2 3.15Å; S658-N662 PolarHBondContact OG-ND2 3.45Å
659	T	96.1	Very high	94.7	Very high	18 Å²	18	33.4 Å²	33.4	11%	0.11	18%	0.175	C	C	.	.	H	α-helix	trans	-68	-47.2	176.3	-62.4	0	0	0	0	111.6	L620 R624 A656 L657 T661 N662 T663	L620-T659 HydrophobicContact CD2-CG2 3.94Å; R624-T659 HydrophobicContact CG-CG2 3.98Å; R624-T659 PolarHBondContact NE-OG1 3.49Å; R624-T659 PolarHBondContact NH2-OG1 3.35Å; A656-T659 CarbonylContact O-C 3.58Å; A656-T659 WeakPolarHBondContact O-CA 3.38Å; A656-T659 WeakPolarHBondContact O-CB 3.46Å; A656-T659 PolarHBondContact O-N 3.36Å; L657-T659 VanDerWaalsContact C-N 3.34Å; L657-T659 PolarHBondContact O-N 3.1Å; T659-T661 VanDerWaalsContact C-N 3.31Å; T659-T661 PolarHBondContact O-N 3.44Å; T659-N662 PolarHBondContact O-N 3.39Å; T659-T663 HydrophobicContact CG2-CG2 4.14Å; T659-T663 WeakPolarHBondContact O-CB 3.41Å; T659-T663 WeakPolarHBondContact O-CG2 3.46Å; T659-T663 PolarHBondContact O-N 2.84Å; T659-T663 PolarHBondContact O-OG1 3.38Å
660	L	97.3	Very high	93.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.1	-39.6	178.4	-67.9	179	0	0	0	111.6	L623 L639 A656 L657 V664 I665 T693	L623-L660 HydrophobicContact CD2-CD2 3.66Å; L639-L660 HydrophobicContact CD1-CD2 3.93Å; A656-L660 HydrophobicContact CB-CD1 3.94Å; A656-L660 HydrophobicContact CB-CG 4.14Å; A656-L660 PolarHBondContact O-N 3.15Å; L657-L660 PolarHBondContact O-N 2.97Å; L660-V664 WeakPolarHBondContact O-CB 3.21Å; L660-V664 PolarHBondContact O-N 3.16Å; L660-V664 VanDerWaalsContact O-N 3.12Å; L660-I665 PolarHBondContact O-N 3.15Å; L660-T693 HydrophobicContact CB-CG2 3.83Å; L660-T693 HydrophobicContact CD1-CG2 4.3Å; L660-T693 HydrophobicContact CD2-CG2 4.01Å; L660-T693 HydrophobicContact CG-CG2 4.26Å
661	T	96.2	Very high	92.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	I	π-helix	trans	-62.4	-52.5	175.4	-56.8	0	0	0	0	111	L657 T659 I665 V666 C714 E715 L717	L657-T661 WeakPolarHBondContact O-CB 3.33Å; L657-T661 PolarHBondContact O-N 2.86Å; L657-T661 PolarHBondContact O-OG1 2.96Å; T659-T661 VanDerWaalsContact C-N 3.31Å; T659-T661 PolarHBondContact O-N 3.44Å; T661-I665 PolarHBondContact O-N 3.15Å; T661-V666 HydrophobicContact CG2-CG2 4.02Å; T661-V666 PolarHBondContact O-N 3.12Å; T661-C714 PolarHBondContact OG1-SG 2.79Å; T661-C714 VanDerWaalsContact OG1-SG 3.42Å; T661-E715 WeakPolarHBondContact CG2-O 3.17Å; T661-L717 HydrophobicContact CG2-CB 3.84Å; T661-L717 HydrophobicContact CG2-CD1 4.46Å
662	N	93.3	Very high	91.4	Very high	88 Å²	88	38.8 Å²	38.8	47%	0.471	20%	0.202	S	C	.	.	I	π-helix	trans	-80.3	-25.9	-172.1	-66.3	-29.1	0	0	0	114.6	S658 T659 P667	S658-N662 VanDerWaalsContact O-CB 3.3Å; S658-N662 WeakPolarHBondContact O-CB 3.43Å; S658-N662 VanDerWaalsContact O-CG 3.29Å; S658-N662 PolarHBondContact O-N 3.21Å; S658-N662 PolarHBondContact O-ND2 2.94Å; S658-N662 VanDerWaalsContact O-ND2 3.15Å; S658-N662 PolarHBondContact OG-ND2 3.45Å; T659-N662 PolarHBondContact O-N 3.39Å; N662-P667 WeakPolarHBondContact O-CD 3.28Å; N662-P667 WeakPolarHBondContact O-CG 3.42Å
663	T	92	Very high	89.4	Confident	37 Å²	37	42 Å²	42	23%	0.227	22%	0.219	C	C	.	.	I	π-helix	trans	-102.9	-12.6	-177.7	67.1	0	0	0	0	114.7	R624 R632 T659	R624-T663 HydrophobicContact CG-CG2 4.44Å; R632-T663 PolarHBondContact NH2-O 3.29Å; T659-T663 HydrophobicContact CG2-CG2 4.14Å; T659-T663 WeakPolarHBondContact O-CB 3.41Å; T659-T663 WeakPolarHBondContact O-CG2 3.46Å; T659-T663 PolarHBondContact O-N 2.84Å; T659-T663 PolarHBondContact O-OG1 3.38Å
664	V	92.7	Very high	87	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-130.6	-60.2	177.1	-172.9	0	0	0	0	112.1	L623 T636 L660 P667 H668 V689 L690 T693	L623-V664 HydrophobicContact CD1-CG2 4.47Å; L623-V664 HydrophobicContact CD2-CG2 4.4Å; T636-V664 HydrophobicContact CG2-CG2 4.44Å; L660-V664 WeakPolarHBondContact O-CB 3.21Å; L660-V664 PolarHBondContact O-N 3.16Å; L660-V664 VanDerWaalsContact O-N 3.12Å; V664-P667 WeakPolarHBondContact O-CD 3.42Å; V664-H668 WeakPolarHBondContact O-CB 3.29Å; V664-H668 PolarHBondContact O-CD2 2.91Å; V664-H668 VanDerWaalsContact O-CD2 3.23Å; V664-H668 PolarHBondContact O-N 3.49Å; V664-V689 HydrophobicContact CG1-CG1 3.93Å; V664-V689 HydrophobicContact CG2-CG1 4.09Å; V664-L690 HydrophobicContact CG1-CB 4.44Å; V664-L690 HydrophobicContact CG1-CD1 4.19Å; V664-T693 HydrophobicContact CB-CG2 4.24Å; V664-T693 HydrophobicContact CG1-CG2 4.32Å
665	I	94.2	Very high	84.3	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	25%	0.252	C	S	.	.	I	π-helix	trans	-64	-52.9	-169.4	-55.9	-52.8	0	0	0	112.6	L660 T661 S669 L690 T693 T694 L697 L717	L660-I665 PolarHBondContact O-N 3.15Å; T661-I665 PolarHBondContact O-N 3.15Å; I665-S669 WeakPolarHBondContact O-CB 3.43Å; I665-S669 PolarHBondContact O-N 2.81Å; I665-S669 PolarHBondContact O-OG 2.82Å; I665-L690 HydrophobicContact CD1-CD1 3.45Å; I665-L690 VanDerWaalsContact CD1-CD1 3.45Å; I665-T693 HydrophobicContact CD1-CG2 3.64Å; I665-T693 HydrophobicContact CG1-CG2 4.15Å; I665-T694 HydrophobicContact CD1-CG2 3.93Å; I665-L697 HydrophobicContact CD1-CD1 3.66Å; I665-L697 HydrophobicContact CG1-CD1 3.62Å; I665-L717 HydrophobicContact CG1-CD1 4.39Å; I665-L717 HydrophobicContact CG2-CD1 4.21Å
666	V	91.8	Very high	81.8	Confident	18 Å²	18	50.4 Å²	50.4	11%	0.109	28%	0.283	C	S	.	.	H	α-helix	trans	-64.1	-47.6	-178.8	172.4	0	0	0	0	111.4	T661 S669 W671 N672	T661-V666 HydrophobicContact CG2-CG2 4.02Å; T661-V666 PolarHBondContact O-N 3.12Å; V666-S669 PolarHBondContact O-OG 3.36Å; V666-W671 HydrophobicContact CG1-CE3 4.15Å; V666-W671 HydrophobicContact CG1-CZ3 4.5Å; V666-W671 HydrophobicContact CG2-CE3 4.3Å; V666-W671 HydrophobicContact CG2-CZ3 4.42Å; V666-N672 HydrophobicContact CG1-CB 3.86Å
667	P	88.2	Confident	79.4	Confident	64 Å²	64	54.7 Å²	54.7	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-71	-35.9	179.9	-20.8	34.3	0	0	0	114.7	N662 V664	N662-P667 WeakPolarHBondContact O-CD 3.28Å; N662-P667 WeakPolarHBondContact O-CG 3.42Å; V664-P667 WeakPolarHBondContact O-CD 3.42Å
668	H	86.3	Confident	77	Confident	53 Å²	53	59 Å²	59	25%	0.245	33%	0.329	C	S	.	.	H	α-helix	trans	-90	-15.1	-175.7	-66.8	-115.9	0	0	0	113.9	R632 V664 S687 L690	R632-H668 PolarHBondContact NH2-NE2 3.22Å; V664-H668 WeakPolarHBondContact O-CB 3.29Å; V664-H668 PolarHBondContact O-CD2 2.91Å; V664-H668 VanDerWaalsContact O-CD2 3.23Å; V664-H668 PolarHBondContact O-N 3.49Å; H668-S687 PolarHBondContact ND1-OG 3.45Å; H668-L690 HydrophobicContact CB-CB 4.17Å; H668-L690 HydrophobicContact CB-CD1 4.29Å; H668-L690 HydrophobicContact CB-CD2 3.93Å; H668-L690 HydrophobicContact CB-CG 4.36Å
669	S	85.3	Confident	74.7	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-75.8	-22.7	172.6	60.4	0	0	0	0	113.5	I665 V666 W671 S720 Y723	I665-S669 WeakPolarHBondContact O-CB 3.43Å; I665-S669 PolarHBondContact O-N 2.81Å; I665-S669 PolarHBondContact O-OG 2.82Å; V666-S669 PolarHBondContact O-OG 3.36Å; S669-W671 VanDerWaalsContact C-N 3.29Å; S669-W671 PolarHBondContact O-N 3.4Å; S669-W671 PolarHBondContact OG-N 2.83Å; S669-S720 WeakPolarHBondContact OG-CB 3.39Å; S669-Y723 VanDerWaalsContact O-CD1 3.22Å; S669-Y723 WeakPolarHBondContact O-CD1 3.36Å; S669-Y723 VanDerWaalsContact O-CE1 3.26Å; S669-Y723 WeakPolarHBondContact O-CE1 3.43Å
670	G	78.3	Confident	72.7	Confident	18 Å²	18	62.7 Å²	62.7	19%	0.186	34%	0.34	C	S	.	.			trans	80.7	-2.1	-172.8	0	0	0	0	0	115	N672 N673	G670-N672 PolarHBondContact O-N 3.28Å; G670-N672 VanDerWaalsContact O-N 3.15Å; G670-N673 PolarHBondContact O-N 3.4Å; G670-N673 VanDerWaalsContact O-N 3.15Å
671	W	79.2	Confident	70.4	Confident	93 Å²	93	67 Å²	67	35%	0.352	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-33.5	-175.1	173.8	60.4	0	0	0	114.3	V666 S669 G716 D719 Y723	V666-W671 HydrophobicContact CG1-CE3 4.15Å; V666-W671 HydrophobicContact CG1-CZ3 4.5Å; V666-W671 HydrophobicContact CG2-CE3 4.3Å; V666-W671 HydrophobicContact CG2-CZ3 4.42Å; S669-W671 VanDerWaalsContact C-N 3.29Å; S669-W671 PolarHBondContact O-N 3.4Å; S669-W671 PolarHBondContact OG-N 2.83Å; W671-G716 VanDerWaalsContact CZ3-CA 3.41Å; W671-D719 HydrophobicContact CD2-CB 3.88Å; W671-D719 HydrophobicContact CE3-CB 4.37Å; W671-D719 HydrophobicContact CG-CB 4.48Å; W671-D719 HydrophobicContact CH2-CB 3.92Å; W671-D719 HydrophobicContact CZ2-CB 3.33Å; W671-D719 HydrophobicContact CZ3-CB 4.4Å; W671-Y723 HydrophobicContact CB-CD1 4.02Å; W671-Y723 HydrophobicContact CB-CD2 4.47Å; W671-Y723 HydrophobicContact CB-CG 3.89Å; W671-Y723 AromaticContact CD1-CD2 3.98Å; W671-Y723 HydrophobicContact CG-CG 4.38Å
672	N	66.4	Low	68.2	Low	115 Å²	115	72 Å²	72	62%	0.615	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	6.3	-176.7	-160	42.4	0	0	0	114.1	V666 G670	V666-N672 HydrophobicContact CG1-CB 3.86Å; G670-N672 PolarHBondContact O-N 3.28Å; G670-N672 VanDerWaalsContact O-N 3.15Å
673	N	57.8	Low	66.3	Low	67 Å²	67	73 Å²	73	36%	0.358	38%	0.384	S	S	.	.			trans	-91	107.9	177.7	-79.4	13.4	0	0	0	110.3	G670 S675	G670-N673 PolarHBondContact O-N 3.4Å; G670-N673 VanDerWaalsContact O-N 3.15Å; N673-S675 PolarHBondContact O-N 3.47Å; N673-S675 VanDerWaalsContact O-N 3.16Å
674	S	46.6	Very low	64.7	Low	128 Å²	128	71.6 Å²	71.6	90%	0.895	38%	0.375	S	S	*	.			trans	-75.8	8.8	177.1	56.4	0	0	0	0	114.6
675	S	39.7	Very low	63	Low	69 Å²	69	74.7 Å²	74.7	48%	0.483	39%	0.389	S	S	.	.	S	Bend	trans	-110.6	118.9	-178.4	53	0	0	0	0	111.1	N673 D677	N673-S675 PolarHBondContact O-N 3.47Å; N673-S675 VanDerWaalsContact O-N 3.16Å; S675-D677 VanDerWaalsContact C-N 3.32Å; S675-D677 PolarHBondContact O-N 2.88Å
676	F	45.3	Very low	61.5	Low	205 Å²	205	79.5 Å²	79.5	90%	0.899	42%	0.419	S	S	*	.			trans	-70.4	86.7	169.4	-77.8	-102.6	0	0	0	109.8
677	D	45.8	Very low	61.1	Low	89 Å²	89	79.4 Å²	79.4	48%	0.476	42%	0.419	S	S	.	.			trans	-120	108.1	174.5	-153.8	-15.2	0	0	0	108.7	S675 D679 H680	S675-D677 VanDerWaalsContact C-N 3.32Å; S675-D677 PolarHBondContact O-N 2.88Å; D677-D679 PolarHBondContact O-N 3.18Å; D677-H680 WeakPolarHBondContact O-CB 3.43Å; D677-H680 PolarHBondContact O-N 2.98Å; D677-H680 VanDerWaalsContact O-N 3.08Å
678	D	49.4	Very low	61.2	Low	102 Å²	102	79.5 Å²	79.5	55%	0.545	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.7	-171.3	-78.7	-48.2	0	0	0	112.7	H680 K681	D678-H680 PolarHBondContact O-N 2.69Å; D678-K681 WeakPolarHBondContact O-CB 3.28Å; D678-K681 PolarHBondContact O-N 3.38Å; D678-K681 WeakPolarHBondContact OD1-CD 3.26Å; D678-K681 WeakPolarHBondContact OD1-CE 3.22Å; D678-K681 IonicContact OD1-NZ 3.78Å; D678-K681 PolarHBondContact OD1-NZ 2.98Å
679	D	47.4	Very low	61.5	Low	78 Å²	78	77.6 Å²	77.6	42%	0.417	41%	0.408	S	S	.	.	H	α-helix	trans	-60.1	-26.2	174	-177	45.6	0	0	0	112.5	D677 K683	D677-D679 PolarHBondContact O-N 3.18Å; D679-K683 WeakPolarHBondContact O-CD 3.4Å; D679-K683 VanDerWaalsContact O-CG 3.31Å; D679-K683 WeakPolarHBondContact O-CG 3.3Å; D679-K683 PolarHBondContact O-N 3.15Å; D679-K683 WeakPolarHBondContact OD1-CE 3.31Å; D679-K683 IonicContact OD1-NZ 2.67Å; D679-K683 VanDerWaalsContact OD2-CE 3.3Å; D679-K683 WeakPolarHBondContact OD2-CE 3.33Å; D679-K683 IonicContact OD2-NZ 3.34Å; D679-K683 PolarHBondContact OD2-NZ 3.39Å
680	H	52.8	Low	61.9	Low	88 Å²	88	77.5 Å²	77.5	41%	0.407	41%	0.407	S	S	.	.	H	α-helix	trans	-72.6	-27.8	172.3	-84.2	-58	0	0	0	113.9	D677 D678 K683 F684	D677-H680 WeakPolarHBondContact O-CB 3.43Å; D677-H680 PolarHBondContact O-N 2.98Å; D677-H680 VanDerWaalsContact O-N 3.08Å; D678-H680 PolarHBondContact O-N 2.69Å; H680-K683 PolarHBondContact O-N 3.44Å; H680-F684 PolarHBondContact O-N 2.95Å; H680-F684 VanDerWaalsContact O-N 3.08Å
681	K	50.3	Low	62.7	Low	90 Å²	90	80.6 Å²	80.6	39%	0.391	41%	0.413	S	S	.	.	H	α-helix	trans	-66.2	-43.3	178.9	-61.8	174.8	-178.5	168.3	0	110.9	D678 K683 F684 Q685	D678-K681 WeakPolarHBondContact O-CB 3.28Å; D678-K681 PolarHBondContact O-N 3.38Å; D678-K681 WeakPolarHBondContact OD1-CD 3.26Å; D678-K681 WeakPolarHBondContact OD1-CE 3.22Å; D678-K681 IonicContact OD1-NZ 3.78Å; D678-K681 PolarHBondContact OD1-NZ 2.98Å; K681-K683 VanDerWaalsContact C-N 3.34Å; K681-K683 PolarHBondContact O-N 3.03Å; K681-F684 PolarHBondContact O-N 3.46Å; K681-Q685 PolarHBondContact O-N 3.39Å
682	I	49.6	Very low	63.6	Low	105 Å²	105	76.2 Å²	76.2	54%	0.538	40%	0.396	S	S	.	.	H	α-helix	trans	-64.2	-39.9	177.2	-57.8	173.5	0	0	0	110.7	F684 Q685 T686	I682-F684 PolarHBondContact O-N 3.32Å; I682-Q685 PolarHBondContact O-N 2.96Å; I682-T686 PolarHBondContact O-OG1 3.28Å
683	K	52.9	Low	65.1	Low	109 Å²	109	70.8 Å²	70.8	47%	0.474	37%	0.367	S	S	.	.	H	α-helix	trans	-69.1	-28.4	178.5	-72.5	168.5	-179.1	171.8	0	113.9	D679 H680 K681 S687	D679-K683 WeakPolarHBondContact O-CD 3.4Å; D679-K683 VanDerWaalsContact O-CG 3.31Å; D679-K683 WeakPolarHBondContact O-CG 3.3Å; D679-K683 PolarHBondContact O-N 3.15Å; D679-K683 WeakPolarHBondContact OD1-CE 3.31Å; D679-K683 IonicContact OD1-NZ 2.67Å; D679-K683 VanDerWaalsContact OD2-CE 3.3Å; D679-K683 WeakPolarHBondContact OD2-CE 3.33Å; D679-K683 IonicContact OD2-NZ 3.34Å; D679-K683 PolarHBondContact OD2-NZ 3.39Å; H680-K683 PolarHBondContact O-N 3.44Å; K681-K683 VanDerWaalsContact C-N 3.34Å; K681-K683 PolarHBondContact O-N 3.03Å; K683-S687 WeakPolarHBondContact O-CB 3.35Å
684	F	59.2	Low	67	Low	8 Å²	8	67.6 Å²	67.6	4%	0.035	35%	0.35	C	S	.	.	H	α-helix	trans	-64.7	-51.7	172.1	154.5	-99	0	0	0	111.1	H680 K681 I682 T686 S687 L690 V724 T738	H680-F684 PolarHBondContact O-N 2.95Å; H680-F684 VanDerWaalsContact O-N 3.08Å; K681-F684 PolarHBondContact O-N 3.46Å; I682-F684 PolarHBondContact O-N 3.32Å; F684-T686 VanDerWaalsContact C-N 3.3Å; F684-T686 PolarHBondContact O-N 3.44Å; F684-S687 WeakPolarHBondContact O-CB 3.3Å; F684-S687 PolarHBondContact O-N 3.32Å; F684-S687 VanDerWaalsContact O-N 3.15Å; F684-L690 HydrophobicContact CD2-CD2 3.36Å; F684-L690 HydrophobicContact CE2-CD2 3.45Å; F684-L690 VanDerWaalsContact CE2-CD2 3.45Å; F684-V724 HydrophobicContact CD2-CG2 4.23Å; F684-V724 HydrophobicContact CE2-CB 4.22Å; F684-V724 HydrophobicContact CE2-CG1 3.77Å; F684-V724 HydrophobicContact CE2-CG2 3.55Å; F684-V724 HydrophobicContact CZ-CB 4.32Å; F684-V724 HydrophobicContact CZ-CG1 3.53Å; F684-V724 HydrophobicContact CZ-CG2 4.14Å; F684-T738 HydrophobicContact CE2-CG2 3.77Å; F684-T738 HydrophobicContact CZ-CG2 3.94Å
685	Q	55.9	Low	69.5	Low	66 Å²	66	61.5 Å²	61.5	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-61.9	-36.2	-170.8	-64.8	174.8	-56.9	0	0	112.9	K681 I682 T731	K681-Q685 PolarHBondContact O-N 3.39Å; I682-Q685 PolarHBondContact O-N 2.96Å; Q685-T731 PolarHBondContact NE2-OG1 2.65Å
686	T	63.2	Low	72.3	Confident	102 Å²	102	58.3 Å²	58.3	63%	0.626	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	0.3	-178.6	48.5	0	0	0	0	114.3	I682 F684 L688	I682-T686 PolarHBondContact O-OG1 3.28Å; F684-T686 VanDerWaalsContact C-N 3.3Å; F684-T686 PolarHBondContact O-N 3.44Å; T686-L688 PolarHBondContact O-N 3.36Å
687	S	83.4	Confident	74.8	Confident	16 Å²	16	48.5 Å²	48.5	11%	0.112	24%	0.242	C	C	.	.			trans	-73.6	96.5	-173.7	-168.2	0	0	0	0	113.1	H668 K683 F684 V689 L690 R691	H668-S687 PolarHBondContact ND1-OG 3.45Å; K683-S687 WeakPolarHBondContact O-CB 3.35Å; F684-S687 WeakPolarHBondContact O-CB 3.3Å; F684-S687 PolarHBondContact O-N 3.32Å; F684-S687 VanDerWaalsContact O-N 3.15Å; S687-V689 PolarHBondContact O-N 3.32Å; S687-L690 PolarHBondContact O-N 2.9Å; S687-R691 PolarHBondContact O-N 3.13Å
688	L	90.7	Very high	77.3	Confident	66 Å²	66	47.1 Å²	47.1	35%	0.346	23%	0.23	S	C	.	.	H	α-helix	trans	-57.8	-36.3	175.2	-58.6	174.8	0	0	0	112.2	E633 T686 L690 R691 N692	E633-L688 HydrophobicContact CG-CB 3.8Å; E633-L688 WeakPolarHBondContact OE2-CD1 3.17Å; T686-L688 PolarHBondContact O-N 3.36Å; L688-L690 PolarHBondContact O-N 3.47Å; L688-R691 VanDerWaalsContact CD2-CZ 3.45Å; L688-R691 PolarHBondContact O-N 2.79Å; L688-N692 WeakPolarHBondContact O-CB 3.25Å; L688-N692 PolarHBondContact O-N 3.45Å; L688-N692 PolarHBondContact O-ND2 2.85Å; L688-N692 PolarHBondContact O-OD1 3.44Å
689	V	93.3	Very high	79.6	Confident	12 Å²	12	43.7 Å²	43.7	7%	0.073	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-43.9	174	-170.5	0	0	0	0	111.5	R632 E633 T636 V664 S687 T693	R632-V689 HydrophobicContact CB-CG1 4.12Å; R632-V689 HydrophobicContact CB-CG2 4.01Å; E633-V689 HydrophobicContact CB-CG2 4.27Å; T636-V689 HydrophobicContact CG2-CG1 3.86Å; V664-V689 HydrophobicContact CG1-CG1 3.93Å; V664-V689 HydrophobicContact CG2-CG1 4.09Å; S687-V689 PolarHBondContact O-N 3.32Å; V689-T693 WeakPolarHBondContact O-CB 3.48Å; V689-T693 PolarHBondContact O-N 3.49Å; V689-T693 PolarHBondContact O-OG1 2.81Å
690	L	93.7	Very high	82.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-73.8	-39.9	177.9	-177.4	60.6	0	0	0	112	V664 I665 H668 F684 S687 L688 N692 T693 T694 T738	V664-L690 HydrophobicContact CG1-CB 4.44Å; V664-L690 HydrophobicContact CG1-CD1 4.19Å; I665-L690 HydrophobicContact CD1-CD1 3.45Å; I665-L690 VanDerWaalsContact CD1-CD1 3.45Å; H668-L690 HydrophobicContact CB-CB 4.17Å; H668-L690 HydrophobicContact CB-CD1 4.29Å; H668-L690 HydrophobicContact CB-CD2 3.93Å; H668-L690 HydrophobicContact CB-CG 4.36Å; F684-L690 HydrophobicContact CD2-CD2 3.36Å; F684-L690 HydrophobicContact CE2-CD2 3.45Å; F684-L690 VanDerWaalsContact CE2-CD2 3.45Å; S687-L690 PolarHBondContact O-N 2.9Å; L688-L690 PolarHBondContact O-N 3.47Å; L690-N692 VanDerWaalsContact C-N 3.32Å; L690-N692 PolarHBondContact O-N 3.27Å; L690-T693 PolarHBondContact O-N 3.21Å; L690-T694 HydrophobicContact CD1-CG2 3.94Å; L690-T694 HydrophobicContact CG-CG2 4.28Å; L690-T694 WeakPolarHBondContact O-CB 3.34Å; L690-T694 WeakPolarHBondContact O-CG2 3.36Å; L690-T694 PolarHBondContact O-N 3.22Å; L690-T694 PolarHBondContact O-OG1 3.23Å; L690-T738 HydrophobicContact CD2-CG2 4.18Å; L690-T738 HydrophobicContact CG-CG2 4.06Å
691	R	95.3	Very high	84.2	Confident	84 Å²	84	35.9 Å²	35.9	32%	0.317	17%	0.173	S	C	.	.	H	α-helix	trans	-57.4	-45.8	174	-171.5	-172	71.2	176.5	2	111.3	S687 L688 T694 G695 K737 N741	S687-R691 PolarHBondContact O-N 3.13Å; L688-R691 VanDerWaalsContact CD2-CZ 3.45Å; L688-R691 PolarHBondContact O-N 2.79Å; R691-T694 PolarHBondContact O-OG1 2.9Å; R691-G695 PolarHBondContact O-N 2.95Å; R691-K737 HydrophobicContact CG-CB 4.14Å; R691-K737 HydrophobicContact CG-CG 4.42Å; R691-N741 PolarHBondContact O-ND2 3.4Å
692	N	97.4	Very high	86.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68.2	-41.9	178.4	-64.3	-5.7	0	0	0	111.3	E633 W640 L688 L690 G695 C696	E633-N692 WeakPolarHBondContact CG-ND2 3.39Å; E633-N692 PolarHBondContact O-ND2 2.88Å; W640-N692 HydrophobicContact CE3-CB 4.03Å; L688-N692 WeakPolarHBondContact O-CB 3.25Å; L688-N692 PolarHBondContact O-N 3.45Å; L688-N692 PolarHBondContact O-ND2 2.85Å; L688-N692 PolarHBondContact O-OD1 3.44Å; L690-N692 VanDerWaalsContact C-N 3.32Å; L690-N692 PolarHBondContact O-N 3.27Å; N692-G695 PolarHBondContact O-N 2.88Å; N692-C696 PolarHBondContact O-N 3.45Å
693	T	98.1	Very high	88.5	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-69.1	-40.6	179.8	-54.3	0	0	0	0	112.6	T636 L660 V664 I665 V689 L690 G695 C696 L697	T636-T693 WeakPolarHBondContact CG2-OG1 3.38Å; L660-T693 HydrophobicContact CB-CG2 3.83Å; L660-T693 HydrophobicContact CD1-CG2 4.3Å; L660-T693 HydrophobicContact CD2-CG2 4.01Å; L660-T693 HydrophobicContact CG-CG2 4.26Å; V664-T693 HydrophobicContact CB-CG2 4.24Å; V664-T693 HydrophobicContact CG1-CG2 4.32Å; I665-T693 HydrophobicContact CD1-CG2 3.64Å; I665-T693 HydrophobicContact CG1-CG2 4.15Å; V689-T693 WeakPolarHBondContact O-CB 3.48Å; V689-T693 PolarHBondContact O-N 3.49Å; V689-T693 PolarHBondContact O-OG1 2.81Å; L690-T693 PolarHBondContact O-N 3.21Å; T693-G695 VanDerWaalsContact C-N 3.32Å; T693-C696 WeakPolarHBondContact O-CB 3.37Å; T693-C696 PolarHBondContact O-N 2.74Å; T693-L697 HydrophobicContact CG2-CD1 4.18Å; T693-L697 VanDerWaalsContact O-CG 3.31Å; T693-L697 WeakPolarHBondContact O-CG 3.17Å; T693-L697 PolarHBondContact O-N 3.43Å
694	T	97.7	Very high	90.4	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-66.3	-35.8	173.9	53.3	0	0	0	0	111.4	I665 L690 R691 L697 R698 L721 T738	I665-T694 HydrophobicContact CD1-CG2 3.93Å; L690-T694 HydrophobicContact CD1-CG2 3.94Å; L690-T694 HydrophobicContact CG-CG2 4.28Å; L690-T694 WeakPolarHBondContact O-CB 3.34Å; L690-T694 WeakPolarHBondContact O-CG2 3.36Å; L690-T694 PolarHBondContact O-N 3.22Å; L690-T694 PolarHBondContact O-OG1 3.23Å; R691-T694 PolarHBondContact O-OG1 2.9Å; T694-L697 PolarHBondContact O-N 2.77Å; T694-R698 WeakPolarHBondContact O-CB 3.49Å; T694-R698 PolarHBondContact O-N 3.18Å; T694-L721 HydrophobicContact CG2-CD2 4.26Å; T694-T738 HydrophobicContact CG2-CG2 4.24Å
695	G	98.1	Very high	92.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.1	-40.8	171.1	0	0	0	0	0	113.3	W640 R691 N692 T693 N699 N741	W640-G695 PolarHBondContact NE1-O 3.26Å; R691-G695 PolarHBondContact O-N 2.95Å; N692-G695 PolarHBondContact O-N 2.88Å; T693-G695 VanDerWaalsContact C-N 3.32Å; G695-N699 PolarHBondContact O-N 2.9Å; G695-N741 VanDerWaalsContact CA-ND2 3.26Å; G695-N741 WeakPolarHBondContact CA-ND2 3.35Å; G695-N741 PolarHBondContact N-ND2 2.85Å
696	C	98.5	Very high	93.9	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-54	171.2	-175.3	0	0	0	0	110.7	L639 W640 N692 T693 R698 N699 L700	L639-C696 PolarHBondContact O-SG 2.74Å; W640-C696 HydrophobicContact CB-CB 4.26Å; N692-C696 PolarHBondContact O-N 3.45Å; T693-C696 WeakPolarHBondContact O-CB 3.37Å; T693-C696 PolarHBondContact O-N 2.74Å; C696-R698 VanDerWaalsContact C-N 3.33Å; C696-R698 PolarHBondContact O-N 3.04Å; C696-N699 WeakPolarHBondContact O-CB 3.37Å; C696-N699 PolarHBondContact O-N 3.25Å; C696-L700 WeakPolarHBondContact O-CG 3.48Å; C696-L700 PolarHBondContact O-N 2.88Å
697	L	98.6	Very high	95.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.8	-36.8	-178.6	-67.9	162.6	0	0	0	113.2	L657 I665 T693 T694 N699 L700 S701 M711 L717	L657-L697 HydrophobicContact CD1-CD2 3.62Å; I665-L697 HydrophobicContact CD1-CD1 3.66Å; I665-L697 HydrophobicContact CG1-CD1 3.62Å; T693-L697 HydrophobicContact CG2-CD1 4.18Å; T693-L697 VanDerWaalsContact O-CG 3.31Å; T693-L697 WeakPolarHBondContact O-CG 3.17Å; T693-L697 PolarHBondContact O-N 3.43Å; T694-L697 PolarHBondContact O-N 2.77Å; L697-N699 VanDerWaalsContact C-N 3.34Å; L697-N699 PolarHBondContact O-N 3.45Å; L697-L700 HydrophobicContact CD2-CD1 4.38Å; L697-L700 PolarHBondContact O-N 3.31Å; L697-S701 WeakPolarHBondContact O-CB 3.41Å; L697-S701 PolarHBondContact O-N 3.49Å; L697-S701 PolarHBondContact O-OG 2.85Å; L697-M711 HydrophobicContact CB-CE 4.04Å; L697-M711 HydrophobicContact CD2-CE 3.96Å; L697-L717 HydrophobicContact CD1-CD1 4.01Å
698	R	98.4	Very high	96.2	Very high	59 Å²	59	26.1 Å²	26.1	22%	0.223	14%	0.136	C	C	.	.	H	α-helix	trans	-54.8	-50.1	171.1	178.6	-171.5	-173.9	168.6	2.4	111	T694 C696 S701 E740 N741 C744 T745	T694-R698 WeakPolarHBondContact O-CB 3.49Å; T694-R698 PolarHBondContact O-N 3.18Å; C696-R698 VanDerWaalsContact C-N 3.33Å; C696-R698 PolarHBondContact O-N 3.04Å; R698-S701 PolarHBondContact O-N 2.86Å; R698-S701 PolarHBondContact O-OG 3.48Å; R698-E740 IonicContact CZ-OE1 2.66Å; R698-E740 VanDerWaalsContact CZ-OE1 3.31Å; R698-E740 IonicContact NH1-OE1 3.22Å; R698-E740 PolarHBondContact NH1-OE1 3.28Å; R698-E740 IonicContact NH2-OE1 3.78Å; R698-E740 PolarHBondContact NH2-OE1 2.73Å; R698-N741 VanDerWaalsContact CD-OD1 3.31Å; R698-N741 WeakPolarHBondContact CD-OD1 3.49Å; R698-N741 PolarHBondContact NH1-OD1 3.04Å; R698-C744 HydrophobicContact CG-CB 3.79Å; R698-C744 PolarHBondContact NH2-SG 2.8Å; R698-C744 VanDerWaalsContact NH2-SG 3.37Å; R698-T745 VanDerWaalsContact CA-OG1 3.26Å; R698-T745 WeakPolarHBondContact CA-OG1 3.33Å; R698-T745 PolarHBondContact N-OG1 3.24Å
699	N	98	Very high	96.3	Very high	31 Å²	31	26.5 Å²	26.5	17%	0.166	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-42.8	177.4	-68.5	-11.5	0	0	0	111.8	S643 G695 C696 L697 S701 S702	S643-N699 WeakPolarHBondContact O-CB 3.49Å; S643-N699 WeakPolarHBondContact OG-CB 3.41Å; S643-N699 PolarHBondContact OG-ND2 3.44Å; S643-N699 VanDerWaalsContact OG-ND2 3.07Å; G695-N699 PolarHBondContact O-N 2.9Å; C696-N699 WeakPolarHBondContact O-CB 3.37Å; C696-N699 PolarHBondContact O-N 3.25Å; L697-N699 VanDerWaalsContact C-N 3.34Å; L697-N699 PolarHBondContact O-N 3.45Å; N699-S701 PolarHBondContact O-N 3.39Å; N699-S702 WeakPolarHBondContact O-CB 3.49Å; N699-S702 PolarHBondContact O-N 3.22Å; N699-S702 PolarHBondContact O-OG 2.9Å
700	L	98.4	Very high	96.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.5	-42.2	178	-60.9	-173.4	0	0	0	112.4	K649 I652 I653 C696 L697 S702 A703 M711	K649-L700 HydrophobicContact CB-CD2 4.08Å; K649-L700 HydrophobicContact CG-CD2 4.14Å; I652-L700 HydrophobicContact CB-CD1 4.24Å; I652-L700 HydrophobicContact CB-CD2 3.84Å; I652-L700 HydrophobicContact CD1-CD2 4.22Å; I652-L700 HydrophobicContact CG2-CD1 3.64Å; I652-L700 HydrophobicContact CG2-CD2 3.98Å; I652-L700 HydrophobicContact CG2-CG 4.4Å; I653-L700 HydrophobicContact CD1-CB 4Å; I653-L700 HydrophobicContact CG1-CB 3.8Å; I653-L700 HydrophobicContact CG1-CD1 3.86Å; I653-L700 HydrophobicContact CG1-CD2 4.12Å; I653-L700 HydrophobicContact CG1-CG 4.1Å; C696-L700 WeakPolarHBondContact O-CG 3.48Å; C696-L700 PolarHBondContact O-N 2.88Å; L697-L700 HydrophobicContact CD2-CD1 4.38Å; L697-L700 PolarHBondContact O-N 3.31Å; L700-S702 PolarHBondContact O-N 3.23Å; L700-A703 VanDerWaalsContact O-CB 3.29Å; L700-A703 WeakPolarHBondContact O-CB 3.32Å; L700-A703 PolarHBondContact O-N 3.47Å; L700-M711 HydrophobicContact CB-SD 4.1Å
701	S	98.1	Very high	96.7	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-14.7	180	69.6	0	0	0	0	114.5	L697 R698 N699 M711 N748	L697-S701 WeakPolarHBondContact O-CB 3.41Å; L697-S701 PolarHBondContact O-N 3.49Å; L697-S701 PolarHBondContact O-OG 2.85Å; R698-S701 PolarHBondContact O-N 2.86Å; R698-S701 PolarHBondContact O-OG 3.48Å; N699-S701 PolarHBondContact O-N 3.39Å; S701-M711 VanDerWaalsContact CA-SD 3.59Å; S701-N748 WeakPolarHBondContact OG-CB 3.33Å; S701-N748 PolarHBondContact OG-ND2 3.39Å
702	S	96.5	Very high	96.7	Very high	44 Å²	44	25.4 Å²	25.4	31%	0.308	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-14.4	173.5	73.1	0	0	0	0	114.5	K649 N699 L700 G704	K649-S702 PolarHBondContact NZ-OG 2.75Å; N699-S702 WeakPolarHBondContact O-CB 3.49Å; N699-S702 PolarHBondContact O-N 3.22Å; N699-S702 PolarHBondContact O-OG 2.9Å; L700-S702 PolarHBondContact O-N 3.23Å; S702-G704 PolarHBondContact O-N 3.47Å
703	A	93.1	Very high	96.5	Very high	31 Å²	31	29.2 Å²	29.2	26%	0.256	16%	0.158	S	C	.	.	S	Bend	trans	-73.8	8.9	-168.1	0	0	0	0	0	116	K649 M650 I653 L700 A707	K649-A703 HydrophobicContact CB-CB 3.74Å; K649-A703 HydrophobicContact CD-CB 3.74Å; K649-A703 HydrophobicContact CG-CB 4.33Å; M650-A703 HydrophobicContact SD-CB 4.3Å; I653-A703 HydrophobicContact CD1-CB 4.29Å; L700-A703 VanDerWaalsContact O-CB 3.29Å; L700-A703 WeakPolarHBondContact O-CB 3.32Å; L700-A703 PolarHBondContact O-N 3.47Å; A703-A707 HydrophobicContact CB-CB 3.8Å
704	G	93.3	Very high	96.4	Very high	25 Å²	25	30 Å²	30	26%	0.258	16%	0.164	S	C	.	.			trans	114.6	-169.1	175.3	0	0	0	0	0	114.7	S702 R708	S702-G704 PolarHBondContact O-N 3.47Å; G704-R708 WeakPolarHBondContact O-CG 3.38Å; G704-R708 PolarHBondContact O-N 3.47Å; G704-R708 PolarHBondContact O-NH1 3.36Å
705	E	94.3	Very high	96.1	Very high	71 Å²	71	38.1 Å²	38.1	33%	0.332	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-45.5	-174.6	-178.7	175.7	142.6	0	0	112.7	A707 R708 K709 R752 E756	E705-A707 VanDerWaalsContact C-N 3.34Å; E705-A707 PolarHBondContact O-N 2.92Å; E705-R708 PolarHBondContact O-N 3.41Å; E705-R708 VanDerWaalsContact O-N 3.17Å; E705-K709 HydrophobicContact CG-CD 4.17Å; E705-K709 WeakPolarHBondContact O-CG 3.03Å; E705-K709 PolarHBondContact O-N 2.93Å; E705-K709 VanDerWaalsContact OE1-CE 3.26Å; E705-K709 WeakPolarHBondContact OE1-CE 3.3Å; E705-K709 IonicContact OE1-NZ 2.75Å; E705-K709 PolarHBondContact OE1-NZ 3.28Å; E705-R752 IonicContact OE2-NH2 2.64Å; E705-E756 HydrophobicContact CG-CG 3.91Å
706	E	94.5	Very high	95.9	Very high	95 Å²	95	38.2 Å²	38.2	44%	0.444	20%	0.203	S	C	.	.	H	α-helix	trans	-64.6	-39.3	-178.7	-174.1	53.4	-150.8	0	0	112	M650 R708 K709 Q710	M650-E706 HydrophobicContact CE-CB 4.31Å; M650-E706 HydrophobicContact CE-CG 3.93Å; E706-R708 PolarHBondContact O-N 3.03Å; E706-K709 PolarHBondContact O-N 3.14Å; E706-Q710 WeakPolarHBondContact O-CG 3.48Å; E706-Q710 PolarHBondContact O-N 3.43Å; E706-Q710 WeakPolarHBondContact OE1-CG 3.46Å; E706-Q710 PolarHBondContact OE1-NE2 3.48Å
707	A	96.4	Very high	95.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-47.5	171.8	0	0	0	0	0	112.2	M650 I653 A703 E705 Q710 M711	M650-A707 HydrophobicContact SD-CB 4.02Å; I653-A707 HydrophobicContact CD1-CB 3.37Å; A703-A707 HydrophobicContact CB-CB 3.8Å; E705-A707 VanDerWaalsContact C-N 3.34Å; E705-A707 PolarHBondContact O-N 2.92Å; A707-Q710 PolarHBondContact O-N 3.44Å; A707-M711 WeakPolarHBondContact O-CB 3.36Å; A707-M711 VanDerWaalsContact O-CG 3.3Å; A707-M711 WeakPolarHBondContact O-CG 3.49Å; A707-M711 PolarHBondContact O-N 2.98Å
708	R	97	Very high	95.6	Very high	26 Å²	26	38.2 Å²	38.2	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-41.5	175.9	-68.4	-175.4	-66.8	-89.6	7.9	111.9	G704 E705 E706 M711 R712 N748 L749 E756	G704-R708 WeakPolarHBondContact O-CG 3.38Å; G704-R708 PolarHBondContact O-N 3.47Å; G704-R708 PolarHBondContact O-NH1 3.36Å; E705-R708 PolarHBondContact O-N 3.41Å; E705-R708 VanDerWaalsContact O-N 3.17Å; E706-R708 PolarHBondContact O-N 3.03Å; R708-M711 PolarHBondContact O-N 3.04Å; R708-R712 VanDerWaalsContact O-CB 3.27Å; R708-R712 WeakPolarHBondContact O-CB 3.47Å; R708-R712 WeakPolarHBondContact O-CG 3.33Å; R708-R712 PolarHBondContact O-N 3.22Å; R708-N748 WeakPolarHBondContact CD-O 3.49Å; R708-L749 HydrophobicContact CB-CD2 4.37Å; R708-L749 HydrophobicContact CG-CD2 4.36Å; R708-E756 IonicContact CZ-OE1 2.56Å; R708-E756 IonicContact CZ-OE2 2.69Å; R708-E756 IonicContact NE-OE1 3.63Å; R708-E756 PolarHBondContact NE-OE1 3.07Å; R708-E756 IonicContact NE-OE2 2.86Å; R708-E756 PolarHBondContact NE-OE2 3.39Å; R708-E756 IonicContact NH2-OE1 3.23Å; R708-E756 PolarHBondContact NH2-OE1 3.31Å; R708-E756 IonicContact NH2-OE2 2.68Å
709	K	94.8	Very high	95.4	Very high	73 Å²	73	36.1 Å²	36.1	32%	0.317	20%	0.196	S	C	.	.	H	α-helix	trans	-60.5	-47.2	177.3	-76.9	171.4	170.1	171.3	0	112.2	E705 E706 S713	E705-K709 HydrophobicContact CG-CD 4.17Å; E705-K709 WeakPolarHBondContact O-CG 3.03Å; E705-K709 PolarHBondContact O-N 2.93Å; E705-K709 VanDerWaalsContact OE1-CE 3.26Å; E705-K709 WeakPolarHBondContact OE1-CE 3.3Å; E705-K709 IonicContact OE1-NZ 2.75Å; E705-K709 PolarHBondContact OE1-NZ 3.28Å; E706-K709 PolarHBondContact O-N 3.14Å; K709-S713 WeakPolarHBondContact O-CB 3.22Å; K709-S713 PolarHBondContact O-N 3.05Å; K709-S713 VanDerWaalsContact O-N 3.07Å; K709-S713 PolarHBondContact O-OG 3.44Å
710	Q	96.1	Very high	95.3	Very high	63 Å²	63	34.6 Å²	34.6	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-67.4	-42.8	178.4	-66.6	-174.8	25.3	0	0	111.7	I653 L657 E706 A707 S713 C714	I653-Q710 HydrophobicContact CG2-CB 3.94Å; L657-Q710 HydrophobicContact CD2-CB 4.33Å; E706-Q710 WeakPolarHBondContact O-CG 3.48Å; E706-Q710 PolarHBondContact O-N 3.43Å; E706-Q710 WeakPolarHBondContact OE1-CG 3.46Å; E706-Q710 PolarHBondContact OE1-NE2 3.48Å; A707-Q710 PolarHBondContact O-N 3.44Å; Q710-S713 CarbonylContact O-C 3.53Å; Q710-S713 PolarHBondContact O-N 2.89Å; Q710-C714 PolarHBondContact O-N 3.11Å; Q710-C714 VanDerWaalsContact O-N 3.08Å
711	M	97.5	Very high	95.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-42.1	176.1	-70.8	-177.3	70.2	0	0	113.3	L657 L697 L700 S701 A707 R708 S713 C714 L717 T745 L749	L657-M711 HydrophobicContact CD1-CG 3.93Å; L657-M711 HydrophobicContact CD2-CG 3.93Å; L697-M711 HydrophobicContact CB-CE 4.04Å; L697-M711 HydrophobicContact CD2-CE 3.96Å; L700-M711 HydrophobicContact CB-SD 4.1Å; S701-M711 VanDerWaalsContact CA-SD 3.59Å; A707-M711 WeakPolarHBondContact O-CB 3.36Å; A707-M711 VanDerWaalsContact O-CG 3.3Å; A707-M711 WeakPolarHBondContact O-CG 3.49Å; A707-M711 PolarHBondContact O-N 2.98Å; R708-M711 PolarHBondContact O-N 3.04Å; M711-S713 PolarHBondContact O-N 3.43Å; M711-C714 WeakPolarHBondContact O-CB 2.97Å; M711-C714 PolarHBondContact O-N 3.33Å; M711-L717 HydrophobicContact CB-CD2 4.22Å; M711-L717 HydrophobicContact CE-CD2 4.17Å; M711-T745 HydrophobicContact CE-CG2 3.76Å; M711-L749 HydrophobicContact CB-CD1 4.45Å; M711-L749 HydrophobicContact CB-CD2 3.62Å; M711-L749 HydrophobicContact CE-CD2 4.5Å; M711-L749 HydrophobicContact SD-CD2 4.42Å
712	R	95.3	Very high	95	Very high	11 Å²	11	34.9 Å²	34.9	4%	0.042	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-30.3	172.7	-76.7	-179.1	-162.2	124.4	-1.4	113	R708 L749 Y751 E756 V818 L821	R708-R712 VanDerWaalsContact O-CB 3.27Å; R708-R712 WeakPolarHBondContact O-CB 3.47Å; R708-R712 WeakPolarHBondContact O-CG 3.33Å; R708-R712 PolarHBondContact O-N 3.22Å; R712-L749 HydrophobicContact CG-CB 4.47Å; R712-L749 HydrophobicContact CG-CD2 4.35Å; R712-L749 VanDerWaalsContact CZ-O 3.25Å; R712-L749 PolarHBondContact NE-O 2.85Å; R712-L749 PolarHBondContact NH2-O 3.2Å; R712-Y751 PolarHBondContact NH2-O 2.67Å; R712-E756 IonicContact CZ-OE2 3.95Å; R712-E756 VanDerWaalsContact CZ-OE2 3.27Å; R712-E756 VanDerWaalsContact NH1-CB 3.29Å; R712-E756 IonicContact NH1-OE2 2.9Å; R712-E756 PolarHBondContact NH1-OE2 2.9Å; R712-E756 IonicContact NH2-OE2 3.27Å; R712-E756 PolarHBondContact NH2-OE2 2.8Å; R712-V818 HydrophobicContact CB-CB 4.32Å; R712-V818 HydrophobicContact CB-CG2 3.68Å; R712-V818 HydrophobicContact CG-CG2 3.81Å; R712-L821 HydrophobicContact CG-CD1 4.13Å
713	S	93.8	Very high	94.8	Very high	80 Å²	80	37.2 Å²	37.2	56%	0.559	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.3	-179.3	-53.5	0	0	0	0	113.3	K709 Q710 M711 E715	K709-S713 WeakPolarHBondContact O-CB 3.22Å; K709-S713 PolarHBondContact O-N 3.05Å; K709-S713 VanDerWaalsContact O-N 3.07Å; K709-S713 PolarHBondContact O-OG 3.44Å; Q710-S713 CarbonylContact O-C 3.53Å; Q710-S713 PolarHBondContact O-N 2.89Å; M711-S713 PolarHBondContact O-N 3.43Å; S713-E715 PolarHBondContact O-N 3.23Å
714	C	95.6	Very high	94.8	Very high	18 Å²	18	35.9 Å²	35.9	12%	0.122	18%	0.18	C	C	.	.	S	Bend	trans	-79.5	113.1	175.8	-167	0	0	0	0	109.7	L657 T661 Q710 M711 L717	L657-C714 HydrophobicContact CD2-CB 4.12Å; L657-C714 HydrophobicContact CG-CB 4.23Å; T661-C714 PolarHBondContact OG1-SG 2.79Å; T661-C714 VanDerWaalsContact OG1-SG 3.42Å; Q710-C714 PolarHBondContact O-N 3.11Å; Q710-C714 VanDerWaalsContact O-N 3.08Å; M711-C714 WeakPolarHBondContact O-CB 2.97Å; M711-C714 PolarHBondContact O-N 3.33Å; C714-L717 HydrophobicContact CB-CB 4.09Å; C714-L717 HydrophobicContact CB-CD2 4.08Å; C714-L717 WeakPolarHBondContact O-CB 3.31Å; C714-L717 PolarHBondContact O-N 2.82Å
715	E	92.8	Very high	94.9	Very high	172 Å²	172	34.7 Å²	34.7	80%	0.804	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	139.3	-178.8	-173	170.2	-167.7	0	0	112	T661 S713 L717	T661-E715 WeakPolarHBondContact CG2-O 3.17Å; S713-E715 PolarHBondContact O-N 3.23Å; E715-L717 PolarHBondContact O-N 3.25Å
716	G	92.2	Very high	94.7	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.021	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	-13.8	179.2	0	0	0	0	0	116.1	W671 D719 S720	W671-G716 VanDerWaalsContact CZ3-CA 3.41Å; G716-D719 WeakPolarHBondContact CA-OD2 3.35Å; G716-S720 WeakPolarHBondContact O-CB 3.28Å; G716-S720 PolarHBondContact O-N 3.03Å; G716-S720 PolarHBondContact O-OG 3.42Å
717	L	96.9	Very high	94.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.4	-54.2	-178.3	177.1	56.8	0	0	0	111.7	L657 T661 I665 L697 M711 C714 E715 S720 L721	L657-L717 HydrophobicContact CD1-CD2 3.81Å; T661-L717 HydrophobicContact CG2-CB 3.84Å; T661-L717 HydrophobicContact CG2-CD1 4.46Å; I665-L717 HydrophobicContact CG1-CD1 4.39Å; I665-L717 HydrophobicContact CG2-CD1 4.21Å; L697-L717 HydrophobicContact CD1-CD1 4.01Å; M711-L717 HydrophobicContact CB-CD2 4.22Å; M711-L717 HydrophobicContact CE-CD2 4.17Å; C714-L717 HydrophobicContact CB-CB 4.09Å; C714-L717 HydrophobicContact CB-CD2 4.08Å; C714-L717 WeakPolarHBondContact O-CB 3.31Å; C714-L717 PolarHBondContact O-N 2.82Å; E715-L717 PolarHBondContact O-N 3.25Å; L717-S720 PolarHBondContact O-N 2.68Å; L717-L721 HydrophobicContact CD1-CD1 3.81Å; L717-L721 HydrophobicContact CD1-CG 4.06Å; L717-L721 HydrophobicContact CG-CD1 4.1Å; L717-L721 VanDerWaalsContact O-CG 3.25Å; L717-L721 WeakPolarHBondContact O-CG 3.49Å; L717-L721 PolarHBondContact O-N 3.42Å
718	V	95.9	Very high	94.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.5	-43	-178.8	175.7	0	0	0	0	110.7	S720 L721 L722 L746 L749 G817 M820 L821	V718-S720 PolarHBondContact O-N 3.03Å; V718-L721 PolarHBondContact O-N 3.27Å; V718-L722 HydrophobicContact CG1-CD1 3.93Å; V718-L722 WeakPolarHBondContact O-CG 3.47Å; V718-L722 PolarHBondContact O-N 2.96Å; V718-L746 HydrophobicContact CG1-CD2 4.31Å; V718-L749 HydrophobicContact CG2-CD1 4.21Å; V718-G817 WeakPolarHBondContact CG1-O 3.29Å; V718-M820 HydrophobicContact CG1-CB 4.36Å; V718-L821 HydrophobicContact CG1-CD2 3.65Å; V718-L821 HydrophobicContact CG1-CG 3.86Å
719	D	93.2	Very high	93.9	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.08	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-46.6	178.8	-44.8	-102.4	0	0	0	111.3	W671 G716 L722 Y723 G817	W671-D719 HydrophobicContact CD2-CB 3.88Å; W671-D719 HydrophobicContact CE3-CB 4.37Å; W671-D719 HydrophobicContact CG-CB 4.48Å; W671-D719 HydrophobicContact CH2-CB 3.92Å; W671-D719 HydrophobicContact CZ2-CB 3.33Å; W671-D719 HydrophobicContact CZ3-CB 4.4Å; G716-D719 WeakPolarHBondContact CA-OD2 3.35Å; D719-L722 PolarHBondContact O-N 2.91Å; D719-Y723 VanDerWaalsContact O-CB 3.3Å; D719-Y723 WeakPolarHBondContact O-CB 3.45Å; D719-Y723 PolarHBondContact O-N 2.76Å; D719-G817 PolarHBondContact OD1-N 3.11Å; D719-G817 WeakPolarHBondContact OD2-CA 3.46Å; D719-G817 PolarHBondContact OD2-N 3.23Å
720	S	95.1	Very high	93.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.4	-41.8	178.8	-60.5	0	0	0	0	112.7	S669 G716 L717 V718 L722 Y723 V724	S669-S720 WeakPolarHBondContact OG-CB 3.39Å; G716-S720 WeakPolarHBondContact O-CB 3.28Å; G716-S720 PolarHBondContact O-N 3.03Å; G716-S720 PolarHBondContact O-OG 3.42Å; L717-S720 PolarHBondContact O-N 2.68Å; V718-S720 PolarHBondContact O-N 3.03Å; S720-L722 VanDerWaalsContact C-N 3.31Å; S720-L722 PolarHBondContact O-N 3.26Å; S720-Y723 PolarHBondContact O-N 3.2Å; S720-V724 WeakPolarHBondContact O-CG2 3.37Å; S720-V724 PolarHBondContact O-N 2.97Å
721	L	96.4	Very high	93.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.1	-35.5	177.7	-68.5	173	0	0	0	111.9	T694 L717 V718 I725 C742 T745 L746	T694-L721 HydrophobicContact CG2-CD2 4.26Å; L717-L721 HydrophobicContact CD1-CD1 3.81Å; L717-L721 HydrophobicContact CD1-CG 4.06Å; L717-L721 HydrophobicContact CG-CD1 4.1Å; L717-L721 VanDerWaalsContact O-CG 3.25Å; L717-L721 WeakPolarHBondContact O-CG 3.49Å; L717-L721 PolarHBondContact O-N 3.42Å; V718-L721 PolarHBondContact O-N 3.27Å; L721-I725 PolarHBondContact O-N 3.23Å; L721-C742 HydrophobicContact CD2-CB 4.06Å; L721-C742 WeakPolarHBondContact CD2-SG 3.29Å; L721-T745 HydrophobicContact CD1-CG2 3.78Å; L721-L746 HydrophobicContact CB-CD1 3.92Å; L721-L746 HydrophobicContact CB-CD2 4.15Å; L721-L746 HydrophobicContact CB-CG 4.09Å; L721-L746 HydrophobicContact CD1-CD2 4.46Å; L721-L746 HydrophobicContact CD1-CG 4.49Å
722	L	94.6	Very high	92.9	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-74.6	-36.9	173.3	-73.2	168.8	0	0	0	112	V718 D719 S720 V724 I725 H726 L746 M820 V826	V718-L722 HydrophobicContact CG1-CD1 3.93Å; V718-L722 WeakPolarHBondContact O-CG 3.47Å; V718-L722 PolarHBondContact O-N 2.96Å; D719-L722 PolarHBondContact O-N 2.91Å; S720-L722 VanDerWaalsContact C-N 3.31Å; S720-L722 PolarHBondContact O-N 3.26Å; L722-V724 VanDerWaalsContact C-N 3.3Å; L722-V724 PolarHBondContact O-N 2.95Å; L722-I725 PolarHBondContact O-N 3.36Å; L722-H726 PolarHBondContact O-CD2 2.99Å; L722-H726 VanDerWaalsContact O-CD2 3.23Å; L722-H726 PolarHBondContact O-N 3.34Å; L722-L746 HydrophobicContact CD2-CD1 3.7Å; L722-L746 HydrophobicContact CD2-CD2 4.38Å; L722-L746 HydrophobicContact CG-CD1 3.97Å; L722-L746 HydrophobicContact CG-CD2 4.14Å; L722-M820 HydrophobicContact CD1-CB 3.45Å; L722-M820 VanDerWaalsContact CD1-CB 3.45Å; L722-M820 HydrophobicContact CD1-CE 4.16Å; L722-M820 HydrophobicContact CD1-CG 4.33Å; L722-V826 HydrophobicContact CD1-CG1 4.04Å; L722-V826 HydrophobicContact CD2-CB 4.43Å; L722-V826 HydrophobicContact CD2-CG1 3.92Å
723	Y	93.1	Very high	92.6	Very high	94 Å²	94	38 Å²	38	37%	0.369	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-36	174.2	-173.4	-90.7	0	0	0	112.1	S669 W671 D719 S720 H726 T727	S669-Y723 VanDerWaalsContact O-CD1 3.22Å; S669-Y723 WeakPolarHBondContact O-CD1 3.36Å; S669-Y723 VanDerWaalsContact O-CE1 3.26Å; S669-Y723 WeakPolarHBondContact O-CE1 3.43Å; W671-Y723 HydrophobicContact CB-CD1 4.02Å; W671-Y723 HydrophobicContact CB-CD2 4.47Å; W671-Y723 HydrophobicContact CB-CG 3.89Å; W671-Y723 AromaticContact CD1-CD2 3.98Å; W671-Y723 HydrophobicContact CG-CG 4.38Å; D719-Y723 VanDerWaalsContact O-CB 3.3Å; D719-Y723 WeakPolarHBondContact O-CB 3.45Å; D719-Y723 PolarHBondContact O-N 2.76Å; S720-Y723 PolarHBondContact O-N 3.2Å; Y723-H726 PolarHBondContact O-N 2.62Å; Y723-T727 WeakPolarHBondContact CE1-OG1 3.31Å; Y723-T727 WeakPolarHBondContact O-CB 3.42Å; Y723-T727 PolarHBondContact O-N 2.82Å; Y723-T727 PolarHBondContact O-OG1 2.88Å
724	V	92.7	Very high	92.6	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-58.3	-49.1	170	161.4	0	0	0	0	111.3	F684 S720 L722 T727 C728 T738 C742	F684-V724 HydrophobicContact CD2-CG2 4.23Å; F684-V724 HydrophobicContact CE2-CB 4.22Å; F684-V724 HydrophobicContact CE2-CG1 3.77Å; F684-V724 HydrophobicContact CE2-CG2 3.55Å; F684-V724 HydrophobicContact CZ-CB 4.32Å; F684-V724 HydrophobicContact CZ-CG1 3.53Å; F684-V724 HydrophobicContact CZ-CG2 4.14Å; S720-V724 WeakPolarHBondContact O-CG2 3.37Å; S720-V724 PolarHBondContact O-N 2.97Å; L722-V724 VanDerWaalsContact C-N 3.3Å; L722-V724 PolarHBondContact O-N 2.95Å; V724-T727 PolarHBondContact O-N 3.23Å; V724-C728 PolarHBondContact O-N 2.99Å; V724-T738 HydrophobicContact CG1-CG2 4.49Å; V724-C742 HydrophobicContact CG1-CB 4.23Å
725	I	94.1	Very high	92.5	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-44	177.7	-70.1	171.5	0	0	0	111.3	L721 L722 T727 C728 V729 C742 V743 L746 P829 Y830 L833	L721-I725 PolarHBondContact O-N 3.23Å; L722-I725 PolarHBondContact O-N 3.36Å; I725-T727 VanDerWaalsContact C-N 3.31Å; I725-T727 PolarHBondContact O-N 3.39Å; I725-C728 PolarHBondContact O-N 3.33Å; I725-C728 PolarHBondContact O-SG 2.63Å; I725-C728 VanDerWaalsContact O-SG 3.33Å; I725-V729 WeakPolarHBondContact O-CG2 3.5Å; I725-V729 PolarHBondContact O-N 3.18Å; I725-C742 HydrophobicContact CG1-CB 4.47Å; I725-V743 HydrophobicContact CD1-CB 4.42Å; I725-V743 HydrophobicContact CD1-CG2 3.54Å; I725-V743 HydrophobicContact CG1-CG2 3.94Å; I725-L746 HydrophobicContact CD1-CD1 3.48Å; I725-L746 VanDerWaalsContact CD1-CD1 3.48Å; I725-P829 HydrophobicContact CG2-CB 3.7Å; I725-Y830 HydrophobicContact CD1-CE1 4.18Å; I725-L833 HydrophobicContact CG2-CD1 3.81Å
726	H	91.2	Very high	92.5	Very high	63 Å²	63	30.5 Å²	30.5	29%	0.292	16%	0.164	S	C	.	.	H	α-helix	trans	-60.5	-39.2	175	-83.7	-71.1	0	0	0	112.4	L722 Y723 V729 N730 P829	L722-H726 PolarHBondContact O-CD2 2.99Å; L722-H726 VanDerWaalsContact O-CD2 3.23Å; L722-H726 PolarHBondContact O-N 3.34Å; Y723-H726 PolarHBondContact O-N 2.62Å; H726-V729 PolarHBondContact O-N 2.96Å; H726-N730 PolarHBondContact O-N 3.42Å; H726-N730 VanDerWaalsContact O-N 3.12Å; H726-N730 PolarHBondContact O-ND2 3.33Å; H726-N730 VanDerWaalsContact O-ND2 3.12Å; H726-P829 WeakPolarHBondContact CE1-CG 3.33Å
727	T	89.6	Confident	92.6	Very high	16 Å²	16	34.7 Å²	34.7	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-66.9	-46.2	177.1	-59.2	0	0	0	0	110.6	Y723 V724 I725 V729 N730 T731	Y723-T727 WeakPolarHBondContact CE1-OG1 3.31Å; Y723-T727 WeakPolarHBondContact O-CB 3.42Å; Y723-T727 PolarHBondContact O-N 2.82Å; Y723-T727 PolarHBondContact O-OG1 2.88Å; V724-T727 PolarHBondContact O-N 3.23Å; I725-T727 VanDerWaalsContact C-N 3.31Å; I725-T727 PolarHBondContact O-N 3.39Å; T727-V729 VanDerWaalsContact C-N 3.28Å; T727-V729 PolarHBondContact O-N 3.12Å; T727-N730 CarbonylContact O-C 3.53Å; T727-N730 WeakPolarHBondContact O-CA 3.32Å; T727-N730 PolarHBondContact O-N 2.91Å; T727-T731 HydrophobicContact CG2-CG2 4.42Å; T727-T731 PolarHBondContact O-N 3.16Å; T727-T731 PolarHBondContact O-OG1 2.79Å
728	C	89.9	Confident	92.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-38.9	176.7	107	0	0	0	0	112.3	V724 I725 N730 T731 S732 D733 V739	V724-C728 PolarHBondContact O-N 2.99Å; I725-C728 PolarHBondContact O-N 3.33Å; I725-C728 PolarHBondContact O-SG 2.63Å; I725-C728 VanDerWaalsContact O-SG 3.33Å; C728-N730 VanDerWaalsContact C-N 3.27Å; C728-N730 PolarHBondContact O-N 3.25Å; C728-T731 CarbonylContact O-C 3.58Å; C728-T731 PolarHBondContact O-N 2.98Å; C728-S732 WeakPolarHBondContact O-CA 3.14Å; C728-S732 PolarHBondContact O-N 2.85Å; C728-D733 WeakPolarHBondContact CB-O 3.48Å; C728-D733 PolarHBondContact O-N 2.92Å; C728-D733 VanDerWaalsContact O-N 3.12Å; C728-V739 HydrophobicContact CB-CG2 3.47Å; C728-V739 VanDerWaalsContact CB-CG2 3.47Å
729	V	90.6	Very high	92.5	Very high	30 Å²	30	34.9 Å²	34.9	18%	0.182	18%	0.183	C	C	.	.	H	α-helix	trans	-68.5	-25.8	175.8	165.3	0	0	0	0	112.4	I725 H726 T727 Y734 P829 T832	I725-V729 WeakPolarHBondContact O-CG2 3.5Å; I725-V729 PolarHBondContact O-N 3.18Å; H726-V729 PolarHBondContact O-N 2.96Å; T727-V729 VanDerWaalsContact C-N 3.28Å; T727-V729 PolarHBondContact O-N 3.12Å; V729-Y734 HydrophobicContact CG2-CE1 4.37Å; V729-P829 HydrophobicContact CG2-CB 4.43Å; V729-T832 HydrophobicContact CG1-CG2 4.01Å; V729-T832 HydrophobicContact CG2-CG2 4.21Å
730	N	88.9	Confident	92.7	Very high	133 Å²	133	34.5 Å²	34.5	71%	0.711	18%	0.181	S	C	*	.	H	α-helix	trans	-87.7	-15.8	174.8	-66.1	-28.3	0	0	0	113.4	H726 T727 C728	H726-N730 PolarHBondContact O-N 3.42Å; H726-N730 VanDerWaalsContact O-N 3.12Å; H726-N730 PolarHBondContact O-ND2 3.33Å; H726-N730 VanDerWaalsContact O-ND2 3.12Å; T727-N730 CarbonylContact O-C 3.53Å; T727-N730 WeakPolarHBondContact O-CA 3.32Å; T727-N730 PolarHBondContact O-N 2.91Å; C728-N730 VanDerWaalsContact C-N 3.27Å; C728-N730 PolarHBondContact O-N 3.25Å
731	T	88.6	Confident	92.9	Very high	51 Å²	51	34.6 Å²	34.6	31%	0.313	18%	0.181	S	C	.	.	H	α-helix	trans	-112.3	1.3	178.8	61.9	0	0	0	0	114.1	Q685 T727 C728 D733	Q685-T731 PolarHBondContact NE2-OG1 2.65Å; T727-T731 HydrophobicContact CG2-CG2 4.42Å; T727-T731 PolarHBondContact O-N 3.16Å; T727-T731 PolarHBondContact O-OG1 2.79Å; C728-T731 CarbonylContact O-C 3.58Å; C728-T731 PolarHBondContact O-N 2.98Å; T731-D733 PolarHBondContact O-N 3.12Å
732	S	90.9	Very high	92.9	Very high	80 Å²	80	34.6 Å²	34.6	56%	0.559	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	24.9	-174.6	-54.4	0	0	0	0	115.4	C728 Y734	C728-S732 WeakPolarHBondContact O-CA 3.14Å; C728-S732 PolarHBondContact O-N 2.85Å; S732-Y734 WeakPolarHBondContact O-CD2 3.44Å; S732-Y734 PolarHBondContact O-N 2.86Å
733	D	89.4	Confident	93.1	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.193	18%	0.18	C	C	.	.			trans	-92.5	64.6	177.7	176.8	39.4	0	0	0	111.5	C728 T731 S736	C728-D733 WeakPolarHBondContact CB-O 3.48Å; C728-D733 PolarHBondContact O-N 2.92Å; C728-D733 VanDerWaalsContact O-N 3.12Å; T731-D733 PolarHBondContact O-N 3.12Å; D733-S736 VanDerWaalsContact OD1-CB 3.28Å; D733-S736 WeakPolarHBondContact OD1-CB 3.16Å; D733-S736 PolarHBondContact OD1-OG 3.22Å; D733-S736 WeakPolarHBondContact OD2-CB 3.48Å; D733-S736 PolarHBondContact OD2-OG 3.01Å
734	Y	93.4	Very high	93.3	Very high	34 Å²	34	30.2 Å²	30.2	13%	0.133	17%	0.165	C	C	.	.			trans	-74.1	-29.1	-170.8	-50.8	-63	0	0	0	114.1	V729 S732 T832 L833 E836	V729-Y734 HydrophobicContact CG2-CE1 4.37Å; S732-Y734 WeakPolarHBondContact O-CD2 3.44Å; S732-Y734 PolarHBondContact O-N 2.86Å; Y734-T832 HydrophobicContact CE1-CG2 3.93Å; Y734-L833 HydrophobicContact CD1-CD2 4.06Å; Y734-E836 HydrophobicContact CD1-CB 4.3Å; Y734-E836 HydrophobicContact CD2-CB 3.54Å; Y734-E836 HydrophobicContact CE1-CB 4.06Å; Y734-E836 HydrophobicContact CE1-CG 4.38Å; Y734-E836 HydrophobicContact CE2-CB 3.28Å; Y734-E836 HydrophobicContact CE2-CG 3.99Å; Y734-E836 HydrophobicContact CG-CB 4.03Å
735	D	93.4	Very high	93.6	Very high	56 Å²	56	30.1 Å²	30.1	30%	0.299	16%	0.164	S	C	.	.	S	Bend	trans	-102.4	-3.2	-165.4	-69.2	-32.6	0	0	0	114.5	S837 S838 N839	D735-S837 WeakPolarHBondContact OD1-CA 3.46Å; D735-S837 WeakPolarHBondContact OD1-CB 3.44Å; D735-S837 PolarHBondContact OD1-OG 3.12Å; D735-S838 PolarHBondContact OD1-N 3.37Å; D735-S838 WeakPolarHBondContact OD2-CB 3.03Å; D735-S838 PolarHBondContact OD2-N 2.84Å; D735-S838 PolarHBondContact OD2-OG 2.96Å; D735-N839 HydrophobicContact CB-CB 4.08Å; D735-N839 PolarHBondContact O-ND2 3.24Å; D735-N839 VanDerWaalsContact OD1-CB 3.25Å; D735-N839 WeakPolarHBondContact OD1-CB 3.49Å; D735-N839 PolarHBondContact OD1-N 3.16Å
736	S	93.4	Very high	93.8	Very high	22 Å²	22	30.1 Å²	30.1	15%	0.154	16%	0.164	C	C	.	.			trans	-62.3	142.8	-179.2	67.9	0	0	0	0	112.7	D733 T738 V739 E740	D733-S736 VanDerWaalsContact OD1-CB 3.28Å; D733-S736 WeakPolarHBondContact OD1-CB 3.16Å; D733-S736 PolarHBondContact OD1-OG 3.22Å; D733-S736 WeakPolarHBondContact OD2-CB 3.48Å; D733-S736 PolarHBondContact OD2-OG 3.01Å; S736-T738 PolarHBondContact O-N 3.41Å; S736-V739 WeakPolarHBondContact O-CA 3.43Å; S736-V739 WeakPolarHBondContact O-CB 3.11Å; S736-V739 PolarHBondContact O-N 2.82Å; S736-V739 WeakPolarHBondContact OG-CG2 3.44Å; S736-E740 PolarHBondContact O-N 3.4Å; S736-E740 VanDerWaalsContact O-N 3.11Å
737	K	94.5	Very high	94.2	Very high	90 Å²	90	29.8 Å²	29.8	39%	0.391	16%	0.16	S	C	.	.	H	α-helix	trans	-60.8	-24.6	-174.2	-161.9	57.5	160.3	-171.5	0	113.3	R691 E740 N741	R691-K737 HydrophobicContact CG-CB 4.14Å; R691-K737 HydrophobicContact CG-CG 4.42Å; K737-E740 HydrophobicContact CD-CB 4.38Å; K737-E740 WeakPolarHBondContact CD-OE2 3.18Å; K737-E740 WeakPolarHBondContact CE-OE2 3.47Å; K737-E740 IonicContact NZ-OE1 3.71Å; K737-E740 PolarHBondContact NZ-OE1 2.95Å; K737-E740 IonicContact NZ-OE2 3.66Å; K737-E740 PolarHBondContact NZ-OE2 3.1Å; K737-N741 WeakPolarHBondContact O-CB 3.47Å; K737-N741 PolarHBondContact O-N 2.94Å; K737-N741 PolarHBondContact O-ND2 3.24Å
738	T	94.9	Very high	94.6	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-43.7	172.9	-53.3	0	0	0	0	111.1	F684 L690 T694 V724 S736 N741 C742	F684-T738 HydrophobicContact CE2-CG2 3.77Å; F684-T738 HydrophobicContact CZ-CG2 3.94Å; L690-T738 HydrophobicContact CD2-CG2 4.18Å; L690-T738 HydrophobicContact CG-CG2 4.06Å; T694-T738 HydrophobicContact CG2-CG2 4.24Å; V724-T738 HydrophobicContact CG1-CG2 4.49Å; S736-T738 PolarHBondContact O-N 3.41Å; T738-N741 PolarHBondContact O-N 3.06Å; T738-C742 WeakPolarHBondContact O-CB 3.47Å; T738-C742 PolarHBondContact O-N 3.18Å; T738-C742 PolarHBondContact O-SG 3.5Å
739	V	95.8	Very high	94.9	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-49.4	174.8	174.5	0	0	0	0	110.4	C728 S736 N741 C742 V743 L833 T842	C728-V739 HydrophobicContact CB-CG2 3.47Å; C728-V739 VanDerWaalsContact CB-CG2 3.47Å; S736-V739 WeakPolarHBondContact O-CA 3.43Å; S736-V739 WeakPolarHBondContact O-CB 3.11Å; S736-V739 PolarHBondContact O-N 2.82Å; S736-V739 WeakPolarHBondContact OG-CG2 3.44Å; V739-N741 VanDerWaalsContact C-N 3.27Å; V739-N741 PolarHBondContact O-N 3.06Å; V739-C742 PolarHBondContact O-N 2.94Å; V739-V743 HydrophobicContact CG1-CG2 3.99Å; V739-V743 WeakPolarHBondContact O-CB 3.36Å; V739-V743 VanDerWaalsContact O-CG2 3.26Å; V739-V743 WeakPolarHBondContact O-CG2 3.39Å; V739-V743 PolarHBondContact O-N 3.02Å; V739-L833 HydrophobicContact CG1-CD1 4.48Å; V739-L833 HydrophobicContact CG1-CD2 3.97Å; V739-T842 HydrophobicContact CG1-CG2 4.36Å
740	E	97.3	Very high	95.2	Very high	7 Å²	7	29.7 Å²	29.7	3%	0.033	16%	0.158	C	C	.	.	H	α-helix	trans	-53	-45	176.2	-171.6	-160.7	124.7	0	0	111.7	R698 S736 K737 C744 N839 A841	R698-E740 IonicContact CZ-OE1 2.66Å; R698-E740 VanDerWaalsContact CZ-OE1 3.31Å; R698-E740 IonicContact NH1-OE1 3.22Å; R698-E740 PolarHBondContact NH1-OE1 3.28Å; R698-E740 IonicContact NH2-OE1 3.78Å; R698-E740 PolarHBondContact NH2-OE1 2.73Å; S736-E740 PolarHBondContact O-N 3.4Å; S736-E740 VanDerWaalsContact O-N 3.11Å; K737-E740 HydrophobicContact CD-CB 4.38Å; K737-E740 WeakPolarHBondContact CD-OE2 3.18Å; K737-E740 WeakPolarHBondContact CE-OE2 3.47Å; K737-E740 IonicContact NZ-OE1 3.71Å; K737-E740 PolarHBondContact NZ-OE1 2.95Å; K737-E740 IonicContact NZ-OE2 3.66Å; K737-E740 PolarHBondContact NZ-OE2 3.1Å; E740-C744 VanDerWaalsContact O-CB 3.29Å; E740-C744 WeakPolarHBondContact O-CB 3.09Å; E740-C744 PolarHBondContact O-N 2.83Å; E740-C744 PolarHBondContact O-SG 3.45Å; E740-N839 PolarHBondContact OE2-ND2 3.04Å; E740-A841 VanDerWaalsContact CD-CB 3.46Å; E740-A841 HydrophobicContact CG-CB 3.67Å
741	N	97.8	Very high	95.6	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-66.6	-41	177.6	-75.4	-23.5	0	0	0	112.8	R691 G695 R698 K737 T738 V739 T745	R691-N741 PolarHBondContact O-ND2 3.4Å; G695-N741 VanDerWaalsContact CA-ND2 3.26Å; G695-N741 WeakPolarHBondContact CA-ND2 3.35Å; G695-N741 PolarHBondContact N-ND2 2.85Å; R698-N741 VanDerWaalsContact CD-OD1 3.31Å; R698-N741 WeakPolarHBondContact CD-OD1 3.49Å; R698-N741 PolarHBondContact NH1-OD1 3.04Å; K737-N741 WeakPolarHBondContact O-CB 3.47Å; K737-N741 PolarHBondContact O-N 2.94Å; K737-N741 PolarHBondContact O-ND2 3.24Å; T738-N741 PolarHBondContact O-N 3.06Å; V739-N741 VanDerWaalsContact C-N 3.27Å; V739-N741 PolarHBondContact O-N 3.06Å; N741-T745 WeakPolarHBondContact O-CB 3.44Å; N741-T745 PolarHBondContact O-N 2.71Å; N741-T745 PolarHBondContact O-OG1 2.95Å
742	C	97.8	Very high	95.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.5	-48	177.3	-66.8	0	0	0	0	111.5	L721 V724 I725 T738 V739 C744 T745 L746	L721-C742 HydrophobicContact CD2-CB 4.06Å; L721-C742 WeakPolarHBondContact CD2-SG 3.29Å; V724-C742 HydrophobicContact CG1-CB 4.23Å; I725-C742 HydrophobicContact CG1-CB 4.47Å; T738-C742 WeakPolarHBondContact O-CB 3.47Å; T738-C742 PolarHBondContact O-N 3.18Å; T738-C742 PolarHBondContact O-SG 3.5Å; V739-C742 PolarHBondContact O-N 2.94Å; C742-C744 PolarHBondContact O-N 3.11Å; C742-T745 WeakPolarHBondContact O-CB 3.11Å; C742-T745 PolarHBondContact O-N 3.48Å; C742-L746 WeakPolarHBondContact O-CB 3.49Å; C742-L746 WeakPolarHBondContact O-CG 3.43Å; C742-L746 PolarHBondContact O-N 2.9Å
743	V	98.1	Very high	95.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.3	-46	177	175.9	0	0	0	0	110.7	I725 V739 T745 L746 R747 L833 S846	I725-V743 HydrophobicContact CD1-CB 4.42Å; I725-V743 HydrophobicContact CD1-CG2 3.54Å; I725-V743 HydrophobicContact CG1-CG2 3.94Å; V739-V743 HydrophobicContact CG1-CG2 3.99Å; V739-V743 WeakPolarHBondContact O-CB 3.36Å; V739-V743 VanDerWaalsContact O-CG2 3.26Å; V739-V743 WeakPolarHBondContact O-CG2 3.39Å; V739-V743 PolarHBondContact O-N 3.02Å; V743-T745 VanDerWaalsContact C-N 3.34Å; V743-T745 PolarHBondContact O-N 3.07Å; V743-L746 PolarHBondContact O-N 3.46Å; V743-R747 WeakPolarHBondContact O-CB 3.43Å; V743-R747 PolarHBondContact O-N 2.9Å; V743-L833 HydrophobicContact CG2-CD1 3.58Å; V743-S846 WeakPolarHBondContact CG1-OG 3.35Å
744	C	98.2	Very high	95.6	Very high	9 Å²	9	27 Å²	27	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-64.8	-36.3	176.7	-71.3	0	0	0	0	112.9	R698 E740 C742 N748	R698-C744 HydrophobicContact CG-CB 3.79Å; R698-C744 PolarHBondContact NH2-SG 2.8Å; R698-C744 VanDerWaalsContact NH2-SG 3.37Å; E740-C744 VanDerWaalsContact O-CB 3.29Å; E740-C744 WeakPolarHBondContact O-CB 3.09Å; E740-C744 PolarHBondContact O-N 2.83Å; E740-C744 PolarHBondContact O-SG 3.45Å; C742-C744 PolarHBondContact O-N 3.11Å; C744-N748 VanDerWaalsContact O-CG 3.32Å; C744-N748 PolarHBondContact O-N 3.29Å; C744-N748 PolarHBondContact O-ND2 3.19Å
745	T	98.6	Very high	95.3	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-46.7	173.6	-55.3	0	0	0	0	110.4	R698 M711 L721 N741 C742 V743 N748 L749	R698-T745 VanDerWaalsContact CA-OG1 3.26Å; R698-T745 WeakPolarHBondContact CA-OG1 3.33Å; R698-T745 PolarHBondContact N-OG1 3.24Å; M711-T745 HydrophobicContact CE-CG2 3.76Å; L721-T745 HydrophobicContact CD1-CG2 3.78Å; N741-T745 WeakPolarHBondContact O-CB 3.44Å; N741-T745 PolarHBondContact O-N 2.71Å; N741-T745 PolarHBondContact O-OG1 2.95Å; C742-T745 WeakPolarHBondContact O-CB 3.11Å; C742-T745 PolarHBondContact O-N 3.48Å; V743-T745 VanDerWaalsContact C-N 3.34Å; V743-T745 PolarHBondContact O-N 3.07Å; T745-N748 WeakPolarHBondContact O-CB 3.42Å; T745-N748 PolarHBondContact O-N 3.26Å; T745-L749 HydrophobicContact CG2-CD1 4.23Å; T745-L749 HydrophobicContact CG2-CG 4.4Å; T745-L749 WeakPolarHBondContact O-CG 3.4Å; T745-L749 PolarHBondContact O-N 2.99Å
746	L	98.4	Very high	95.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.7	-33.7	-179.3	-70.4	164	0	0	0	113	V718 L721 L722 I725 C742 V743 N748 L749 S750 L821 Y830	V718-L746 HydrophobicContact CG1-CD2 4.31Å; L721-L746 HydrophobicContact CB-CD1 3.92Å; L721-L746 HydrophobicContact CB-CD2 4.15Å; L721-L746 HydrophobicContact CB-CG 4.09Å; L721-L746 HydrophobicContact CD1-CD2 4.46Å; L721-L746 HydrophobicContact CD1-CG 4.49Å; L722-L746 HydrophobicContact CD2-CD1 3.7Å; L722-L746 HydrophobicContact CD2-CD2 4.38Å; L722-L746 HydrophobicContact CG-CD1 3.97Å; L722-L746 HydrophobicContact CG-CD2 4.14Å; I725-L746 HydrophobicContact CD1-CD1 3.48Å; I725-L746 VanDerWaalsContact CD1-CD1 3.48Å; C742-L746 WeakPolarHBondContact O-CB 3.49Å; C742-L746 WeakPolarHBondContact O-CG 3.43Å; C742-L746 PolarHBondContact O-N 2.9Å; V743-L746 PolarHBondContact O-N 3.46Å; L746-N748 VanDerWaalsContact C-N 3.33Å; L746-N748 PolarHBondContact O-N 3.38Å; L746-L749 PolarHBondContact O-N 2.92Å; L746-S750 VanDerWaalsContact O-CB 3.27Å; L746-S750 WeakPolarHBondContact O-CB 3.38Å; L746-S750 PolarHBondContact O-N 3.23Å; L746-S750 PolarHBondContact O-OG 3.18Å; L746-L821 HydrophobicContact CD2-CD2 3.58Å; L746-Y830 WeakPolarHBondContact CB-OH 3.39Å
747	R	98.3	Very high	94.5	Very high	56 Å²	56	28.7 Å²	28.7	21%	0.211	13%	0.131	C	C	.	.	H	α-helix	trans	-54.2	-49.8	167.2	174.4	177.5	173.9	-158.4	13.1	111.1	V743 S750 Y751 E844 S849 N852	V743-R747 WeakPolarHBondContact O-CB 3.43Å; V743-R747 PolarHBondContact O-N 2.9Å; R747-S750 PolarHBondContact O-N 3.09Å; R747-Y751 PolarHBondContact O-N 2.6Å; R747-E844 IonicContact CZ-OE1 3.37Å; R747-E844 VanDerWaalsContact CZ-OE1 3.24Å; R747-E844 IonicContact NH1-OE1 2.69Å; R747-E844 PolarHBondContact NH1-OE1 3.04Å; R747-E844 IonicContact NH2-OE1 3.23Å; R747-E844 PolarHBondContact NH2-OE1 3.32Å; R747-S849 WeakPolarHBondContact CA-OG 3.36Å; R747-S849 WeakPolarHBondContact CB-OG 3.25Å; R747-S849 PolarHBondContact N-OG 2.94Å; R747-N852 PolarHBondContact O-ND2 2.96Å
748	N	98.2	Very high	93	Very high	44 Å²	44	28.1 Å²	28.1	24%	0.235	14%	0.136	C	C	.	.	H	α-helix	trans	-66.4	-43.4	179.9	-68	-13.3	0	0	0	111.4	S701 R708 C744 T745 L746 S750 Y751	S701-N748 WeakPolarHBondContact OG-CB 3.33Å; S701-N748 PolarHBondContact OG-ND2 3.39Å; R708-N748 WeakPolarHBondContact CD-O 3.49Å; C744-N748 VanDerWaalsContact O-CG 3.32Å; C744-N748 PolarHBondContact O-N 3.29Å; C744-N748 PolarHBondContact O-ND2 3.19Å; T745-N748 WeakPolarHBondContact O-CB 3.42Å; T745-N748 PolarHBondContact O-N 3.26Å; L746-N748 VanDerWaalsContact C-N 3.33Å; L746-N748 PolarHBondContact O-N 3.38Å; N748-S750 PolarHBondContact O-N 2.92Å; N748-Y751 WeakPolarHBondContact O-CB 3.02Å; N748-Y751 PolarHBondContact O-N 3.37Å
749	L	97.8	Very high	91.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.7	-23	174.8	-61.2	-177.1	0	0	0	112.9	R708 M711 R712 V718 T745 L746 L821	R708-L749 HydrophobicContact CB-CD2 4.37Å; R708-L749 HydrophobicContact CG-CD2 4.36Å; M711-L749 HydrophobicContact CB-CD1 4.45Å; M711-L749 HydrophobicContact CB-CD2 3.62Å; M711-L749 HydrophobicContact CE-CD2 4.5Å; M711-L749 HydrophobicContact SD-CD2 4.42Å; R712-L749 HydrophobicContact CG-CB 4.47Å; R712-L749 HydrophobicContact CG-CD2 4.35Å; R712-L749 VanDerWaalsContact CZ-O 3.25Å; R712-L749 PolarHBondContact NE-O 2.85Å; R712-L749 PolarHBondContact NH2-O 3.2Å; V718-L749 HydrophobicContact CG2-CD1 4.21Å; T745-L749 HydrophobicContact CG2-CD1 4.23Å; T745-L749 HydrophobicContact CG2-CG 4.4Å; T745-L749 WeakPolarHBondContact O-CG 3.4Å; T745-L749 PolarHBondContact O-N 2.99Å; L746-L749 PolarHBondContact O-N 2.92Å; L749-L821 HydrophobicContact CB-CD1 4.09Å
750	S	96.8	Very high	88.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-80	-15	175.5	-58.9	0	0	0	0	114.1	L746 R747 N748 L753	L746-S750 VanDerWaalsContact O-CB 3.27Å; L746-S750 WeakPolarHBondContact O-CB 3.38Å; L746-S750 PolarHBondContact O-N 3.23Å; L746-S750 PolarHBondContact O-OG 3.18Å; R747-S750 PolarHBondContact O-N 3.09Å; N748-S750 PolarHBondContact O-N 2.92Å; S750-L753 WeakPolarHBondContact O-CD1 3.4Å; S750-L753 WeakPolarHBondContact O-CG 3.4Å
751	Y	96.4	Very high	86.6	Confident	67 Å²	67	42.8 Å²	42.8	26%	0.263	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	132.4	-178.6	-178.5	-104.7	0	0	0	111.9	R712 R747 N748 L753 V1192	R712-Y751 PolarHBondContact NH2-O 2.67Å; R747-Y751 PolarHBondContact O-N 2.6Å; N748-Y751 WeakPolarHBondContact O-CB 3.02Å; N748-Y751 PolarHBondContact O-N 3.37Å; Y751-L753 VanDerWaalsContact C-N 3.26Å; Y751-L753 PolarHBondContact O-N 3.47Å; Y751-L753 VanDerWaalsContact O-N 3.17Å; Y751-V1192 HydrophobicContact CE2-CG1 4.42Å; Y751-V1192 VanDerWaalsContact OH-CG1 3.23Å; Y751-V1192 WeakPolarHBondContact OH-CG1 3.24Å; Y751-V1192 PolarHBondContact OH-OXT 2.87Å; Y751-V1192 VanDerWaalsContact OH-OXT 3.05Å
752	R	92	Very high	84.4	Confident	96 Å²	96	43.4 Å²	43.4	36%	0.362	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	28.8	176.4	-70	177.4	57.5	155.1	-9.2	116	E705 E754 L755 E756 V1192	E705-R752 IonicContact OE2-NH2 2.64Å; R752-E754 VanDerWaalsContact C-N 3.3Å; R752-E754 PolarHBondContact O-N 3.11Å; R752-L755 PolarHBondContact O-N 3.26Å; R752-E756 HydrophobicContact CB-CG 3.97Å; R752-E756 WeakPolarHBondContact CB-OE1 3.37Å; R752-E756 IonicContact NE-OE1 2.74Å; R752-E756 WeakPolarHBondContact O-CG 3.29Å; R752-E756 PolarHBondContact O-N 3.42Å; R752-V1192 HydrophobicContact CG-CG1 4.39Å
753	L	89.9	Confident	82	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.031	23%	0.231	C	C	.	.	H	α-helix	trans	-50.9	-43.3	-179.7	-77.6	166.2	0	0	0	114.2	S750 Y751 L755 E756 V757 L821 W822 L853 W858	S750-L753 WeakPolarHBondContact O-CD1 3.4Å; S750-L753 WeakPolarHBondContact O-CG 3.4Å; Y751-L753 VanDerWaalsContact C-N 3.26Å; Y751-L753 PolarHBondContact O-N 3.47Å; Y751-L753 VanDerWaalsContact O-N 3.17Å; L753-L755 PolarHBondContact O-N 3.13Å; L753-L755 VanDerWaalsContact O-N 3.13Å; L753-E756 PolarHBondContact O-N 3.26Å; L753-V757 HydrophobicContact CD2-CG2 3.67Å; L753-V757 WeakPolarHBondContact O-CB 3.31Å; L753-V757 PolarHBondContact O-N 2.83Å; L753-V757 VanDerWaalsContact O-N 3.12Å; L753-L821 HydrophobicContact CD1-CB 4.06Å; L753-L821 HydrophobicContact CD2-CD1 4Å; L753-W822 HydrophobicContact CD1-CE3 4.13Å; L753-W822 HydrophobicContact CD2-CE3 4Å; L753-W822 HydrophobicContact CD2-CZ3 4.05Å; L753-L853 HydrophobicContact CD1-CD2 3.58Å; L753-W858 HydrophobicContact CB-CH2 3.74Å; L753-W858 HydrophobicContact CB-CZ2 4.04Å; L753-W858 HydrophobicContact CD1-CH2 4.48Å
754	E	87.4	Confident	79.4	Confident	76 Å²	76	49.6 Å²	49.6	36%	0.355	26%	0.263	S	S	.	.	H	α-helix	trans	-55	-27.4	177.1	-176.2	173.6	-165.6	0	0	113.7	R752 G856 W858	R752-E754 VanDerWaalsContact C-N 3.3Å; R752-E754 PolarHBondContact O-N 3.11Å; E754-G856 WeakPolarHBondContact OE2-CA 3.21Å; E754-W858 HydrophobicContact CB-CD2 3.83Å; E754-W858 HydrophobicContact CB-CE3 4.22Å; E754-W858 HydrophobicContact CB-CG 3.98Å; E754-W858 VanDerWaalsContact CD-CD1 3.48Å; E754-W858 HydrophobicContact CG-CB 3.89Å; E754-W858 HydrophobicContact CG-CD2 4.07Å; E754-W858 HydrophobicContact CG-CE3 4.5Å; E754-W858 HydrophobicContact CG-CG 3.76Å; E754-W858 VanDerWaalsContact OE1-CB 3.31Å; E754-W858 WeakPolarHBondContact OE1-CB 3.48Å; E754-W858 PolarHBondContact OE1-N 2.97Å; E754-W858 VanDerWaalsContact OE2-CD1 3.23Å
755	L	87.4	Confident	76.9	Confident	126 Å²	126	54.3 Å²	54.3	66%	0.66	29%	0.287	S	S	*	.	H	α-helix	trans	-105.4	-27.5	-176.9	-59.8	175.2	0	0	0	113.2	R752 L753	R752-L755 PolarHBondContact O-N 3.26Å; L753-L755 PolarHBondContact O-N 3.13Å; L753-L755 VanDerWaalsContact O-N 3.13Å
756	E	88.1	Confident	74.1	Confident	9 Å²	9	59.4 Å²	59.4	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-99.8	-12.2	-171.2	-63.8	-179	-177.7	0	0	113.9	E705 R708 R712 R752 L753	E705-E756 HydrophobicContact CG-CG 3.91Å; R708-E756 IonicContact CZ-OE1 2.56Å; R708-E756 IonicContact CZ-OE2 2.69Å; R708-E756 IonicContact NE-OE1 3.63Å; R708-E756 PolarHBondContact NE-OE1 3.07Å; R708-E756 IonicContact NE-OE2 2.86Å; R708-E756 PolarHBondContact NE-OE2 3.39Å; R708-E756 IonicContact NH2-OE1 3.23Å; R708-E756 PolarHBondContact NH2-OE1 3.31Å; R708-E756 IonicContact NH2-OE2 2.68Å; R712-E756 IonicContact CZ-OE2 3.95Å; R712-E756 VanDerWaalsContact CZ-OE2 3.27Å; R712-E756 VanDerWaalsContact NH1-CB 3.29Å; R712-E756 IonicContact NH1-OE2 2.9Å; R712-E756 PolarHBondContact NH1-OE2 2.9Å; R712-E756 IonicContact NH2-OE2 3.27Å; R712-E756 PolarHBondContact NH2-OE2 2.8Å; R752-E756 HydrophobicContact CB-CG 3.97Å; R752-E756 WeakPolarHBondContact CB-OE1 3.37Å; R752-E756 IonicContact NE-OE1 2.74Å; R752-E756 WeakPolarHBondContact O-CG 3.29Å; R752-E756 PolarHBondContact O-N 3.42Å; L753-E756 PolarHBondContact O-N 3.26Å
757	V	80.3	Confident	71.4	Confident	12 Å²	12	65.7 Å²	65.7	7%	0.073	34%	0.344	C	S	.	.	S	Bend	trans	-106.7	124.8	179.1	179.8	0	0	0	0	109.9	L753 Q759 L762 V818 W822	L753-V757 HydrophobicContact CD2-CG2 3.67Å; L753-V757 WeakPolarHBondContact O-CB 3.31Å; L753-V757 PolarHBondContact O-N 2.83Å; L753-V757 VanDerWaalsContact O-N 3.12Å; V757-Q759 PolarHBondContact O-N 2.75Å; V757-L762 HydrophobicContact CG1-CD1 4.19Å; V757-V818 HydrophobicContact CG2-CG2 4.49Å; V757-W822 HydrophobicContact CB-CZ3 4.45Å; V757-W822 HydrophobicContact CG1-CH2 3.74Å; V757-W822 HydrophobicContact CG1-CZ3 4.02Å; V757-W822 HydrophobicContact CG2-CZ3 4Å
758	P	63.5	Low	68.5	Low	77 Å²	77	69.4 Å²	69.4	50%	0.5	37%	0.367	S	S	.	.			trans	-59.1	121.7	-176.4	-27.8	35.8	0	0	0	113.9	A760 R761	P758-A760 PolarHBondContact O-N 3.14Å; P758-R761 PolarHBondContact O-N 2.66Å
759	Q	55	Low	65.6	Low	93 Å²	93	74.1 Å²	74.1	44%	0.435	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.8	-177	-164.3	71.8	-18.2	0	0	114	V757 R761 L762 L763	V757-Q759 PolarHBondContact O-N 2.75Å; Q759-R761 VanDerWaalsContact C-N 3.29Å; Q759-R761 PolarHBondContact O-N 3.33Å; Q759-L762 CarbonylContact O-C 3.6Å; Q759-L762 WeakPolarHBondContact O-CA 3.49Å; Q759-L762 VanDerWaalsContact O-CB 3.27Å; Q759-L762 WeakPolarHBondContact O-CB 3.4Å; Q759-L762 PolarHBondContact O-N 3.1Å; Q759-L763 HydrophobicContact CG-CD1 3.78Å; Q759-L763 HydrophobicContact CG-CG 4.14Å; Q759-L763 PolarHBondContact O-N 3.22Å; Q759-L763 VanDerWaalsContact O-N 3.08Å
760	A	45.7	Very low	62.8	Low	81 Å²	81	81.4 Å²	81.4	67%	0.669	43%	0.432	S	S	*	.	H	α-helix	trans	-56.9	-37.2	172.8	0	0	0	0	0	113.3	P758 L762 G764	P758-A760 PolarHBondContact O-N 3.14Å; A760-L762 PolarHBondContact O-N 2.95Å; A760-G764 PolarHBondContact O-N 3.39Å
761	R	52.4	Low	60.2	Low	146 Å²	146	88.1 Å²	88.1	55%	0.551	47%	0.467	S	S	*	.	H	α-helix	trans	-72.6	-16.6	172.7	-56.6	-168.1	-162	-174.7	8	112.8	P758 Q759	P758-R761 PolarHBondContact O-N 2.66Å; Q759-R761 VanDerWaalsContact C-N 3.29Å; Q759-R761 PolarHBondContact O-N 3.33Å
762	L	53.2	Low	57.4	Low	13 Å²	13	91.2 Å²	91.2	7%	0.068	49%	0.487	C	S	.	.	H	α-helix	trans	-98	-21.2	-169.7	-123.4	96.8	0	0	0	114	V757 Q759 A760 W822 W858 K859 F860	V757-L762 HydrophobicContact CG1-CD1 4.19Å; Q759-L762 CarbonylContact O-C 3.6Å; Q759-L762 WeakPolarHBondContact O-CA 3.49Å; Q759-L762 VanDerWaalsContact O-CB 3.27Å; Q759-L762 WeakPolarHBondContact O-CB 3.4Å; Q759-L762 PolarHBondContact O-N 3.1Å; A760-L762 PolarHBondContact O-N 2.95Å; L762-W822 HydrophobicContact CD1-CH2 4.2Å; L762-W822 HydrophobicContact CD1-CZ2 3.86Å; L762-W858 HydrophobicContact CD1-CZ3 4.34Å; L762-W858 HydrophobicContact CD2-CE3 3.67Å; L762-W858 HydrophobicContact CD2-CZ3 3.84Å; L762-K859 WeakPolarHBondContact O-CE 3.35Å; L762-K859 PolarHBondContact O-NZ 2.85Å; L762-F860 HydrophobicContact CD2-CD2 3.8Å; L762-F860 HydrophobicContact CD2-CE2 3.63Å; L762-F860 HydrophobicContact CG-CD2 4.31Å; L762-F860 HydrophobicContact CG-CE2 3.75Å
763	L	46.9	Very low	54.5	Low	65 Å²	65	90 Å²	90	34%	0.34	50%	0.504	S	S	.	.	H	α-helix	trans	-123.4	-11.5	-178.4	-63.5	179	0	0	0	114.3	Q759 L765 N766	Q759-L763 HydrophobicContact CG-CD1 3.78Å; Q759-L763 HydrophobicContact CG-CG 4.14Å; Q759-L763 PolarHBondContact O-N 3.22Å; Q759-L763 VanDerWaalsContact O-N 3.08Å; L763-L765 PolarHBondContact O-N 2.65Å; L763-N766 PolarHBondContact O-N 3.43Å
764	G	43.5	Very low	51.7	Low	65 Å²	65	99.5 Å²	99.5	67%	0.67	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	40.4	-170	0	0	0	0	0	118	A760	A760-G764 PolarHBondContact O-N 3.39Å
765	L	45.8	Very low	49.1	Very low	109 Å²	109	105.3 Å²	105.3	57%	0.571	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.5	-14	170.3	-81.7	177.5	0	0	0	115	L763	L763-L765 PolarHBondContact O-N 2.65Å
766	N	40.3	Very low	46.4	Very low	107 Å²	107	104.4 Å²	104.4	57%	0.572	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.7	-26	-171.2	-77.4	44.8	0	0	0	115.8	L763	L763-N766 PolarHBondContact O-N 3.43Å
767	E	40.1	Very low	44.2	Very low	132 Å²	132	110.2 Å²	110.2	62%	0.617	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-14.7	-171.8	-67.4	-178.8	163.8	0	0	114.5
768	L	38.1	Very low	41.7	Very low	134 Å²	134	115.1 Å²	115.1	70%	0.702	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-21.6	-176.4	-151.2	74.2	0	0	0	113.8	L772	L768-L772 HydrophobicContact CG-CD1 4.5Å
769	D	37.2	Very low	40.3	Very low	143 Å²	143	119.9 Å²	119.9	77%	0.765	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-35.7	-178.8	-152	48.4	0	0	0	111.4	L771	D769-L771 PolarHBondContact O-N 2.99Å
770	D	39.3	Very low	39.2	Very low	153 Å²	153	121.3 Å²	121.3	82%	0.818	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-6.7	179.8	-144.3	41.4	0	0	0	113.2
771	L	42.1	Very low	38.4	Very low	140 Å²	140	123.5 Å²	123.5	73%	0.733	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-14.3	179.6	-68.7	177.2	0	0	0	114.3	D769	D769-L771 PolarHBondContact O-N 2.99Å
772	L	37.6	Very low	37.4	Very low	132 Å²	132	125.3 Å²	125.3	69%	0.691	70%	0.699	S	S	*	*	S	Bend	trans	-113.3	56.8	-178.9	-67.3	178.6	0	0	0	111	L768	L768-L772 HydrophobicContact CG-CD1 4.5Å
773	G	31.8	Very low	37.3	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	73%	0.729	S	S	*	*			trans	-59.5	142.3	-175	0	0	0	0	0	114.2
774	K	31.3	Very low	36.4	Very low	207 Å²	207	132.3 Å²	132.3	90%	0.9	75%	0.752	S	S	*	*			trans	-94.9	84.7	164.2	-76.5	-168.1	173.9	-175.6	0	110.8
775	E	32.6	Very low	36.1	Very low	197 Å²	197	134.4 Å²	134.4	92%	0.921	75%	0.754	S	S	*	*			trans	-67.8	134.3	151.1	-70.7	-159.9	153.3	0	0	109.3
776	S	29	Very low	35.4	Very low	108 Å²	108	140.3 Å²	140.3	76%	0.755	77%	0.77	S	S	*	*			trans	-150.5	139.4	157.7	53.9	0	0	0	0	108.7
777	P	41.9	Very low	35.6	Very low	131 Å²	131	139 Å²	139	85%	0.851	78%	0.781	S	S	*	*			trans	-116.5	121.1	-152.5	34.6	-20.3	0	0	0	114.1
778	S	28.6	Very low	35.4	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	79%	0.791	S	S	*	*			trans	-155.4	85.8	166.6	64.5	0	0	0	0	114.4
779	K	34.7	Very low	35.6	Very low	177 Å²	177	145 Å²	145	77%	0.77	80%	0.799	S	S	*	*			trans	56.7	146.5	133.9	-95.4	-175.8	144.5	-109.8	0	124
780	D	31	Very low	35.5	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	81%	0.808	S	S	*	*			trans	70.3	78	145.4	-54.7	-14.8	0	0	0	119.7
781	S	29.2	Very low	35.6	Very low	127 Å²	127	150.9 Å²	150.9	89%	0.888	81%	0.811	S	S	*	*				-173.2	121.6	112.3	47	0	0	0	0	114.4
782	E	31.2	Very low	35.6	Very low	185 Å²	185	154.1 Å²	154.1	86%	0.864	82%	0.819	S	S	*	*			trans	-101.1	173.8	159.4	-102.7	-159.9	157.8	0	0	109.3
783	P	50.8	Low	35.4	Very low	108 Å²	108	157.1 Å²	157.1	70%	0.701	83%	0.826	S	S	*	*			cis	-131.6	171.7	-31.2	36	-21.2	0	0	0	112
784	S	28.8	Very low	35.4	Very low	117 Å²	117	162.5 Å²	162.5	82%	0.818	83%	0.83	S	S	*	*			trans	-155.8	142.9	148.7	-158.1	0	0	0	0	113.4
785	C	36.6	Very low	35.4	Very low	108 Å²	108	162.3 Å²	162.3	73%	0.73	82%	0.824	S	S	*	*			trans	-82.2	168.6	-177	-63.8	0	0	0	0	112.8
786	W	32.2	Very low	35.4	Very low	234 Å²	234	156.7 Å²	156.7	89%	0.886	80%	0.803	S	S	*	*				165.9	84.7	115.7	-95.1	90.3	0	0	0	109.4
787	G	43.7	Very low	35.9	Very low	79 Å²	79	158.1 Å²	158.1	81%	0.814	81%	0.81	S	S	*	*			trans	-72.9	131	-171.8	0	0	0	0	0	114.3
788	K	36.7	Very low	35.8	Very low	189 Å²	189	159.1 Å²	159.1	82%	0.822	80%	0.803	S	S	*	*			trans	-131.2	105.3	164.9	-72.3	-174.6	179.6	173.3	0	111.8
789	K	40.6	Very low	36.6	Very low	202 Å²	202	160 Å²	160	88%	0.878	79%	0.794	S	S	*	*			trans	29.4	100.9	159.3	-60.9	-176.6	179.5	-178.2	0	116.5	K791	K789-K791 VanDerWaalsContact C-N 3.34Å; K789-K791 PolarHBondContact O-N 2.79Å
790	K	36.5	Very low	37.4	Very low	218 Å²	218	157 Å²	157	95%	0.948	79%	0.787	S	S	*	*			trans	-59	89.3	165.9	-76.3	-175.3	177.2	177.7	0	111	K792	K790-K792 PolarHBondContact O-N 3.22Å; K790-K792 VanDerWaalsContact O-N 3.13Å
791	K	40.1	Very low	38.8	Very low	202 Å²	202	158.1 Å²	158.1	88%	0.878	79%	0.788	S	S	*	*			trans	-60	114.7	161.9	-171.5	174	-174.5	176.5	0	106.3	K789 K793	K789-K791 VanDerWaalsContact C-N 3.34Å; K789-K791 PolarHBondContact O-N 2.79Å; K791-K793 PolarHBondContact O-N 3Å
792	K	42.8	Very low	40.9	Very low	208 Å²	208	153.1 Å²	153.1	90%	0.904	75%	0.75	S	S	*	*			trans	-68.1	77	-176.5	-169.3	174	-177.2	175.4	0	109.8	K790 K794	K790-K792 PolarHBondContact O-N 3.22Å; K790-K792 VanDerWaalsContact O-N 3.13Å; K792-K794 VanDerWaalsContact C-N 3.34Å; K792-K794 PolarHBondContact O-N 3.46Å
793	K	33	Very low	42.6	Very low	195 Å²	195	147.6 Å²	147.6	85%	0.848	73%	0.726	S	S	*	*			trans	-59.2	101.8	168.6	-175.1	-178.3	-179.1	-173.7	0	105.6	K791 R795	K791-K793 PolarHBondContact O-N 3Å; K793-R795 PolarHBondContact O-N 3.41Å
794	K	32.9	Very low	43.3	Very low	184 Å²	184	142.6 Å²	142.6	80%	0.8	69%	0.694	S	S	*	*			trans	-55.7	104.5	170.4	-175.2	179.4	-177.5	-177.6	0	105.6	K792 T796	K792-K794 VanDerWaalsContact C-N 3.34Å; K792-K794 PolarHBondContact O-N 3.46Å; K794-T796 PolarHBondContact O-N 2.87Å
795	R	30.7	Very low	44.9	Very low	203 Å²	203	141.9 Å²	141.9	77%	0.766	68%	0.684	S	S	*	*			trans	-61.5	106.4	171.9	-137.1	178.7	171.3	168.5	-3.4	104.5	K793 E799	K793-R795 PolarHBondContact O-N 3.41Å; R795-E799 IonicContact CZ-OE2 3.67Å; R795-E799 IonicContact NE-OE2 3.4Å; R795-E799 PolarHBondContact NE-OE2 2.83Å; R795-E799 IonicContact NH2-OE2 3.1Å; R795-E799 PolarHBondContact NH2-OE2 3.49Å; R795-E799 VanDerWaalsContact NH2-OE2 3.1Å
796	T	32.3	Very low	46.2	Very low	79 Å²	79	139 Å²	139	49%	0.485	67%	0.673	S	S	.	*			trans	-64.6	139.7	166.4	36.3	0	0	0	0	106.7	K794 Q798	K794-T796 PolarHBondContact O-N 2.87Å; T796-Q798 PolarHBondContact O-N 3.08Å
797	P	39.8	Very low	47.9	Very low	138 Å²	138	133.7 Å²	133.7	90%	0.896	67%	0.669	S	S	*	*	S	Bend	trans	-72.3	73.6	165.5	31.3	-32.7	0	0	0	107.6
798	Q	39.1	Very low	49.2	Very low	151 Å²	151	131.1 Å²	131.1	71%	0.706	64%	0.636	S	S	*	*			trans	-132	36.1	-175.6	-161.8	-171.9	-10.5	0	0	109.9	T796	T796-Q798 PolarHBondContact O-N 3.08Å
799	E	45.5	Very low	50.5	Low	133 Å²	133	124.3 Å²	124.3	62%	0.621	61%	0.611	S	S	*	*	S	Bend	trans	-113.8	154.6	160.8	-60.1	177.7	118.6	0	0	104.1	R795 Q801	R795-E799 IonicContact CZ-OE2 3.67Å; R795-E799 IonicContact NE-OE2 3.4Å; R795-E799 PolarHBondContact NE-OE2 2.83Å; R795-E799 IonicContact NH2-OE2 3.1Å; R795-E799 PolarHBondContact NH2-OE2 3.49Å; R795-E799 VanDerWaalsContact NH2-OE2 3.1Å; E799-Q801 PolarHBondContact O-N 3.23Å
800	D	52.1	Low	51.6	Low	115 Å²	115	117 Å²	117	62%	0.615	59%	0.593	S	S	*	*	S	Bend	trans	73.5	-5.5	-177.1	-60.8	-13.3	0	0	0	121.6	W802 Y863	D800-W802 PolarHBondContact O-N 3.25Å; D800-Y863 PolarHBondContact O-OH 2.98Å
801	Q	60.3	Low	52.9	Low	145 Å²	145	109 Å²	109	68%	0.678	56%	0.56	S	S	*	*			trans	-78.9	86.7	167.1	-173.2	165.9	100.7	0	0	111.3	E799 D803	E799-Q801 PolarHBondContact O-N 3.23Å; Q801-D803 PolarHBondContact O-N 3.08Å
802	W	74	Confident	53.4	Low	23 Å²	23	104.6 Å²	104.6	9%	0.087	56%	0.555	C	S	.	*			trans	-54	121.9	168.7	-177.1	74.8	0	0	0	110.1	D800 G804 V805 G806 I808 P809 P824 Y863 A866 A867	D800-W802 PolarHBondContact O-N 3.25Å; W802-G804 VanDerWaalsContact CZ2-C 3.48Å; W802-G804 WeakPolarHBondContact CZ2-O 3.34Å; W802-V805 PolarHBondContact NE1-O 3.38Å; W802-V805 VanDerWaalsContact NE1-O 3.08Å; W802-G806 PolarHBondContact NE1-O 3.48Å; W802-I808 HydrophobicContact CD2-CG1 4.17Å; W802-I808 HydrophobicContact CH2-CG1 4.31Å; W802-I808 HydrophobicContact CZ2-CG1 3.8Å; W802-P809 HydrophobicContact CB-CG 4.27Å; W802-P824 HydrophobicContact CH2-CB 4.08Å; W802-P824 HydrophobicContact CH2-CG 4.3Å; W802-P824 HydrophobicContact CZ3-CB 4.2Å; W802-P824 HydrophobicContact CZ3-CG 4.05Å; W802-Y863 HydrophobicContact CB-CD1 3.73Å; W802-Y863 HydrophobicContact CB-CE1 3.52Å; W802-Y863 HydrophobicContact CB-CG 4.37Å; W802-Y863 HydrophobicContact CE3-CD1 4.23Å; W802-Y863 HydrophobicContact CE3-CG 4.06Å; W802-A866 HydrophobicContact CE3-CB 4.36Å; W802-A866 HydrophobicContact CZ3-CB 4.42Å; W802-A867 HydrophobicContact CZ3-CB 4.32Å
803	D	67.2	Low	54.5	Low	69 Å²	69	101.8 Å²	101.8	37%	0.369	54%	0.543	S	S	.	.			trans	-89.3	-9.9	-168	83.5	-41.3	0	0	0	113.4	Q801 V805 R904	Q801-D803 PolarHBondContact O-N 3.08Å; D803-V805 VanDerWaalsContact OD1-CB 3.31Å; D803-V805 WeakPolarHBondContact OD1-CB 3.43Å; D803-V805 PolarHBondContact OD1-N 3.49Å; D803-R904 PolarHBondContact O-NH2 3.46Å; D803-R904 IonicContact OD2-NH1 3.38Å
804	G	65.6	Low	56.4	Low	2 Å²	2	96.6 Å²	96.6	2%	0.021	53%	0.531	C	S	.	.	S	Bend	trans	122.4	-18.6	-170.7	0	0	0	0	0	113.2	W802 K870	W802-G804 VanDerWaalsContact CZ2-C 3.48Å; W802-G804 WeakPolarHBondContact CZ2-O 3.34Å; G804-K870 WeakPolarHBondContact O-CD 3.39Å; G804-K870 WeakPolarHBondContact O-CE 3.38Å; G804-K870 PolarHBondContact O-NZ 3.27Å
805	V	61.8	Low	58.8	Low	102 Å²	102	89 Å²	89	62%	0.618	50%	0.501	S	S	*	.	S	Bend	trans	-108.9	146.3	-169.5	-170.6	0	0	0	0	111.4	W802 D803	W802-V805 PolarHBondContact NE1-O 3.38Å; W802-V805 VanDerWaalsContact NE1-O 3.08Å; D803-V805 VanDerWaalsContact OD1-CB 3.31Å; D803-V805 WeakPolarHBondContact OD1-CB 3.43Å; D803-V805 PolarHBondContact OD1-N 3.49Å
806	G	63.4	Low	61.4	Low	48 Å²	48	86.1 Å²	86.1	50%	0.495	49%	0.494	S	S	.	.	S	Bend	trans	74.6	-178.8	-178	0	0	0	0	0	114.2	W802	W802-G806 PolarHBondContact NE1-O 3.48Å
807	P	67.4	Low	64.1	Low	123 Å²	123	83.2 Å²	83.2	80%	0.799	48%	0.479	S	S	*	.	S	Bend	trans	-64.7	151.3	174.9	29.5	-35.3	0	0	0	111.1
808	I	70.8	Confident	66.5	Low	24 Å²	24	77.2 Å²	77.2	12%	0.123	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-81.3	129.7	-176	-55	155.4	0	0	0	109.4	W802 G810 L811 H823 P824 Y863	W802-I808 HydrophobicContact CD2-CG1 4.17Å; W802-I808 HydrophobicContact CH2-CG1 4.31Å; W802-I808 HydrophobicContact CZ2-CG1 3.8Å; I808-G810 PolarHBondContact O-N 3.34Å; I808-L811 HydrophobicContact CB-CB 4.21Å; I808-L811 HydrophobicContact CB-CD1 4.11Å; I808-L811 HydrophobicContact CD1-CD1 4.26Å; I808-L811 HydrophobicContact CG2-CB 4.45Å; I808-L811 HydrophobicContact CG2-CD1 3.7Å; I808-L811 PolarHBondContact O-N 2.87Å; I808-H823 WeakPolarHBondContact CD1-NE2 3.31Å; I808-P824 HydrophobicContact CD1-CB 4.18Å; I808-P824 HydrophobicContact CD1-CG 3.72Å; I808-Y863 HydrophobicContact CG2-CD2 3.54Å; I808-Y863 HydrophobicContact CG2-CE2 3.5Å; I808-Y863 HydrophobicContact CG2-CG 4.5Å
809	P	65.3	Low	68.8	Low	46 Å²	46	73.3 Å²	73.3	30%	0.299	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	134.5	178.7	-26.5	35.3	0	0	0	112.8	W802 L811	W802-P809 HydrophobicContact CB-CG 4.27Å; P809-L811 PolarHBondContact O-N 3.31Å
810	G	62.6	Low	71	Confident	49 Å²	49	68.5 Å²	68.5	51%	0.505	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-4.5	179.2	0	0	0	0	0	116.2	I808	I808-G810 PolarHBondContact O-N 3.34Å
811	L	63.4	Low	73	Confident	49 Å²	49	63 Å²	63	26%	0.257	37%	0.371	S	S	.	.			trans	-107.6	71.7	-179.3	-82	167	0	0	0	111.4	I808 P809 F860	I808-L811 HydrophobicContact CB-CB 4.21Å; I808-L811 HydrophobicContact CB-CD1 4.11Å; I808-L811 HydrophobicContact CD1-CD1 4.26Å; I808-L811 HydrophobicContact CG2-CB 4.45Å; I808-L811 HydrophobicContact CG2-CD1 3.7Å; I808-L811 PolarHBondContact O-N 2.87Å; P809-L811 PolarHBondContact O-N 3.31Å; L811-F860 HydrophobicContact CD1-CE1 3.83Å
812	S	52	Low	74.4	Confident	110 Å²	110	56.6 Å²	56.6	77%	0.769	34%	0.34	S	S	*	.			trans	-89.5	-16.3	177.3	58.6	0	0	0	0	114.4
813	K	65.2	Low	75.2	Confident	150 Å²	150	56.9 Å²	56.9	65%	0.652	34%	0.342	S	S	*	.	S	Bend	trans	-97.4	150.6	175.4	-64.4	176.1	-177	172.3	0	109.8	P815	K813-P815 WeakPolarHBondContact O-CD 3.26Å
814	S	74	Confident	76.4	Confident	86 Å²	86	54.2 Å²	54.2	60%	0.601	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-61.7	122	168.1	57.8	0	0	0	0	109.4
815	P	82.9	Confident	77.6	Confident	23 Å²	23	56.6 Å²	56.6	15%	0.149	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-60.4	147.6	174.9	26.4	-35.7	0	0	0	110.8	K813 E819 M820 H823	K813-P815 WeakPolarHBondContact O-CD 3.26Å; P815-E819 HydrophobicContact CB-CB 4.05Å; P815-M820 HydrophobicContact CB-CG 4.45Å; P815-M820 HydrophobicContact CB-SD 3.94Å; P815-M820 HydrophobicContact CG-SD 3.66Å; P815-H823 HydrophobicContact CB-CB 4.28Å; P815-H823 HydrophobicContact CG-CB 4.08Å
816	K	84.9	Confident	79.2	Confident	144 Å²	144	51.8 Å²	51.8	63%	0.626	32%	0.316	S	S	*	.			trans	-143	154.5	177.7	-68	-168.9	175.9	-168.8	0	111.8	V818 E819	K816-V818 PolarHBondContact O-N 3.45Å; K816-E819 WeakPolarHBondContact O-CB 3.35Å; K816-E819 PolarHBondContact O-N 3.24Å; K816-E819 VanDerWaalsContact O-N 3.13Å
817	G	88.1	Confident	80.7	Confident	17 Å²	17	49.5 Å²	49.5	18%	0.175	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	53.2	-129.1	178.4	0	0	0	0	0	111.6	V718 D719 E819 M820	V718-G817 WeakPolarHBondContact CG1-O 3.29Å; D719-G817 PolarHBondContact OD1-N 3.11Å; D719-G817 WeakPolarHBondContact OD2-CA 3.46Å; D719-G817 PolarHBondContact OD2-N 3.23Å; G817-E819 PolarHBondContact O-N 3.27Å; G817-E819 VanDerWaalsContact O-N 3.12Å; G817-M820 WeakPolarHBondContact O-CB 3.5Å; G817-M820 PolarHBondContact O-N 3.5Å; G817-M820 VanDerWaalsContact O-N 3.12Å
818	V	90.1	Very high	82.1	Confident	13 Å²	13	49.6 Å²	49.6	8%	0.079	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-53.7	-31.8	-179.8	72	0	0	0	0	114.2	R712 V757 K816 M820 L821 W822	R712-V818 HydrophobicContact CB-CB 4.32Å; R712-V818 HydrophobicContact CB-CG2 3.68Å; R712-V818 HydrophobicContact CG-CG2 3.81Å; V757-V818 HydrophobicContact CG2-CG2 4.49Å; K816-V818 PolarHBondContact O-N 3.45Å; V818-M820 PolarHBondContact O-N 2.79Å; V818-L821 HydrophobicContact CG2-CD1 4.12Å; V818-L821 WeakPolarHBondContact O-CB 3.5Å; V818-L821 WeakPolarHBondContact O-CG 3.1Å; V818-L821 PolarHBondContact O-N 3.37Å; V818-L821 VanDerWaalsContact O-N 3.15Å; V818-W822 HydrophobicContact CG1-CH2 4.1Å; V818-W822 HydrophobicContact CG2-CH2 4.17Å; V818-W822 HydrophobicContact CG2-CZ3 3.8Å; V818-W822 WeakPolarHBondContact O-CZ3 3.31Å
819	E	88.9	Confident	83.3	Confident	69 Å²	69	48.9 Å²	48.9	32%	0.322	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24.8	-177.4	-58.4	179.3	168.3	0	0	112.9	P815 K816 G817 L821 W822 H823	P815-E819 HydrophobicContact CB-CB 4.05Å; K816-E819 WeakPolarHBondContact O-CB 3.35Å; K816-E819 PolarHBondContact O-N 3.24Å; K816-E819 VanDerWaalsContact O-N 3.13Å; G817-E819 PolarHBondContact O-N 3.27Å; G817-E819 VanDerWaalsContact O-N 3.12Å; E819-L821 PolarHBondContact O-N 3.27Å; E819-W822 HydrophobicContact CB-CZ2 4.09Å; E819-W822 HydrophobicContact CG-CH2 4.4Å; E819-W822 HydrophobicContact CG-CZ2 3.97Å; E819-H823 PolarHBondContact O-N 3.15Å
820	M	91	Very high	84.9	Confident	32 Å²	32	46.8 Å²	46.8	16%	0.158	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-61.6	-32.7	175.5	-70.9	-71.8	-69.4	0	0	112.1	V718 L722 P815 G817 V818 W822 H823 V826	V718-M820 HydrophobicContact CG1-CB 4.36Å; L722-M820 HydrophobicContact CD1-CB 3.45Å; L722-M820 VanDerWaalsContact CD1-CB 3.45Å; L722-M820 HydrophobicContact CD1-CE 4.16Å; L722-M820 HydrophobicContact CD1-CG 4.33Å; P815-M820 HydrophobicContact CB-CG 4.45Å; P815-M820 HydrophobicContact CB-SD 3.94Å; P815-M820 HydrophobicContact CG-SD 3.66Å; G817-M820 WeakPolarHBondContact O-CB 3.5Å; G817-M820 PolarHBondContact O-N 3.5Å; G817-M820 VanDerWaalsContact O-N 3.12Å; V818-M820 PolarHBondContact O-N 2.79Å; M820-W822 VanDerWaalsContact C-N 3.3Å; M820-W822 PolarHBondContact O-N 3.46Å; M820-H823 PolarHBondContact O-N 3.3Å; M820-H823 VanDerWaalsContact O-N 3.13Å; M820-V826 WeakPolarHBondContact O-CG1 3.34Å
821	L	93.1	Very high	86.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-58	-40.9	-172.8	-64.9	175.3	0	0	0	112.7	R712 V718 L746 L749 L753 V818 E819 L853	R712-L821 HydrophobicContact CG-CD1 4.13Å; V718-L821 HydrophobicContact CG1-CD2 3.65Å; V718-L821 HydrophobicContact CG1-CG 3.86Å; L746-L821 HydrophobicContact CD2-CD2 3.58Å; L749-L821 HydrophobicContact CB-CD1 4.09Å; L753-L821 HydrophobicContact CD1-CB 4.06Å; L753-L821 HydrophobicContact CD2-CD1 4Å; V818-L821 HydrophobicContact CG2-CD1 4.12Å; V818-L821 WeakPolarHBondContact O-CB 3.5Å; V818-L821 WeakPolarHBondContact O-CG 3.1Å; V818-L821 PolarHBondContact O-N 3.37Å; V818-L821 VanDerWaalsContact O-N 3.15Å; E819-L821 PolarHBondContact O-N 3.27Å; L821-L853 VanDerWaalsContact O-CD1 3.27Å; L821-L853 WeakPolarHBondContact O-CD1 3.27Å; L821-L853 WeakPolarHBondContact O-CD2 3.38Å
822	W	90.4	Very high	88.3	Confident	9 Å²	9	43.9 Å²	43.9	3%	0.034	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-102.4	5.9	-179.7	62.3	75.7	0	0	0	113.6	L753 V757 L762 V818 E819 M820 W858 F860	L753-W822 HydrophobicContact CD1-CE3 4.13Å; L753-W822 HydrophobicContact CD2-CE3 4Å; L753-W822 HydrophobicContact CD2-CZ3 4.05Å; V757-W822 HydrophobicContact CB-CZ3 4.45Å; V757-W822 HydrophobicContact CG1-CH2 3.74Å; V757-W822 HydrophobicContact CG1-CZ3 4.02Å; V757-W822 HydrophobicContact CG2-CZ3 4Å; L762-W822 HydrophobicContact CD1-CH2 4.2Å; L762-W822 HydrophobicContact CD1-CZ2 3.86Å; V818-W822 HydrophobicContact CG1-CH2 4.1Å; V818-W822 HydrophobicContact CG2-CH2 4.17Å; V818-W822 HydrophobicContact CG2-CZ3 3.8Å; V818-W822 WeakPolarHBondContact O-CZ3 3.31Å; E819-W822 HydrophobicContact CB-CZ2 4.09Å; E819-W822 HydrophobicContact CG-CH2 4.4Å; E819-W822 HydrophobicContact CG-CZ2 3.97Å; M820-W822 VanDerWaalsContact C-N 3.3Å; M820-W822 PolarHBondContact O-N 3.46Å; W822-W858 HydrophobicContact CB-CH2 3.79Å; W822-W858 HydrophobicContact CB-CZ2 4.41Å; W822-W858 HydrophobicContact CD2-CH2 4.29Å; W822-W858 HydrophobicContact CE3-CH2 4.4Å; W822-W858 HydrophobicContact CG-CH2 4.06Å; W822-W858 HydrophobicContact CG-CZ3 4.45Å; W822-F860 HydrophobicContact CB-CB 4.05Å; W822-F860 HydrophobicContact CB-CG 4.39Å; W822-F860 AromaticContact CD1-CD1 3.44Å; W822-F860 VanDerWaalsContact CD1-CD1 3.44Å; W822-F860 AromaticContact CD1-CD2 3.82Å; W822-F860 AromaticContact CD1-CE1 3.75Å; W822-F860 AromaticContact CD1-CG 3.47Å; W822-F860 VanDerWaalsContact CD1-CG 3.47Å; W822-F860 HydrophobicContact CG-CB 4.28Å; W822-F860 HydrophobicContact CG-CD1 4.4Å; W822-F860 HydrophobicContact CG-CD2 4.44Å; W822-F860 HydrophobicContact CG-CG 4.11Å; W822-F860 AromaticContact NE1-CE1 3.97Å; W822-F860 AromaticContact NE1-CE2 3.97Å; W822-F860 AromaticContact NE1-CZ 3.89Å
823	H	91.3	Very high	90.5	Very high	30 Å²	30	38.6 Å²	38.6	14%	0.139	20%	0.201	C	C	.	.	S	Bend	trans	-78.1	129.2	177.5	-173.1	-105.5	0	0	0	110.8	I808 P815 E819 M820 S825 V826	I808-H823 WeakPolarHBondContact CD1-NE2 3.31Å; P815-H823 HydrophobicContact CB-CB 4.28Å; P815-H823 HydrophobicContact CG-CB 4.08Å; E819-H823 PolarHBondContact O-N 3.15Å; M820-H823 PolarHBondContact O-N 3.3Å; M820-H823 VanDerWaalsContact O-N 3.13Å; H823-S825 WeakPolarHBondContact ND1-CB 3.26Å; H823-S825 PolarHBondContact ND1-N 2.96Å; H823-S825 PolarHBondContact ND1-OG 3.06Å; H823-S825 PolarHBondContact O-N 3.39Å; H823-V826 WeakPolarHBondContact O-CG2 3.41Å; H823-V826 PolarHBondContact O-N 2.97Å; H823-V826 VanDerWaalsContact O-N 3.09Å
824	P	92.1	Very high	92	Very high	13 Å²	13	31.6 Å²	31.6	8%	0.084	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-51	-19.2	-177.1	-34.2	39	0	0	0	117.6	W802 I808 V826 V827 A867	W802-P824 HydrophobicContact CH2-CB 4.08Å; W802-P824 HydrophobicContact CH2-CG 4.3Å; W802-P824 HydrophobicContact CZ3-CB 4.2Å; W802-P824 HydrophobicContact CZ3-CG 4.05Å; I808-P824 HydrophobicContact CD1-CB 4.18Å; I808-P824 HydrophobicContact CD1-CG 3.72Å; P824-V826 VanDerWaalsContact C-N 3.27Å; P824-V826 PolarHBondContact O-N 3.46Å; P824-V827 WeakPolarHBondContact O-CB 3.26Å; P824-V827 PolarHBondContact O-N 3.41Å; P824-A867 HydrophobicContact CB-CB 4.01Å
825	S	91.1	Very high	93.2	Very high	52 Å²	52	30 Å²	30	36%	0.364	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-63.2	-26.7	175.8	60.9	0	0	0	0	114.3	H823 V827 P829	H823-S825 WeakPolarHBondContact ND1-CB 3.26Å; H823-S825 PolarHBondContact ND1-N 2.96Å; H823-S825 PolarHBondContact ND1-OG 3.06Å; H823-S825 PolarHBondContact O-N 3.39Å; S825-V827 PolarHBondContact O-N 3.37Å; S825-P829 WeakPolarHBondContact O-CD 3.45Å
826	V	94.1	Very high	93.9	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-72.1	-16.5	179.5	-53.4	0	0	0	0	113.1	L722 M820 H823 P824 K828 P829 Y830 L853	L722-V826 HydrophobicContact CD1-CG1 4.04Å; L722-V826 HydrophobicContact CD2-CB 4.43Å; L722-V826 HydrophobicContact CD2-CG1 3.92Å; M820-V826 WeakPolarHBondContact O-CG1 3.34Å; H823-V826 WeakPolarHBondContact O-CG2 3.41Å; H823-V826 PolarHBondContact O-N 2.97Å; H823-V826 VanDerWaalsContact O-N 3.09Å; P824-V826 VanDerWaalsContact C-N 3.27Å; P824-V826 PolarHBondContact O-N 3.46Å; V826-K828 PolarHBondContact O-N 2.58Å; V826-P829 WeakPolarHBondContact O-CD 3.3Å; V826-Y830 HydrophobicContact CB-CD2 4.32Å; V826-Y830 HydrophobicContact CB-CE2 3.93Å; V826-Y830 HydrophobicContact CG2-CD2 4.2Å; V826-Y830 HydrophobicContact CG2-CE2 3.79Å; V826-Y830 WeakPolarHBondContact O-CD2 3.38Å; V826-Y830 PolarHBondContact O-N 2.91Å; V826-L853 HydrophobicContact CG2-CD1 3.88Å
827	V	96.8	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-43.5	-179.5	172.2	0	0	0	0	111.5	P824 S825 Y830 L831 L850 I864 A867 V868	P824-V827 WeakPolarHBondContact O-CB 3.26Å; P824-V827 PolarHBondContact O-N 3.41Å; S825-V827 PolarHBondContact O-N 3.37Å; V827-Y830 PolarHBondContact O-N 3.01Å; V827-L831 HydrophobicContact CG1-CD1 3.68Å; V827-L831 HydrophobicContact CG1-CG 4.14Å; V827-L831 WeakPolarHBondContact O-CB 3.37Å; V827-L831 WeakPolarHBondContact O-CG 2.97Å; V827-L831 PolarHBondContact O-N 2.91Å; V827-L850 HydrophobicContact CG1-CD2 4.43Å; V827-L850 HydrophobicContact CG2-CD2 4.23Å; V827-I864 HydrophobicContact CG2-CD1 3.6Å; V827-I864 HydrophobicContact CG2-CG2 4.13Å; V827-A867 HydrophobicContact CB-CB 4.25Å; V827-A867 HydrophobicContact CG1-CB 4.3Å; V827-A867 HydrophobicContact CG2-CB 4.01Å; V827-V868 HydrophobicContact CG1-CB 4.31Å; V827-V868 HydrophobicContact CG1-CG2 3.49Å; V827-V868 VanDerWaalsContact CG1-CG2 3.49Å; V827-V868 HydrophobicContact CG2-CG2 4.35Å
828	K	96.2	Very high	94.8	Very high	124 Å²	124	31.5 Å²	31.5	54%	0.539	18%	0.176	S	C	.	.	H	α-helix	trans	-63.4	-49.5	-177.2	178	175.2	-180	177	0	112.6	V826 Y830 L831 T832 E871	V826-K828 PolarHBondContact O-N 2.58Å; K828-Y830 PolarHBondContact O-N 2.87Å; K828-L831 PolarHBondContact O-N 2.55Å; K828-L831 VanDerWaalsContact O-N 3.12Å; K828-T832 PolarHBondContact O-N 3.27Å; K828-T832 PolarHBondContact O-OG1 3.32Å; K828-E871 HydrophobicContact CB-CG 4.4Å
829	P	96.9	Very high	95.1	Very high	9 Å²	9	32.1 Å²	32.1	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-58	-42.1	174.8	-24.9	32.3	0	0	0	114.2	I725 H726 V729 S825 V826 L831 T832 L833	I725-P829 HydrophobicContact CG2-CB 3.7Å; H726-P829 WeakPolarHBondContact CE1-CG 3.33Å; V729-P829 HydrophobicContact CG2-CB 4.43Å; S825-P829 WeakPolarHBondContact O-CD 3.45Å; V826-P829 WeakPolarHBondContact O-CD 3.3Å; P829-L831 VanDerWaalsContact C-N 3.31Å; P829-L831 PolarHBondContact O-N 3.4Å; P829-T832 PolarHBondContact O-N 3.47Å; P829-L833 WeakPolarHBondContact O-CG 3.31Å; P829-L833 PolarHBondContact O-N 2.87Å
830	Y	98.5	Very high	95.5	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-36.5	174.7	-68.2	-50.7	0	0	0	112.3	I725 L746 V826 V827 K828 L834 L850 L853	I725-Y830 HydrophobicContact CD1-CE1 4.18Å; L746-Y830 WeakPolarHBondContact CB-OH 3.39Å; V826-Y830 HydrophobicContact CB-CD2 4.32Å; V826-Y830 HydrophobicContact CB-CE2 3.93Å; V826-Y830 HydrophobicContact CG2-CD2 4.2Å; V826-Y830 HydrophobicContact CG2-CE2 3.79Å; V826-Y830 WeakPolarHBondContact O-CD2 3.38Å; V826-Y830 PolarHBondContact O-N 2.91Å; V827-Y830 PolarHBondContact O-N 3.01Å; K828-Y830 PolarHBondContact O-N 2.87Å; Y830-L834 WeakPolarHBondContact O-CB 3.3Å; Y830-L834 WeakPolarHBondContact O-CD1 3.25Å; Y830-L834 WeakPolarHBondContact O-CG 3.33Å; Y830-L834 PolarHBondContact O-N 2.84Å; Y830-L850 HydrophobicContact CD2-CD2 4.03Å; Y830-L850 HydrophobicContact CG-CD2 4.49Å; Y830-L853 HydrophobicContact CE2-CD1 4.06Å
831	L	98.3	Very high	95.8	Very high	6 Å²	6	30.9 Å²	30.9	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-70.6	-34.5	176.1	-71.4	177	0	0	0	113	V827 K828 P829 L834 A835 L850 E871 G873 I876	V827-L831 HydrophobicContact CG1-CD1 3.68Å; V827-L831 HydrophobicContact CG1-CG 4.14Å; V827-L831 WeakPolarHBondContact O-CB 3.37Å; V827-L831 WeakPolarHBondContact O-CG 2.97Å; V827-L831 PolarHBondContact O-N 2.91Å; K828-L831 PolarHBondContact O-N 2.55Å; K828-L831 VanDerWaalsContact O-N 3.12Å; P829-L831 VanDerWaalsContact C-N 3.31Å; P829-L831 PolarHBondContact O-N 3.4Å; L831-L834 HydrophobicContact CD2-CD1 4.27Å; L831-L834 PolarHBondContact O-N 3.29Å; L831-A835 PolarHBondContact O-N 3.32Å; L831-A835 VanDerWaalsContact O-N 3.13Å; L831-L850 HydrophobicContact CD2-CD1 3.73Å; L831-L850 HydrophobicContact CG-CD1 4.26Å; L831-E871 HydrophobicContact CD1-CB 3.71Å; L831-G873 VanDerWaalsContact CD2-CA 3.48Å; L831-I876 HydrophobicContact CB-CD1 4.25Å; L831-I876 HydrophobicContact CD2-CD1 4.49Å
832	T	97.9	Very high	96	Very high	31 Å²	31	30.9 Å²	30.9	19%	0.19	18%	0.182	C	C	.	.	H	α-helix	trans	-66.4	-45.1	171.6	-58	0	0	0	0	111.1	V729 Y734 K828 P829 L834 A835 E836	V729-T832 HydrophobicContact CG1-CG2 4.01Å; V729-T832 HydrophobicContact CG2-CG2 4.21Å; Y734-T832 HydrophobicContact CE1-CG2 3.93Å; K828-T832 PolarHBondContact O-N 3.27Å; K828-T832 PolarHBondContact O-OG1 3.32Å; P829-T832 PolarHBondContact O-N 3.47Å; T832-L834 PolarHBondContact O-N 3.02Å; T832-A835 PolarHBondContact O-N 3Å; T832-E836 HydrophobicContact CG2-CG 3.86Å; T832-E836 WeakPolarHBondContact O-CG 3.16Å; T832-E836 PolarHBondContact O-N 3.44Å
833	L	98.1	Very high	96.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57	-38.3	172	-72.9	173	0	0	0	112.1	I725 Y734 V739 V743 P829 A835 S837 T842 L843	I725-L833 HydrophobicContact CG2-CD1 3.81Å; Y734-L833 HydrophobicContact CD1-CD2 4.06Å; V739-L833 HydrophobicContact CG1-CD1 4.48Å; V739-L833 HydrophobicContact CG1-CD2 3.97Å; V743-L833 HydrophobicContact CG2-CD1 3.58Å; P829-L833 WeakPolarHBondContact O-CG 3.31Å; P829-L833 PolarHBondContact O-N 2.87Å; L833-A835 VanDerWaalsContact C-N 3.28Å; L833-A835 PolarHBondContact O-N 2.73Å; L833-S837 WeakPolarHBondContact O-CB 3.32Å; L833-S837 PolarHBondContact O-N 2.89Å; L833-S837 VanDerWaalsContact O-N 3.16Å; L833-T842 HydrophobicContact CB-CG2 4.4Å; L833-T842 HydrophobicContact CD1-CG2 4.45Å; L833-T842 HydrophobicContact CD2-CG2 3.95Å; L833-L843 WeakPolarHBondContact O-CD2 3.17Å
834	L	98.3	Very high	96.7	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-72.2	-15.3	177.6	-74.4	164.9	0	0	0	114.8	Y830 L831 T832 L843 A847 L850 I876 L877 L880	Y830-L834 WeakPolarHBondContact O-CB 3.3Å; Y830-L834 WeakPolarHBondContact O-CD1 3.25Å; Y830-L834 WeakPolarHBondContact O-CG 3.33Å; Y830-L834 PolarHBondContact O-N 2.84Å; L831-L834 HydrophobicContact CD2-CD1 4.27Å; L831-L834 PolarHBondContact O-N 3.29Å; T832-L834 PolarHBondContact O-N 3.02Å; L834-L843 HydrophobicContact CD2-CD2 4.22Å; L834-L843 WeakPolarHBondContact CD2-O 3.31Å; L834-A847 HydrophobicContact CD2-CB 3.91Å; L834-L850 HydrophobicContact CD1-CD1 3.62Å; L834-I876 HydrophobicContact CB-CG2 3.79Å; L834-I876 WeakPolarHBondContact O-CG2 3.31Å; L834-L877 HydrophobicContact CD1-CD2 4.22Å; L834-L880 HydrophobicContact CB-CD1 3.93Å; L834-L880 HydrophobicContact CD2-CD1 3.4Å; L834-L880 VanDerWaalsContact CD2-CD1 3.4Å; L834-L880 HydrophobicContact CG-CD1 4.21Å
835	A	97.6	Very high	97	Very high	54 Å²	54	30 Å²	30	45%	0.446	18%	0.177	S	C	.	.	H	α-helix	trans	-99	-35.7	176.8	0	0	0	0	0	113	L831 T832 L833 I876	L831-A835 PolarHBondContact O-N 3.32Å; L831-A835 VanDerWaalsContact O-N 3.13Å; T832-A835 PolarHBondContact O-N 3Å; L833-A835 VanDerWaalsContact C-N 3.28Å; L833-A835 PolarHBondContact O-N 2.73Å; A835-I876 HydrophobicContact CB-CD1 4.2Å; A835-I876 HydrophobicContact CB-CG2 4.22Å
836	E	97.2	Very high	97.4	Very high	114 Å²	114	27.5 Å²	27.5	53%	0.533	16%	0.159	S	C	.	.	H	α-helix	trans	-112.2	-14.3	-165.5	-47.2	-71.2	148	0	0	114.4	Y734 T832	Y734-E836 HydrophobicContact CD1-CB 4.3Å; Y734-E836 HydrophobicContact CD2-CB 3.54Å; Y734-E836 HydrophobicContact CE1-CB 4.06Å; Y734-E836 HydrophobicContact CE1-CG 4.38Å; Y734-E836 HydrophobicContact CE2-CB 3.28Å; Y734-E836 HydrophobicContact CE2-CG 3.99Å; Y734-E836 HydrophobicContact CG-CB 4.03Å; T832-E836 HydrophobicContact CG2-CG 3.86Å; T832-E836 WeakPolarHBondContact O-CG 3.16Å; T832-E836 PolarHBondContact O-N 3.44Å
837	S	96.8	Very high	97.6	Very high	11 Å²	11	27.4 Å²	27.4	8%	0.077	16%	0.159	C	C	.	.			trans	-81.2	133.1	-180	-178.1	0	0	0	0	111.7	D735 L833 N839 T842	D735-S837 WeakPolarHBondContact OD1-CA 3.46Å; D735-S837 WeakPolarHBondContact OD1-CB 3.44Å; D735-S837 PolarHBondContact OD1-OG 3.12Å; L833-S837 WeakPolarHBondContact O-CB 3.32Å; L833-S837 PolarHBondContact O-N 2.89Å; L833-S837 VanDerWaalsContact O-N 3.16Å; S837-N839 PolarHBondContact OG-N 3.25Å; S837-T842 WeakPolarHBondContact OG-CB 3.21Å; S837-T842 WeakPolarHBondContact OG-CG2 3.48Å
838	S	96	Very high	97.6	Very high	89 Å²	89	27.4 Å²	27.4	62%	0.622	16%	0.159	S	C	*	.			trans	-88.2	-22.5	169.7	74.2	0	0	0	0	113.1	D735 P840	D735-S838 PolarHBondContact OD1-N 3.37Å; D735-S838 WeakPolarHBondContact OD2-CB 3.03Å; D735-S838 PolarHBondContact OD2-N 2.84Å; D735-S838 PolarHBondContact OD2-OG 2.96Å; S838-P840 WeakPolarHBondContact O-CD 3.47Å
839	N	96.8	Very high	97.7	Very high	27 Å²	27	21.5 Å²	21.5	14%	0.144	13%	0.133	C	C	.	.			trans	-70	112.5	-177.1	-179.9	-17	0	0	0	111.5	D735 E740 S837 A841 T842 L843	D735-N839 HydrophobicContact CB-CB 4.08Å; D735-N839 PolarHBondContact O-ND2 3.24Å; D735-N839 VanDerWaalsContact OD1-CB 3.25Å; D735-N839 WeakPolarHBondContact OD1-CB 3.49Å; D735-N839 PolarHBondContact OD1-N 3.16Å; E740-N839 PolarHBondContact OE2-ND2 3.04Å; S837-N839 PolarHBondContact OG-N 3.25Å; N839-A841 PolarHBondContact O-N 3.21Å; N839-A841 VanDerWaalsContact O-N 3.11Å; N839-A841 WeakPolarHBondContact OD1-CB 3.41Å; N839-A841 PolarHBondContact OD1-N 3.04Å; N839-T842 WeakPolarHBondContact O-CB 3.43Å; N839-T842 PolarHBondContact O-N 3.05Å; N839-T842 PolarHBondContact OD1-N 3.47Å; N839-L843 PolarHBondContact O-N 3.11Å
840	P	97	Very high	97.8	Very high	52 Å²	52	21.1 Å²	21.1	34%	0.338	13%	0.131	S	C	.	.	H	α-helix	trans	-62.8	-24.2	-176.9	-22.9	34.9	0	0	0	114.2	S838 E844 N885 V888	S838-P840 WeakPolarHBondContact O-CD 3.47Å; P840-E844 VanDerWaalsContact O-CB 3.3Å; P840-E844 WeakPolarHBondContact O-CB 3.4Å; P840-E844 PolarHBondContact O-N 2.66Å; P840-N885 HydrophobicContact CB-CB 4.41Å; P840-N885 WeakPolarHBondContact CB-ND2 3.24Å; P840-V888 HydrophobicContact CB-CG2 4.15Å; P840-V888 VanDerWaalsContact O-CG2 3.3Å; P840-V888 WeakPolarHBondContact O-CG2 3.38Å
841	A	97.2	Very high	97.8	Very high	23 Å²	23	22.9 Å²	22.9	19%	0.19	14%	0.139	C	C	.	.	H	α-helix	trans	-77.8	-30.1	176.1	0	0	0	0	0	112.6	E740 N839 G845	E740-A841 VanDerWaalsContact CD-CB 3.46Å; E740-A841 HydrophobicContact CG-CB 3.67Å; N839-A841 PolarHBondContact O-N 3.21Å; N839-A841 VanDerWaalsContact O-N 3.11Å; N839-A841 WeakPolarHBondContact OD1-CB 3.41Å; N839-A841 PolarHBondContact OD1-N 3.04Å; A841-G845 PolarHBondContact O-N 2.88Å
842	T	98.1	Very high	97.7	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.8	-39.6	169.7	-64.2	0	0	0	0	110.7	V739 L833 S837 N839 G845 S846	V739-T842 HydrophobicContact CG1-CG2 4.36Å; L833-T842 HydrophobicContact CB-CG2 4.4Å; L833-T842 HydrophobicContact CD1-CG2 4.45Å; L833-T842 HydrophobicContact CD2-CG2 3.95Å; S837-T842 WeakPolarHBondContact OG-CB 3.21Å; S837-T842 WeakPolarHBondContact OG-CG2 3.48Å; N839-T842 WeakPolarHBondContact O-CB 3.43Å; N839-T842 PolarHBondContact O-N 3.05Å; N839-T842 PolarHBondContact OD1-N 3.47Å; T842-G845 PolarHBondContact O-N 2.94Å; T842-S846 WeakPolarHBondContact O-CB 3.49Å; T842-S846 PolarHBondContact O-N 3.38Å; T842-S846 PolarHBondContact O-OG 3.28Å
843	L	98.4	Very high	97.7	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-65.4	-49.5	173.8	-63.6	174.2	0	0	0	112.1	L833 L834 N839 G845 S846 A847 L880 M883 V888	L833-L843 WeakPolarHBondContact O-CD2 3.17Å; L834-L843 HydrophobicContact CD2-CD2 4.22Å; L834-L843 WeakPolarHBondContact CD2-O 3.31Å; N839-L843 PolarHBondContact O-N 3.11Å; L843-G845 VanDerWaalsContact C-N 3.29Å; L843-G845 PolarHBondContact O-N 3.43Å; L843-S846 PolarHBondContact O-N 3.12Å; L843-A847 WeakPolarHBondContact O-CB 3.28Å; L843-A847 PolarHBondContact O-N 3.37Å; L843-L880 HydrophobicContact CD1-CD2 4.28Å; L843-L880 HydrophobicContact CD2-CD2 4.28Å; L843-M883 HydrophobicContact CD1-CE 3.63Å; L843-M883 HydrophobicContact CD1-SD 3.7Å; L843-V888 HydrophobicContact CB-CG1 4.13Å; L843-V888 HydrophobicContact CB-CG2 3.96Å
844	E	98.1	Very high	97.6	Very high	29 Å²	29	22.6 Å²	22.6	14%	0.136	14%	0.136	C	C	.	.	H	α-helix	trans	-58.2	-43.3	174.4	-167	-154.7	136.1	0	0	110.8	R747 P840 G848 R887 V888 S891	R747-E844 IonicContact CZ-OE1 3.37Å; R747-E844 VanDerWaalsContact CZ-OE1 3.24Å; R747-E844 IonicContact NH1-OE1 2.69Å; R747-E844 PolarHBondContact NH1-OE1 3.04Å; R747-E844 IonicContact NH2-OE1 3.23Å; R747-E844 PolarHBondContact NH2-OE1 3.32Å; P840-E844 VanDerWaalsContact O-CB 3.3Å; P840-E844 WeakPolarHBondContact O-CB 3.4Å; P840-E844 PolarHBondContact O-N 2.66Å; E844-G848 WeakPolarHBondContact O-CA 3.48Å; E844-G848 PolarHBondContact O-N 3.04Å; E844-R887 HydrophobicContact CG-CB 4.03Å; E844-R887 WeakPolarHBondContact OE2-CB 3.37Å; E844-R887 WeakPolarHBondContact OE2-CD 3.2Å; E844-R887 IonicContact OE2-NH1 2.68Å; E844-V888 HydrophobicContact CB-CG2 4.25Å; E844-S891 WeakPolarHBondContact CG-OG 3.35Å
845	G	98	Very high	97.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-45	176.7	0	0	0	0	0	113.2	A841 T842 L843 S849	A841-G845 PolarHBondContact O-N 2.88Å; T842-G845 PolarHBondContact O-N 2.94Å; L843-G845 VanDerWaalsContact C-N 3.29Å; L843-G845 PolarHBondContact O-N 3.43Å; G845-S849 WeakPolarHBondContact O-CB 3.46Å; G845-S849 PolarHBondContact O-N 3.36Å; G845-S849 PolarHBondContact O-OG 3.29Å
846	S	98.5	Very high	96.9	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-74.7	-43.1	-177.2	-59	0	0	0	0	111.7	V743 T842 L843 S849 L850	V743-S846 WeakPolarHBondContact CG1-OG 3.35Å; T842-S846 WeakPolarHBondContact O-CB 3.49Å; T842-S846 PolarHBondContact O-N 3.38Å; T842-S846 PolarHBondContact O-OG 3.28Å; L843-S846 PolarHBondContact O-N 3.12Å; S846-S849 WeakPolarHBondContact O-CB 3.36Å; S846-S849 PolarHBondContact O-N 2.97Å; S846-L850 PolarHBondContact O-N 3.44Å
847	A	98.5	Very high	96.5	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-44	174	0	0	0	0	0	110.9	L834 L843 S849 L850 Q851 V892	L834-A847 HydrophobicContact CD2-CB 3.91Å; L843-A847 WeakPolarHBondContact O-CB 3.28Å; L843-A847 PolarHBondContact O-N 3.37Å; A847-S849 VanDerWaalsContact C-N 3.29Å; A847-S849 PolarHBondContact O-N 2.9Å; A847-L850 PolarHBondContact O-N 3.49Å; A847-Q851 VanDerWaalsContact O-CB 3.31Å; A847-Q851 WeakPolarHBondContact O-CB 3.32Å; A847-Q851 PolarHBondContact O-N 3.01Å; A847-V892 HydrophobicContact CB-CG2 3.68Å
848	G	98.1	Very high	96.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.3	-29.8	174.6	0	0	0	0	0	113.7	E844 N852	E844-G848 WeakPolarHBondContact O-CA 3.48Å; E844-G848 PolarHBondContact O-N 3.04Å; G848-N852 WeakPolarHBondContact O-CB 3.45Å; G848-N852 VanDerWaalsContact O-CG 3.29Å; G848-N852 PolarHBondContact O-N 2.8Å
849	S	98.4	Very high	95.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.6	-50.8	171.8	-61.5	0	0	0	0	110.7	R747 G845 S846 A847 Q851 N852 L853	R747-S849 WeakPolarHBondContact CA-OG 3.36Å; R747-S849 WeakPolarHBondContact CB-OG 3.25Å; R747-S849 PolarHBondContact N-OG 2.94Å; G845-S849 WeakPolarHBondContact O-CB 3.46Å; G845-S849 PolarHBondContact O-N 3.36Å; G845-S849 PolarHBondContact O-OG 3.29Å; S846-S849 WeakPolarHBondContact O-CB 3.36Å; S846-S849 PolarHBondContact O-N 2.97Å; A847-S849 VanDerWaalsContact C-N 3.29Å; A847-S849 PolarHBondContact O-N 2.9Å; S849-Q851 VanDerWaalsContact C-N 3.32Å; S849-Q851 PolarHBondContact O-N 3.3Å; S849-N852 PolarHBondContact O-N 3.26Å; S849-L853 WeakPolarHBondContact O-CB 3.19Å; S849-L853 VanDerWaalsContact O-CG 3.26Å; S849-L853 WeakPolarHBondContact O-CG 3.45Å; S849-L853 PolarHBondContact O-N 3.28Å
850	L	98.2	Very high	95.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.1	-36	176.1	-66.3	-178.8	0	0	0	112.6	V827 Y830 L831 L834 S846 A847 S854 V868 M899	V827-L850 HydrophobicContact CG1-CD2 4.43Å; V827-L850 HydrophobicContact CG2-CD2 4.23Å; Y830-L850 HydrophobicContact CD2-CD2 4.03Å; Y830-L850 HydrophobicContact CG-CD2 4.49Å; L831-L850 HydrophobicContact CD2-CD1 3.73Å; L831-L850 HydrophobicContact CG-CD1 4.26Å; L834-L850 HydrophobicContact CD1-CD1 3.62Å; S846-L850 PolarHBondContact O-N 3.44Å; A847-L850 PolarHBondContact O-N 3.49Å; L850-S854 VanDerWaalsContact O-CB 3.24Å; L850-S854 WeakPolarHBondContact O-CB 3.26Å; L850-S854 PolarHBondContact O-N 2.69Å; L850-S854 PolarHBondContact O-OG 2.93Å; L850-V868 HydrophobicContact CD1-CG2 4.42Å; L850-V868 HydrophobicContact CD2-CG2 4.22Å; L850-M899 HydrophobicContact CB-CE 4.24Å
851	Q	97.8	Very high	95.2	Very high	40 Å²	40	21.1 Å²	21.1	19%	0.187	12%	0.119	C	C	.	.	H	α-helix	trans	-56.5	-52.9	171.5	174.2	-170.9	-16.4	0	0	111.1	A847 S849 S854 A855 T894 A895 N898	A847-Q851 VanDerWaalsContact O-CB 3.31Å; A847-Q851 WeakPolarHBondContact O-CB 3.32Å; A847-Q851 PolarHBondContact O-N 3.01Å; S849-Q851 VanDerWaalsContact C-N 3.32Å; S849-Q851 PolarHBondContact O-N 3.3Å; Q851-S854 PolarHBondContact O-N 2.86Å; Q851-S854 PolarHBondContact O-OG 2.9Å; Q851-A855 PolarHBondContact O-N 3.27Å; Q851-T894 HydrophobicContact CG-CG2 3.9Å; Q851-A895 HydrophobicContact CB-CB 4.11Å; Q851-N898 PolarHBondContact O-ND2 3.35Å
852	N	97.6	Very high	95	Very high	29 Å²	29	20.9 Å²	20.9	16%	0.155	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-42	-179.4	-75.7	-12.7	0	0	0	112.1	R747 G848 S849 S854 A855	R747-N852 PolarHBondContact O-ND2 2.96Å; G848-N852 WeakPolarHBondContact O-CB 3.45Å; G848-N852 VanDerWaalsContact O-CG 3.29Å; G848-N852 PolarHBondContact O-N 2.8Å; S849-N852 PolarHBondContact O-N 3.26Å; N852-S854 PolarHBondContact O-N 2.68Å; N852-A855 PolarHBondContact O-N 3.14Å
853	L	96.3	Very high	94.8	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-73.3	-23.2	-178.9	-66.3	176.6	0	0	0	114.2	L753 L821 V826 Y830 S849 A861 I864	L753-L853 HydrophobicContact CD1-CD2 3.58Å; L821-L853 VanDerWaalsContact O-CD1 3.27Å; L821-L853 WeakPolarHBondContact O-CD1 3.27Å; L821-L853 WeakPolarHBondContact O-CD2 3.38Å; V826-L853 HydrophobicContact CG2-CD1 3.88Å; Y830-L853 HydrophobicContact CE2-CD1 4.06Å; S849-L853 WeakPolarHBondContact O-CB 3.19Å; S849-L853 VanDerWaalsContact O-CG 3.26Å; S849-L853 WeakPolarHBondContact O-CG 3.45Å; S849-L853 PolarHBondContact O-N 3.28Å; L853-A861 WeakPolarHBondContact O-CA 3.42Å; L853-A861 WeakPolarHBondContact O-CB 3.32Å; L853-I864 HydrophobicContact CB-CD1 4.44Å; L853-I864 HydrophobicContact CB-CG1 4.21Å; L853-I864 HydrophobicContact CB-CG2 4.03Å
854	S	96.3	Very high	94.6	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-0.8	177.3	60.4	0	0	0	0	114.1	L850 Q851 N852 R865 N898 M899	L850-S854 VanDerWaalsContact O-CB 3.24Å; L850-S854 WeakPolarHBondContact O-CB 3.26Å; L850-S854 PolarHBondContact O-N 2.69Å; L850-S854 PolarHBondContact O-OG 2.93Å; Q851-S854 PolarHBondContact O-N 2.86Å; Q851-S854 PolarHBondContact O-OG 2.9Å; N852-S854 PolarHBondContact O-N 2.68Å; S854-R865 PolarHBondContact O-NH1 3.03Å; S854-N898 VanDerWaalsContact OG-CB 3.25Å; S854-N898 WeakPolarHBondContact OG-CB 3.36Å; S854-M899 WeakPolarHBondContact OG-CE 3.38Å
855	A	94.1	Very high	94.6	Very high	35 Å²	35	20.3 Å²	20.3	29%	0.289	11%	0.114	S	C	.	.			trans	-73.4	153.1	177.1	0	0	0	0	0	112.4	Q851 N852 W858 A861	Q851-A855 PolarHBondContact O-N 3.27Å; N852-A855 PolarHBondContact O-N 3.14Å; A855-W858 PolarHBondContact O-NE1 3.04Å; A855-A861 WeakPolarHBondContact O-CB 3.41Å
856	G	87.9	Confident	94.4	Very high	28 Å²	28	20.4 Å²	20.4	29%	0.289	12%	0.115	S	C	.	.	S	Bend	trans	79	-177.9	175.2	0	0	0	0	0	114.9	E754 R865	E754-G856 WeakPolarHBondContact OE2-CA 3.21Å; G856-R865 PolarHBondContact O-NH1 3.32Å
857	N	88	Confident	94.3	Very high	138 Å²	138	20.6 Å²	20.6	74%	0.738	12%	0.116	S	C	*	.	S	Bend	trans	-112.8	-3.1	-173.8	-76	-39.6	0	0	0	114
858	W	88.7	Confident	94.2	Very high	22 Å²	22	20.6 Å²	20.6	8%	0.083	12%	0.116	C	C	.	.	S	Bend	trans	-55	155.5	169.3	66.9	-40.6	0	0	0	114.8	L753 E754 L762 W822 A855 F860 A861 A862	L753-W858 HydrophobicContact CB-CH2 3.74Å; L753-W858 HydrophobicContact CB-CZ2 4.04Å; L753-W858 HydrophobicContact CD1-CH2 4.48Å; E754-W858 HydrophobicContact CB-CD2 3.83Å; E754-W858 HydrophobicContact CB-CE3 4.22Å; E754-W858 HydrophobicContact CB-CG 3.98Å; E754-W858 VanDerWaalsContact CD-CD1 3.48Å; E754-W858 HydrophobicContact CG-CB 3.89Å; E754-W858 HydrophobicContact CG-CD2 4.07Å; E754-W858 HydrophobicContact CG-CE3 4.5Å; E754-W858 HydrophobicContact CG-CG 3.76Å; E754-W858 VanDerWaalsContact OE1-CB 3.31Å; E754-W858 WeakPolarHBondContact OE1-CB 3.48Å; E754-W858 PolarHBondContact OE1-N 2.97Å; E754-W858 VanDerWaalsContact OE2-CD1 3.23Å; L762-W858 HydrophobicContact CD1-CZ3 4.34Å; L762-W858 HydrophobicContact CD2-CE3 3.67Å; L762-W858 HydrophobicContact CD2-CZ3 3.84Å; W822-W858 HydrophobicContact CB-CH2 3.79Å; W822-W858 HydrophobicContact CB-CZ2 4.41Å; W822-W858 HydrophobicContact CD2-CH2 4.29Å; W822-W858 HydrophobicContact CE3-CH2 4.4Å; W822-W858 HydrophobicContact CG-CH2 4.06Å; W822-W858 HydrophobicContact CG-CZ3 4.45Å; A855-W858 PolarHBondContact O-NE1 3.04Å; W858-F860 VanDerWaalsContact C-N 3.3Å; W858-F860 HydrophobicContact CD2-CB 4.26Å; W858-F860 HydrophobicContact CE3-CB 4.14Å; W858-F860 AromaticContact CE3-CD2 3.8Å; W858-F860 HydrophobicContact CE3-CD2 3.8Å; W858-F860 HydrophobicContact CE3-CG 4.47Å; W858-F860 HydrophobicContact CH2-CB 4.06Å; W858-F860 HydrophobicContact CH2-CD2 4.49Å; W858-F860 HydrophobicContact CZ2-CB 4.21Å; W858-F860 HydrophobicContact CZ3-CB 4.04Å; W858-F860 AromaticContact CZ3-CD2 3.73Å; W858-F860 HydrophobicContact CZ3-CD2 3.73Å; W858-F860 HydrophobicContact CZ3-CG 4.3Å; W858-F860 PolarHBondContact O-N 3.46Å; W858-A861 VanDerWaalsContact NE1-CB 3.31Å; W858-A861 PolarHBondContact O-N 3.4Å; W858-A862 PolarHBondContact O-N 3.07Å
859	K	88.2	Confident	94.1	Very high	82 Å²	82	22.5 Å²	22.5	36%	0.357	12%	0.124	S	C	.	.	H	α-helix	trans	-54.8	-39	-174.5	64.4	-175.2	178.9	-177.7	0	114	L762 A862 Y863	L762-K859 WeakPolarHBondContact O-CE 3.35Å; L762-K859 PolarHBondContact O-NZ 2.85Å; K859-A862 WeakPolarHBondContact O-CB 3.46Å; K859-A862 PolarHBondContact O-N 3.43Å; K859-Y863 VanDerWaalsContact O-CD1 3.28Å; K859-Y863 WeakPolarHBondContact O-CD1 3.17Å; K859-Y863 VanDerWaalsContact O-CG 3.32Å; K859-Y863 PolarHBondContact O-N 3.18Å
860	F	89.9	Confident	93.9	Very high	13 Å²	13	27.7 Å²	27.7	6%	0.057	15%	0.146	C	C	.	.	H	α-helix	trans	-72.5	-36.2	-176.6	-64.7	-72.1	0	0	0	113.3	L762 L811 W822 W858 A862 Y863 I864	L762-F860 HydrophobicContact CD2-CD2 3.8Å; L762-F860 HydrophobicContact CD2-CE2 3.63Å; L762-F860 HydrophobicContact CG-CD2 4.31Å; L762-F860 HydrophobicContact CG-CE2 3.75Å; L811-F860 HydrophobicContact CD1-CE1 3.83Å; W822-F860 HydrophobicContact CB-CB 4.05Å; W822-F860 HydrophobicContact CB-CG 4.39Å; W822-F860 AromaticContact CD1-CD1 3.44Å; W822-F860 VanDerWaalsContact CD1-CD1 3.44Å; W822-F860 AromaticContact CD1-CD2 3.82Å; W822-F860 AromaticContact CD1-CE1 3.75Å; W822-F860 AromaticContact CD1-CG 3.47Å; W822-F860 VanDerWaalsContact CD1-CG 3.47Å; W822-F860 HydrophobicContact CG-CB 4.28Å; W822-F860 HydrophobicContact CG-CD1 4.4Å; W822-F860 HydrophobicContact CG-CD2 4.44Å; W822-F860 HydrophobicContact CG-CG 4.11Å; W822-F860 AromaticContact NE1-CE1 3.97Å; W822-F860 AromaticContact NE1-CE2 3.97Å; W822-F860 AromaticContact NE1-CZ 3.89Å; W858-F860 VanDerWaalsContact C-N 3.3Å; W858-F860 HydrophobicContact CD2-CB 4.26Å; W858-F860 HydrophobicContact CE3-CB 4.14Å; W858-F860 AromaticContact CE3-CD2 3.8Å; W858-F860 HydrophobicContact CE3-CD2 3.8Å; W858-F860 HydrophobicContact CE3-CG 4.47Å; W858-F860 HydrophobicContact CH2-CB 4.06Å; W858-F860 HydrophobicContact CH2-CD2 4.49Å; W858-F860 HydrophobicContact CZ2-CB 4.21Å; W858-F860 HydrophobicContact CZ3-CB 4.04Å; W858-F860 AromaticContact CZ3-CD2 3.73Å; W858-F860 HydrophobicContact CZ3-CD2 3.73Å; W858-F860 HydrophobicContact CZ3-CG 4.3Å; W858-F860 PolarHBondContact O-N 3.46Å; F860-A862 VanDerWaalsContact C-N 3.28Å; F860-A862 PolarHBondContact O-N 2.64Å; F860-Y863 HydrophobicContact CD1-CD2 4.05Å; F860-Y863 HydrophobicContact CE1-CD2 4.38Å; F860-Y863 CarbonylContact O-C 3.59Å; F860-Y863 PolarHBondContact O-N 3.07Å; F860-Y863 VanDerWaalsContact O-N 3.09Å; F860-I864 WeakPolarHBondContact O-CG1 3.42Å; F860-I864 PolarHBondContact O-N 3.39Å
861	A	93.4	Very high	93.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-36.5	171.3	0	0	0	0	0	112.1	L853 A855 W858 Y863 I864 R865	L853-A861 WeakPolarHBondContact O-CA 3.42Å; L853-A861 WeakPolarHBondContact O-CB 3.32Å; A855-A861 WeakPolarHBondContact O-CB 3.41Å; W858-A861 VanDerWaalsContact NE1-CB 3.31Å; W858-A861 PolarHBondContact O-N 3.4Å; A861-Y863 VanDerWaalsContact C-N 3.33Å; A861-Y863 PolarHBondContact O-N 3.33Å; A861-I864 PolarHBondContact O-N 2.96Å; A861-R865 WeakPolarHBondContact O-CB 3.42Å; A861-R865 WeakPolarHBondContact O-CG 3.4Å; A861-R865 PolarHBondContact O-N 3.02Å
862	A	92.6	Very high	93.6	Very high	19 Å²	19	36.9 Å²	36.9	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-41.4	171.5	0	0	0	0	0	111.9	W858 K859 F860 R865 A866	W858-A862 PolarHBondContact O-N 3.07Å; K859-A862 WeakPolarHBondContact O-CB 3.46Å; K859-A862 PolarHBondContact O-N 3.43Å; F860-A862 VanDerWaalsContact C-N 3.28Å; F860-A862 PolarHBondContact O-N 2.64Å; A862-R865 PolarHBondContact O-N 2.9Å; A862-A866 WeakPolarHBondContact O-CB 3.31Å; A862-A866 PolarHBondContact O-N 3.29Å
863	Y	93.1	Very high	93.6	Very high	9 Å²	9	35.5 Å²	35.5	4%	0.035	18%	0.179	C	C	.	.	H	α-helix	trans	-68.1	-38.7	177.2	-59.6	-8.6	0	0	0	112.3	D800 W802 I808 K859 F860 A861 A866 A867	D800-Y863 PolarHBondContact O-OH 2.98Å; W802-Y863 HydrophobicContact CB-CD1 3.73Å; W802-Y863 HydrophobicContact CB-CE1 3.52Å; W802-Y863 HydrophobicContact CB-CG 4.37Å; W802-Y863 HydrophobicContact CE3-CD1 4.23Å; W802-Y863 HydrophobicContact CE3-CG 4.06Å; I808-Y863 HydrophobicContact CG2-CD2 3.54Å; I808-Y863 HydrophobicContact CG2-CE2 3.5Å; I808-Y863 HydrophobicContact CG2-CG 4.5Å; K859-Y863 VanDerWaalsContact O-CD1 3.28Å; K859-Y863 WeakPolarHBondContact O-CD1 3.17Å; K859-Y863 VanDerWaalsContact O-CG 3.32Å; K859-Y863 PolarHBondContact O-N 3.18Å; F860-Y863 HydrophobicContact CD1-CD2 4.05Å; F860-Y863 HydrophobicContact CE1-CD2 4.38Å; F860-Y863 CarbonylContact O-C 3.59Å; F860-Y863 PolarHBondContact O-N 3.07Å; F860-Y863 VanDerWaalsContact O-N 3.09Å; A861-Y863 VanDerWaalsContact C-N 3.33Å; A861-Y863 PolarHBondContact O-N 3.33Å; Y863-A866 PolarHBondContact O-N 3.34Å; Y863-A867 WeakPolarHBondContact O-CB 3.5Å; Y863-A867 PolarHBondContact O-N 3.42Å
864	I	95.8	Very high	93.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-45.6	172.7	-66.8	-71.5	0	0	0	110.7	V827 L853 F860 A861 A866 A867 V868	V827-I864 HydrophobicContact CG2-CD1 3.6Å; V827-I864 HydrophobicContact CG2-CG2 4.13Å; L853-I864 HydrophobicContact CB-CD1 4.44Å; L853-I864 HydrophobicContact CB-CG1 4.21Å; L853-I864 HydrophobicContact CB-CG2 4.03Å; F860-I864 WeakPolarHBondContact O-CG1 3.42Å; F860-I864 PolarHBondContact O-N 3.39Å; A861-I864 PolarHBondContact O-N 2.96Å; I864-A866 VanDerWaalsContact C-N 3.29Å; I864-A866 PolarHBondContact O-N 3.36Å; I864-A867 PolarHBondContact O-N 3.34Å; I864-V868 WeakPolarHBondContact O-CG2 3.45Å; I864-V868 PolarHBondContact O-N 3.46Å
865	R	96.8	Very high	93.7	Very high	11 Å²	11	40.1 Å²	40.1	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-35.3	175.9	-70.1	-177	-60.8	-116.5	9.9	112.5	S854 G856 A861 A862 N898 M899 D902 N905	S854-R865 PolarHBondContact O-NH1 3.03Å; G856-R865 PolarHBondContact O-NH1 3.32Å; A861-R865 WeakPolarHBondContact O-CB 3.42Å; A861-R865 WeakPolarHBondContact O-CG 3.4Å; A861-R865 PolarHBondContact O-N 3.02Å; A862-R865 PolarHBondContact O-N 2.9Å; R865-N898 WeakPolarHBondContact CD-O 3.3Å; R865-M899 HydrophobicContact CB-SD 4.32Å; R865-M899 HydrophobicContact CG-SD 3.89Å; R865-D902 HydrophobicContact CB-CB 4.11Å; R865-N905 PolarHBondContact O-ND2 3.15Å
866	A	95.2	Very high	93.9	Very high	2 Å²	2	40 Å²	40	2%	0.017	20%	0.203	C	C	.	.	H	α-helix	trans	-72.6	-39.4	173.8	0	0	0	0	0	113.1	W802 A862 Y863 I864 R869 K870	W802-A866 HydrophobicContact CE3-CB 4.36Å; W802-A866 HydrophobicContact CZ3-CB 4.42Å; A862-A866 WeakPolarHBondContact O-CB 3.31Å; A862-A866 PolarHBondContact O-N 3.29Å; Y863-A866 PolarHBondContact O-N 3.34Å; I864-A866 VanDerWaalsContact C-N 3.29Å; I864-A866 PolarHBondContact O-N 3.36Å; A866-R869 PolarHBondContact O-N 3.2Å; A866-K870 PolarHBondContact O-N 3.19Å; A866-K870 VanDerWaalsContact O-N 3.1Å
867	A	95.8	Very high	94.4	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.033	19%	0.189	C	C	.	.	H	α-helix	trans	-66.2	-43.4	176.7	0	0	0	0	0	112.3	W802 P824 V827 Y863 I864 R869 K870 E871	W802-A867 HydrophobicContact CZ3-CB 4.32Å; P824-A867 HydrophobicContact CB-CB 4.01Å; V827-A867 HydrophobicContact CB-CB 4.25Å; V827-A867 HydrophobicContact CG1-CB 4.3Å; V827-A867 HydrophobicContact CG2-CB 4.01Å; Y863-A867 WeakPolarHBondContact O-CB 3.5Å; Y863-A867 PolarHBondContact O-N 3.42Å; I864-A867 PolarHBondContact O-N 3.34Å; A867-R869 PolarHBondContact O-N 3.4Å; A867-K870 PolarHBondContact O-N 3.19Å; A867-K870 VanDerWaalsContact O-N 3.07Å; A867-E871 WeakPolarHBondContact O-CG 3.27Å; A867-E871 PolarHBondContact O-N 2.56Å
868	V	97.1	Very high	94.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.4	-36.8	176.3	168.8	0	0	0	0	111.6	V827 L850 I864 G873 L874 L877 M899	V827-V868 HydrophobicContact CG1-CB 4.31Å; V827-V868 HydrophobicContact CG1-CG2 3.49Å; V827-V868 VanDerWaalsContact CG1-CG2 3.49Å; V827-V868 HydrophobicContact CG2-CG2 4.35Å; L850-V868 HydrophobicContact CD1-CG2 4.42Å; L850-V868 HydrophobicContact CD2-CG2 4.22Å; I864-V868 WeakPolarHBondContact O-CG2 3.45Å; I864-V868 PolarHBondContact O-N 3.46Å; V868-G873 WeakPolarHBondContact O-CA 3.41Å; V868-G873 PolarHBondContact O-N 3.44Å; V868-L874 HydrophobicContact CG1-CD2 4.29Å; V868-L877 HydrophobicContact CG1-CD1 4.35Å; V868-M899 HydrophobicContact CB-CE 4.24Å; V868-M899 HydrophobicContact CB-SD 3.9Å; V868-M899 HydrophobicContact CG1-CE 4.17Å; V868-M899 HydrophobicContact CG1-CG 4.4Å; V868-M899 HydrophobicContact CG1-SD 3.88Å; V868-M899 HydrophobicContact CG2-CE 3.75Å; V868-M899 HydrophobicContact CG2-SD 4.04Å
869	R	95.1	Very high	95.1	Very high	40 Å²	40	37.8 Å²	37.8	15%	0.151	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-47.5	172.6	175.7	174.1	47.3	-119.3	-1.8	112.6	A866 A867 K872 D902 N905 L908	A866-R869 PolarHBondContact O-N 3.2Å; A867-R869 PolarHBondContact O-N 3.4Å; R869-K872 PolarHBondContact O-N 3.39Å; R869-K872 VanDerWaalsContact O-N 3.17Å; R869-D902 IonicContact CZ-OD1 3.35Å; R869-D902 IonicContact CZ-OD2 2.64Å; R869-D902 IonicContact NH1-OD1 3Å; R869-D902 PolarHBondContact NH1-OD1 2.79Å; R869-D902 IonicContact NH1-OD2 3.75Å; R869-D902 PolarHBondContact NH1-OD2 3.12Å; R869-D902 IonicContact NH2-OD1 2.76Å; R869-D902 IonicContact NH2-OD2 3.7Å; R869-D902 PolarHBondContact NH2-OD2 3.1Å; R869-N905 WeakPolarHBondContact CB-OD1 3.41Å; R869-N905 WeakPolarHBondContact CD-OD1 3.41Å; R869-N905 PolarHBondContact NH1-OD1 2.96Å; R869-L908 HydrophobicContact CG-CD1 4.12Å
870	K	93.7	Very high	95.5	Very high	108 Å²	108	34.6 Å²	34.6	47%	0.47	17%	0.169	S	C	.	.	H	α-helix	trans	-62.4	-46.3	-177.9	170.9	177.6	168.1	-173.2	0	112.4	G804 A866 A867 K872	G804-K870 WeakPolarHBondContact O-CD 3.39Å; G804-K870 WeakPolarHBondContact O-CE 3.38Å; G804-K870 PolarHBondContact O-NZ 3.27Å; A866-K870 PolarHBondContact O-N 3.19Å; A866-K870 VanDerWaalsContact O-N 3.1Å; A867-K870 PolarHBondContact O-N 3.19Å; A867-K870 VanDerWaalsContact O-N 3.07Å; K870-K872 PolarHBondContact O-N 3.03Å; K870-K872 VanDerWaalsContact O-N 3.13Å
871	E	95.2	Very high	95.8	Very high	71 Å²	71	34 Å²	34	33%	0.332	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	13.9	177.4	-55.7	-56.5	126.4	0	0	112.6	K828 L831 A867 G873	K828-E871 HydrophobicContact CB-CG 4.4Å; L831-E871 HydrophobicContact CD1-CB 3.71Å; A867-E871 WeakPolarHBondContact O-CG 3.27Å; A867-E871 PolarHBondContact O-N 2.56Å; E871-G873 PolarHBondContact O-N 3.38Å
872	K	95.6	Very high	95.7	Very high	162 Å²	162	40.2 Å²	40.2	70%	0.704	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	30.4	178	-54.4	178.3	-176.3	173.4	0	114.7	R869 K870 L874 P875	R869-K872 PolarHBondContact O-N 3.39Å; R869-K872 VanDerWaalsContact O-N 3.17Å; K870-K872 PolarHBondContact O-N 3.03Å; K870-K872 VanDerWaalsContact O-N 3.13Å; K872-L874 VanDerWaalsContact C-N 3.3Å; K872-L874 PolarHBondContact O-N 2.87Å; K872-P875 VanDerWaalsContact O-CD 3.3Å; K872-P875 WeakPolarHBondContact O-CD 3.41Å
873	G	97.2	Very high	95.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.9	-17.3	-178.7	0	0	0	0	0	115.7	L831 V868 E871 I876 L877	L831-G873 VanDerWaalsContact CD2-CA 3.48Å; V868-G873 WeakPolarHBondContact O-CA 3.41Å; V868-G873 PolarHBondContact O-N 3.44Å; E871-G873 PolarHBondContact O-N 3.38Å; G873-I876 PolarHBondContact O-N 2.97Å; G873-L877 WeakPolarHBondContact O-CG 3.3Å; G873-L877 PolarHBondContact O-N 3.13Å
874	L	97.4	Very high	95.6	Very high	13 Å²	13	48.4 Å²	48.4	7%	0.068	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-50.9	178.6	-65.6	-179.7	0	0	0	112.4	V868 K872 I876 L877 V878 L896 M899 L908 I909	V868-L874 HydrophobicContact CG1-CD2 4.29Å; K872-L874 VanDerWaalsContact C-N 3.3Å; K872-L874 PolarHBondContact O-N 2.87Å; L874-I876 VanDerWaalsContact C-N 3.34Å; L874-I876 PolarHBondContact O-N 2.9Å; L874-L877 PolarHBondContact O-N 3.29Å; L874-V878 WeakPolarHBondContact O-CG2 3.39Å; L874-V878 PolarHBondContact O-N 3.43Å; L874-L896 HydrophobicContact CD2-CD2 4.24Å; L874-M899 HydrophobicContact CD2-CB 4.16Å; L874-M899 HydrophobicContact CD2-CG 4.21Å; L874-L908 HydrophobicContact CD1-CB 3.94Å; L874-L908 HydrophobicContact CD1-CD1 4.09Å; L874-I909 HydrophobicContact CD1-CG1 4.23Å; L874-I909 HydrophobicContact CD2-CD1 4.03Å; L874-I909 HydrophobicContact CD2-CG1 4.01Å
875	P	97.2	Very high	95.5	Very high	85 Å²	85	50.9 Å²	50.9	55%	0.552	24%	0.243	S	C	*	.	H	α-helix	trans	-46.7	-48.8	168.2	-33	33.2	0	0	0	115.1	K872 L877 V878 E879	K872-P875 VanDerWaalsContact O-CD 3.3Å; K872-P875 WeakPolarHBondContact O-CD 3.41Å; P875-L877 PolarHBondContact O-N 2.9Å; P875-V878 PolarHBondContact O-N 3.04Å; P875-E879 PolarHBondContact O-N 2.8Å
876	I	97.9	Very high	95.4	Very high	34 Å²	34	52.4 Å²	52.4	17%	0.174	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-47	-178.1	-55.8	170.3	0	0	0	110.2	L831 L834 A835 G873 L874 V878 E879 L880	L831-I876 HydrophobicContact CB-CD1 4.25Å; L831-I876 HydrophobicContact CD2-CD1 4.49Å; L834-I876 HydrophobicContact CB-CG2 3.79Å; L834-I876 WeakPolarHBondContact O-CG2 3.31Å; A835-I876 HydrophobicContact CB-CD1 4.2Å; A835-I876 HydrophobicContact CB-CG2 4.22Å; G873-I876 PolarHBondContact O-N 2.97Å; L874-I876 VanDerWaalsContact C-N 3.34Å; L874-I876 PolarHBondContact O-N 2.9Å; I876-V878 VanDerWaalsContact C-N 3.31Å; I876-V878 PolarHBondContact O-N 2.75Å; I876-E879 PolarHBondContact O-N 3.43Å; I876-L880 HydrophobicContact CG2-CD1 4.39Å; I876-L880 WeakPolarHBondContact O-CG 3.42Å; I876-L880 PolarHBondContact O-N 3.38Å
877	L	97.9	Very high	95.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-35.7	174.9	-67.6	172.5	0	0	0	112.5	L834 V868 G873 L874 P875 L881 V892 L896 M899	L834-L877 HydrophobicContact CD1-CD2 4.22Å; V868-L877 HydrophobicContact CG1-CD1 4.35Å; G873-L877 WeakPolarHBondContact O-CG 3.3Å; G873-L877 PolarHBondContact O-N 3.13Å; L874-L877 PolarHBondContact O-N 3.29Å; P875-L877 PolarHBondContact O-N 2.9Å; L877-L881 PolarHBondContact O-N 3.27Å; L877-V892 HydrophobicContact CB-CG1 4.25Å; L877-V892 HydrophobicContact CD2-CG1 4.31Å; L877-V892 HydrophobicContact CD2-CG2 4.28Å; L877-V892 WeakPolarHBondContact O-CG1 3.43Å; L877-L896 HydrophobicContact CB-CD1 4.32Å; L877-L896 HydrophobicContact CB-CD2 3.85Å; L877-L896 HydrophobicContact CB-CG 4.05Å; L877-L896 HydrophobicContact CD1-CD2 4.14Å; L877-L896 HydrophobicContact CD1-CG 4.48Å; L877-M899 HydrophobicContact CD1-CG 4.43Å
878	V	97	Very high	95.4	Very high	13 Å²	13	58.3 Å²	58.3	8%	0.079	27%	0.274	C	S	.	.	H	α-helix	trans	-72.2	-31.1	177.4	174.2	0	0	0	0	112.3	L874 P875 I876 L881 L896 A913 D916	L874-V878 WeakPolarHBondContact O-CG2 3.39Å; L874-V878 PolarHBondContact O-N 3.43Å; P875-V878 PolarHBondContact O-N 3.04Å; I876-V878 VanDerWaalsContact C-N 3.31Å; I876-V878 PolarHBondContact O-N 2.75Å; V878-L881 WeakPolarHBondContact O-CB 3.49Å; V878-L896 HydrophobicContact CG2-CD1 4.47Å; V878-A913 HydrophobicContact CB-CB 4.48Å; V878-A913 HydrophobicContact CG1-CB 4.24Å; V878-A913 HydrophobicContact CG2-CB 3.39Å; V878-D916 HydrophobicContact CG1-CB 4.3Å
879	E	96.1	Very high	95.4	Very high	127 Å²	127	58.3 Å²	58.3	59%	0.593	27%	0.274	S	S	*	.	H	α-helix	trans	-70.1	-43.5	174.5	-175	151.5	-151.7	0	0	111.6	P875 I876 L881 R882	P875-E879 PolarHBondContact O-N 2.8Å; I876-E879 PolarHBondContact O-N 3.43Å; E879-L881 PolarHBondContact O-N 3.3Å; E879-R882 VanDerWaalsContact O-CB 3.27Å; E879-R882 WeakPolarHBondContact O-CB 3.31Å; E879-R882 PolarHBondContact O-N 3.45Å
880	L	96.6	Very high	95.5	Very high	15 Å²	15	57.7 Å²	57.7	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-21.5	176.3	-66.7	172	0	0	0	113.9	L834 L843 I876 R882 M883 V892	L834-L880 HydrophobicContact CB-CD1 3.93Å; L834-L880 HydrophobicContact CD2-CD1 3.4Å; L834-L880 VanDerWaalsContact CD2-CD1 3.4Å; L834-L880 HydrophobicContact CG-CD1 4.21Å; L843-L880 HydrophobicContact CD1-CD2 4.28Å; L843-L880 HydrophobicContact CD2-CD2 4.28Å; I876-L880 HydrophobicContact CG2-CD1 4.39Å; I876-L880 WeakPolarHBondContact O-CG 3.42Å; I876-L880 PolarHBondContact O-N 3.38Å; L880-R882 PolarHBondContact O-N 3.24Å; L880-R882 VanDerWaalsContact O-N 3.09Å; L880-M883 HydrophobicContact CD2-CG 4.23Å; L880-M883 HydrophobicContact CD2-SD 3.5Å; L880-M883 WeakPolarHBondContact CD2-SD 3.23Å; L880-M883 PolarHBondContact O-N 2.85Å; L880-V892 HydrophobicContact CB-CG1 4.27Å; L880-V892 HydrophobicContact CB-CG2 3.89Å; L880-V892 HydrophobicContact CD1-CG2 4.11Å
881	L	94.8	Very high	95.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-12	168	-71.5	177	0	0	0	113.3	L877 V878 E879 V889 V892 A893 L896 L917 R920	L877-L881 PolarHBondContact O-N 3.27Å; V878-L881 WeakPolarHBondContact O-CB 3.49Å; E879-L881 PolarHBondContact O-N 3.3Å; L881-V889 HydrophobicContact CD2-CG1 4.27Å; L881-V892 HydrophobicContact CD2-CB 4.46Å; L881-V892 HydrophobicContact CD2-CG1 3.76Å; L881-V892 HydrophobicContact CG-CG1 3.89Å; L881-A893 HydrophobicContact CD2-CB 4.22Å; L881-L896 HydrophobicContact CD1-CD1 3.62Å; L881-L896 HydrophobicContact CD2-CD1 4.27Å; L881-L896 HydrophobicContact CG-CD1 3.97Å; L881-L917 HydrophobicContact CD1-CD2 3.56Å; L881-L917 HydrophobicContact CD1-CG 3.76Å; L881-L917 HydrophobicContact CD2-CD2 4.15Å; L881-R920 WeakPolarHBondContact O-CD 3.27Å; L881-R920 WeakPolarHBondContact O-CG 3.43Å; L881-R920 PolarHBondContact O-NE 3.2Å; L881-R920 PolarHBondContact O-NH1 3.16Å
882	R	92.4	Very high	95.9	Very high	131 Å²	131	49.5 Å²	49.5	49%	0.494	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-10.3	177.9	-58.5	-176	-178.2	137.9	8.4	114.2	E879 L880 D916 R920	E879-R882 VanDerWaalsContact O-CB 3.27Å; E879-R882 WeakPolarHBondContact O-CB 3.31Å; E879-R882 PolarHBondContact O-N 3.45Å; L880-R882 PolarHBondContact O-N 3.24Å; L880-R882 VanDerWaalsContact O-N 3.09Å; R882-D916 IonicContact CZ-OD1 2.72Å; R882-D916 IonicContact NE-OD1 3.82Å; R882-D916 PolarHBondContact NE-OD1 3.38Å; R882-D916 IonicContact NH2-OD1 2.89Å; R882-D916 PolarHBondContact NH2-OD1 3.33Å; R882-D916 IonicContact NH2-OD2 3.79Å; R882-R920 PolarHBondContact O-NH1 3.46Å
883	M	91.9	Very high	96	Very high	57 Å²	57	41.8 Å²	41.8	28%	0.281	21%	0.206	S	C	.	.	S	Bend	trans	-67.3	149.5	-179.7	-63.1	-170.4	83.5	0	0	113.2	L843 L880 N885 V888 V889 R920	L843-M883 HydrophobicContact CD1-CE 3.63Å; L843-M883 HydrophobicContact CD1-SD 3.7Å; L880-M883 HydrophobicContact CD2-CG 4.23Å; L880-M883 HydrophobicContact CD2-SD 3.5Å; L880-M883 WeakPolarHBondContact CD2-SD 3.23Å; L880-M883 PolarHBondContact O-N 2.85Å; M883-N885 PolarHBondContact O-N 2.96Å; M883-V888 HydrophobicContact SD-CB 4.5Å; M883-V888 HydrophobicContact SD-CG1 3.89Å; M883-V889 HydrophobicContact CB-CG2 4.48Å; M883-V889 VanDerWaalsContact O-CG2 3.32Å; M883-V889 WeakPolarHBondContact O-CG2 3.34Å; M883-R920 VanDerWaalsContact O-CZ 3.25Å; M883-R920 PolarHBondContact O-NH1 3.32Å; M883-R920 PolarHBondContact O-NH2 3.38Å
884	D	90.3	Very high	96.1	Very high	142 Å²	142	43 Å²	43	76%	0.759	21%	0.214	S	C	*	.	S	Bend	trans	-79.4	-0.1	175.2	-60.8	-55.3	0	0	0	113.9	D886	D884-D886 PolarHBondContact O-N 3.47Å
885	N	93.9	Very high	96.1	Very high	52 Å²	52	42.4 Å²	42.4	28%	0.278	21%	0.21	S	C	.	.			trans	-84.4	106.5	175.3	-167.8	-69	0	0	0	112.2	P840 M883 R887 V888 V889	P840-N885 HydrophobicContact CB-CB 4.41Å; P840-N885 WeakPolarHBondContact CB-ND2 3.24Å; M883-N885 PolarHBondContact O-N 2.96Å; N885-R887 VanDerWaalsContact C-N 3.31Å; N885-R887 PolarHBondContact O-N 3.46Å; N885-R887 PolarHBondContact OD1-N 3.31Å; N885-R887 VanDerWaalsContact OD1-N 3.11Å; N885-V888 HydrophobicContact CB-CB 4.2Å; N885-V888 HydrophobicContact CB-CG2 3.99Å; N885-V888 PolarHBondContact O-N 3.28Å; N885-V888 PolarHBondContact OD1-N 2.93Å; N885-V888 VanDerWaalsContact OD1-N 3.13Å; N885-V889 WeakPolarHBondContact O-CG2 3.34Å; N885-V889 PolarHBondContact O-N 2.78Å
886	D	94.2	Very high	96.2	Very high	43 Å²	43	38.4 Å²	38.4	23%	0.23	18%	0.184	C	C	.	.	H	α-helix	trans	-53.2	-41	-179.4	-170.9	64.3	0	0	0	113.7	D884 V889 S890 L930 S931 T934	D884-D886 PolarHBondContact O-N 3.47Å; D886-V889 PolarHBondContact O-N 2.96Å; D886-S890 WeakPolarHBondContact O-CB 3.22Å; D886-S890 PolarHBondContact O-N 2.74Å; D886-L930 WeakPolarHBondContact OD1-CA 3.25Å; D886-S931 PolarHBondContact OD1-N 3.28Å; D886-S931 PolarHBondContact OD1-OG 3.2Å; D886-S931 WeakPolarHBondContact OD2-CB 3.33Å; D886-S931 PolarHBondContact OD2-OG 3.28Å; D886-T934 PolarHBondContact O-OG1 3.16Å; D886-T934 WeakPolarHBondContact OD1-CB 3.14Å; D886-T934 PolarHBondContact OD1-OG1 3.39Å; D886-T934 PolarHBondContact OD2-OG1 3.34Å
887	R	95.7	Very high	96.2	Very high	131 Å²	131	41.6 Å²	41.6	49%	0.494	19%	0.194	S	C	.	.	H	α-helix	trans	-70.1	-40.6	-178.5	-59.7	-171.4	-174.9	176.6	3.1	112.9	E844 N885 S891	E844-R887 HydrophobicContact CG-CB 4.03Å; E844-R887 WeakPolarHBondContact OE2-CB 3.37Å; E844-R887 WeakPolarHBondContact OE2-CD 3.2Å; E844-R887 IonicContact OE2-NH1 2.68Å; N885-R887 VanDerWaalsContact C-N 3.31Å; N885-R887 PolarHBondContact O-N 3.46Å; N885-R887 PolarHBondContact OD1-N 3.31Å; N885-R887 VanDerWaalsContact OD1-N 3.11Å; R887-S891 WeakPolarHBondContact O-CB 3.35Å; R887-S891 PolarHBondContact O-N 3.32Å; R887-S891 PolarHBondContact O-OG 3.45Å
888	V	97.2	Very high	96.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-49.7	174	178.3	0	0	0	0	109.1	P840 L843 E844 M883 N885 S890 S891 V892	P840-V888 HydrophobicContact CB-CG2 4.15Å; P840-V888 VanDerWaalsContact O-CG2 3.3Å; P840-V888 WeakPolarHBondContact O-CG2 3.38Å; L843-V888 HydrophobicContact CB-CG1 4.13Å; L843-V888 HydrophobicContact CB-CG2 3.96Å; E844-V888 HydrophobicContact CB-CG2 4.25Å; M883-V888 HydrophobicContact SD-CB 4.5Å; M883-V888 HydrophobicContact SD-CG1 3.89Å; N885-V888 HydrophobicContact CB-CB 4.2Å; N885-V888 HydrophobicContact CB-CG2 3.99Å; N885-V888 PolarHBondContact O-N 3.28Å; N885-V888 PolarHBondContact OD1-N 2.93Å; N885-V888 VanDerWaalsContact OD1-N 3.13Å; V888-S890 PolarHBondContact O-N 3.23Å; V888-S891 PolarHBondContact O-N 2.87Å; V888-V892 HydrophobicContact CG1-CG2 4.07Å; V888-V892 VanDerWaalsContact O-CB 3.31Å; V888-V892 WeakPolarHBondContact O-CB 3.31Å; V888-V892 WeakPolarHBondContact O-CG2 3.5Å; V888-V892 PolarHBondContact O-N 3.36Å
889	V	96.9	Very high	96.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-39.5	-179	175.1	0	0	0	0	112.2	L881 M883 N885 D886 V892 A893 T934 I938	L881-V889 HydrophobicContact CD2-CG1 4.27Å; M883-V889 HydrophobicContact CB-CG2 4.48Å; M883-V889 VanDerWaalsContact O-CG2 3.32Å; M883-V889 WeakPolarHBondContact O-CG2 3.34Å; N885-V889 WeakPolarHBondContact O-CG2 3.34Å; N885-V889 PolarHBondContact O-N 2.78Å; D886-V889 PolarHBondContact O-N 2.96Å; V889-V892 PolarHBondContact O-N 3.11Å; V889-A893 VanDerWaalsContact O-CB 3.23Å; V889-A893 WeakPolarHBondContact O-CB 3.31Å; V889-A893 PolarHBondContact O-N 3.42Å; V889-T934 HydrophobicContact CB-CG2 4.29Å; V889-T934 HydrophobicContact CG1-CG2 3.85Å; V889-I938 HydrophobicContact CG1-CD1 4.46Å
890	S	97.3	Very high	96.3	Very high	26 Å²	26	36 Å²	36	18%	0.182	17%	0.167	C	C	.	.	H	α-helix	trans	-62.9	-45.4	174.4	-167.4	0	0	0	0	112.7	D886 V888 T894 T934	D886-S890 WeakPolarHBondContact O-CB 3.22Å; D886-S890 PolarHBondContact O-N 2.74Å; V888-S890 PolarHBondContact O-N 3.23Å; S890-T894 WeakPolarHBondContact O-CB 3.28Å; S890-T894 PolarHBondContact O-N 3.46Å; S890-T894 PolarHBondContact O-OG1 2.77Å; S890-T934 WeakPolarHBondContact CB-OG1 3.49Å
891	S	98.1	Very high	96.2	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.049	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-42.7	177.6	-55.5	0	0	0	0	111.4	E844 R887 V888 T894 A895	E844-S891 WeakPolarHBondContact CG-OG 3.35Å; R887-S891 WeakPolarHBondContact O-CB 3.35Å; R887-S891 PolarHBondContact O-N 3.32Å; R887-S891 PolarHBondContact O-OG 3.45Å; V888-S891 PolarHBondContact O-N 2.87Å; S891-T894 PolarHBondContact O-N 3.02Å; S891-A895 WeakPolarHBondContact O-CB 3.2Å; S891-A895 PolarHBondContact O-N 3.3Å
892	V	98.2	Very high	96.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.2	-43.3	178.2	167.6	0	0	0	0	112	A847 L877 L880 L881 V888 V889 T894 A895 L896	A847-V892 HydrophobicContact CB-CG2 3.68Å; L877-V892 HydrophobicContact CB-CG1 4.25Å; L877-V892 HydrophobicContact CD2-CG1 4.31Å; L877-V892 HydrophobicContact CD2-CG2 4.28Å; L877-V892 WeakPolarHBondContact O-CG1 3.43Å; L880-V892 HydrophobicContact CB-CG1 4.27Å; L880-V892 HydrophobicContact CB-CG2 3.89Å; L880-V892 HydrophobicContact CD1-CG2 4.11Å; L881-V892 HydrophobicContact CD2-CB 4.46Å; L881-V892 HydrophobicContact CD2-CG1 3.76Å; L881-V892 HydrophobicContact CG-CG1 3.89Å; V888-V892 HydrophobicContact CG1-CG2 4.07Å; V888-V892 VanDerWaalsContact O-CB 3.31Å; V888-V892 WeakPolarHBondContact O-CB 3.31Å; V888-V892 WeakPolarHBondContact O-CG2 3.5Å; V888-V892 PolarHBondContact O-N 3.36Å; V889-V892 PolarHBondContact O-N 3.11Å; V892-T894 VanDerWaalsContact C-N 3.31Å; V892-T894 PolarHBondContact O-N 3.17Å; V892-A895 PolarHBondContact O-N 2.81Å; V892-L896 HydrophobicContact CG1-CD1 4.16Å; V892-L896 WeakPolarHBondContact O-CB 3.45Å; V892-L896 WeakPolarHBondContact O-CG 3.17Å; V892-L896 PolarHBondContact O-N 3.49Å
893	A	98.1	Very high	96.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.3	-40.9	174.5	0	0	0	0	0	111.3	L881 V889 L896 R897 A937 I938 A941	L881-A893 HydrophobicContact CD2-CB 4.22Å; V889-A893 VanDerWaalsContact O-CB 3.23Å; V889-A893 WeakPolarHBondContact O-CB 3.31Å; V889-A893 PolarHBondContact O-N 3.42Å; A893-L896 PolarHBondContact O-N 3.08Å; A893-R897 PolarHBondContact O-N 3.4Å; A893-A937 HydrophobicContact CB-CB 4.28Å; A893-I938 HydrophobicContact CB-CG1 4.02Å; A893-A941 WeakPolarHBondContact O-CB 3.41Å
894	T	98.2	Very high	96.4	Very high	27 Å²	27	39 Å²	39	17%	0.166	19%	0.191	C	C	.	.	H	α-helix	trans	-72.4	-34.5	177.3	-48	0	0	0	0	112.2	Q851 S890 S891 V892 R897 N898	Q851-T894 HydrophobicContact CG-CG2 3.9Å; S890-T894 WeakPolarHBondContact O-CB 3.28Å; S890-T894 PolarHBondContact O-N 3.46Å; S890-T894 PolarHBondContact O-OG1 2.77Å; S891-T894 PolarHBondContact O-N 3.02Å; V892-T894 VanDerWaalsContact C-N 3.31Å; V892-T894 PolarHBondContact O-N 3.17Å; T894-R897 WeakPolarHBondContact O-CB 3.39Å; T894-R897 PolarHBondContact O-N 3.47Å; T894-N898 PolarHBondContact O-N 2.9Å; T894-N898 VanDerWaalsContact O-N 3.09Å
895	A	98.4	Very high	96.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-47.8	169	0	0	0	0	0	111.1	Q851 S891 V892 R897 N898 M899	Q851-A895 HydrophobicContact CB-CB 4.11Å; S891-A895 WeakPolarHBondContact O-CB 3.2Å; S891-A895 PolarHBondContact O-N 3.3Å; V892-A895 PolarHBondContact O-N 2.81Å; A895-R897 PolarHBondContact O-N 3.09Å; A895-N898 CarbonylContact O-C 3.56Å; A895-N898 PolarHBondContact O-N 3.4Å; A895-N898 VanDerWaalsContact O-N 3.1Å; A895-M899 VanDerWaalsContact O-CG 3.32Å; A895-M899 WeakPolarHBondContact O-CG 3.5Å; A895-M899 PolarHBondContact O-N 2.83Å
896	L	98.4	Very high	96.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-38.5	177.7	-75	168.9	0	0	0	112.8	L874 L877 V878 L881 V892 A893 N898 M899 A900 I909	L874-L896 HydrophobicContact CD2-CD2 4.24Å; L877-L896 HydrophobicContact CB-CD1 4.32Å; L877-L896 HydrophobicContact CB-CD2 3.85Å; L877-L896 HydrophobicContact CB-CG 4.05Å; L877-L896 HydrophobicContact CD1-CD2 4.14Å; L877-L896 HydrophobicContact CD1-CG 4.48Å; V878-L896 HydrophobicContact CG2-CD1 4.47Å; L881-L896 HydrophobicContact CD1-CD1 3.62Å; L881-L896 HydrophobicContact CD2-CD1 4.27Å; L881-L896 HydrophobicContact CG-CD1 3.97Å; V892-L896 HydrophobicContact CG1-CD1 4.16Å; V892-L896 WeakPolarHBondContact O-CB 3.45Å; V892-L896 WeakPolarHBondContact O-CG 3.17Å; V892-L896 PolarHBondContact O-N 3.49Å; A893-L896 PolarHBondContact O-N 3.08Å; L896-N898 VanDerWaalsContact C-N 3.33Å; L896-N898 PolarHBondContact O-N 3.23Å; L896-M899 PolarHBondContact O-N 2.82Å; L896-A900 PolarHBondContact O-N 3.16Å; L896-I909 HydrophobicContact CD2-CD1 4.17Å; L896-I909 HydrophobicContact CD2-CG1 4.24Å
897	R	98	Very high	96.9	Very high	102 Å²	102	33.1 Å²	33.1	39%	0.385	16%	0.155	S	C	.	.	H	α-helix	trans	-54.3	-49.4	169.3	-178.7	-169.8	172.8	-163.8	-7.2	111	A893 T894 A895 A900 A941 E944	A893-R897 PolarHBondContact O-N 3.4Å; T894-R897 WeakPolarHBondContact O-CB 3.39Å; T894-R897 PolarHBondContact O-N 3.47Å; A895-R897 PolarHBondContact O-N 3.09Å; R897-A900 PolarHBondContact O-N 3.37Å; R897-A941 HydrophobicContact CB-CB 4.03Å; R897-E944 HydrophobicContact CG-CB 3.98Å
898	N	98	Very high	96.9	Very high	21 Å²	21	29.9 Å²	29.9	11%	0.112	15%	0.148	C	C	.	.	H	α-helix	trans	-68.1	-39.8	179.8	-69.9	-0.9	0	0	0	111.7	Q851 S854 R865 T894 A895 L896 A900 L901	Q851-N898 PolarHBondContact O-ND2 3.35Å; S854-N898 VanDerWaalsContact OG-CB 3.25Å; S854-N898 WeakPolarHBondContact OG-CB 3.36Å; R865-N898 WeakPolarHBondContact CD-O 3.3Å; T894-N898 PolarHBondContact O-N 2.9Å; T894-N898 VanDerWaalsContact O-N 3.09Å; A895-N898 CarbonylContact O-C 3.56Å; A895-N898 PolarHBondContact O-N 3.4Å; A895-N898 VanDerWaalsContact O-N 3.1Å; L896-N898 VanDerWaalsContact C-N 3.33Å; L896-N898 PolarHBondContact O-N 3.23Å; N898-A900 PolarHBondContact O-N 3.05Å; N898-L901 VanDerWaalsContact O-CB 3.31Å; N898-L901 WeakPolarHBondContact O-CB 3.28Å; N898-L901 WeakPolarHBondContact O-CG 3.47Å; N898-L901 PolarHBondContact O-N 2.99Å; N898-L901 VanDerWaalsContact O-N 3.11Å
899	M	97.5	Very high	96.8	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.5	-36.8	174.8	-65.3	-53.1	153.5	0	0	112.3	L850 S854 R865 V868 L874 L877 A895 L896 L901 D902 N905 I909	L850-M899 HydrophobicContact CB-CE 4.24Å; S854-M899 WeakPolarHBondContact OG-CE 3.38Å; R865-M899 HydrophobicContact CB-SD 4.32Å; R865-M899 HydrophobicContact CG-SD 3.89Å; V868-M899 HydrophobicContact CB-CE 4.24Å; V868-M899 HydrophobicContact CB-SD 3.9Å; V868-M899 HydrophobicContact CG1-CE 4.17Å; V868-M899 HydrophobicContact CG1-CG 4.4Å; V868-M899 HydrophobicContact CG1-SD 3.88Å; V868-M899 HydrophobicContact CG2-CE 3.75Å; V868-M899 HydrophobicContact CG2-SD 4.04Å; L874-M899 HydrophobicContact CD2-CB 4.16Å; L874-M899 HydrophobicContact CD2-CG 4.21Å; L877-M899 HydrophobicContact CD1-CG 4.43Å; A895-M899 VanDerWaalsContact O-CG 3.32Å; A895-M899 WeakPolarHBondContact O-CG 3.5Å; A895-M899 PolarHBondContact O-N 2.83Å; L896-M899 PolarHBondContact O-N 2.82Å; M899-L901 PolarHBondContact O-N 2.82Å; M899-D902 PolarHBondContact O-N 3.37Å; M899-N905 WeakPolarHBondContact O-CB 3.3Å; M899-N905 PolarHBondContact O-ND2 3.39Å; M899-I909 HydrophobicContact CB-CD1 3.83Å
900	A	97.3	Very high	96.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-6.6	178.4	0	0	0	0	0	114.7	L896 R897 N898 D902 K906 I909 E944 V945	L896-A900 PolarHBondContact O-N 3.16Å; R897-A900 PolarHBondContact O-N 3.37Å; N898-A900 PolarHBondContact O-N 3.05Å; A900-D902 PolarHBondContact O-N 2.97Å; A900-K906 HydrophobicContact CB-CB 4.45Å; A900-K906 WeakPolarHBondContact O-CE 3.29Å; A900-I909 HydrophobicContact CB-CD1 4.11Å; A900-E944 HydrophobicContact CB-CG 4.11Å; A900-V945 HydrophobicContact CB-CG2 3.82Å
901	L	95.6	Very high	96.6	Very high	64 Å²	64	36 Å²	36	34%	0.335	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.8	168.9	-62.2	173.7	0	0	0	112.4	N898 M899 E944	N898-L901 VanDerWaalsContact O-CB 3.31Å; N898-L901 WeakPolarHBondContact O-CB 3.28Å; N898-L901 WeakPolarHBondContact O-CG 3.47Å; N898-L901 PolarHBondContact O-N 2.99Å; N898-L901 VanDerWaalsContact O-N 3.11Å; M899-L901 PolarHBondContact O-N 2.82Å; L901-E944 HydrophobicContact CD2-CG 4.22Å
902	D	94.6	Very high	96.4	Very high	18 Å²	18	42.5 Å²	42.5	10%	0.096	20%	0.196	C	C	.	.	S	Bend	trans	-85.5	125.9	165.7	173.8	-47.1	0	0	0	109.4	R865 R869 M899 A900 R904 N905 K906	R865-D902 HydrophobicContact CB-CB 4.11Å; R869-D902 IonicContact CZ-OD1 3.35Å; R869-D902 IonicContact CZ-OD2 2.64Å; R869-D902 IonicContact NH1-OD1 3Å; R869-D902 PolarHBondContact NH1-OD1 2.79Å; R869-D902 IonicContact NH1-OD2 3.75Å; R869-D902 PolarHBondContact NH1-OD2 3.12Å; R869-D902 IonicContact NH2-OD1 2.76Å; R869-D902 IonicContact NH2-OD2 3.7Å; R869-D902 PolarHBondContact NH2-OD2 3.1Å; M899-D902 PolarHBondContact O-N 3.37Å; A900-D902 PolarHBondContact O-N 2.97Å; D902-R904 PolarHBondContact O-N 2.99Å; D902-R904 WeakPolarHBondContact OD1-CA 3.41Å; D902-R904 WeakPolarHBondContact OD1-CB 3.47Å; D902-R904 PolarHBondContact OD1-N 3.3Å; D902-N905 HydrophobicContact CB-CB 4.11Å; D902-N905 CarbonylContact O-C 3.59Å; D902-N905 WeakPolarHBondContact O-CA 3.1Å; D902-N905 WeakPolarHBondContact O-CB 3.43Å; D902-N905 PolarHBondContact O-N 3.26Å; D902-N905 VanDerWaalsContact O-N 3.08Å; D902-N905 PolarHBondContact OD1-N 2.89Å; D902-N905 VanDerWaalsContact OD1-N 3.1Å; D902-K906 PolarHBondContact O-N 3.08Å
903	V	94.1	Very high	96.2	Very high	96 Å²	96	42.5 Å²	42.5	58%	0.582	20%	0.196	S	C	*	.	H	α-helix	trans	-60.9	-41.2	-174.7	-177.1	0	0	0	0	112.6	N905 K906 E907	V903-N905 VanDerWaalsContact C-N 3.27Å; V903-N905 PolarHBondContact O-N 3.43Å; V903-K906 WeakPolarHBondContact O-CB 3.13Å; V903-K906 PolarHBondContact O-N 3.01Å; V903-K906 VanDerWaalsContact O-N 3.13Å; V903-E907 PolarHBondContact O-N 3.07Å; V903-E907 VanDerWaalsContact O-N 3.13Å
904	R	94.4	Very high	96.2	Very high	89 Å²	89	42.7 Å²	42.7	34%	0.336	20%	0.197	S	C	.	.	H	α-helix	trans	-67.8	-30.2	177.6	-64.7	-177.5	-68.5	167.5	-2.5	111.1	D803 D902 L908	D803-R904 PolarHBondContact O-NH2 3.46Å; D803-R904 IonicContact OD2-NH1 3.38Å; D902-R904 PolarHBondContact O-N 2.99Å; D902-R904 WeakPolarHBondContact OD1-CA 3.41Å; D902-R904 WeakPolarHBondContact OD1-CB 3.47Å; D902-R904 PolarHBondContact OD1-N 3.3Å; R904-L908 WeakPolarHBondContact O-CD1 3.33Å; R904-L908 VanDerWaalsContact O-CG 3.3Å; R904-L908 WeakPolarHBondContact O-CG 3.42Å; R904-L908 PolarHBondContact O-N 3.47Å
905	N	96.4	Very high	96	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-72.4	-40.6	169.8	-77.7	-11.1	0	0	0	111.9	R865 R869 M899 D902 V903 E907 L908 I909	R865-N905 PolarHBondContact O-ND2 3.15Å; R869-N905 WeakPolarHBondContact CB-OD1 3.41Å; R869-N905 WeakPolarHBondContact CD-OD1 3.41Å; R869-N905 PolarHBondContact NH1-OD1 2.96Å; M899-N905 WeakPolarHBondContact O-CB 3.3Å; M899-N905 PolarHBondContact O-ND2 3.39Å; D902-N905 HydrophobicContact CB-CB 4.11Å; D902-N905 CarbonylContact O-C 3.59Å; D902-N905 WeakPolarHBondContact O-CA 3.1Å; D902-N905 WeakPolarHBondContact O-CB 3.43Å; D902-N905 PolarHBondContact O-N 3.26Å; D902-N905 VanDerWaalsContact O-N 3.08Å; D902-N905 PolarHBondContact OD1-N 2.89Å; D902-N905 VanDerWaalsContact OD1-N 3.1Å; V903-N905 VanDerWaalsContact C-N 3.27Å; V903-N905 PolarHBondContact O-N 3.43Å; N905-E907 VanDerWaalsContact C-N 3.29Å; N905-E907 PolarHBondContact O-N 3.27Å; N905-L908 PolarHBondContact O-N 3.4Å; N905-I909 HydrophobicContact CB-CD1 4.2Å; N905-I909 WeakPolarHBondContact O-CB 3.13Å; N905-I909 WeakPolarHBondContact O-CG1 3.2Å; N905-I909 PolarHBondContact O-N 3.24Å
906	K	96.3	Very high	95.8	Very high	17 Å²	17	48.6 Å²	48.6	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-55.6	-45	178.5	-171.3	171	-60.5	-149.2	0	111.7	A900 D902 V903 G910 E944 V945 S947 N949 N952	A900-K906 HydrophobicContact CB-CB 4.45Å; A900-K906 WeakPolarHBondContact O-CE 3.29Å; D902-K906 PolarHBondContact O-N 3.08Å; V903-K906 WeakPolarHBondContact O-CB 3.13Å; V903-K906 PolarHBondContact O-N 3.01Å; V903-K906 VanDerWaalsContact O-N 3.13Å; K906-G910 PolarHBondContact O-N 3.4Å; K906-E944 VanDerWaalsContact CE-O 3.26Å; K906-E944 WeakPolarHBondContact CE-O 3.3Å; K906-E944 PolarHBondContact NZ-O 3.18Å; K906-E944 IonicContact NZ-OE1 3.91Å; K906-E944 PolarHBondContact NZ-OE1 3.06Å; K906-V945 WeakPolarHBondContact CG-O 3.45Å; K906-S947 WeakPolarHBondContact CD-O 3.35Å; K906-S947 PolarHBondContact NZ-O 3.48Å; K906-N949 HydrophobicContact CD-CB 4.02Å; K906-N949 HydrophobicContact CG-CB 4.38Å; K906-N952 PolarHBondContact O-ND2 3.24Å
907	E	95.5	Very high	95.7	Very high	97 Å²	97	48.7 Å²	48.7	45%	0.453	22%	0.217	S	C	.	.	H	α-helix	trans	-61	-49	175	-68.9	160.9	-166.3	0	0	112.1	V903 N905 G910 K911	V903-E907 PolarHBondContact O-N 3.07Å; V903-E907 VanDerWaalsContact O-N 3.13Å; N905-E907 VanDerWaalsContact C-N 3.29Å; N905-E907 PolarHBondContact O-N 3.27Å; E907-G910 PolarHBondContact O-N 2.91Å; E907-K911 WeakPolarHBondContact O-CB 3.48Å; E907-K911 PolarHBondContact O-N 3.21Å
908	L	95.7	Very high	95.5	Very high	63 Å²	63	43.9 Å²	43.9	33%	0.33	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-43.7	179.3	-68.1	171.2	0	0	0	112.5	R869 L874 R904 N905 K911 Y912	R869-L908 HydrophobicContact CG-CD1 4.12Å; L874-L908 HydrophobicContact CD1-CB 3.94Å; L874-L908 HydrophobicContact CD1-CD1 4.09Å; R904-L908 WeakPolarHBondContact O-CD1 3.33Å; R904-L908 VanDerWaalsContact O-CG 3.3Å; R904-L908 WeakPolarHBondContact O-CG 3.42Å; R904-L908 PolarHBondContact O-N 3.47Å; N905-L908 PolarHBondContact O-N 3.4Å; L908-K911 PolarHBondContact O-N 2.99Å; L908-Y912 HydrophobicContact CD2-CD2 4.33Å; L908-Y912 HydrophobicContact CD2-CE2 3.93Å; L908-Y912 WeakPolarHBondContact O-CB 3.41Å; L908-Y912 VanDerWaalsContact O-CD2 3.24Å; L908-Y912 WeakPolarHBondContact O-CD2 3.44Å; L908-Y912 PolarHBondContact O-N 2.99Å
909	I	96.8	Very high	95.3	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.015	22%	0.218	C	C	.	.	H	α-helix	trans	-65.4	-42.4	178.6	-65	165.4	0	0	0	109.8	L874 L896 M899 A900 N905 K911 Y912 A913 M914 V945	L874-I909 HydrophobicContact CD1-CG1 4.23Å; L874-I909 HydrophobicContact CD2-CD1 4.03Å; L874-I909 HydrophobicContact CD2-CG1 4.01Å; L896-I909 HydrophobicContact CD2-CD1 4.17Å; L896-I909 HydrophobicContact CD2-CG1 4.24Å; M899-I909 HydrophobicContact CB-CD1 3.83Å; A900-I909 HydrophobicContact CB-CD1 4.11Å; N905-I909 HydrophobicContact CB-CD1 4.2Å; N905-I909 WeakPolarHBondContact O-CB 3.13Å; N905-I909 WeakPolarHBondContact O-CG1 3.2Å; N905-I909 PolarHBondContact O-N 3.24Å; I909-K911 VanDerWaalsContact C-N 3.31Å; I909-K911 PolarHBondContact O-N 3.29Å; I909-Y912 PolarHBondContact O-N 3.15Å; I909-A913 HydrophobicContact CG2-CB 3.73Å; I909-A913 WeakPolarHBondContact O-CA 3.41Å; I909-A913 WeakPolarHBondContact O-CB 3.48Å; I909-A913 PolarHBondContact O-N 3.34Å; I909-M914 PolarHBondContact O-N 3.42Å; I909-V945 HydrophobicContact CB-CG2 4.33Å; I909-V945 HydrophobicContact CG2-CG1 4.25Å; I909-V945 HydrophobicContact CG2-CG2 3.54Å
910	G	95.8	Very high	94.9	Very high	2 Å²	2	49.1 Å²	49.1	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-62.5	-36.1	174.5	0	0	0	0	0	113.8	K906 E907 M914 N952	K906-G910 PolarHBondContact O-N 3.4Å; E907-G910 PolarHBondContact O-N 2.91Å; G910-M914 WeakPolarHBondContact O-CB 3.3Å; G910-N952 WeakPolarHBondContact CA-OD1 3.48Å
911	K	93.4	Very high	94.6	Very high	150 Å²	150	49.2 Å²	49.2	65%	0.652	23%	0.225	S	C	*	.	H	α-helix	trans	-75.3	-35.3	178.3	-172.8	175.4	178.8	-168.8	0	114.2	E907 L908 I909	E907-K911 WeakPolarHBondContact O-CB 3.48Å; E907-K911 PolarHBondContact O-N 3.21Å; L908-K911 PolarHBondContact O-N 2.99Å; I909-K911 VanDerWaalsContact C-N 3.31Å; I909-K911 PolarHBondContact O-N 3.29Å
912	Y	93.3	Very high	94	Very high	144 Å²	144	48.1 Å²	48.1	57%	0.565	22%	0.222	S	C	*	.	H	α-helix	trans	-115.8	-21.4	-169.2	-62.6	-68.2	0	0	0	115.2	L908 I909	L908-Y912 HydrophobicContact CD2-CD2 4.33Å; L908-Y912 HydrophobicContact CD2-CE2 3.93Å; L908-Y912 WeakPolarHBondContact O-CB 3.41Å; L908-Y912 VanDerWaalsContact O-CD2 3.24Å; L908-Y912 WeakPolarHBondContact O-CD2 3.44Å; L908-Y912 PolarHBondContact O-N 2.99Å; I909-Y912 PolarHBondContact O-N 3.15Å
913	A	95.5	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-20.2	-177.3	0	0	0	0	0	114.6	V878 I909 R915 D916 L917	V878-A913 HydrophobicContact CB-CB 4.48Å; V878-A913 HydrophobicContact CG1-CB 4.24Å; V878-A913 HydrophobicContact CG2-CB 3.39Å; I909-A913 HydrophobicContact CG2-CB 3.73Å; I909-A913 WeakPolarHBondContact O-CA 3.41Å; I909-A913 WeakPolarHBondContact O-CB 3.48Å; I909-A913 PolarHBondContact O-N 3.34Å; A913-R915 PolarHBondContact O-N 2.9Å; A913-D916 PolarHBondContact O-N 3.13Å; A913-L917 HydrophobicContact CB-CD1 4.19Å; A913-L917 PolarHBondContact O-N 3.11Å
914	M	96.5	Very high	91.1	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-56.5	-48.5	-166.2	-176.6	61.9	70.1	0	0	113.5	I909 G910 D916 L917 V918 L942 V945 T946 N952 A955 L956	I909-M914 PolarHBondContact O-N 3.42Å; G910-M914 WeakPolarHBondContact O-CB 3.3Å; M914-D916 VanDerWaalsContact C-N 3.29Å; M914-D916 PolarHBondContact O-N 2.97Å; M914-L917 PolarHBondContact O-N 2.81Å; M914-V918 WeakPolarHBondContact O-CB 3.48Å; M914-V918 WeakPolarHBondContact O-CG2 3.33Å; M914-V918 PolarHBondContact O-N 2.87Å; M914-V918 HydrophobicContact SD-CG2 4.34Å; M914-L942 HydrophobicContact SD-CD2 3.53Å; M914-L942 VanDerWaalsContact SD-CD2 3.53Å; M914-V945 HydrophobicContact CE-CG1 3.64Å; M914-T946 HydrophobicContact CE-CG2 3.95Å; M914-N952 HydrophobicContact CE-CB 4.28Å; M914-N952 WeakPolarHBondContact CE-O 3.38Å; M914-A955 HydrophobicContact CG-CB 4.21Å; M914-L956 HydrophobicContact CE-CB 4.05Å; M914-L956 HydrophobicContact CG-CB 4.26Å; M914-L956 HydrophobicContact SD-CB 3.55Å; M914-L956 VanDerWaalsContact SD-CB 3.55Å; M914-L956 HydrophobicContact SD-CD1 4.03Å; M914-L956 HydrophobicContact SD-CG 3.84Å
915	R	94.5	Very high	88.9	Confident	141 Å²	141	51 Å²	51	53%	0.532	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-41.5	177.2	-176.6	-164.8	64.5	157.5	2.5	111.7	A913 V918 N919	A913-R915 PolarHBondContact O-N 2.9Å; R915-V918 PolarHBondContact O-N 3.43Å; R915-N919 WeakPolarHBondContact O-CB 3.29Å; R915-N919 PolarHBondContact O-N 3.3Å; R915-N919 PolarHBondContact O-OD1 3.32Å
916	D	95.1	Very high	86.9	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.053	29%	0.294	C	S	.	.	H	α-helix	trans	-74.4	-37.9	-175.9	-70.5	-104.6	0	0	0	111.5	V878 R882 A913 M914 N919 R920	V878-D916 HydrophobicContact CG1-CB 4.3Å; R882-D916 IonicContact CZ-OD1 2.72Å; R882-D916 IonicContact NE-OD1 3.82Å; R882-D916 PolarHBondContact NE-OD1 3.38Å; R882-D916 IonicContact NH2-OD1 2.89Å; R882-D916 PolarHBondContact NH2-OD1 3.33Å; R882-D916 IonicContact NH2-OD2 3.79Å; A913-D916 PolarHBondContact O-N 3.13Å; M914-D916 VanDerWaalsContact C-N 3.29Å; M914-D916 PolarHBondContact O-N 2.97Å; D916-N919 PolarHBondContact O-N 3.19Å; D916-R920 PolarHBondContact O-N 3.21Å
917	L	95.4	Very high	84.9	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-44.7	167.5	-73.1	166.5	0	0	0	112.3	L881 A913 M914 N919 R920 I938 A941 L942	L881-L917 HydrophobicContact CD1-CD2 3.56Å; L881-L917 HydrophobicContact CD1-CG 3.76Å; L881-L917 HydrophobicContact CD2-CD2 4.15Å; A913-L917 HydrophobicContact CB-CD1 4.19Å; A913-L917 PolarHBondContact O-N 3.11Å; M914-L917 PolarHBondContact O-N 2.81Å; L917-N919 VanDerWaalsContact C-N 3.34Å; L917-R920 PolarHBondContact O-N 3.28Å; L917-I938 HydrophobicContact CD2-CG2 4.41Å; L917-I938 WeakPolarHBondContact O-CG2 3.34Å; L917-A941 HydrophobicContact CD2-CB 4.34Å; L917-L942 HydrophobicContact CB-CD2 3.7Å; L917-L942 HydrophobicContact CB-CG 4.21Å; L917-L942 HydrophobicContact CD1-CD2 4.13Å
918	V	94.9	Very high	83.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-33.5	176.7	168.8	0	0	0	0	111.7	M914 R915 R920 L921 L942 L956 S959 K964	M914-V918 WeakPolarHBondContact O-CB 3.48Å; M914-V918 WeakPolarHBondContact O-CG2 3.33Å; M914-V918 PolarHBondContact O-N 2.87Å; M914-V918 HydrophobicContact SD-CG2 4.34Å; R915-V918 PolarHBondContact O-N 3.43Å; V918-R920 VanDerWaalsContact C-N 3.31Å; V918-R920 PolarHBondContact O-N 3.17Å; V918-L921 PolarHBondContact O-N 2.99Å; V918-L942 HydrophobicContact CG2-CD2 4.14Å; V918-L956 HydrophobicContact CG2-CG 4.29Å; V918-S959 WeakPolarHBondContact CG1-O 3.27Å; V918-K964 HydrophobicContact CG1-CD 4.35Å; V918-K964 WeakPolarHBondContact O-CD 3.08Å; V918-K964 PolarHBondContact O-NZ 3.39Å
919	N	92.3	Very high	82.2	Confident	94 Å²	94	58.9 Å²	58.9	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-36.4	175.8	-79.8	-9.9	0	0	0	112.1	R915 D916 L917 L921 K964	R915-N919 WeakPolarHBondContact O-CB 3.29Å; R915-N919 PolarHBondContact O-N 3.3Å; R915-N919 PolarHBondContact O-OD1 3.32Å; D916-N919 PolarHBondContact O-N 3.19Å; L917-N919 VanDerWaalsContact C-N 3.34Å; N919-L921 VanDerWaalsContact C-N 3.32Å; N919-L921 PolarHBondContact O-N 3.29Å; N919-K964 PolarHBondContact O-NZ 2.87Å; N919-K964 VanDerWaalsContact O-NZ 3.11Å
920	R	90.4	Very high	81.6	Confident	37 Å²	37	59.6 Å²	59.6	14%	0.14	35%	0.346	C	S	.	.	H	α-helix	trans	-73	-14.4	176.3	-63.5	-56.7	-72.9	-130.5	11.2	115.1	L881 R882 M883 D916 L917 V918 L930 I938	L881-R920 WeakPolarHBondContact O-CD 3.27Å; L881-R920 WeakPolarHBondContact O-CG 3.43Å; L881-R920 PolarHBondContact O-NE 3.2Å; L881-R920 PolarHBondContact O-NH1 3.16Å; R882-R920 PolarHBondContact O-NH1 3.46Å; M883-R920 VanDerWaalsContact O-CZ 3.25Å; M883-R920 PolarHBondContact O-NH1 3.32Å; M883-R920 PolarHBondContact O-NH2 3.38Å; D916-R920 PolarHBondContact O-N 3.21Å; L917-R920 PolarHBondContact O-N 3.28Å; V918-R920 VanDerWaalsContact C-N 3.31Å; V918-R920 PolarHBondContact O-N 3.17Å; R920-L930 HydrophobicContact CB-CD1 4.04Å; R920-L930 WeakPolarHBondContact O-CD1 3.42Å; R920-I938 HydrophobicContact CB-CD1 3.66Å
921	L	89.7	Confident	81.3	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.016	36%	0.359	C	S	.	.	S	Bend	trans	-69.7	143.7	167.2	-65.5	-179.4	0	0	0	110.4	V918 N919 I938 L942 K964 L965 I968	V918-L921 PolarHBondContact O-N 2.99Å; N919-L921 VanDerWaalsContact C-N 3.32Å; N919-L921 PolarHBondContact O-N 3.29Å; L921-I938 HydrophobicContact CD2-CB 4.36Å; L921-I938 HydrophobicContact CD2-CG2 3.73Å; L921-I938 HydrophobicContact CG-CG2 4.14Å; L921-L942 HydrophobicContact CD1-CD1 3.7Å; L921-L942 HydrophobicContact CG-CD1 4.21Å; L921-K964 HydrophobicContact CB-CB 4.16Å; L921-K964 HydrophobicContact CB-CD 3.76Å; L921-K964 HydrophobicContact CD1-CB 4.35Å; L921-K964 WeakPolarHBondContact O-CD 3.5Å; L921-K964 WeakPolarHBondContact O-CE 3.45Å; L921-K964 PolarHBondContact O-NZ 2.86Å; L921-L965 HydrophobicContact CD1-CD2 3.75Å; L921-L965 HydrophobicContact CD1-CG 3.94Å; L921-I968 HydrophobicContact CD2-CD1 4.18Å
922	P	84.2	Confident	81.2	Confident	41 Å²	41	57.2 Å²	57.2	27%	0.266	34%	0.343	S	S	.	.			trans	-57.8	142.5	177.4	23.9	-35.2	0	0	0	112.2	M935 K964 I968	P922-M935 HydrophobicContact CG-SD 3.9Å; P922-K964 WeakPolarHBondContact O-CD 3.4Å; P922-K964 WeakPolarHBondContact O-CG 3.47Å; P922-I968 HydrophobicContact CG-CD1 3.99Å; P922-I968 HydrophobicContact CG-CG1 3.98Å
923	G	65.5	Low	81.2	Confident	56 Å²	56	56.3 Å²	56.3	58%	0.577	34%	0.344	S	S	*	.			trans	-146.4	125.8	177.1	0	0	0	0	0	110.9
924	G	61	Low	81.1	Confident	65 Å²	65	56.4 Å²	56.4	67%	0.67	35%	0.345	S	S	*	.	S	Bend	trans	82.8	-177.5	-174.2	0	0	0	0	0	114.1	G926	G924-G926 VanDerWaalsContact C-N 3.34Å; G924-G926 PolarHBondContact O-N 2.87Å
925	N	49.3	Very low	81	Confident	142 Å²	142	56.4 Å²	56.4	76%	0.759	35%	0.345	S	S	*	.	S	Bend	trans	-82.3	-0.9	-169.9	-88.1	-15.6	0	0	0	115.6	R975	N925-R975 PolarHBondContact O-NH1 3.39Å
926	G	54.1	Low	81	Confident	50 Å²	50	50.6 Å²	50.6	52%	0.515	33%	0.327	S	S	.	.	S	Bend	trans	-65.1	165.3	179.1	0	0	0	0	0	113.8	G924	G924-G926 VanDerWaalsContact C-N 3.34Å; G924-G926 PolarHBondContact O-N 2.87Å
927	P	54.7	Low	81.1	Confident	124 Å²	124	50.7 Å²	50.7	81%	0.805	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-65.8	143.6	171.7	28.9	-34.1	0	0	0	110.8	V929	P927-V929 PolarHBondContact O-N 3.13Å
928	S	62.9	Low	81.2	Confident	53 Å²	53	50.6 Å²	50.6	37%	0.371	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-71.2	123.6	169.6	-178	0	0	0	0	109.5	L930	S928-L930 PolarHBondContact OG-N 3.28Å; S928-L930 PolarHBondContact OG-O 2.68Å
929	V	70	Confident	81.3	Confident	115 Å²	115	50.6 Å²	50.6	70%	0.697	33%	0.328	S	S	*	.	S	Bend	trans	-73.6	-20.9	171.1	-177.6	0	0	0	0	111.2	P927	P927-V929 PolarHBondContact O-N 3.13Å
930	L	84.1	Confident	81.5	Confident	18 Å²	18	47.6 Å²	47.6	9%	0.094	31%	0.314	C	S	.	.	S	Bend	trans	-100.6	147.4	-174.9	-43.8	-173	0	0	0	111.8	D886 R920 S928 T934 M935 I938	D886-L930 WeakPolarHBondContact OD1-CA 3.25Å; R920-L930 HydrophobicContact CB-CD1 4.04Å; R920-L930 WeakPolarHBondContact O-CD1 3.42Å; S928-L930 PolarHBondContact OG-N 3.28Å; S928-L930 PolarHBondContact OG-O 2.68Å; L930-T934 HydrophobicContact CB-CG2 4.25Å; L930-T934 HydrophobicContact CD1-CG2 4.14Å; L930-M935 HydrophobicContact CB-CG 4.18Å; L930-I938 HydrophobicContact CD1-CD1 3.77Å
931	S	90.7	Very high	81.9	Confident	42 Å²	42	45.8 Å²	45.8	29%	0.294	31%	0.308	S	S	.	.			trans	-69.8	159.1	174.9	69.5	0	0	0	0	112.4	D886 E933 T934 M935	D886-S931 PolarHBondContact OD1-N 3.28Å; D886-S931 PolarHBondContact OD1-OG 3.2Å; D886-S931 WeakPolarHBondContact OD2-CB 3.33Å; D886-S931 PolarHBondContact OD2-OG 3.28Å; S931-E933 PolarHBondContact O-N 2.9Å; S931-T934 PolarHBondContact O-N 2.96Å; S931-T934 PolarHBondContact OG-N 3.45Å; S931-T934 PolarHBondContact OG-OG1 2.9Å; S931-T934 VanDerWaalsContact OG-OG1 3.11Å; S931-M935 WeakPolarHBondContact O-CG 3.26Å; S931-M935 PolarHBondContact O-N 2.92Å
932	D	91.2	Very high	82.3	Confident	60 Å²	60	45.7 Å²	45.7	32%	0.321	31%	0.307	S	S	.	.	H	α-helix	trans	-55.3	-30.7	170.5	-90.8	-63.4	0	0	0	112.8	A936 S977 V980	D932-A936 VanDerWaalsContact O-CB 3.28Å; D932-A936 WeakPolarHBondContact O-CB 3.45Å; D932-A936 PolarHBondContact O-N 2.88Å; D932-S977 WeakPolarHBondContact OD1-CB 3.5Å; D932-S977 PolarHBondContact OD1-N 3.26Å; D932-S977 PolarHBondContact OD1-OG 2.8Å; D932-S977 WeakPolarHBondContact OD2-CB 3.34Å; D932-V980 HydrophobicContact CB-CG2 4.02Å; D932-V980 WeakPolarHBondContact O-CG2 3.44Å; D932-V980 WeakPolarHBondContact OD1-CG2 3.26Å
933	E	92.1	Very high	83	Confident	126 Å²	126	45.4 Å²	45.4	59%	0.589	30%	0.302	S	S	*	.	H	α-helix	trans	-74.1	-43.4	-179.1	-51.8	-155.2	134.8	0	0	110.8	S931 A936 A937 K979	S931-E933 PolarHBondContact O-N 2.9Å; E933-A936 PolarHBondContact O-N 3.22Å; E933-A937 WeakPolarHBondContact O-CB 3.29Å; E933-A937 PolarHBondContact O-N 3.24Å; E933-K979 IonicContact OE1-NZ 3.28Å
934	T	94.9	Very high	84.5	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-64.8	-43.4	173	-56.3	0	0	0	0	112.1	D886 V889 S890 L930 S931 A936 A937 I938	D886-T934 PolarHBondContact O-OG1 3.16Å; D886-T934 WeakPolarHBondContact OD1-CB 3.14Å; D886-T934 PolarHBondContact OD1-OG1 3.39Å; D886-T934 PolarHBondContact OD2-OG1 3.34Å; V889-T934 HydrophobicContact CB-CG2 4.29Å; V889-T934 HydrophobicContact CG1-CG2 3.85Å; S890-T934 WeakPolarHBondContact CB-OG1 3.49Å; L930-T934 HydrophobicContact CB-CG2 4.25Å; L930-T934 HydrophobicContact CD1-CG2 4.14Å; S931-T934 PolarHBondContact O-N 2.96Å; S931-T934 PolarHBondContact OG-N 3.45Å; S931-T934 PolarHBondContact OG-OG1 2.9Å; S931-T934 VanDerWaalsContact OG-OG1 3.11Å; T934-A936 VanDerWaalsContact C-N 3.31Å; T934-A936 PolarHBondContact O-N 3.23Å; T934-A937 PolarHBondContact O-N 3.4Å; T934-I938 HydrophobicContact CG2-CD1 3.93Å; T934-I938 WeakPolarHBondContact O-CD1 3.48Å; T934-I938 VanDerWaalsContact O-CG1 3.31Å; T934-I938 WeakPolarHBondContact O-CG1 3.43Å; T934-I938 PolarHBondContact O-N 3.43Å
935	M	93.7	Very high	86.2	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-61.4	-39.6	175.3	-73	-167.9	-73	0	0	111.9	P922 L930 S931 C939 V980	P922-M935 HydrophobicContact CG-SD 3.9Å; L930-M935 HydrophobicContact CB-CG 4.18Å; S931-M935 WeakPolarHBondContact O-CG 3.26Å; S931-M935 PolarHBondContact O-N 2.92Å; M935-C939 PolarHBondContact O-N 2.83Å; M935-C939 PolarHBondContact O-SG 3.27Å; M935-V980 HydrophobicContact CB-CG1 3.93Å; M935-V980 HydrophobicContact CB-CG2 3.74Å; M935-V980 HydrophobicContact CE-CG2 4.49Å
936	A	94.9	Very high	88.5	Confident	18 Å²	18	34.7 Å²	34.7	15%	0.149	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-40.6	173.8	0	0	0	0	0	112	D932 E933 T934 C939 C940 V980	D932-A936 VanDerWaalsContact O-CB 3.28Å; D932-A936 WeakPolarHBondContact O-CB 3.45Å; D932-A936 PolarHBondContact O-N 2.88Å; E933-A936 PolarHBondContact O-N 3.22Å; T934-A936 VanDerWaalsContact C-N 3.31Å; T934-A936 PolarHBondContact O-N 3.23Å; A936-C939 PolarHBondContact O-N 2.9Å; A936-C940 WeakPolarHBondContact O-CB 3.39Å; A936-C940 PolarHBondContact O-N 3.49Å; A936-C940 PolarHBondContact O-SG 3.12Å; A936-V980 HydrophobicContact CB-CG2 4.16Å
937	A	96.9	Very high	90.5	Very high	12 Å²	12	33.2 Å²	33.2	10%	0.099	20%	0.197	C	C	.	.	H	α-helix	trans	-61	-44.8	175.6	0	0	0	0	0	112.1	A893 E933 T934 C940 A941	A893-A937 HydrophobicContact CB-CB 4.28Å; E933-A937 WeakPolarHBondContact O-CB 3.29Å; E933-A937 PolarHBondContact O-N 3.24Å; T934-A937 PolarHBondContact O-N 3.4Å; A937-C940 PolarHBondContact O-N 3.47Å; A937-A941 PolarHBondContact O-N 2.93Å
938	I	97.2	Very high	92.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-45.1	175.1	-65.7	159.3	0	0	0	110.8	V889 A893 L917 R920 L921 L930 T934 C940 A941 L942	V889-I938 HydrophobicContact CG1-CD1 4.46Å; A893-I938 HydrophobicContact CB-CG1 4.02Å; L917-I938 HydrophobicContact CD2-CG2 4.41Å; L917-I938 WeakPolarHBondContact O-CG2 3.34Å; R920-I938 HydrophobicContact CB-CD1 3.66Å; L921-I938 HydrophobicContact CD2-CB 4.36Å; L921-I938 HydrophobicContact CD2-CG2 3.73Å; L921-I938 HydrophobicContact CG-CG2 4.14Å; L930-I938 HydrophobicContact CD1-CD1 3.77Å; T934-I938 HydrophobicContact CG2-CD1 3.93Å; T934-I938 WeakPolarHBondContact O-CD1 3.48Å; T934-I938 VanDerWaalsContact O-CG1 3.31Å; T934-I938 WeakPolarHBondContact O-CG1 3.43Å; T934-I938 PolarHBondContact O-N 3.43Å; I938-C940 VanDerWaalsContact C-N 3.35Å; I938-C940 PolarHBondContact O-N 2.91Å; I938-A941 PolarHBondContact O-N 3.21Å; I938-L942 HydrophobicContact CG2-CD1 4.03Å; I938-L942 HydrophobicContact CG2-CG 4.47Å; I938-L942 WeakPolarHBondContact O-CG 3.4Å; I938-L942 PolarHBondContact O-N 2.88Å
939	C	97	Very high	94	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-41.2	176	-68.9	0	0	0	0	112.1	M935 A936 L942 H943 A983 V987	M935-C939 PolarHBondContact O-N 2.83Å; M935-C939 PolarHBondContact O-SG 3.27Å; A936-C939 PolarHBondContact O-N 2.9Å; C939-L942 PolarHBondContact O-N 3.41Å; C939-H943 WeakPolarHBondContact O-CB 3.2Å; C939-H943 PolarHBondContact O-N 2.86Å; C939-A983 HydrophobicContact CB-CB 3.55Å; C939-V987 HydrophobicContact CB-CG2 4.39Å; C939-V987 WeakPolarHBondContact O-CG2 3.45Å
940	C	97.5	Very high	95.2	Very high	31 Å²	31	33.2 Å²	33.2	21%	0.209	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-35.2	175.5	-71	0	0	0	0	112.7	A936 A937 I938 E944	A936-C940 WeakPolarHBondContact O-CB 3.39Å; A936-C940 PolarHBondContact O-N 3.49Å; A936-C940 PolarHBondContact O-SG 3.12Å; A937-C940 PolarHBondContact O-N 3.47Å; I938-C940 VanDerWaalsContact C-N 3.35Å; I938-C940 PolarHBondContact O-N 2.91Å; C940-E944 PolarHBondContact O-N 2.93Å
941	A	98.1	Very high	95.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-47	172.9	0	0	0	0	0	111.6	A893 R897 L917 A937 I938 H943 E944 V945	A893-A941 WeakPolarHBondContact O-CB 3.41Å; R897-A941 HydrophobicContact CB-CB 4.03Å; L917-A941 HydrophobicContact CD2-CB 4.34Å; A937-A941 PolarHBondContact O-N 2.93Å; I938-A941 PolarHBondContact O-N 3.21Å; A941-H943 VanDerWaalsContact C-N 3.31Å; A941-H943 PolarHBondContact O-N 2.92Å; A941-E944 PolarHBondContact O-N 3.11Å; A941-V945 WeakPolarHBondContact O-CB 2.92Å; A941-V945 VanDerWaalsContact O-CG2 3.23Å; A941-V945 WeakPolarHBondContact O-CG2 3.34Å; A941-V945 PolarHBondContact O-N 2.84Å
942	L	98.3	Very high	96.1	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-38.7	174.7	-71.6	169.8	0	0	0	112.1	M914 L917 V918 L921 I938 C939 T946 L956 V987	M914-L942 HydrophobicContact SD-CD2 3.53Å; M914-L942 VanDerWaalsContact SD-CD2 3.53Å; L917-L942 HydrophobicContact CB-CD2 3.7Å; L917-L942 HydrophobicContact CB-CG 4.21Å; L917-L942 HydrophobicContact CD1-CD2 4.13Å; V918-L942 HydrophobicContact CG2-CD2 4.14Å; L921-L942 HydrophobicContact CD1-CD1 3.7Å; L921-L942 HydrophobicContact CG-CD1 4.21Å; I938-L942 HydrophobicContact CG2-CD1 4.03Å; I938-L942 HydrophobicContact CG2-CG 4.47Å; I938-L942 WeakPolarHBondContact O-CG 3.4Å; I938-L942 PolarHBondContact O-N 2.88Å; C939-L942 PolarHBondContact O-N 3.41Å; L942-T946 WeakPolarHBondContact O-CB 3.36Å; L942-T946 WeakPolarHBondContact O-CG2 3.39Å; L942-T946 PolarHBondContact O-N 3.17Å; L942-T946 PolarHBondContact O-OG1 3.15Å; L942-L956 HydrophobicContact CB-CD1 4.14Å; L942-L956 HydrophobicContact CD2-CD1 3.94Å; L942-L956 HydrophobicContact CG-CD1 4.48Å; L942-V987 HydrophobicContact CB-CG1 4.35Å; L942-V987 HydrophobicContact CB-CG2 4.16Å
943	H	97.8	Very high	96.4	Very high	35 Å²	35	35.1 Å²	35.1	16%	0.162	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-51.8	174	175.7	53.2	0	0	0	111.2	C939 A941 V945 T946 S947 Q986 V987 T990	C939-H943 WeakPolarHBondContact O-CB 3.2Å; C939-H943 PolarHBondContact O-N 2.86Å; A941-H943 VanDerWaalsContact C-N 3.31Å; A941-H943 PolarHBondContact O-N 2.92Å; H943-V945 PolarHBondContact O-N 2.98Å; H943-T946 PolarHBondContact O-N 2.91Å; H943-T946 PolarHBondContact O-OG1 3.34Å; H943-S947 WeakPolarHBondContact O-CB 3.25Å; H943-S947 PolarHBondContact O-N 2.96Å; H943-Q986 PolarHBondContact CD2-NE2 2.68Å; H943-Q986 PolarHBondContact NE2-NE2 2.67Å; H943-V987 HydrophobicContact CB-CG2 3.97Å; H943-T990 PolarHBondContact CE1-OG1 3.22Å; H943-T990 PolarHBondContact ND1-OG1 2.75Å
944	E	97.9	Very high	96.5	Very high	37 Å²	37	32.9 Å²	32.9	17%	0.173	16%	0.162	C	C	.	.	H	α-helix	trans	-65.6	-42	-178.8	-170.9	52.6	-131	0	0	111.6	R897 A900 L901 K906 C940 A941 T946 S947	R897-E944 HydrophobicContact CG-CB 3.98Å; A900-E944 HydrophobicContact CB-CG 4.11Å; L901-E944 HydrophobicContact CD2-CG 4.22Å; K906-E944 VanDerWaalsContact CE-O 3.26Å; K906-E944 WeakPolarHBondContact CE-O 3.3Å; K906-E944 PolarHBondContact NZ-O 3.18Å; K906-E944 IonicContact NZ-OE1 3.91Å; K906-E944 PolarHBondContact NZ-OE1 3.06Å; C940-E944 PolarHBondContact O-N 2.93Å; A941-E944 PolarHBondContact O-N 3.11Å; E944-T946 VanDerWaalsContact C-N 3.3Å; E944-T946 PolarHBondContact O-N 3.41Å; E944-S947 WeakPolarHBondContact O-CB 3.26Å; E944-S947 PolarHBondContact O-N 3.47Å
945	V	97.6	Very high	96.6	Very high	1 Å²	1	34 Å²	34	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-35.5	178.3	173.7	0	0	0	0	112	A900 K906 I909 M914 A941 H943 N952	A900-V945 HydrophobicContact CB-CG2 3.82Å; K906-V945 WeakPolarHBondContact CG-O 3.45Å; I909-V945 HydrophobicContact CB-CG2 4.33Å; I909-V945 HydrophobicContact CG2-CG1 4.25Å; I909-V945 HydrophobicContact CG2-CG2 3.54Å; M914-V945 HydrophobicContact CE-CG1 3.64Å; A941-V945 WeakPolarHBondContact O-CB 2.92Å; A941-V945 VanDerWaalsContact O-CG2 3.23Å; A941-V945 WeakPolarHBondContact O-CG2 3.34Å; A941-V945 PolarHBondContact O-N 2.84Å; H943-V945 PolarHBondContact O-N 2.98Å; V945-N952 HydrophobicContact CG1-CB 4.3Å; V945-N952 WeakPolarHBondContact O-CB 3.32Å; V945-N952 PolarHBondContact O-ND2 2.96Å
946	T	97.4	Very high	96.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-89.7	-11.1	175.9	59	0	0	0	0	114.4	M914 L942 H943 E944 K948 N949 N952 A953 L956 L991 Y994	M914-T946 HydrophobicContact CE-CG2 3.95Å; L942-T946 WeakPolarHBondContact O-CB 3.36Å; L942-T946 WeakPolarHBondContact O-CG2 3.39Å; L942-T946 PolarHBondContact O-N 3.17Å; L942-T946 PolarHBondContact O-OG1 3.15Å; H943-T946 PolarHBondContact O-N 2.91Å; H943-T946 PolarHBondContact O-OG1 3.34Å; E944-T946 VanDerWaalsContact C-N 3.3Å; E944-T946 PolarHBondContact O-N 3.41Å; T946-K948 PolarHBondContact O-N 3.48Å; T946-N949 PolarHBondContact O-N 3.03Å; T946-N952 HydrophobicContact CG2-CB 4.4Å; T946-A953 HydrophobicContact CG2-CB 4.42Å; T946-L956 HydrophobicContact CG2-CB 4.08Å; T946-L956 HydrophobicContact CG2-CD1 3.64Å; T946-L991 HydrophobicContact CG2-CD2 4.32Å; T946-Y994 PolarHBondContact O-OH 2.99Å
947	S	96	Very high	96.8	Very high	20 Å²	20	33.9 Å²	33.9	14%	0.14	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	119.8	178.9	-179.8	0	0	0	0	111.1	K906 H943 E944 N949	K906-S947 WeakPolarHBondContact CD-O 3.35Å; K906-S947 PolarHBondContact NZ-O 3.48Å; H943-S947 WeakPolarHBondContact O-CB 3.25Å; H943-S947 PolarHBondContact O-N 2.96Å; E944-S947 WeakPolarHBondContact O-CB 3.26Å; E944-S947 PolarHBondContact O-N 3.47Å; S947-N949 PolarHBondContact O-N 2.94Å
948	K	94.3	Very high	96.6	Very high	196 Å²	196	38.3 Å²	38.3	85%	0.852	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	16.7	-177.6	-53.3	169.3	-174	166.2	0	115.1	T946 Y994	T946-K948 PolarHBondContact O-N 3.48Å; K948-Y994 WeakPolarHBondContact CA-OH 3.35Å; K948-Y994 PolarHBondContact N-OH 3.41Å
949	N	96.3	Very high	96.5	Very high	19 Å²	19	40.2 Å²	40.2	10%	0.102	21%	0.206	C	C	.	.			trans	-128.9	111.3	170.1	-174.9	-43.4	0	0	0	110.5	K906 T946 S947 E951 N952 A953 Y994	K906-N949 HydrophobicContact CD-CB 4.02Å; K906-N949 HydrophobicContact CG-CB 4.38Å; T946-N949 PolarHBondContact O-N 3.03Å; S947-N949 PolarHBondContact O-N 2.94Å; N949-E951 PolarHBondContact OD1-N 3.09Å; N949-N952 HydrophobicContact CB-CB 4.12Å; N949-N952 VanDerWaalsContact CG-CG 3.43Å; N949-N952 PolarHBondContact OD1-N 2.89Å; N949-N952 PolarHBondContact OD1-OD1 3.2Å; N949-A953 PolarHBondContact O-N 3.35Å; N949-Y994 PolarHBondContact N-OH 3.18Å; N949-Y994 PolarHBondContact O-OH 2.93Å
950	M	95.7	Very high	96.3	Very high	76 Å²	76	42 Å²	42	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-76.6	-31	-177.3	-171.3	170	68.1	0	0	113.2	N952 A953 K954 Y994 D996 L997	M950-N952 VanDerWaalsContact C-N 3.33Å; M950-A953 PolarHBondContact O-N 3.44Å; M950-K954 PolarHBondContact O-N 2.97Å; M950-Y994 HydrophobicContact CB-CD1 3.69Å; M950-Y994 HydrophobicContact CB-CE1 3.77Å; M950-Y994 HydrophobicContact CB-CG 4.38Å; M950-Y994 HydrophobicContact CG-CD1 3.69Å; M950-Y994 HydrophobicContact CG-CE1 4.28Å; M950-Y994 HydrophobicContact CG-CG 3.99Å; M950-Y994 HydrophobicContact SD-CD1 4.06Å; M950-Y994 HydrophobicContact SD-CG 4.49Å; M950-D996 HydrophobicContact SD-CB 4.18Å; M950-L997 HydrophobicContact CG-CD1 3.75Å; M950-L997 HydrophobicContact CG-CD2 4.17Å; M950-L997 HydrophobicContact CG-CG 3.85Å; M950-L997 HydrophobicContact SD-CD2 4.48Å; M950-L997 HydrophobicContact SD-CG 4.18Å
951	E	95.9	Very high	96.1	Very high	154 Å²	154	40.5 Å²	40.5	72%	0.72	22%	0.215	S	C	*	.	H	α-helix	trans	-65.4	-41.6	177	-59.5	-172	166.9	0	0	110.3	N949 K954 A955	N949-E951 PolarHBondContact OD1-N 3.09Å; E951-K954 WeakPolarHBondContact O-CB 3.3Å; E951-K954 PolarHBondContact O-N 2.95Å; E951-A955 WeakPolarHBondContact O-CB 3.3Å; E951-A955 PolarHBondContact O-N 3.44Å
952	N	97.1	Very high	96	Very high	6 Å²	6	40.9 Å²	40.9	3%	0.032	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-40.1	173.4	-68.1	1.3	0	0	0	112.1	K906 G910 M914 V945 T946 N949 M950 K954 A955 L956	K906-N952 PolarHBondContact O-ND2 3.24Å; G910-N952 WeakPolarHBondContact CA-OD1 3.48Å; M914-N952 HydrophobicContact CE-CB 4.28Å; M914-N952 WeakPolarHBondContact CE-O 3.38Å; V945-N952 HydrophobicContact CG1-CB 4.3Å; V945-N952 WeakPolarHBondContact O-CB 3.32Å; V945-N952 PolarHBondContact O-ND2 2.96Å; T946-N952 HydrophobicContact CG2-CB 4.4Å; N949-N952 HydrophobicContact CB-CB 4.12Å; N949-N952 VanDerWaalsContact CG-CG 3.43Å; N949-N952 PolarHBondContact OD1-N 2.89Å; N949-N952 PolarHBondContact OD1-OD1 3.2Å; M950-N952 VanDerWaalsContact C-N 3.33Å; N952-K954 VanDerWaalsContact C-N 3.26Å; N952-K954 PolarHBondContact O-N 3.47Å; N952-A955 PolarHBondContact O-N 2.87Å; N952-L956 PolarHBondContact O-N 2.85Å
953	A	97.1	Very high	95.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-29.5	175.1	0	0	0	0	0	112.8	T946 N949 M950 L991 Y994 L997 Y1001	T946-A953 HydrophobicContact CG2-CB 4.42Å; N949-A953 PolarHBondContact O-N 3.35Å; M950-A953 PolarHBondContact O-N 3.44Å; A953-L991 HydrophobicContact CB-CD2 3.78Å; A953-Y994 HydrophobicContact CB-CD2 3.51Å; A953-Y994 HydrophobicContact CB-CE2 3.38Å; A953-Y994 HydrophobicContact CB-CG 4.43Å; A953-L997 HydrophobicContact CB-CD1 3.82Å; A953-Y1001 PolarHBondContact O-OH 3.18Å
954	K	95.5	Very high	95.4	Very high	80 Å²	80	46.5 Å²	46.5	35%	0.348	24%	0.242	S	C	.	.	H	α-helix	trans	-72.6	-47.6	168.3	-167.4	-165	179.4	-56.9	0	111.2	M950 E951 N952 L956 A957 D958 L997	M950-K954 PolarHBondContact O-N 2.97Å; E951-K954 WeakPolarHBondContact O-CB 3.3Å; E951-K954 PolarHBondContact O-N 2.95Å; N952-K954 VanDerWaalsContact C-N 3.26Å; N952-K954 PolarHBondContact O-N 3.47Å; K954-L956 VanDerWaalsContact C-N 3.26Å; K954-L956 PolarHBondContact O-N 2.86Å; K954-A957 WeakPolarHBondContact O-CA 3.42Å; K954-A957 WeakPolarHBondContact O-CB 3.26Å; K954-A957 PolarHBondContact O-N 3.03Å; K954-D958 IonicContact NZ-OD1 2.63Å; K954-D958 PolarHBondContact NZ-OD1 3.18Å; K954-D958 IonicContact NZ-OD2 2.77Å; K954-D958 PolarHBondContact NZ-OD2 3.32Å; K954-D958 VanDerWaalsContact O-CG 3.28Å; K954-D958 PolarHBondContact O-N 3.16Å; K954-L997 HydrophobicContact CB-CD1 4.29Å; K954-L997 HydrophobicContact CB-CD2 4.08Å; K954-L997 HydrophobicContact CG-CD2 4.24Å
955	A	96.6	Very high	95.2	Very high	24 Å²	24	44.7 Å²	44.7	20%	0.198	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-34.4	179.9	0	0	0	0	0	113	M914 E951 N952 S959	M914-A955 HydrophobicContact CG-CB 4.21Å; E951-A955 WeakPolarHBondContact O-CB 3.3Å; E951-A955 PolarHBondContact O-N 3.44Å; N952-A955 PolarHBondContact O-N 2.87Å; A955-S959 VanDerWaalsContact O-CB 3.3Å; A955-S959 WeakPolarHBondContact O-CB 3.49Å; A955-S959 PolarHBondContact O-N 3.21Å; A955-S959 PolarHBondContact O-OG 3.44Å
956	L	96.9	Very high	94.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-44.2	172.8	-170.3	157.1	0	0	0	111.5	M914 V918 L942 T946 N952 K954 S959 G961 I962 L965 V987 L991	M914-L956 HydrophobicContact CE-CB 4.05Å; M914-L956 HydrophobicContact CG-CB 4.26Å; M914-L956 HydrophobicContact SD-CB 3.55Å; M914-L956 VanDerWaalsContact SD-CB 3.55Å; M914-L956 HydrophobicContact SD-CD1 4.03Å; M914-L956 HydrophobicContact SD-CG 3.84Å; V918-L956 HydrophobicContact CG2-CG 4.29Å; L942-L956 HydrophobicContact CB-CD1 4.14Å; L942-L956 HydrophobicContact CD2-CD1 3.94Å; L942-L956 HydrophobicContact CG-CD1 4.48Å; T946-L956 HydrophobicContact CG2-CB 4.08Å; T946-L956 HydrophobicContact CG2-CD1 3.64Å; N952-L956 PolarHBondContact O-N 2.85Å; K954-L956 VanDerWaalsContact C-N 3.26Å; K954-L956 PolarHBondContact O-N 2.86Å; L956-S959 PolarHBondContact O-N 2.89Å; L956-G961 PolarHBondContact O-N 3.1Å; L956-I962 HydrophobicContact CD2-CG1 4.47Å; L956-L965 HydrophobicContact CD2-CD1 4.02Å; L956-V987 HydrophobicContact CD1-CG1 3.78Å; L956-L991 HydrophobicContact CD1-CD2 4.43Å; L956-L991 HydrophobicContact CD2-CD1 3.75Å; L956-L991 HydrophobicContact CD2-CD2 4.34Å
957	A	95	Very high	94.5	Very high	21 Å²	21	48.4 Å²	48.4	17%	0.174	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-48.2	177	0	0	0	0	0	111.9	K954 S959 G960 I962 Y1001	K954-A957 WeakPolarHBondContact O-CA 3.42Å; K954-A957 WeakPolarHBondContact O-CB 3.26Å; K954-A957 PolarHBondContact O-N 3.03Å; A957-S959 PolarHBondContact O-N 3.4Å; A957-G960 PolarHBondContact O-N 3.41Å; A957-I962 HydrophobicContact CB-CD1 3.45Å; A957-I962 VanDerWaalsContact CB-CD1 3.45Å; A957-I962 HydrophobicContact CB-CG1 4.17Å; A957-Y1001 HydrophobicContact CB-CD1 4.37Å; A957-Y1001 HydrophobicContact CB-CE1 3.62Å
958	D	94.3	Very high	94.1	Very high	104 Å²	104	47.8 Å²	47.8	56%	0.556	25%	0.248	S	C	*	.	H	α-helix	trans	-58.5	-27.1	175.7	-62.8	-15.3	0	0	0	112	K954 G960	K954-D958 IonicContact NZ-OD1 2.63Å; K954-D958 PolarHBondContact NZ-OD1 3.18Å; K954-D958 IonicContact NZ-OD2 2.77Å; K954-D958 PolarHBondContact NZ-OD2 3.32Å; K954-D958 VanDerWaalsContact O-CG 3.28Å; K954-D958 PolarHBondContact O-N 3.16Å; D958-G960 VanDerWaalsContact C-N 3.31Å
959	S	94.3	Very high	93.8	Very high	40 Å²	40	38.9 Å²	38.9	28%	0.28	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.7	175.3	-56.9	0	0	0	0	114.3	V918 A955 L956 A957 G961	V918-S959 WeakPolarHBondContact CG1-O 3.27Å; A955-S959 VanDerWaalsContact O-CB 3.3Å; A955-S959 WeakPolarHBondContact O-CB 3.49Å; A955-S959 PolarHBondContact O-N 3.21Å; A955-S959 PolarHBondContact O-OG 3.44Å; L956-S959 PolarHBondContact O-N 2.89Å; A957-S959 PolarHBondContact O-N 3.4Å; S959-G961 VanDerWaalsContact C-N 3.29Å; S959-G961 PolarHBondContact O-N 3.1Å
960	G	92.8	Very high	93.2	Very high	38 Å²	38	43.5 Å²	43.5	39%	0.392	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	9.2	-176.9	0	0	0	0	0	115	A957 D958 I962 E963	A957-G960 PolarHBondContact O-N 3.41Å; D958-G960 VanDerWaalsContact C-N 3.31Å; G960-I962 VanDerWaalsContact C-N 3.27Å; G960-I962 PolarHBondContact O-N 2.74Å; G960-E963 PolarHBondContact O-N 2.82Å
961	G	94.1	Very high	91.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-25.9	-172.7	0	0	0	0	0	114.7	L956 S959 E963 L965	L956-G961 PolarHBondContact O-N 3.1Å; S959-G961 VanDerWaalsContact C-N 3.29Å; S959-G961 PolarHBondContact O-N 3.1Å; G961-E963 PolarHBondContact O-N 3.22Å; G961-L965 WeakPolarHBondContact O-CB 3.26Å; G961-L965 WeakPolarHBondContact O-CD1 3.44Å; G961-L965 WeakPolarHBondContact O-CG 3.25Å; G961-L965 PolarHBondContact O-N 2.84Å; G961-L965 VanDerWaalsContact O-N 3.08Å
962	I	94.4	Very high	90	Very high	7 Å²	7	40.8 Å²	40.8	4%	0.036	22%	0.217	C	C	.	.	H	α-helix	trans	-60.4	-45.4	177.2	-64	167.3	0	0	0	110.7	L956 A957 G960 L965 V966 L988 L991 Y1001 W1006 F1011	L956-I962 HydrophobicContact CD2-CG1 4.47Å; A957-I962 HydrophobicContact CB-CD1 3.45Å; A957-I962 VanDerWaalsContact CB-CD1 3.45Å; A957-I962 HydrophobicContact CB-CG1 4.17Å; G960-I962 VanDerWaalsContact C-N 3.27Å; G960-I962 PolarHBondContact O-N 2.74Å; I962-L965 PolarHBondContact O-N 3.49Å; I962-V966 HydrophobicContact CG2-CG2 4.1Å; I962-V966 WeakPolarHBondContact O-CB 3.41Å; I962-V966 VanDerWaalsContact O-CG2 3.23Å; I962-V966 WeakPolarHBondContact O-CG2 3.32Å; I962-V966 PolarHBondContact O-N 3Å; I962-L988 HydrophobicContact CG2-CD2 4.34Å; I962-L991 HydrophobicContact CG1-CD1 3.88Å; I962-Y1001 HydrophobicContact CD1-CD1 3.82Å; I962-Y1001 HydrophobicContact CD1-CE1 3.78Å; I962-Y1001 HydrophobicContact CD1-CG 4.48Å; I962-W1006 HydrophobicContact CG2-CD2 3.53Å; I962-W1006 HydrophobicContact CG2-CE3 3.61Å; I962-W1006 HydrophobicContact CG2-CG 4.07Å; I962-W1006 HydrophobicContact CG2-CH2 4.29Å; I962-W1006 HydrophobicContact CG2-CZ2 4.16Å; I962-W1006 HydrophobicContact CG2-CZ3 4.01Å; I962-F1011 HydrophobicContact CD1-CE1 4.06Å; I962-F1011 HydrophobicContact CD1-CZ 3.97Å; I962-F1011 HydrophobicContact CG1-CE1 4.1Å; I962-F1011 HydrophobicContact CG1-CZ 4.43Å; I962-F1011 HydrophobicContact CG2-CE1 3.93Å; I962-F1011 HydrophobicContact CG2-CZ 3.96Å
963	E	92.3	Very high	88	Confident	112 Å²	112	43.7 Å²	43.7	52%	0.523	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-50	-177	-171.2	-168.9	153.8	0	0	111.2	G960 G961 L965 V966 N967 W1006	G960-E963 PolarHBondContact O-N 2.82Å; G961-E963 PolarHBondContact O-N 3.22Å; E963-L965 PolarHBondContact O-N 3.29Å; E963-V966 PolarHBondContact O-N 3.46Å; E963-N967 WeakPolarHBondContact O-CB 3.39Å; E963-N967 PolarHBondContact O-N 3.29Å; E963-N967 PolarHBondContact O-ND2 3.29Å; E963-W1006 HydrophobicContact CB-CH2 3.9Å; E963-W1006 HydrophobicContact CB-CZ2 4.05Å; E963-W1006 HydrophobicContact CG-CH2 4.08Å; E963-W1006 HydrophobicContact CG-CZ2 4.5Å
964	K	91.9	Very high	86.2	Confident	41 Å²	41	51.4 Å²	51.4	18%	0.178	29%	0.29	C	S	.	.	H	α-helix	trans	-58	-46.9	177.4	-66.1	-167.8	174.2	-169	0	112.1	V918 N919 L921 P922 V966 N967 I968	V918-K964 HydrophobicContact CG1-CD 4.35Å; V918-K964 WeakPolarHBondContact O-CD 3.08Å; V918-K964 PolarHBondContact O-NZ 3.39Å; N919-K964 PolarHBondContact O-NZ 2.87Å; N919-K964 VanDerWaalsContact O-NZ 3.11Å; L921-K964 HydrophobicContact CB-CB 4.16Å; L921-K964 HydrophobicContact CB-CD 3.76Å; L921-K964 HydrophobicContact CD1-CB 4.35Å; L921-K964 WeakPolarHBondContact O-CD 3.5Å; L921-K964 WeakPolarHBondContact O-CE 3.45Å; L921-K964 PolarHBondContact O-NZ 2.86Å; P922-K964 WeakPolarHBondContact O-CD 3.4Å; P922-K964 WeakPolarHBondContact O-CG 3.47Å; K964-V966 PolarHBondContact O-N 3.28Å; K964-N967 PolarHBondContact O-N 2.9Å; K964-I968 VanDerWaalsContact O-CG1 3.29Å; K964-I968 WeakPolarHBondContact O-CG1 3.22Å; K964-I968 PolarHBondContact O-N 2.62Å
965	L	93	Very high	84.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-38.8	178.6	-69.6	166.3	0	0	0	112.4	L921 L956 G961 I962 E963 I968 T969 A984 V987 L988	L921-L965 HydrophobicContact CD1-CD2 3.75Å; L921-L965 HydrophobicContact CD1-CG 3.94Å; L956-L965 HydrophobicContact CD2-CD1 4.02Å; G961-L965 WeakPolarHBondContact O-CB 3.26Å; G961-L965 WeakPolarHBondContact O-CD1 3.44Å; G961-L965 WeakPolarHBondContact O-CG 3.25Å; G961-L965 PolarHBondContact O-N 2.84Å; G961-L965 VanDerWaalsContact O-N 3.08Å; I962-L965 PolarHBondContact O-N 3.49Å; E963-L965 PolarHBondContact O-N 3.29Å; L965-I968 PolarHBondContact O-N 2.9Å; L965-T969 PolarHBondContact O-N 3.39Å; L965-T969 PolarHBondContact O-OG1 3.11Å; L965-A984 HydrophobicContact CD2-CB 3.77Å; L965-V987 HydrophobicContact CD1-CB 3.95Å; L965-V987 HydrophobicContact CD1-CG1 3.56Å; L965-V987 HydrophobicContact CD2-CB 4.32Å; L965-V987 HydrophobicContact CD2-CG2 4.39Å; L965-L988 HydrophobicContact CB-CD1 4.01Å; L965-L988 HydrophobicContact CB-CD2 3.88Å; L965-L988 HydrophobicContact CB-CG 3.84Å; L965-L988 HydrophobicContact CD1-CD2 4.42Å
966	V	91.3	Very high	84	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-70.3	-35.6	176.5	171.7	0	0	0	0	111.5	I962 E963 K964 T969 K970 L988 W1006 H1010	I962-V966 HydrophobicContact CG2-CG2 4.1Å; I962-V966 WeakPolarHBondContact O-CB 3.41Å; I962-V966 VanDerWaalsContact O-CG2 3.23Å; I962-V966 WeakPolarHBondContact O-CG2 3.32Å; I962-V966 PolarHBondContact O-N 3Å; E963-V966 PolarHBondContact O-N 3.46Å; K964-V966 PolarHBondContact O-N 3.28Å; V966-T969 PolarHBondContact O-N 2.81Å; V966-T969 PolarHBondContact O-OG1 2.99Å; V966-K970 HydrophobicContact CG1-CD 3.72Å; V966-K970 VanDerWaalsContact CG1-CE 3.41Å; V966-K970 HydrophobicContact CG1-CG 4.24Å; V966-K970 VanDerWaalsContact O-CB 3.31Å; V966-K970 WeakPolarHBondContact O-CB 3.39Å; V966-K970 VanDerWaalsContact O-CG 3.28Å; V966-K970 WeakPolarHBondContact O-CG 3.33Å; V966-K970 PolarHBondContact O-N 2.91Å; V966-L988 HydrophobicContact CG2-CD1 3.95Å; V966-L988 HydrophobicContact CG2-CD2 3.82Å; V966-W1006 HydrophobicContact CB-CZ3 4.01Å; V966-W1006 HydrophobicContact CG1-CZ3 4.05Å; V966-W1006 HydrophobicContact CG2-CE3 4.18Å; V966-W1006 HydrophobicContact CG2-CZ3 3.88Å; V966-H1010 HydrophobicContact CG1-CB 4.44Å; V966-H1010 HydrophobicContact CG2-CB 4.1Å
967	N	88.9	Confident	83.5	Confident	77 Å²	77	55.8 Å²	55.8	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-66.5	-39.6	174.7	-69.8	-17.5	0	0	0	111.1	E963 K964 K970 G971	E963-N967 WeakPolarHBondContact O-CB 3.39Å; E963-N967 PolarHBondContact O-N 3.29Å; E963-N967 PolarHBondContact O-ND2 3.29Å; K964-N967 PolarHBondContact O-N 2.9Å; N967-K970 PolarHBondContact O-N 3.36Å; N967-G971 PolarHBondContact O-N 3.06Å
968	I	88.9	Confident	83.1	Confident	7 Å²	7	58 Å²	58	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-47.2	171.7	-69.3	164.1	0	0	0	111.4	L921 P922 K964 L965 V980 A984	L921-I968 HydrophobicContact CD2-CD1 4.18Å; P922-I968 HydrophobicContact CG-CD1 3.99Å; P922-I968 HydrophobicContact CG-CG1 3.98Å; K964-I968 VanDerWaalsContact O-CG1 3.29Å; K964-I968 WeakPolarHBondContact O-CG1 3.22Å; K964-I968 PolarHBondContact O-N 2.62Å; L965-I968 PolarHBondContact O-N 2.9Å; I968-V980 HydrophobicContact CG2-CG1 3.71Å; I968-A984 HydrophobicContact CB-CB 4.19Å; I968-A984 HydrophobicContact CG2-CB 3.63Å
969	T	88	Confident	82.8	Confident	10 Å²	10	59.4 Å²	59.4	6%	0.061	32%	0.316	C	S	.	.	H	α-helix	trans	-74.3	-24.4	-178.8	58.3	0	0	0	0	114.1	L965 V966 A984 A985 L988	L965-T969 PolarHBondContact O-N 3.39Å; L965-T969 PolarHBondContact O-OG1 3.11Å; V966-T969 PolarHBondContact O-N 2.81Å; V966-T969 PolarHBondContact O-OG1 2.99Å; T969-A984 HydrophobicContact CG2-CB 3.93Å; T969-A985 HydrophobicContact CG2-CB 3.98Å; T969-L988 HydrophobicContact CG2-CD1 3.92Å
970	K	82.4	Confident	82.7	Confident	116 Å²	116	57.5 Å²	57.5	50%	0.504	30%	0.303	S	S	.	.	H	α-helix	trans	-82.9	-30.2	173.9	-72.7	177	179.4	173.9	0	113.3	V966 N967 R972 H1010	V966-K970 HydrophobicContact CG1-CD 3.72Å; V966-K970 VanDerWaalsContact CG1-CE 3.41Å; V966-K970 HydrophobicContact CG1-CG 4.24Å; V966-K970 VanDerWaalsContact O-CB 3.31Å; V966-K970 WeakPolarHBondContact O-CB 3.39Å; V966-K970 VanDerWaalsContact O-CG 3.28Å; V966-K970 WeakPolarHBondContact O-CG 3.33Å; V966-K970 PolarHBondContact O-N 2.91Å; N967-K970 PolarHBondContact O-N 3.36Å; K970-R972 PolarHBondContact O-N 3.09Å; K970-H1010 PolarHBondContact NZ-CD2 3.25Å; K970-H1010 PolarHBondContact NZ-NE2 2.94Å; K970-H1010 VanDerWaalsContact NZ-NE2 3.17Å
971	G	68.9	Low	82.6	Confident	27 Å²	27	56.1 Å²	56.1	28%	0.278	29%	0.287	S	S	.	.	S	Bend	trans	-72.7	59.2	-180	0	0	0	0	0	114.1	N967	N967-G971 PolarHBondContact O-N 3.06Å
972	R	55.5	Low	82.4	Confident	146 Å²	146	59.3 Å²	59.3	55%	0.551	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	138	-178.1	-59.8	-168.1	-172.3	-150.3	16.4	111.7	K970 D974 D1021	K970-R972 PolarHBondContact O-N 3.09Å; R972-D974 VanDerWaalsContact C-N 3.3Å; R972-D974 PolarHBondContact O-N 3.16Å; R972-D1021 IonicContact CZ-OD2 3.66Å; R972-D1021 IonicContact NH1-OD2 3.87Å; R972-D1021 PolarHBondContact NH1-OD2 2.99Å; R972-D1021 IonicContact NH2-OD2 3.3Å
973	G	55.7	Low	82.3	Confident	67 Å²	67	59.4 Å²	59.4	69%	0.691	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	-66.8	167.9	0	0	0	0	0	113.9	R975	G973-R975 PolarHBondContact O-N 3.11Å
974	D	59	Low	82.4	Confident	161 Å²	161	54 Å²	54	86%	0.861	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-7.7	-155.1	-54.7	-22.5	0	0	0	115	R972	R972-D974 VanDerWaalsContact C-N 3.3Å; R972-D974 PolarHBondContact O-N 3.16Å
975	R	67.8	Low	82.5	Confident	148 Å²	148	52.1 Å²	52.1	56%	0.558	27%	0.269	S	S	*	.	S	Bend	trans	-137.4	-9.2	-174	-67.6	-171.6	-178.8	-115.4	2.9	116.6	N925 G973	N925-R975 PolarHBondContact O-NH1 3.39Å; G973-R975 PolarHBondContact O-N 3.11Å
976	S	77.8	Confident	82.6	Confident	17 Å²	17	56.6 Å²	56.6	12%	0.119	29%	0.29	C	S	.	.	S	Bend	trans	-159.2	138.7	-178.8	-67.1	0	0	0	0	111.4
977	S	86.9	Confident	82.9	Confident	32 Å²	32	56.5 Å²	56.5	22%	0.224	29%	0.29	C	S	.	.			trans	-67.4	158.9	178.7	69.3	0	0	0	0	113.2	D932 K979 V980 V981	D932-S977 WeakPolarHBondContact OD1-CB 3.5Å; D932-S977 PolarHBondContact OD1-N 3.26Å; D932-S977 PolarHBondContact OD1-OG 2.8Å; D932-S977 WeakPolarHBondContact OD2-CB 3.34Å; S977-K979 PolarHBondContact O-N 3.36Å; S977-K979 VanDerWaalsContact O-N 3.15Å; S977-K979 PolarHBondContact OG-N 2.93Å; S977-V980 PolarHBondContact O-N 3.25Å; S977-V980 VanDerWaalsContact O-N 3.1Å; S977-V980 PolarHBondContact OG-N 2.96Å; S977-V981 WeakPolarHBondContact O-CG2 3.43Å; S977-V981 PolarHBondContact O-N 2.93Å
978	L	86.9	Confident	83.2	Confident	68 Å²	68	52.9 Å²	52.9	36%	0.356	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-26.2	172	-176.2	60.3	0	0	0	112.9	K982 L1018	L978-K982 HydrophobicContact CD1-CD 4.49Å; L978-K982 HydrophobicContact CD1-CG 4.23Å; L978-K982 HydrophobicContact CG-CD 4.33Å; L978-K982 HydrophobicContact CG-CG 4.47Å; L978-K982 WeakPolarHBondContact O-CB 3.41Å; L978-K982 VanDerWaalsContact O-CG 3.27Å; L978-K982 WeakPolarHBondContact O-CG 3.43Å; L978-K982 PolarHBondContact O-N 3.47Å; L978-L1018 HydrophobicContact CD1-CB 4.02Å; L978-L1018 HydrophobicContact CD1-CD1 3.89Å; L978-L1018 HydrophobicContact CD1-CG 4.5Å
979	K	88.3	Confident	83.5	Confident	132 Å²	132	54.6 Å²	54.6	57%	0.574	28%	0.28	S	S	*	.	H	α-helix	trans	-63.7	-52	173.5	-67.7	-178.3	179.4	178.4	0	110.3	E933 S977 K982 A983	E933-K979 IonicContact OE1-NZ 3.28Å; S977-K979 PolarHBondContact O-N 3.36Å; S977-K979 VanDerWaalsContact O-N 3.15Å; S977-K979 PolarHBondContact OG-N 2.93Å; K979-K982 PolarHBondContact O-N 2.86Å; K979-A983 PolarHBondContact O-N 3.13Å
980	V	91.1	Very high	83.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-43.3	179.6	176.4	0	0	0	0	111.3	D932 M935 A936 I968 S977 K982 A983 A984	D932-V980 HydrophobicContact CB-CG2 4.02Å; D932-V980 WeakPolarHBondContact O-CG2 3.44Å; D932-V980 WeakPolarHBondContact OD1-CG2 3.26Å; M935-V980 HydrophobicContact CB-CG1 3.93Å; M935-V980 HydrophobicContact CB-CG2 3.74Å; M935-V980 HydrophobicContact CE-CG2 4.49Å; A936-V980 HydrophobicContact CB-CG2 4.16Å; I968-V980 HydrophobicContact CG2-CG1 3.71Å; S977-V980 PolarHBondContact O-N 3.25Å; S977-V980 VanDerWaalsContact O-N 3.1Å; S977-V980 PolarHBondContact OG-N 2.96Å; V980-K982 PolarHBondContact O-N 3.42Å; V980-A983 PolarHBondContact O-N 3.49Å; V980-A984 WeakPolarHBondContact O-CB 3.41Å; V980-A984 PolarHBondContact O-N 3.48Å
981	V	90.6	Very high	84.4	Confident	10 Å²	10	49 Å²	49	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-58.3	-44.5	175.2	171.7	0	0	0	0	111.6	S977 A985 L1018	S977-V981 WeakPolarHBondContact O-CG2 3.43Å; S977-V981 PolarHBondContact O-N 2.93Å; V981-A985 VanDerWaalsContact O-CB 3.27Å; V981-A985 WeakPolarHBondContact O-CB 3.43Å; V981-A985 PolarHBondContact O-N 2.91Å; V981-L1018 HydrophobicContact CG1-CD1 3.9Å
982	K	90.8	Very high	85.6	Confident	67 Å²	67	48.1 Å²	48.1	29%	0.291	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-43	176.3	-76.9	-178.6	177.5	-175.5	0	111.9	L978 K979 V980 A985 Q986 V1015 E1019	L978-K982 HydrophobicContact CD1-CD 4.49Å; L978-K982 HydrophobicContact CD1-CG 4.23Å; L978-K982 HydrophobicContact CG-CD 4.33Å; L978-K982 HydrophobicContact CG-CG 4.47Å; L978-K982 WeakPolarHBondContact O-CB 3.41Å; L978-K982 VanDerWaalsContact O-CG 3.27Å; L978-K982 WeakPolarHBondContact O-CG 3.43Å; L978-K982 PolarHBondContact O-N 3.47Å; K979-K982 PolarHBondContact O-N 2.86Å; V980-K982 PolarHBondContact O-N 3.42Å; K982-A985 PolarHBondContact O-N 3.24Å; K982-Q986 PolarHBondContact O-N 2.89Å; K982-V1015 HydrophobicContact CD-CG1 4.12Å; K982-V1015 HydrophobicContact CG-CG1 3.93Å; K982-E1019 IonicContact NZ-OE1 2.77Å; K982-E1019 PolarHBondContact NZ-OE1 3.13Å
983	A	93.4	Very high	87.5	Confident	8 Å²	8	47.5 Å²	47.5	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-44.5	178.3	0	0	0	0	0	112.5	C939 K979 V980 A985 Q986 V987	C939-A983 HydrophobicContact CB-CB 3.55Å; K979-A983 PolarHBondContact O-N 3.13Å; V980-A983 PolarHBondContact O-N 3.49Å; A983-A985 PolarHBondContact O-N 2.92Å; A983-Q986 WeakPolarHBondContact O-CB 3.37Å; A983-Q986 PolarHBondContact O-N 3.27Å; A983-Q986 VanDerWaalsContact O-N 3.13Å; A983-V987 PolarHBondContact O-N 3.16Å; A983-V987 VanDerWaalsContact O-N 3.16Å
984	A	94.3	Very high	89.4	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-41.3	176.3	0	0	0	0	0	112.1	L965 I968 T969 V980 Q986 V987 L988	L965-A984 HydrophobicContact CD2-CB 3.77Å; I968-A984 HydrophobicContact CB-CB 4.19Å; I968-A984 HydrophobicContact CG2-CB 3.63Å; T969-A984 HydrophobicContact CG2-CB 3.93Å; V980-A984 WeakPolarHBondContact O-CB 3.41Å; V980-A984 PolarHBondContact O-N 3.48Å; A984-Q986 VanDerWaalsContact C-N 3.28Å; A984-Q986 PolarHBondContact O-N 3.25Å; A984-V987 PolarHBondContact O-N 3.14Å; A984-L988 WeakPolarHBondContact O-CG 3.47Å; A984-L988 PolarHBondContact O-N 3.36Å
985	A	93.6	Very high	91	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-33.8	172.8	0	0	0	0	0	112.4	T969 V981 K982 A983 L988 N989 V1015	T969-A985 HydrophobicContact CG2-CB 3.98Å; V981-A985 VanDerWaalsContact O-CB 3.27Å; V981-A985 WeakPolarHBondContact O-CB 3.43Å; V981-A985 PolarHBondContact O-N 2.91Å; K982-A985 PolarHBondContact O-N 3.24Å; A983-A985 PolarHBondContact O-N 2.92Å; A985-L988 PolarHBondContact O-N 2.7Å; A985-N989 WeakPolarHBondContact O-CB 3.38Å; A985-N989 PolarHBondContact O-N 2.86Å; A985-N989 PolarHBondContact O-ND2 2.89Å; A985-V1015 HydrophobicContact CB-CG2 4.32Å
986	Q	95	Very high	92.3	Very high	94 Å²	94	46.1 Å²	46.1	44%	0.439	22%	0.217	S	C	.	.	H	α-helix	trans	-67.4	-39.9	175.7	-176.6	171.7	-8.9	0	0	112.2	H943 K982 A983 A984 T990	H943-Q986 PolarHBondContact CD2-NE2 2.68Å; H943-Q986 PolarHBondContact NE2-NE2 2.67Å; K982-Q986 PolarHBondContact O-N 2.89Å; A983-Q986 WeakPolarHBondContact O-CB 3.37Å; A983-Q986 PolarHBondContact O-N 3.27Å; A983-Q986 VanDerWaalsContact O-N 3.13Å; A984-Q986 VanDerWaalsContact C-N 3.28Å; A984-Q986 PolarHBondContact O-N 3.25Å; Q986-T990 PolarHBondContact O-N 3.35Å; Q986-T990 VanDerWaalsContact O-N 3.15Å; Q986-T990 PolarHBondContact O-OG1 3.48Å
987	V	96.6	Very high	93.1	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-52.4	171.3	-173.7	0	0	0	0	110.1	C939 L942 H943 L956 L965 A983 A984 N989 T990 L991	C939-V987 HydrophobicContact CB-CG2 4.39Å; C939-V987 WeakPolarHBondContact O-CG2 3.45Å; L942-V987 HydrophobicContact CB-CG1 4.35Å; L942-V987 HydrophobicContact CB-CG2 4.16Å; H943-V987 HydrophobicContact CB-CG2 3.97Å; L956-V987 HydrophobicContact CD1-CG1 3.78Å; L965-V987 HydrophobicContact CD1-CB 3.95Å; L965-V987 HydrophobicContact CD1-CG1 3.56Å; L965-V987 HydrophobicContact CD2-CB 4.32Å; L965-V987 HydrophobicContact CD2-CG2 4.39Å; A983-V987 PolarHBondContact O-N 3.16Å; A983-V987 VanDerWaalsContact O-N 3.16Å; A984-V987 PolarHBondContact O-N 3.14Å; V987-N989 PolarHBondContact O-N 3.4Å; V987-T990 WeakPolarHBondContact O-CA 3.32Å; V987-T990 VanDerWaalsContact O-CB 3.24Å; V987-T990 WeakPolarHBondContact O-CB 3.39Å; V987-T990 PolarHBondContact O-N 2.82Å; V987-L991 WeakPolarHBondContact O-CG 3.31Å; V987-L991 PolarHBondContact O-N 3.46Å
988	L	96	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.9	-44.7	-178.6	-73.9	169.7	0	0	0	113.2	I962 L965 V966 T969 A984 A985 T990 L991 W992 F1011	I962-L988 HydrophobicContact CG2-CD2 4.34Å; L965-L988 HydrophobicContact CB-CD1 4.01Å; L965-L988 HydrophobicContact CB-CD2 3.88Å; L965-L988 HydrophobicContact CB-CG 3.84Å; L965-L988 HydrophobicContact CD1-CD2 4.42Å; V966-L988 HydrophobicContact CG2-CD1 3.95Å; V966-L988 HydrophobicContact CG2-CD2 3.82Å; T969-L988 HydrophobicContact CG2-CD1 3.92Å; A984-L988 WeakPolarHBondContact O-CG 3.47Å; A984-L988 PolarHBondContact O-N 3.36Å; A985-L988 PolarHBondContact O-N 2.7Å; L988-T990 PolarHBondContact O-N 2.94Å; L988-L991 HydrophobicContact CD2-CD1 4.38Å; L988-L991 PolarHBondContact O-N 3.2Å; L988-W992 PolarHBondContact O-N 3.4Å; L988-W992 VanDerWaalsContact O-N 3.15Å; L988-F1011 HydrophobicContact CB-CB 4.48Å; L988-F1011 HydrophobicContact CB-CD1 4.28Å; L988-F1011 WeakPolarHBondContact CB-O 3.35Å; L988-F1011 HydrophobicContact CD2-CD1 3.77Å; L988-F1011 HydrophobicContact CD2-CE1 4.15Å; L988-F1011 WeakPolarHBondContact O-CD1 3.4Å
989	N	94.1	Very high	93.7	Very high	44 Å²	44	48.7 Å²	48.7	24%	0.235	23%	0.227	C	C	.	.	H	α-helix	trans	-61.3	-28.3	173.5	-82.4	-67.9	0	0	0	112.6	A985 V987 Q993	A985-N989 WeakPolarHBondContact O-CB 3.38Å; A985-N989 PolarHBondContact O-N 2.86Å; A985-N989 PolarHBondContact O-ND2 2.89Å; V987-N989 PolarHBondContact O-N 3.4Å; N989-Q993 WeakPolarHBondContact O-CG 3.47Å; N989-Q993 PolarHBondContact O-NE2 3.38Å
990	T	94.8	Very high	93.8	Very high	8 Å²	8	45.2 Å²	45.2	5%	0.049	21%	0.214	C	C	.	.	H	α-helix	trans	-74.3	-45.1	176.1	-53.9	0	0	0	0	111.2	H943 Q986 V987 L988 W992 Q993 Y994	H943-T990 PolarHBondContact CE1-OG1 3.22Å; H943-T990 PolarHBondContact ND1-OG1 2.75Å; Q986-T990 PolarHBondContact O-N 3.35Å; Q986-T990 VanDerWaalsContact O-N 3.15Å; Q986-T990 PolarHBondContact O-OG1 3.48Å; V987-T990 WeakPolarHBondContact O-CA 3.32Å; V987-T990 VanDerWaalsContact O-CB 3.24Å; V987-T990 WeakPolarHBondContact O-CB 3.39Å; V987-T990 PolarHBondContact O-N 2.82Å; L988-T990 PolarHBondContact O-N 2.94Å; T990-W992 VanDerWaalsContact C-N 3.29Å; T990-W992 PolarHBondContact O-N 3.09Å; T990-Q993 WeakPolarHBondContact O-CB 3.28Å; T990-Q993 PolarHBondContact O-N 3.39Å; T990-Q993 VanDerWaalsContact O-N 3.08Å; T990-Y994 HydrophobicContact CG2-CE2 4.47Å; T990-Y994 WeakPolarHBondContact O-CD2 3.45Å
991	L	95.8	Very high	94	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-45.1	175.6	-60.6	175.5	0	0	0	111.2	T946 A953 L956 I962 V987 L988 Q993 Y994 Y1001 F1011	T946-L991 HydrophobicContact CG2-CD2 4.32Å; A953-L991 HydrophobicContact CB-CD2 3.78Å; L956-L991 HydrophobicContact CD1-CD2 4.43Å; L956-L991 HydrophobicContact CD2-CD1 3.75Å; L956-L991 HydrophobicContact CD2-CD2 4.34Å; I962-L991 HydrophobicContact CG1-CD1 3.88Å; V987-L991 WeakPolarHBondContact O-CG 3.31Å; V987-L991 PolarHBondContact O-N 3.46Å; L988-L991 HydrophobicContact CD2-CD1 4.38Å; L988-L991 PolarHBondContact O-N 3.2Å; L991-Q993 PolarHBondContact O-N 3.3Å; L991-Y994 PolarHBondContact O-N 3.35Å; L991-Y1001 HydrophobicContact CB-CE2 4.15Å; L991-F1011 HydrophobicContact CB-CD1 4.15Å; L991-F1011 HydrophobicContact CB-CE1 4.05Å; L991-F1011 HydrophobicContact CD1-CE1 4.16Å
992	W	94.6	Very high	94.1	Very high	8 Å²	8	51.5 Å²	51.5	3%	0.03	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.1	-179.6	-162.5	-106.6	0	0	0	114.5	L988 T990 Y994 R998 Y1001 Q1008 F1011	L988-W992 PolarHBondContact O-N 3.4Å; L988-W992 VanDerWaalsContact O-N 3.15Å; T990-W992 VanDerWaalsContact C-N 3.29Å; T990-W992 PolarHBondContact O-N 3.09Å; W992-Y994 VanDerWaalsContact C-N 3.32Å; W992-R998 HydrophobicContact CD2-CG 4.07Å; W992-R998 HydrophobicContact CE3-CG 4Å; W992-R998 HydrophobicContact CH2-CB 4.37Å; W992-R998 HydrophobicContact CH2-CG 4.31Å; W992-R998 HydrophobicContact CZ2-CG 4.34Å; W992-R998 HydrophobicContact CZ3-CB 4.31Å; W992-R998 HydrophobicContact CZ3-CG 4.13Å; W992-R998 PolarHBondContact O-NE 3.03Å; W992-R998 PolarHBondContact O-NH2 3.41Å; W992-Y1001 HydrophobicContact CE3-CD2 4.07Å; W992-Y1001 HydrophobicContact CZ3-CD2 4.29Å; W992-Q1008 HydrophobicContact CH2-CB 4.32Å; W992-Q1008 HydrophobicContact CZ2-CB 3.61Å; W992-Q1008 HydrophobicContact CZ2-CG 4.08Å; W992-F1011 HydrophobicContact CB-CB 3.66Å; W992-F1011 HydrophobicContact CB-CD1 4.39Å; W992-F1011 HydrophobicContact CB-CG 4.01Å; W992-F1011 HydrophobicContact CD2-CB 4.23Å; W992-F1011 AromaticContact CD2-CD2 3.94Å; W992-F1011 HydrophobicContact CD2-CD2 3.94Å; W992-F1011 HydrophobicContact CD2-CG 4.23Å; W992-F1011 HydrophobicContact CE3-CB 4.27Å; W992-F1011 AromaticContact CE3-CD2 3.16Å; W992-F1011 HydrophobicContact CE3-CD2 3.16Å; W992-F1011 AromaticContact CE3-CE2 3.44Å; W992-F1011 HydrophobicContact CE3-CE2 3.44Å; W992-F1011 VanDerWaalsContact CE3-CE2 3.44Å; W992-F1011 AromaticContact CE3-CG 3.76Å; W992-F1011 HydrophobicContact CE3-CG 3.76Å; W992-F1011 HydrophobicContact CE3-CZ 4.24Å; W992-F1011 HydrophobicContact CG-CB 4.02Å; W992-F1011 HydrophobicContact CG-CG 4.37Å; W992-F1011 AromaticContact CZ3-CD2 3.57Å; W992-F1011 HydrophobicContact CZ3-CD2 3.57Å; W992-F1011 AromaticContact CZ3-CE2 3.54Å; W992-F1011 HydrophobicContact CZ3-CE2 3.54Å
993	Q	94	Very high	94.2	Very high	133 Å²	133	56.9 Å²	56.9	62%	0.621	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-30.1	173.3	-74.4	164	49.6	0	0	112	N989 T990 L991 R995	N989-Q993 WeakPolarHBondContact O-CG 3.47Å; N989-Q993 PolarHBondContact O-NE2 3.38Å; T990-Q993 WeakPolarHBondContact O-CB 3.28Å; T990-Q993 PolarHBondContact O-N 3.39Å; T990-Q993 VanDerWaalsContact O-N 3.08Å; L991-Q993 PolarHBondContact O-N 3.3Å; Q993-R995 PolarHBondContact O-N 3.09Å
994	Y	95.4	Very high	94.1	Very high	36 Å²	36	60.7 Å²	60.7	14%	0.141	28%	0.284	C	S	.	.			trans	-71.1	98.9	176.4	-61.5	-70.6	0	0	0	111.1	T946 K948 N949 M950 A953 T990 L991 W992 D996 L997 R998	T946-Y994 PolarHBondContact O-OH 2.99Å; K948-Y994 WeakPolarHBondContact CA-OH 3.35Å; K948-Y994 PolarHBondContact N-OH 3.41Å; N949-Y994 PolarHBondContact N-OH 3.18Å; N949-Y994 PolarHBondContact O-OH 2.93Å; M950-Y994 HydrophobicContact CB-CD1 3.69Å; M950-Y994 HydrophobicContact CB-CE1 3.77Å; M950-Y994 HydrophobicContact CB-CG 4.38Å; M950-Y994 HydrophobicContact CG-CD1 3.69Å; M950-Y994 HydrophobicContact CG-CE1 4.28Å; M950-Y994 HydrophobicContact CG-CG 3.99Å; M950-Y994 HydrophobicContact SD-CD1 4.06Å; M950-Y994 HydrophobicContact SD-CG 4.49Å; A953-Y994 HydrophobicContact CB-CD2 3.51Å; A953-Y994 HydrophobicContact CB-CE2 3.38Å; A953-Y994 HydrophobicContact CB-CG 4.43Å; T990-Y994 HydrophobicContact CG2-CE2 4.47Å; T990-Y994 WeakPolarHBondContact O-CD2 3.45Å; L991-Y994 PolarHBondContact O-N 3.35Å; W992-Y994 VanDerWaalsContact C-N 3.32Å; Y994-D996 PolarHBondContact O-N 3.47Å; Y994-L997 HydrophobicContact CD2-CD1 4.33Å; Y994-L997 HydrophobicContact CG-CD1 4.23Å; Y994-L997 PolarHBondContact O-N 3.4Å; Y994-R998 PolarHBondContact O-N 3Å
995	R	94	Very high	93.9	Very high	204 Å²	204	63.4 Å²	63.4	77%	0.77	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-40.3	-176.2	-67.4	-175.7	177.4	-165	-0.9	112.5	Q993 R998	Q993-R995 PolarHBondContact O-N 3.09Å; R995-R998 WeakPolarHBondContact O-CB 3.47Å; R995-R998 PolarHBondContact O-N 3.34Å
996	D	94.5	Very high	93.9	Very high	107 Å²	107	65.9 Å²	65.9	57%	0.572	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-41.7	-173.1	-47.3	-43.9	0	0	0	111.2	M950 Y994 R998 S999	M950-D996 HydrophobicContact SD-CB 4.18Å; Y994-D996 PolarHBondContact O-N 3.47Å; D996-R998 VanDerWaalsContact C-N 3.26Å; D996-R998 PolarHBondContact O-N 2.9Å; D996-S999 PolarHBondContact O-N 2.95Å; D996-S999 PolarHBondContact O-OG 3.19Å
997	L	94.5	Very high	93.6	Very high	9 Å²	9	64.4 Å²	64.4	5%	0.047	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-22.8	177.6	-57.3	-175.1	0	0	0	113.3	M950 A953 K954 Y994 S999 I1000 Y1001	M950-L997 HydrophobicContact CG-CD1 3.75Å; M950-L997 HydrophobicContact CG-CD2 4.17Å; M950-L997 HydrophobicContact CG-CG 3.85Å; M950-L997 HydrophobicContact SD-CD2 4.48Å; M950-L997 HydrophobicContact SD-CG 4.18Å; A953-L997 HydrophobicContact CB-CD1 3.82Å; K954-L997 HydrophobicContact CB-CD1 4.29Å; K954-L997 HydrophobicContact CB-CD2 4.08Å; K954-L997 HydrophobicContact CG-CD2 4.24Å; Y994-L997 HydrophobicContact CD2-CD1 4.33Å; Y994-L997 HydrophobicContact CG-CD1 4.23Å; Y994-L997 PolarHBondContact O-N 3.4Å; L997-S999 PolarHBondContact O-N 3.46Å; L997-S999 VanDerWaalsContact O-N 3.13Å; L997-I1000 HydrophobicContact CD2-CD1 3.98Å; L997-I1000 WeakPolarHBondContact O-CB 3.3Å; L997-I1000 PolarHBondContact O-N 2.91Å; L997-Y1001 HydrophobicContact CB-CD2 4.37Å; L997-Y1001 HydrophobicContact CB-CE1 4.03Å; L997-Y1001 HydrophobicContact CB-CE2 3.76Å; L997-Y1001 VanDerWaalsContact CD1-OH 3.31Å; L997-Y1001 WeakPolarHBondContact CD1-OH 3.5Å; L997-Y1001 VanDerWaalsContact O-CG 3.26Å; L997-Y1001 PolarHBondContact O-N 3.21Å
998	R	94.1	Very high	93.2	Very high	80 Å²	80	69 Å²	69	30%	0.302	34%	0.338	S	S	.	.	H	α-helix	trans	-58.3	-27.4	175.8	-61.8	179	-177.5	-174.1	-2.7	113.2	W992 Y994 R995 D996 K1002	W992-R998 HydrophobicContact CD2-CG 4.07Å; W992-R998 HydrophobicContact CE3-CG 4Å; W992-R998 HydrophobicContact CH2-CB 4.37Å; W992-R998 HydrophobicContact CH2-CG 4.31Å; W992-R998 HydrophobicContact CZ2-CG 4.34Å; W992-R998 HydrophobicContact CZ3-CB 4.31Å; W992-R998 HydrophobicContact CZ3-CG 4.13Å; W992-R998 PolarHBondContact O-NE 3.03Å; W992-R998 PolarHBondContact O-NH2 3.41Å; Y994-R998 PolarHBondContact O-N 3Å; R995-R998 WeakPolarHBondContact O-CB 3.47Å; R995-R998 PolarHBondContact O-N 3.34Å; D996-R998 VanDerWaalsContact C-N 3.26Å; D996-R998 PolarHBondContact O-N 2.9Å; R998-K1002 WeakPolarHBondContact O-CB 3.4Å; R998-K1002 VanDerWaalsContact O-CG 3.27Å; R998-K1002 WeakPolarHBondContact O-CG 3.34Å; R998-K1002 PolarHBondContact O-N 3.2Å
999	S	92	Very high	92.8	Very high	82 Å²	82	75.2 Å²	75.2	57%	0.573	37%	0.371	S	S	*	.	H	α-helix	trans	-67.6	-42.8	175.8	64.9	0	0	0	0	111.6	D996 L997 K1003	D996-S999 PolarHBondContact O-N 2.95Å; D996-S999 PolarHBondContact O-OG 3.19Å; L997-S999 PolarHBondContact O-N 3.46Å; L997-S999 VanDerWaalsContact O-N 3.13Å; S999-K1003 PolarHBondContact O-N 3.26Å
1000	I	91.6	Very high	92.5	Very high	59 Å²	59	75.1 Å²	75.1	30%	0.303	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-54.2	176.6	-53.4	176.1	0	0	0	109.1	L997 K1002 K1003 D1004	L997-I1000 HydrophobicContact CD2-CD1 3.98Å; L997-I1000 WeakPolarHBondContact O-CB 3.3Å; L997-I1000 PolarHBondContact O-N 2.91Å; I1000-K1002 PolarHBondContact O-N 3.17Å; I1000-K1002 VanDerWaalsContact O-N 3.12Å; I1000-K1003 WeakPolarHBondContact O-CA 3.45Å; I1000-K1003 VanDerWaalsContact O-CB 3.27Å; I1000-K1003 WeakPolarHBondContact O-CB 3.34Å; I1000-K1003 PolarHBondContact O-N 3.48Å; I1000-D1004 WeakPolarHBondContact CG2-OD2 3.4Å; I1000-D1004 PolarHBondContact O-N 3.33Å
1001	Y	94.4	Very high	92.2	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.008	37%	0.367	C	S	.	.	H	α-helix	trans	-54	-39.1	-179.9	-58.1	-22.7	0	0	0	113	A953 A957 I962 L991 W992 L997 D1004 G1005 W1006 F1011	A953-Y1001 PolarHBondContact O-OH 3.18Å; A957-Y1001 HydrophobicContact CB-CD1 4.37Å; A957-Y1001 HydrophobicContact CB-CE1 3.62Å; I962-Y1001 HydrophobicContact CD1-CD1 3.82Å; I962-Y1001 HydrophobicContact CD1-CE1 3.78Å; I962-Y1001 HydrophobicContact CD1-CG 4.48Å; L991-Y1001 HydrophobicContact CB-CE2 4.15Å; W992-Y1001 HydrophobicContact CE3-CD2 4.07Å; W992-Y1001 HydrophobicContact CZ3-CD2 4.29Å; L997-Y1001 HydrophobicContact CB-CD2 4.37Å; L997-Y1001 HydrophobicContact CB-CE1 4.03Å; L997-Y1001 HydrophobicContact CB-CE2 3.76Å; L997-Y1001 VanDerWaalsContact CD1-OH 3.31Å; L997-Y1001 WeakPolarHBondContact CD1-OH 3.5Å; L997-Y1001 VanDerWaalsContact O-CG 3.26Å; L997-Y1001 PolarHBondContact O-N 3.21Å; Y1001-D1004 CarbonylContact O-C 3.59Å; Y1001-D1004 PolarHBondContact O-N 3.5Å; Y1001-G1005 PolarHBondContact O-N 2.91Å; Y1001-W1006 WeakPolarHBondContact O-CA 3.49Å; Y1001-W1006 WeakPolarHBondContact O-CB 3.49Å; Y1001-W1006 PolarHBondContact O-N 3.23Å; Y1001-F1011 HydrophobicContact CD1-CZ 4.48Å; Y1001-F1011 HydrophobicContact CD2-CE1 4.17Å; Y1001-F1011 HydrophobicContact CD2-CE2 4.09Å; Y1001-F1011 AromaticContact CD2-CZ 3.6Å; Y1001-F1011 HydrophobicContact CD2-CZ 3.6Å; Y1001-F1011 HydrophobicContact CE2-CE1 4.25Å; Y1001-F1011 HydrophobicContact CE2-CZ 4.14Å; Y1001-F1011 HydrophobicContact CG-CE2 4.33Å; Y1001-F1011 AromaticContact CG-CZ 3.79Å; Y1001-F1011 HydrophobicContact CG-CZ 3.79Å
1002	K	92.9	Very high	91.5	Very high	140 Å²	140	78 Å²	78	61%	0.609	38%	0.383	S	S	*	.	H	α-helix	trans	-68.7	-36.4	175.3	-78.1	178.6	175.7	-170.1	0	113.7	R998 I1000 D1004 G1005 W1006	R998-K1002 WeakPolarHBondContact O-CB 3.4Å; R998-K1002 VanDerWaalsContact O-CG 3.27Å; R998-K1002 WeakPolarHBondContact O-CG 3.34Å; R998-K1002 PolarHBondContact O-N 3.2Å; I1000-K1002 PolarHBondContact O-N 3.17Å; I1000-K1002 VanDerWaalsContact O-N 3.12Å; K1002-D1004 PolarHBondContact O-N 3.2Å; K1002-G1005 PolarHBondContact O-N 2.95Å; K1002-W1006 WeakPolarHBondContact CA-O 3.3Å
1003	K	92.2	Very high	90.4	Very high	181 Å²	181	78.8 Å²	78.8	79%	0.787	39%	0.389	S	S	*	.	H	α-helix	trans	-62.8	-36.6	173.8	-172.4	-165.7	173.5	-163.3	0	110.7	S999 I1000 G1005	S999-K1003 PolarHBondContact O-N 3.26Å; I1000-K1003 WeakPolarHBondContact O-CA 3.45Å; I1000-K1003 VanDerWaalsContact O-CB 3.27Å; I1000-K1003 WeakPolarHBondContact O-CB 3.34Å; I1000-K1003 PolarHBondContact O-N 3.48Å; K1003-G1005 PolarHBondContact O-N 3.07Å
1004	D	90.7	Very high	88.8	Confident	88 Å²	88	75.6 Å²	75.6	47%	0.471	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	16	179.3	-48.3	-30.5	0	0	0	112.7	I1000 Y1001 K1002 W1006	I1000-D1004 WeakPolarHBondContact CG2-OD2 3.4Å; I1000-D1004 PolarHBondContact O-N 3.33Å; Y1001-D1004 CarbonylContact O-C 3.59Å; Y1001-D1004 PolarHBondContact O-N 3.5Å; K1002-D1004 PolarHBondContact O-N 3.2Å; D1004-W1006 VanDerWaalsContact O-CD1 3.31Å; D1004-W1006 PolarHBondContact O-NE1 3.05Å
1005	G	91.4	Very high	86.8	Confident	57 Å²	57	76.6 Å²	76.6	59%	0.588	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-2.5	173.6	0	0	0	0	0	116.5	Y1001 K1002 K1003	Y1001-G1005 PolarHBondContact O-N 2.91Å; K1002-G1005 PolarHBondContact O-N 2.95Å; K1003-G1005 PolarHBondContact O-N 3.07Å
1006	W	92.6	Very high	84.6	Confident	52 Å²	52	70.9 Å²	70.9	20%	0.197	38%	0.381	C	S	.	.			trans	-85.8	135	-176.6	-52.7	93.1	0	0	0	112.9	I962 E963 V966 Y1001 K1002 D1004 H1010 F1011	I962-W1006 HydrophobicContact CG2-CD2 3.53Å; I962-W1006 HydrophobicContact CG2-CE3 3.61Å; I962-W1006 HydrophobicContact CG2-CG 4.07Å; I962-W1006 HydrophobicContact CG2-CH2 4.29Å; I962-W1006 HydrophobicContact CG2-CZ2 4.16Å; I962-W1006 HydrophobicContact CG2-CZ3 4.01Å; E963-W1006 HydrophobicContact CB-CH2 3.9Å; E963-W1006 HydrophobicContact CB-CZ2 4.05Å; E963-W1006 HydrophobicContact CG-CH2 4.08Å; E963-W1006 HydrophobicContact CG-CZ2 4.5Å; V966-W1006 HydrophobicContact CB-CZ3 4.01Å; V966-W1006 HydrophobicContact CG1-CZ3 4.05Å; V966-W1006 HydrophobicContact CG2-CE3 4.18Å; V966-W1006 HydrophobicContact CG2-CZ3 3.88Å; Y1001-W1006 WeakPolarHBondContact O-CA 3.49Å; Y1001-W1006 WeakPolarHBondContact O-CB 3.49Å; Y1001-W1006 PolarHBondContact O-N 3.23Å; K1002-W1006 WeakPolarHBondContact CA-O 3.3Å; D1004-W1006 VanDerWaalsContact O-CD1 3.31Å; D1004-W1006 PolarHBondContact O-NE1 3.05Å; W1006-H1010 HydrophobicContact CE3-CB 4.03Å; W1006-H1010 AromaticContact CE3-ND1 3.34Å; W1006-H1010 VanDerWaalsContact CE3-ND1 3.34Å; W1006-H1010 AromaticContact CZ3-ND1 3.83Å; W1006-F1011 HydrophobicContact CB-CE2 3.56Å; W1006-F1011 HydrophobicContact CB-CZ 3.94Å; W1006-F1011 HydrophobicContact CG-CE2 4.43Å; W1006-F1011 HydrophobicContact CG-CZ 4.39Å
1007	N	89.2	Confident	82.4	Confident	62 Å²	62	68.3 Å²	68.3	33%	0.332	37%	0.369	S	S	.	.			trans	-116.9	168.7	-179.5	66.8	67.8	0	0	0	111.6	N1009 H1010 F1011	N1007-N1009 PolarHBondContact O-N 3.09Å; N1007-N1009 VanDerWaalsContact O-N 3.16Å; N1007-N1009 WeakPolarHBondContact OD1-CA 3.31Å; N1007-N1009 VanDerWaalsContact OD1-CB 3.31Å; N1007-N1009 WeakPolarHBondContact OD1-CB 3.46Å; N1007-N1009 PolarHBondContact OD1-N 3.17Å; N1007-H1010 PolarHBondContact ND2-CE1 3.24Å; N1007-H1010 VanDerWaalsContact ND2-CE1 3.28Å; N1007-H1010 PolarHBondContact ND2-NE2 2.91Å; N1007-H1010 WeakPolarHBondContact O-CB 3.35Å; N1007-H1010 PolarHBondContact O-N 3.39Å; N1007-H1010 PolarHBondContact OD1-N 2.96Å; N1007-F1011 WeakPolarHBondContact O-CD2 3.34Å
1008	Q	88.8	Confident	80.3	Confident	98 Å²	98	69.2 Å²	69.2	46%	0.458	37%	0.374	S	S	.	.	H	α-helix	trans	-56.2	-34.1	-176.5	-176.7	160.7	-47.2	0	0	113.7	W992 H1010 F1011 I1012	W992-Q1008 HydrophobicContact CH2-CB 4.32Å; W992-Q1008 HydrophobicContact CZ2-CB 3.61Å; W992-Q1008 HydrophobicContact CZ2-CG 4.08Å; Q1008-H1010 PolarHBondContact O-N 3Å; Q1008-F1011 PolarHBondContact O-N 2.89Å; Q1008-I1012 HydrophobicContact CG-CD1 3.61Å; Q1008-I1012 HydrophobicContact CG-CG1 3.99Å; Q1008-I1012 PolarHBondContact O-N 3.1Å
1009	N	87.1	Confident	78	Confident	130 Å²	130	70 Å²	70	70%	0.695	38%	0.381	S	S	*	.	H	α-helix	trans	-73.8	-18	-177.3	-52.9	-11	0	0	0	112.1	N1007	N1007-N1009 PolarHBondContact O-N 3.09Å; N1007-N1009 VanDerWaalsContact O-N 3.16Å; N1007-N1009 WeakPolarHBondContact OD1-CA 3.31Å; N1007-N1009 VanDerWaalsContact OD1-CB 3.31Å; N1007-N1009 WeakPolarHBondContact OD1-CB 3.46Å; N1007-N1009 PolarHBondContact OD1-N 3.17Å
1010	H	88.4	Confident	75.5	Confident	42 Å²	42	74.3 Å²	74.3	19%	0.194	38%	0.384	C	S	.	.	H	α-helix	trans	-75.8	-30.9	171.2	-65.4	175.4	0	0	0	112	V966 K970 W1006 N1007 Q1008	V966-H1010 HydrophobicContact CG1-CB 4.44Å; V966-H1010 HydrophobicContact CG2-CB 4.1Å; K970-H1010 PolarHBondContact NZ-CD2 3.25Å; K970-H1010 PolarHBondContact NZ-NE2 2.94Å; K970-H1010 VanDerWaalsContact NZ-NE2 3.17Å; W1006-H1010 HydrophobicContact CE3-CB 4.03Å; W1006-H1010 AromaticContact CE3-ND1 3.34Å; W1006-H1010 VanDerWaalsContact CE3-ND1 3.34Å; W1006-H1010 AromaticContact CZ3-ND1 3.83Å; N1007-H1010 PolarHBondContact ND2-CE1 3.24Å; N1007-H1010 VanDerWaalsContact ND2-CE1 3.28Å; N1007-H1010 PolarHBondContact ND2-NE2 2.91Å; N1007-H1010 WeakPolarHBondContact O-CB 3.35Å; N1007-H1010 PolarHBondContact O-N 3.39Å; N1007-H1010 PolarHBondContact OD1-N 2.96Å; Q1008-H1010 PolarHBondContact O-N 3Å
1011	F	88.8	Confident	73	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-95.5	-40	-178.6	-63.5	-88.1	0	0	0	114	I962 L988 L991 W992 Y1001 W1006 N1007 Q1008 T1013	I962-F1011 HydrophobicContact CD1-CE1 4.06Å; I962-F1011 HydrophobicContact CD1-CZ 3.97Å; I962-F1011 HydrophobicContact CG1-CE1 4.1Å; I962-F1011 HydrophobicContact CG1-CZ 4.43Å; I962-F1011 HydrophobicContact CG2-CE1 3.93Å; I962-F1011 HydrophobicContact CG2-CZ 3.96Å; L988-F1011 HydrophobicContact CB-CB 4.48Å; L988-F1011 HydrophobicContact CB-CD1 4.28Å; L988-F1011 WeakPolarHBondContact CB-O 3.35Å; L988-F1011 HydrophobicContact CD2-CD1 3.77Å; L988-F1011 HydrophobicContact CD2-CE1 4.15Å; L988-F1011 WeakPolarHBondContact O-CD1 3.4Å; L991-F1011 HydrophobicContact CB-CD1 4.15Å; L991-F1011 HydrophobicContact CB-CE1 4.05Å; L991-F1011 HydrophobicContact CD1-CE1 4.16Å; W992-F1011 HydrophobicContact CB-CB 3.66Å; W992-F1011 HydrophobicContact CB-CD1 4.39Å; W992-F1011 HydrophobicContact CB-CG 4.01Å; W992-F1011 HydrophobicContact CD2-CB 4.23Å; W992-F1011 AromaticContact CD2-CD2 3.94Å; W992-F1011 HydrophobicContact CD2-CD2 3.94Å; W992-F1011 HydrophobicContact CD2-CG 4.23Å; W992-F1011 HydrophobicContact CE3-CB 4.27Å; W992-F1011 AromaticContact CE3-CD2 3.16Å; W992-F1011 HydrophobicContact CE3-CD2 3.16Å; W992-F1011 AromaticContact CE3-CE2 3.44Å; W992-F1011 HydrophobicContact CE3-CE2 3.44Å; W992-F1011 VanDerWaalsContact CE3-CE2 3.44Å; W992-F1011 AromaticContact CE3-CG 3.76Å; W992-F1011 HydrophobicContact CE3-CG 3.76Å; W992-F1011 HydrophobicContact CE3-CZ 4.24Å; W992-F1011 HydrophobicContact CG-CB 4.02Å; W992-F1011 HydrophobicContact CG-CG 4.37Å; W992-F1011 AromaticContact CZ3-CD2 3.57Å; W992-F1011 HydrophobicContact CZ3-CD2 3.57Å; W992-F1011 AromaticContact CZ3-CE2 3.54Å; W992-F1011 HydrophobicContact CZ3-CE2 3.54Å; Y1001-F1011 HydrophobicContact CD1-CZ 4.48Å; Y1001-F1011 HydrophobicContact CD2-CE1 4.17Å; Y1001-F1011 HydrophobicContact CD2-CE2 4.09Å; Y1001-F1011 AromaticContact CD2-CZ 3.6Å; Y1001-F1011 HydrophobicContact CD2-CZ 3.6Å; Y1001-F1011 HydrophobicContact CE2-CE1 4.25Å; Y1001-F1011 HydrophobicContact CE2-CZ 4.14Å; Y1001-F1011 HydrophobicContact CG-CE2 4.33Å; Y1001-F1011 AromaticContact CG-CZ 3.79Å; Y1001-F1011 HydrophobicContact CG-CZ 3.79Å; W1006-F1011 HydrophobicContact CB-CE2 3.56Å; W1006-F1011 HydrophobicContact CB-CZ 3.94Å; W1006-F1011 HydrophobicContact CG-CE2 4.43Å; W1006-F1011 HydrophobicContact CG-CZ 4.39Å; N1007-F1011 WeakPolarHBondContact O-CD2 3.34Å; Q1008-F1011 PolarHBondContact O-N 2.89Å; F1011-T1013 PolarHBondContact O-N 3.08Å
1012	I	81.4	Confident	70.5	Confident	68 Å²	68	83.4 Å²	83.4	35%	0.349	42%	0.42	S	S	.	.			trans	-93.1	80.6	-178.1	-51.4	-173.4	0	0	0	109.2	Q1008 P1014	Q1008-I1012 HydrophobicContact CG-CD1 3.61Å; Q1008-I1012 HydrophobicContact CG-CG1 3.99Å; Q1008-I1012 PolarHBondContact O-N 3.1Å; I1012-P1014 WeakPolarHBondContact O-CD 3.45Å
1013	T	70.9	Confident	67.7	Low	24 Å²	24	85.4 Å²	85.4	15%	0.147	43%	0.429	C	S	.	.			trans	-77.7	117.5	162.8	-53.6	0	0	0	0	108.9	F1011 V1015	F1011-T1013 PolarHBondContact O-N 3.08Å; T1013-V1015 PolarHBondContact O-N 3.14Å
1014	P	58.9	Low	65.1	Low	67 Å²	67	84.9 Å²	84.9	44%	0.435	43%	0.427	S	S	.	.			trans	-72	97.2	177.6	28.2	-33.1	0	0	0	110.5	I1012 S1016 T1017	I1012-P1014 WeakPolarHBondContact O-CD 3.45Å; P1014-S1016 PolarHBondContact O-N 3.37Å; P1014-T1017 HydrophobicContact CB-CG2 4.2Å; P1014-T1017 HydrophobicContact CG-CG2 4.09Å; P1014-T1017 PolarHBondContact O-N 3.18Å; P1014-T1017 PolarHBondContact O-OG1 3.07Å; P1014-T1017 VanDerWaalsContact O-OG1 3.1Å
1015	V	54.6	Low	62.4	Low	57 Å²	57	85.4 Å²	85.4	35%	0.345	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.7	-179.1	177.5	0	0	0	0	112.6	K982 A985 T1013 T1017	K982-V1015 HydrophobicContact CD-CG1 4.12Å; K982-V1015 HydrophobicContact CG-CG1 3.93Å; A985-V1015 HydrophobicContact CB-CG2 4.32Å; T1013-V1015 PolarHBondContact O-N 3.14Å; V1015-T1017 PolarHBondContact O-N 2.69Å
1016	S	47.9	Very low	59.3	Low	84 Å²	84	90.8 Å²	90.8	59%	0.587	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-1.5	178.7	54.7	0	0	0	0	116.1	P1014 R1020	P1014-S1016 PolarHBondContact O-N 3.37Å; S1016-R1020 PolarHBondContact O-NH1 2.73Å
1017	T	48	Very low	56.7	Low	52 Å²	52	94.7 Å²	94.7	32%	0.319	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-22.7	168.9	65	0	0	0	0	113.1	P1014 V1015 E1019 R1020 D1021	P1014-T1017 HydrophobicContact CB-CG2 4.2Å; P1014-T1017 HydrophobicContact CG-CG2 4.09Å; P1014-T1017 PolarHBondContact O-N 3.18Å; P1014-T1017 PolarHBondContact O-OG1 3.07Å; P1014-T1017 VanDerWaalsContact O-OG1 3.1Å; V1015-T1017 PolarHBondContact O-N 2.69Å; T1017-E1019 PolarHBondContact O-N 3.02Å; T1017-R1020 PolarHBondContact O-N 3.33Å; T1017-D1021 PolarHBondContact O-N 3.15Å
1018	L	50.3	Low	53.9	Low	28 Å²	28	97.3 Å²	97.3	15%	0.147	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.6	-179.7	-66.8	172.6	0	0	0	113.5	L978 V981	L978-L1018 HydrophobicContact CD1-CB 4.02Å; L978-L1018 HydrophobicContact CD1-CD1 3.89Å; L978-L1018 HydrophobicContact CD1-CG 4.5Å; V981-L1018 HydrophobicContact CG1-CD1 3.9Å
1019	E	45.3	Very low	51	Low	96 Å²	96	100.5 Å²	100.5	45%	0.449	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-15.6	176.3	-69.4	174.5	-159.8	0	0	113.5	K982 T1017	K982-E1019 IonicContact NZ-OE1 2.77Å; K982-E1019 PolarHBondContact NZ-OE1 3.13Å; T1017-E1019 PolarHBondContact O-N 3.02Å
1020	R	39.9	Very low	48.1	Very low	173 Å²	173	99.7 Å²	99.7	65%	0.653	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-34.4	175.1	-77.5	-173.6	171.2	89.1	-6.7	113.3	S1016 T1017 R1022 F1023	S1016-R1020 PolarHBondContact O-NH1 2.73Å; T1017-R1020 PolarHBondContact O-N 3.33Å; R1020-R1022 PolarHBondContact O-N 3.37Å; R1020-R1022 VanDerWaalsContact O-N 3.09Å; R1020-F1023 PolarHBondContact O-N 3.04Å; R1020-F1023 VanDerWaalsContact O-N 3.12Å
1021	D	39.1	Very low	45.3	Very low	67 Å²	67	104.5 Å²	104.5	36%	0.358	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-64.8	-16.3	-175.5	-70.8	-29	0	0	0	113	R972 T1017 F1023	R972-D1021 IonicContact CZ-OD2 3.66Å; R972-D1021 IonicContact NH1-OD2 3.87Å; R972-D1021 PolarHBondContact NH1-OD2 2.99Å; R972-D1021 IonicContact NH2-OD2 3.3Å; T1017-D1021 PolarHBondContact O-N 3.15Å; D1021-F1023 PolarHBondContact O-N 3.45Å
1022	R	42.6	Very low	42.4	Very low	186 Å²	186	111 Å²	111	70%	0.702	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-68.6	-12.8	173.8	-121.4	-166.8	-58.7	-172.8	4.5	115	R1020	R1020-R1022 PolarHBondContact O-N 3.37Å; R1020-R1022 VanDerWaalsContact O-N 3.09Å
1023	F	34.5	Very low	40	Very low	181 Å²	181	114.9 Å²	114.9	79%	0.794	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-106.6	11	-177.1	-71.1	-78.8	0	0	0	114.2	R1020 D1021	R1020-F1023 PolarHBondContact O-N 3.04Å; R1020-F1023 VanDerWaalsContact O-N 3.12Å; D1021-F1023 PolarHBondContact O-N 3.45Å
1024	K	37.8	Very low	38	Very low	170 Å²	170	123 Å²	123	74%	0.739	66%	0.656	S	S	*	*			trans	-98	0.2	179.2	-76.5	-175.2	172.4	177.7	0	115.1	H1026	K1024-H1026 PolarHBondContact O-N 2.97Å
1025	S	32.1	Very low	36.6	Very low	100 Å²	100	128.6 Å²	128.6	70%	0.699	68%	0.677	S	S	*	*			trans	-97.4	59.4	-178	59	0	0	0	0	113.1
1026	H	27.7	Very low	35.1	Very low	169 Å²	169	134.8 Å²	134.8	78%	0.782	70%	0.704	S	S	*	*			trans	-126.8	127.9	160.8	-81.9	-68	0	0	0	109	K1024	K1024-H1026 PolarHBondContact O-N 2.97Å
1027	P	38.3	Very low	34.2	Very low	134 Å²	134	136.2 Å²	136.2	87%	0.87	71%	0.714	S	S	*	*			trans	-83.3	127.4	-178.8	31.8	-32.7	0	0	0	111.7
1028	S	29.7	Very low	33.9	Very low	117 Å²	117	139 Å²	139	82%	0.818	73%	0.732	S	S	*	*			trans	-134.7	98.9	170.6	61.9	0	0	0	0	111.2
1029	L	28.3	Very low	32.8	Very low	165 Å²	165	144.5 Å²	144.5	86%	0.864	76%	0.761	S	S	*	*			trans	-0.7	119.4	166.5	-63.7	164.4	0	0	0	119.7
1030	S	25.3	Very low	32	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	78%	0.775	S	S	*	*			trans	21.7	120.9	135.7	-49.8	0	0	0	0	121.5
1031	T	29.5	Very low	31.5	Very low	144 Å²	144	147.4 Å²	147.4	88%	0.883	79%	0.785	S	S	*	*			trans	-132.7	150.2	141.4	53	0	0	0	0	110.3
1032	T	28.9	Very low	30.9	Very low	136 Å²	136	149.1 Å²	149.1	83%	0.834	80%	0.802	S	S	*	*			trans	-83.3	159.6	-158.6	-47.7	0	0	0	0	115.5
1033	N	30.7	Very low	30.3	Very low	149 Å²	149	147.3 Å²	147.3	80%	0.797	81%	0.811	S	S	*	*			trans	-51.2	149	173.3	-57.9	-62.5	0	0	0	114.7
1034	Q	28.8	Very low	30.1	Very low	195 Å²	195	142 Å²	142	91%	0.911	81%	0.808	S	S	*	*				-160.5	173.9	119.7	-110.4	173.7	24.5	0	0	112.6
1035	Q	28.9	Very low	29.8	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	81%	0.809	S	S	*	*			trans	-88.2	146.2	-165.4	-58.1	165.1	-51.4	0	0	113.3
1036	M	24.1	Very low	29.8	Very low	187 Å²	187	140.8 Å²	140.8	92%	0.921	82%	0.815	S	S	*	*				-175.8	138.9	115.7	-103.1	-174.4	173.2	0	0	112.4
1037	S	28.8	Very low	29.9	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	81%	0.811	S	S	*	*			trans	-90.4	152.8	157	-54.3	0	0	0	0	108.1
1038	P	42.2	Very low	29.5	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	81%	0.808	S	S	*	*				-154.7	152.1	92.8	39.3	-20.7	0	0	0	118.4
1039	I	25.9	Very low	29.5	Very low	145 Å²	145	136 Å²	136	74%	0.744	80%	0.804	S	S	*	*			trans	70.7	110	132.3	-66.9	171.8	0	0	0	122.5
1040	I	29.9	Very low	30.3	Very low	144 Å²	144	133.9 Å²	133.9	74%	0.738	80%	0.8	S	S	*	*				39.9	138.8	127.6	-30.5	173.1	0	0	0	121.5
1041	Q	27.8	Very low	30.5	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	79%	0.793	S	S	*	*			trans	109.3	151.7	150.3	-57.4	-172.2	17.9	0	0	116.4
1042	S	28.1	Very low	30.5	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	79%	0.788	S	S	*	*			cis	176.6	166	-46.6	-174.6	0	0	0	0	107.7
1043	V	29.6	Very low	30.4	Very low	149 Å²	149	134.1 Å²	134.1	90%	0.903	79%	0.791	S	S	*	*			trans	69.5	149.1	166.5	-157.3	0	0	0	0	116.6
1044	G	30.5	Very low	30.3	Very low	69 Å²	69	130.7 Å²	130.7	71%	0.711	79%	0.79	S	S	*	*			trans	141	104.6	167.8	0	0	0	0	0	113.4
1045	S	31.3	Very low	30.5	Very low	109 Å²	109	129.3 Å²	129.3	76%	0.762	79%	0.788	S	S	*	*			trans	-136.5	171.2	-178.5	-71.6	0	0	0	0	111.6
1046	T	32	Very low	30.5	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	79%	0.79	S	S	*	*			trans	69.3	164.5	177	88.6	0	0	0	0	113.6
1047	S	29.8	Very low	30.8	Very low	102 Å²	102	130.5 Å²	130.5	71%	0.713	79%	0.785	S	S	*	*			cis	-170	158.3	-2.7	20.5	0	0	0	0	107.8
1048	S	29.1	Very low	31.4	Very low	113 Å²	113	130 Å²	130	79%	0.79	78%	0.78	S	S	*	*			cis	-168.2	173.3	-13.4	55	0	0	0	0	110.5
1049	S	29.3	Very low	30.7	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	79%	0.788	S	S	*	*			trans	-65.5	172.7	163.6	-48.7	0	0	0	0	111.5
1050	P	45.4	Very low	30.8	Very low	121 Å²	121	134 Å²	134	79%	0.786	79%	0.787	S	S	*	*			cis	-156	-177	26.5	45.6	-23.1	0	0	0	120.9
1051	A	30.5	Very low	30.6	Very low	77 Å²	77	135.3 Å²	135.3	64%	0.636	79%	0.79	S	S	*	*			trans	82.5	121.2	132.1	0	0	0	0	0	125
1052	L	29.1	Very low	30.6	Very low	152 Å²	152	136.1 Å²	136.1	80%	0.796	79%	0.787	S	S	*	*				82.3	114.1	127.7	-64.4	169.3	0	0	0	123.3
1053	L	27.5	Very low	30.6	Very low	168 Å²	168	137.1 Å²	137.1	88%	0.88	78%	0.784	S	S	*	*			trans	64.7	130	131.4	-59.9	175.1	0	0	0	122.2
1054	G	27.7	Very low	30.6	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	78%	0.78	S	S	*	*			trans	178.2	117.2	157.6	0	0	0	0	0	112.1
1055	I	32.7	Very low	30.6	Very low	167 Å²	167	144 Å²	144	86%	0.856	79%	0.789	S	S	*	*			trans	-107.2	126.5	177.9	-60.8	172.5	0	0	0	109.4
1056	R	30.4	Very low	30.4	Very low	243 Å²	243	147.4 Å²	147.4	92%	0.917	79%	0.793	S	S	*	*			trans	172.6	123.1	140.1	-99.8	163.7	-178.6	-172.4	-0.2	114.1
1057	D	28.5	Very low	31.8	Very low	153 Å²	153	146.2 Å²	146.2	82%	0.818	79%	0.787	S	S	*	*			trans	-69.6	169.8	145.1	-67.1	-65.4	0	0	0	110
1058	P	41.7	Very low	32.5	Very low	104 Å²	104	146.5 Å²	146.5	68%	0.675	79%	0.787	S	S	*	*			cis	-148.6	-170.4	25.9	42.7	-21	0	0	0	118.2
1059	R	27.8	Very low	32.4	Very low	233 Å²	233	148.3 Å²	148.3	88%	0.879	78%	0.784	S	S	*	*			trans	77.6	130.9	170.4	-56.9	166.8	-177.6	170.6	-1.4	114.2
1060	S	28.4	Very low	32.3	Very low	105 Å²	105	150.7 Å²	150.7	73%	0.734	78%	0.784	S	S	*	*			cis	81.9	98.5	31.3	-168.9	0	0	0	0	114.5
1061	E	25.1	Very low	31.5	Very low	171 Å²	171	155.7 Å²	155.7	80%	0.799	79%	0.789	S	S	*	*				-177.1	-178.4	114.3	-97.1	178.9	162.3	0	0	112.9
1062	Y	28.8	Very low	31.5	Very low	204 Å²	204	161.8 Å²	161.8	80%	0.8	80%	0.797	S	S	*	*			trans	-41.5	168.1	178.5	-69.5	-100.8	0	0	0	117.4
1063	D	27.7	Very low	31.5	Very low	123 Å²	123	161.6 Å²	161.6	66%	0.658	80%	0.796	S	S	*	*			cis	-144.6	150.5	11.7	-113.3	-39.1	0	0	0	108
1064	R	28.4	Very low	31.5	Very low	216 Å²	216	158.5 Å²	158.5	82%	0.815	79%	0.789	S	S	*	*				57.6	99	72.8	-165.6	-166.2	-176.7	177.8	1.1	116.6
1065	T	31	Very low	31.5	Very low	145 Å²	145	164.4 Å²	164.4	89%	0.89	80%	0.796	S	S	*	*			trans	-164.4	153.7	135.5	19	0	0	0	0	111.2
1066	Q	27.7	Very low	31.2	Very low	182 Å²	182	159.9 Å²	159.9	85%	0.85	79%	0.79	S	S	*	*			trans	-128.7	-165.9	172.5	-68.3	-169	-14.2	0	0	108.9
1067	P	61.2	Low	31.1	Very low	109 Å²	109	156.2 Å²	156.2	71%	0.708	79%	0.789	S	S	*	*				-112.5	-154	-76.1	36.4	-18.6	0	0	0	109.2
1068	P	43.7	Very low	31.3	Very low	108 Å²	108	152.7 Å²	152.7	70%	0.701	78%	0.781	S	S	*	*				-156.4	-170.9	73.4	42.1	-19.5	0	0	0	116.1
1069	M	26.8	Very low	30.9	Very low	151 Å²	151	153.3 Å²	153.3	74%	0.744	78%	0.783	S	S	*	*			trans	30.4	154.7	141.3	-65	-67.4	-154.4	0	0	121.7
1070	Q	28.5	Very low	31.3	Very low	156 Å²	156	149.7 Å²	149.7	73%	0.729	78%	0.776	S	S	*	*			cis	-157.8	138.2	12.4	-123.7	145.4	13.4	0	0	107.4
1071	Y	28.6	Very low	31.6	Very low	225 Å²	225	153.5 Å²	153.5	88%	0.882	78%	0.779	S	S	*	*				58.9	153.9	86	-96.7	-84.8	0	0	0	118.9
1072	Y	29.9	Very low	31.9	Very low	205 Å²	205	148.2 Å²	148.2	80%	0.804	77%	0.77	S	S	*	*			trans	-139.2	169.8	-146.1	-143.4	-86.6	0	0	0	113.4
1073	N	29.5	Very low	31.9	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	77%	0.769	S	S	*	*			trans	75.2	161	176.2	-60.9	-45.3	0	0	0	115.6
1074	S	27.1	Very low	32	Very low	104 Å²	104	149.6 Å²	149.6	73%	0.727	78%	0.777	S	S	*	*			cis	-160	148.4	20.1	56.4	0	0	0	0	115
1075	Q	27.8	Very low	32.8	Very low	200 Å²	200	145.2 Å²	145.2	94%	0.935	78%	0.776	S	S	*	*			trans	-171.3	139.7	147.7	-146.2	101.5	45.7	0	0	108.7
1076	G	26.3	Very low	32.7	Very low	72 Å²	72	142 Å²	142	74%	0.742	77%	0.772	S	S	*	*			cis	-139	-163.5	-18.8	0	0	0	0	0	108.3
1077	D	28.3	Very low	32.8	Very low	167 Å²	167	138.5 Å²	138.5	89%	0.893	77%	0.768	S	S	*	*			cis	-152	-172.6	0	-155.5	-15.3	0	0	0	109.9
1078	A	33.3	Very low	31.2	Very low	79 Å²	79	138.7 Å²	138.7	65%	0.653	77%	0.771	S	S	*	*			trans	-54.4	157.4	-168.4	0	0	0	0	0	116.7
1079	T	33.3	Very low	30.4	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	78%	0.778	S	S	*	*			cis	-155.4	145.3	44	45.3	0	0	0	0	115.1
1080	H	35.7	Very low	30.8	Very low	158 Å²	158	141.6 Å²	141.6	73%	0.731	78%	0.782	S	S	*	*			trans	50.4	131.6	154.4	-61.7	-38.8	0	0	0	120.7
1081	K	36	Very low	30.9	Very low	185 Å²	185	139.2 Å²	139.2	80%	0.804	78%	0.782	S	S	*	*			cis	-161.7	171.4	1.8	-86.7	146.3	-172.3	166.4	0	106
1082	G	30.6	Very low	31.6	Very low	59 Å²	59	133.7 Å²	133.7	61%	0.608	77%	0.774	S	S	*	*			cis	146	149.2	-0.3	0	0	0	0	0	111.3
1083	L	28	Very low	31.5	Very low	147 Å²	147	130.9 Å²	130.9	77%	0.77	77%	0.771	S	S	*	*			trans	70	158.9	176.9	-65.2	71.5	0	0	0	115.4
1084	Y	31.4	Very low	31.3	Very low	210 Å²	210	133.3 Å²	133.3	82%	0.824	77%	0.771	S	S	*	*			cis	-158.1	173.2	-27	-101.4	-15.5	0	0	0	111
1085	P	44.3	Very low	31.3	Very low	124 Å²	124	134.9 Å²	134.9	81%	0.805	77%	0.769	S	S	*	*			trans	-135.3	-177.5	-145.4	46.1	-32.2	0	0	0	119
1086	G	29.6	Very low	31	Very low	77 Å²	77	129.8 Å²	129.8	79%	0.794	76%	0.756	S	S	*	*			trans	114.9	163	151.1	0	0	0	0	0	117
1087	S	28.9	Very low	31	Very low	109 Å²	109	131.4 Å²	131.4	76%	0.762	76%	0.756	S	S	*	*			cis	-169.8	152.8	-15.7	-178.6	0	0	0	0	112.5
1088	S	28	Very low	30.8	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	75%	0.754	S	S	*	*			trans	65.6	153.2	147.6	44.3	0	0	0	0	124.4
1089	K	25.8	Very low	30.3	Very low	195 Å²	195	135.1 Å²	135.1	85%	0.848	76%	0.759	S	S	*	*			trans	-67.8	174.9	168.3	-62.6	177.7	-179.5	176.9	0	111.7
1090	P	36.4	Very low	30	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	76%	0.762	S	S	*	*			cis	-150	-168.7	26.6	42.3	-18.6	0	0	0	118.7
1091	S	29.1	Very low	30.3	Very low	105 Å²	105	133.2 Å²	133.2	73%	0.734	77%	0.765	S	S	*	*			trans	-72.5	-177.6	160.4	-34.5	0	0	0	0	111.6
1092	P	44.8	Very low	29.8	Very low	109 Å²	109	128.4 Å²	128.4	71%	0.708	76%	0.76	S	S	*	*			cis	-154.2	-174	22.2	43.5	-19.8	0	0	0	119.8
1093	I	28.3	Very low	29.7	Very low	147 Å²	147	135.7 Å²	135.7	75%	0.754	77%	0.769	S	S	*	*			trans	69.5	124.7	136.6	-80.8	162.9	0	0	0	124.3
1094	Y	25.2	Very low	29.5	Very low	199 Å²	199	134.8 Å²	134.8	78%	0.78	76%	0.761	S	S	*	*			trans	82.7	130.7	140.8	-93.4	-141.7	0	0	0	127.4
1095	I	25.2	Very low	29.3	Very low	136 Å²	136	132.6 Å²	132.6	70%	0.697	76%	0.758	S	S	*	*			trans	73.8	120.6	134.2	-79.5	-173.4	0	0	0	124.1
1096	S	23.4	Very low	28.4	Very low	93 Å²	93	134 Å²	134	65%	0.65	76%	0.759	S	S	*	*			trans	42.9	128	139.2	-162.2	0	0	0	0	122.2
1097	S	24.9	Very low	28.3	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	76%	0.761	S	S	*	*				177.3	141	93.4	-71.3	0	0	0	0	116.1
1098	Y	24	Very low	28.2	Very low	215 Å²	215	144.3 Å²	144.3	84%	0.843	76%	0.757	S	S	*	*			trans	7.6	148.7	153.1	-90.2	-89.4	0	0	0	125.2
1099	S	23.2	Very low	28.2	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	75%	0.752	S	S	*	*			trans	86.3	125.5	143.3	-65.4	0	0	0	0	121.9
1100	S	28.1	Very low	28.2	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	74%	0.741	S	S	*	*			trans	-79.3	172	157.4	-44.3	0	0	0	0	111.4
1101	P	40	Very low	27.7	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	73%	0.733	S	S	*	*				-150.3	137.1	100.1	36.1	-18.7	0	0	0	117.7
1102	A	26.9	Very low	27.4	Very low	85 Å²	85	144.4 Å²	144.4	70%	0.702	73%	0.729	S	S	*	*				53	151.4	127.9	0	0	0	0	0	124.9
1103	R	27.2	Very low	26.5	Very low	211 Å²	211	145.6 Å²	145.6	80%	0.796	73%	0.725	S	S	*	*			trans	76.7	146.6	156.1	-66.1	180	122.8	156.2	-3	117.9
1104	E	25.6	Very low	26.3	Very low	129 Å²	129	145.5 Å²	145.5	60%	0.603	73%	0.725	S	S	*	*			cis	-154.4	148.1	-6.7	-143.6	123.2	-146.2	0	0	113.3
1105	Q	25.5	Very low	26.2	Very low	164 Å²	164	144.4 Å²	144.4	77%	0.766	72%	0.721	S	S	*	*			trans	58.5	107.8	137.5	-164.6	162.9	-30.1	0	0	125.6
1106	N	26.2	Very low	26.1	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	72%	0.724	S	S	*	*			trans	26.8	124.7	135.4	-81.7	-69.3	0	0	0	123.6
1107	R	27.1	Very low	26.1	Very low	220 Å²	220	147.1 Å²	147.1	83%	0.83	72%	0.723	S	S	*	*				166.5	158.4	129.8	-97.8	-173.9	179.7	-163.8	3.1	110.7
1108	R	27.7	Very low	26	Very low	183 Å²	183	150.1 Å²	150.1	69%	0.691	73%	0.726	S	S	*	*			cis	-174.7	147.1	-24.1	-136.3	-169.4	-176.5	-164	2.8	108.4
1109	L	27.6	Very low	26.1	Very low	130 Å²	130	146.6 Å²	146.6	68%	0.681	72%	0.721	S	S	*	*			trans	65.7	164.8	159	-50.5	172	0	0	0	116.2
1110	Q	26.7	Very low	26.3	Very low	132 Å²	132	148.1 Å²	148.1	62%	0.617	72%	0.721	S	S	*	*			cis	-160.6	160.7	-20.7	-120.3	168.5	-54.3	0	0	111.7
1111	H	24.6	Very low	26.1	Very low	137 Å²	137	147.5 Å²	147.5	63%	0.634	72%	0.717	S	S	*	*			trans	66.9	142	153.1	-67.7	-31.6	0	0	0	119.5
1112	Q	24	Very low	25.2	Very low	140 Å²	140	148.1 Å²	148.1	65%	0.654	71%	0.713	S	S	*	*				70.5	138.1	54.3	-93.9	-177.7	-60.9	0	0	112.9
1113	Q	25	Very low	25.2	Very low	134 Å²	134	155 Å²	155	63%	0.626	72%	0.721	S	S	*	*			cis	-167.9	-168.5	-5.7	-153.2	173.3	2.9	0	0	109
1114	L	24.8	Very low	25	Very low	145 Å²	145	153.9 Å²	153.9	76%	0.759	72%	0.722	S	S	*	*			trans	77.5	157.9	156.5	-59.9	132.5	0	0	0	118.1
1115	Y	22.3	Very low	25	Very low	176 Å²	176	155.7 Å²	155.7	69%	0.69	74%	0.736	S	S	*	*			cis	-175.4	162.6	-41.3	-135.5	-79.8	0	0	0	109.3
1116	Y	23.7	Very low	24.8	Very low	196 Å²	196	157.4 Å²	157.4	77%	0.769	74%	0.741	S	S	*	*			trans	65	150.4	170.9	-76	-93.1	0	0	0	117.9
1117	S	22.6	Very low	24.8	Very low	90 Å²	90	157.8 Å²	157.8	63%	0.629	74%	0.743	S	S	*	*			cis	177.9	169.2	-36.3	-96.6	0	0	0	0	109.9
1118	Q	23.5	Very low	24.7	Very low	171 Å²	171	150.9 Å²	150.9	80%	0.799	73%	0.733	S	S	*	*			trans	77.2	141.4	149	-146.8	155.2	17	0	0	116.9
1119	D	25.2	Very low	24.6	Very low	141 Å²	141	153 Å²	153	75%	0.754	74%	0.742	S	S	*	*			cis	-179.7	165.1	-33.1	-91.1	-10.7	0	0	0	104.1
1120	D	27.3	Very low	24.5	Very low	139 Å²	139	158.6 Å²	158.6	74%	0.743	76%	0.755	S	S	*	*			cis	-168.6	157.5	-27.7	175.5	27.7	0	0	0	105.7
1121	S	23.7	Very low	24.3	Very low	98 Å²	98	160.3 Å²	160.3	69%	0.685	77%	0.767	S	S	*	*			trans	173.2	118.7	151.1	-89	0	0	0	0	115.8
1122	N	22.7	Very low	24.5	Very low	136 Å²	136	160.7 Å²	160.7	73%	0.727	76%	0.764	S	S	*	*			trans	49.7	107.7	141.9	-78.2	-63.2	0	0	0	119
1123	R	25.5	Very low	24.6	Very low	229 Å²	229	161.9 Å²	161.9	86%	0.864	77%	0.774	S	S	*	*				-163.5	132.7	61.9	-86.9	-175.5	171.8	-176.7	-1.1	114.2
1124	K	24.7	Very low	24.4	Very low	188 Å²	188	163.8 Å²	163.8	82%	0.817	78%	0.783	S	S	*	*			trans	31.2	90.7	133.7	-57.5	-177.4	-179.1	-177.9	0	117.8
1125	N	24.4	Very low	24.4	Very low	168 Å²	168	159.2 Å²	159.2	90%	0.898	76%	0.763	S	S	*	*			trans	-77.7	140.7	149.8	-87	-27	0	0	0	110.2
1126	F	22.6	Very low	24.8	Very low	200 Å²	200	155.9 Å²	155.9	88%	0.877	76%	0.763	S	S	*	*			trans	-99	120.8	162.5	-117.1	-88.2	0	0	0	107.4
1127	D	25	Very low	25	Very low	161 Å²	161	151.5 Å²	151.5	86%	0.861	75%	0.749	S	S	*	*			trans	-148.3	141.4	158	-136	-29.6	0	0	0	110.2
1128	A	25.6	Very low	25.2	Very low	74 Å²	74	152.9 Å²	152.9	61%	0.612	76%	0.759	S	S	*	*			trans	-129.6	85.1	-150.9	0	0	0	0	0	114.5
1129	Y	25.8	Very low	25.7	Very low	228 Å²	228	154.5 Å²	154.5	89%	0.894	76%	0.759	S	S	*	*			trans	-145	82.9	168.6	-87.2	-73	0	0	0	113.7
1130	R	25.2	Very low	25.7	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	76%	0.758	S	S	*	*			trans	-173.6	93.4	154	-94.6	-113.8	173.3	148.1	0.5	111.1
1131	L	23.1	Very low	25.6	Very low	168 Å²	168	156.3 Å²	156.3	88%	0.88	76%	0.764	S	S	*	*			trans	-151.2	79.6	167.6	-114.2	174.7	0	0	0	111.4
1132	Y	27.2	Very low	26.3	Very low	145 Å²	145	155.8 Å²	155.8	57%	0.569	76%	0.758	S	S	*	*			trans	-154	157	164.4	-114.8	-88.7	0	0	0	107.2	W1191	Y1132-W1191 HydrophobicContact CE2-CE3 4.18Å; Y1132-W1191 AromaticContact CE2-CZ3 3.82Å; Y1132-W1191 HydrophobicContact CE2-CZ3 3.82Å; Y1132-W1191 VanDerWaalsContact OH-CE3 3.31Å
1133	L	26.3	Very low	26.5	Very low	165 Å²	165	159.8 Å²	159.8	86%	0.864	76%	0.764	S	S	*	*			trans	70.4	79.4	-166.4	-60.9	156.3	0	0	0	114.1
1134	Q	21.8	Very low	26.6	Very low	173 Å²	173	158.1 Å²	158.1	81%	0.808	76%	0.764	S	S	*	*			trans	-101.4	96.8	159.6	-170.2	170	4.2	0	0	108.6
1135	S	24.7	Very low	26.6	Very low	50 Å²	50	154.9 Å²	154.9	35%	0.35	76%	0.756	S	S	.	*	P	Polyproline II helix	trans	-62.4	139.5	-177	-60.2	0	0	0	0	111.8	D646 H1137	D646-S1135 PolarHBondContact OD2-OG 2.9Å; S1135-H1137 PolarHBondContact O-N 3.26Å; S1135-H1137 PolarHBondContact O-ND1 2.94Å
1136	P	31.1	Very low	26.6	Very low	106 Å²	106	153.9 Å²	153.9	69%	0.688	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-63.8	129.2	-170.7	25.6	-34.8	0	0	0	111.2	S1138	P1136-S1138 PolarHBondContact O-N 2.89Å
1137	H	27.8	Very low	26.7	Very low	104 Å²	104	154 Å²	154	48%	0.481	75%	0.745	S	S	.	*	P	Polyproline II helix	trans	-78.6	117.8	179.2	-69.9	28.8	0	0	0	110	S1135	S1135-H1137 PolarHBondContact O-N 3.26Å; S1135-H1137 PolarHBondContact O-ND1 2.94Å
1138	S	25.6	Very low	26.7	Very low	118 Å²	118	152.2 Å²	152.2	83%	0.825	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-63.8	144.5	155.8	-56.7	0	0	0	0	109	P1136	P1136-S1138 PolarHBondContact O-N 2.89Å
1139	Y	34.8	Very low	26.7	Very low	206 Å²	206	157.1 Å²	157.1	81%	0.808	75%	0.749	S	S	*	*			trans	-116.4	139.4	-177.1	-151.6	-104.1	0	0	0	109.3
1140	E	25.3	Very low	26.6	Very low	155 Å²	155	155.5 Å²	155.5	72%	0.724	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-94.7	160.5	168.6	-68.3	-177.6	132.8	0	0	109.1
1141	D	25.7	Very low	26.7	Very low	162 Å²	162	149.5 Å²	149.5	87%	0.866	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.6	153.7	175.9	-96.3	-45.6	0	0	0	112.2
1142	P	36.9	Very low	26.8	Very low	88 Å²	88	146.3 Å²	146.3	57%	0.571	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-92.3	126.5	-163.1	34	-34.1	0	0	0	114
1143	Y	26.6	Very low	26.7	Very low	219 Å²	219	145.1 Å²	145.1	86%	0.859	75%	0.751	S	S	*	*			trans	-152.1	134.9	152.8	-98	-71.2	0	0	0	111.6
1144	F	28.8	Very low	26.7	Very low	194 Å²	194	143.6 Å²	143.6	85%	0.851	75%	0.749	S	S	*	*			trans	62.1	109.3	176.4	-64.9	-82.4	0	0	0	118.8
1145	D	25.1	Very low	26.9	Very low	121 Å²	121	141.9 Å²	141.9	65%	0.647	75%	0.746	S	S	*	*			trans	-109.9	133.6	145.9	178.8	25.8	0	0	0	106.1	R1147	D1145-R1147 IonicContact OD2-NE 2.9Å; D1145-R1147 PolarHBondContact OD2-NE 3.21Å; D1145-R1147 IonicContact OD2-NH2 3.24Å
1146	D	24.6	Very low	26.9	Very low	147 Å²	147	150.9 Å²	150.9	79%	0.786	77%	0.774	S	S	*	*			trans	-144.8	130.6	171.4	-161.7	0.4	0	0	0	109.7
1147	R	24.5	Very low	26.6	Very low	202 Å²	202	150.7 Å²	150.7	76%	0.762	78%	0.775	S	S	*	*			trans	-115	111.5	-159.5	-69.2	-175.8	178.3	-163	-1	112.3	D1145	D1145-R1147 IonicContact OD2-NE 2.9Å; D1145-R1147 PolarHBondContact OD2-NE 3.21Å; D1145-R1147 IonicContact OD2-NH2 3.24Å
1148	V	25.3	Very low	26.5	Very low	123 Å²	123	151.6 Å²	151.6	75%	0.745	79%	0.788	S	S	*	*			trans	-100.3	137	170.5	-174.7	0	0	0	0	110.8	F1150	V1148-F1150 HydrophobicContact CG1-CD2 4.03Å; V1148-F1150 HydrophobicContact CG1-CE2 4.33Å
1149	H	23.9	Very low	26.5	Very low	177 Å²	177	152.4 Å²	152.4	82%	0.819	78%	0.778	S	S	*	*			trans	-130.2	124.6	-179.1	-124.5	61.2	0	0	0	108.9
1150	F	24.8	Very low	26.1	Very low	195 Å²	195	152.2 Å²	152.2	86%	0.855	78%	0.778	S	S	*	*			trans	-150.7	162.9	170.7	-85.3	-56.8	0	0	0	110.4	V1148	V1148-F1150 HydrophobicContact CG1-CD2 4.03Å; V1148-F1150 HydrophobicContact CG1-CE2 4.33Å
1151	P	26	Very low	26.2	Very low	121 Å²	121	148.1 Å²	148.1	79%	0.786	78%	0.777	S	S	*	*			trans	-116	179.5	-136.4	40.8	-30	0	0	0	114.8
1152	A	25.5	Very low	26.1	Very low	102 Å²	102	148.4 Å²	148.4	84%	0.843	78%	0.778	S	S	*	*			trans	-85	160.4	-179.6	0	0	0	0	0	114
1153	S	25.5	Very low	25.6	Very low	120 Å²	120	153.4 Å²	153.4	84%	0.839	79%	0.79	S	S	*	*			trans	-140.5	175.5	168.1	59.1	0	0	0	0	110.7
1154	T	26.6	Very low	25.4	Very low	133 Å²	133	148.1 Å²	148.1	82%	0.816	79%	0.785	S	S	*	*			trans	-114.6	165.1	-135.4	-29.4	0	0	0	0	116.1
1155	D	24.9	Very low	25.2	Very low	137 Å²	137	145.7 Å²	145.7	73%	0.733	79%	0.787	S	S	*	*			trans	-66.1	163.4	-173.4	-44.6	-102.9	0	0	0	117.1
1156	Y	25.3	Very low	25.1	Very low	239 Å²	239	145.1 Å²	145.1	94%	0.937	79%	0.787	S	S	*	*			trans	-134.2	162.6	141.7	-104.2	-88.2	0	0	0	109.8
1157	S	25.3	Very low	25.1	Very low	102 Å²	102	145 Å²	145	71%	0.713	79%	0.787	S	S	*	*			trans	-145.6	-176.5	-155.8	-170.9	0	0	0	0	114.2
1158	T	25.8	Very low	25	Very low	123 Å²	123	145 Å²	145	76%	0.755	79%	0.788	S	S	*	*			trans	90.5	149.6	167	69.9	0	0	0	0	119.6
1159	Q	26	Very low	24.9	Very low	135 Å²	135	144.3 Å²	144.3	63%	0.631	78%	0.784	S	S	*	*			cis	-172.8	162.5	-30.4	-162	164.8	21.3	0	0	110.9
1160	Y	26.5	Very low	24.9	Very low	202 Å²	202	141.4 Å²	141.4	79%	0.792	78%	0.775	S	S	*	*			trans	71.2	149.9	170.2	-48.6	-78.6	0	0	0	118.4
1161	G	26	Very low	24.9	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	77%	0.766	S	S	*	*			cis	167.2	137.5	-15.8	0	0	0	0	0	118.1
1162	L	24.4	Very low	24.8	Very low	168 Å²	168	143.9 Å²	143.9	88%	0.88	77%	0.769	S	S	*	*			trans	81.9	145.3	146.1	-72.6	167.1	0	0	0	124.3
1163	K	25.5	Very low	24.7	Very low	193 Å²	193	143.2 Å²	143.2	84%	0.839	76%	0.758	S	S	*	*			trans	75.7	118.5	168.7	-62.4	169.5	-174.7	175.2	0	116.5
1164	S	23.7	Very low	24.7	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	75%	0.753	S	S	*	*			cis	96.2	111.9	21.3	-168.9	0	0	0	0	116.1
1165	T	24.9	Very low	24.6	Very low	144 Å²	144	146.6 Å²	146.6	88%	0.883	76%	0.756	S	S	*	*			trans	-159.3	161.7	139.2	14.3	0	0	0	0	109.5
1166	T	23.1	Very low	24.7	Very low	108 Å²	108	151.2 Å²	151.2	66%	0.663	76%	0.763	S	S	*	*			trans	-135.8	-179.2	-166.8	59.6	0	0	0	0	112.7
1167	N	24.1	Very low	24.6	Very low	144 Å²	144	145.7 Å²	145.7	77%	0.77	76%	0.757	S	S	*	*			trans	86.5	150	160.3	-55	-17.7	0	0	0	117.6
1168	Y	22.4	Very low	24.6	Very low	202 Å²	202	145.6 Å²	145.6	79%	0.792	76%	0.756	S	S	*	*			cis	-172.9	133.8	-24	-168.3	-119.5	0	0	0	110
1169	V	23.3	Very low	24.5	Very low	110 Å²	110	151.4 Å²	151.4	67%	0.667	77%	0.766	S	S	*	*			trans	48.5	148.5	146.2	166.8	0	0	0	0	121.4
1170	D	23.8	Very low	24.5	Very low	115 Å²	115	156.6 Å²	156.6	62%	0.615	78%	0.78	S	S	*	*			cis	162.2	164.9	-16.7	-156.8	-14	0	0	0	106.7
1171	F	23.6	Very low	24.5	Very low	154 Å²	154	151.5 Å²	151.5	68%	0.675	78%	0.779	S	S	*	*			trans	62.5	156.2	170.9	-63.1	-71.9	0	0	0	119.8
1172	Y	25.1	Very low	24.4	Very low	215 Å²	215	157.1 Å²	157.1	84%	0.843	79%	0.787	S	S	*	*			cis	-122.1	159.2	9.3	-79.3	-112.9	0	0	0	110.9
1173	S	23.9	Very low	24.4	Very low	87 Å²	87	158.4 Å²	158.4	61%	0.608	79%	0.789	S	S	*	*			cis	99.1	158.5	22.5	-163.9	0	0	0	0	116.2
1174	T	24	Very low	24.4	Very low	120 Å²	120	159.6 Å²	159.6	74%	0.736	79%	0.79	S	S	*	*			trans	86.3	145.2	-172.2	79.2	0	0	0	0	116.4
1175	K	25.5	Very low	24.7	Very low	204 Å²	204	160.1 Å²	160.1	89%	0.887	79%	0.79	S	S	*	*			cis	-130.3	169.6	5.4	-71.6	-178.3	-180	176.7	0	112.8
1176	R	26.1	Very low	24.7	Very low	234 Å²	234	157.2 Å²	157.2	88%	0.883	79%	0.789	S	S	*	*			trans	-140.7	149.4	177.1	-147.7	-172.8	-160.5	-169.3	7.6	110.4
1177	P	24.5	Very low	24.9	Very low	123 Å²	123	156.4 Å²	156.4	80%	0.799	79%	0.788	S	S	*	*			trans	-128.3	136.2	131.8	35.1	-26.6	0	0	0	110.1
1178	S	24.2	Very low	25.1	Very low	100 Å²	100	155.2 Å²	155.2	70%	0.699	79%	0.787	S	S	*	*			cis	92	77.4	37.5	-172.1	0	0	0	0	114.1
1179	Y	25.1	Very low	25.3	Very low	245 Å²	245	151.4 Å²	151.4	96%	0.961	78%	0.781	S	S	*	*			trans	-120.2	152.9	145	-102.7	-93.3	0	0	0	109.2
1180	R	23.9	Very low	25.4	Very low	244 Å²	244	151 Å²	151	92%	0.921	78%	0.783	S	S	*	*			trans	-120.9	123.6	-161.8	-171.1	-177.7	-169.7	174	2.5	110.2
1181	A	26.8	Very low	25.5	Very low	95 Å²	95	154.9 Å²	154.9	79%	0.785	79%	0.789	S	S	*	*			trans	-108.1	150.1	170.9	0	0	0	0	0	110.1
1182	E	24.4	Very low	25.8	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	79%	0.791	S	S	*	*			trans	-79.5	150.8	-176.7	-61.8	-173.8	122.6	0	0	112.6	Y1184	E1182-Y1184 PolarHBondContact O-N 3.36Å
1183	Q	24.3	Very low	25.8	Very low	196 Å²	196	150 Å²	150	92%	0.916	79%	0.788	S	S	*	*			trans	-85.6	112.4	178.4	-70.4	176.3	-77.6	0	0	111.2
1184	Y	26	Very low	25.9	Very low	218 Å²	218	153.3 Å²	153.3	86%	0.855	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-86.5	139.1	157.5	-104.2	-97.4	0	0	0	110.3	E1182	E1182-Y1184 PolarHBondContact O-N 3.36Å
1185	P	28.9	Very low	26	Very low	118 Å²	118	155.2 Å²	155.2	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.3	138.6	172.4	29.1	-33.9	0	0	0	110.6
1186	G	26.6	Very low	26	Very low	82 Å²	82	152.3 Å²	152.3	85%	0.845	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68.8	139.9	-168.3	0	0	0	0	0	115.3
1187	S	25.6	Very low	26	Very low	92 Å²	92	147.2 Å²	147.2	64%	0.643	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-89.7	138.2	169.5	-160.8	0	0	0	0	110.8	D1189	S1187-D1189 VanDerWaalsContact C-N 3.33Å; S1187-D1189 VanDerWaalsContact CB-OD2 3.28Å; S1187-D1189 WeakPolarHBondContact CB-OD2 3.46Å; S1187-D1189 PolarHBondContact O-N 3.4Å; S1187-D1189 VanDerWaalsContact O-N 3.11Å; S1187-D1189 PolarHBondContact OG-OD2 3.24Å
1188	P	28.5	Very low	26.1	Very low	118 Å²	118	148.8 Å²	148.8	77%	0.766	79%	0.79	S	S	*	*			trans	-88.4	54	-172	37.2	-37.6	0	0	0	113.7
1189	D	27.6	Very low	26.3	Very low	123 Å²	123	152.3 Å²	152.3	66%	0.658	80%	0.796	S	S	*	*			trans	-101.2	14.9	-172	-65.8	-70.3	0	0	0	114.9	S1187 W1191	S1187-D1189 VanDerWaalsContact C-N 3.33Å; S1187-D1189 VanDerWaalsContact CB-OD2 3.28Å; S1187-D1189 WeakPolarHBondContact CB-OD2 3.46Å; S1187-D1189 PolarHBondContact O-N 3.4Å; S1187-D1189 VanDerWaalsContact O-N 3.11Å; S1187-D1189 PolarHBondContact OG-OD2 3.24Å; D1189-W1191 PolarHBondContact O-N 2.68Å
1190	S	25.3	Very low	26.3	Very low	102 Å²	102	145.2 Å²	145.2	71%	0.713	78%	0.784	S	S	*	*			trans	-93.1	45.8	-173.4	72.7	0	0	0	0	115
1191	W	25.7	Very low	26.6	Very low	196 Å²	196	136.9 Å²	136.9	74%	0.742	77%	0.772	S	S	*	*			trans	-138.2	90.9	173.9	-71.8	85.9	0	0	0	111	Y1132 D1189	Y1132-W1191 HydrophobicContact CE2-CE3 4.18Å; Y1132-W1191 AromaticContact CE2-CZ3 3.82Å; Y1132-W1191 HydrophobicContact CE2-CZ3 3.82Å; Y1132-W1191 VanDerWaalsContact OH-CE3 3.31Å; D1189-W1191 PolarHBondContact O-N 2.68Å
1192	V	28.9	Very low	26.5	Very low	116 Å²	116	140.7 Å²	140.7	70%	0.703	77%	0.771	S	S	*	*			trans	-140.4	0	177	172.3	0	0	0	0	108.8	Y751 R752	Y751-V1192 HydrophobicContact CE2-CG1 4.42Å; Y751-V1192 VanDerWaalsContact OH-CG1 3.23Å; Y751-V1192 WeakPolarHBondContact OH-CG1 3.24Å; Y751-V1192 PolarHBondContact OH-OXT 2.87Å; Y751-V1192 VanDerWaalsContact OH-OXT 3.05Å; R752-V1192 HydrophobicContact CG-CG1 4.39Å

Retrieved 1,192 of 1,192 residues in 647 ms (Link to these results)

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