A0A077YUL1_TRITR Loading...

RBD and RhoGEF domain containing protein

AlphaFold DB , UniProt , Accession A0A077YUL1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,059 aa.

						>A0A077YUL1_TRITR|A0A077YUL1
MDFVRHFHKATNCANGSDDSDGSCCETLVAIKGVTLKDALAGLTKKYQFNIERINIFLKSSNTPLPLETDTSFLGGLKVFLRSKEVTTLSSKSNASNTLPNNSNTSCFTKPDLSWKQERKLSFGTVSKRKGEKLLLINDSTGGNGEKQEMLNEGSAVHSAAMSGMDSVSGRKERTRSYGRLSQIFPNPFKVVDRADMLDSLMQWQEEGLKTAASFLQESNSPTGCQVLFLEDHWQTIVKSGEQLSRKQQKQQEGIWELITTELEYICKLGSIVELQSCIRTLQQDGLGAELDVETVFSNISEICRANLGFWLCCVHPLLQYSRQTGKPLDPTKMESGFSRLDYLFRPYIPYCLAHVDVLCYIRQKLKESDFFRDLIVWIQSRKAFGRLHLTDLLAKPMQRLTKYPLLLKAVLNNSTDTADVKSLRVMIEKAEEFASRVNVELCFKQHYDTLCSIMQCIDSYEVVDSANDELEKLVKEFALVDLTSPMPGCRQGLLRRHLIRGELKLRESYTKTDVICFLFTDMFLVCKQIARKGDRPRVKVIRPPYHIENIIVKQLRETNGFMFVQMNEFRVPAYACVFLTGTLEETYRWLENFQIAKEEYSYLSAYDYPSLIGYADEFGTERGYPLRYMVPIGGEPPGGSNTIRHRKGDGAKASALKRLTDAKSDRVIPFRRTSMGAVDYRSESASSTLDINHRKCNSMDTTSSSSRKSFERESRSSEQPSTVDTHKEERFLKPMLPNHERETAPQRSPFSLPNFFPVHRMFPMEMLPKEHSEQAGQSIKIIESQAGATTSGSNYTGEEGHLSPSSRRLERRYHTADGIEVLKPSSQSTNILKRFSWNTAASASRARSGTHHPSCRKASSSTVSSDSCYSSSGISSSSSHLYYSYSENELAESAGLRGVIRGRKLSFAPPAEGPAVDELIDDVSPLTLQAGQPAVVEVDKAMNISSFHVTDSSDAAVSLSHSPASCSSNSSTICASVSNDSSSIENQTVEISNTASHFEPPTTAAMWPEGSKSPSKTADSVSLVAKEDAAAQATTARRHNRHREDLFKIIHKGHLESS
					

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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	26.2	Very low	30.3	Very low	126 Å²	126	138 Å²	138	62%	0.621	68%	0.68	S	S	*	*				0	126.6	0	-48.2	-31.4	-106.4	0	0	108.6	Y47	M1-Y47 HydrophobicContact CB-CD1 3.99Å; M1-Y47 HydrophobicContact CB-CE1 4.26Å; M1-Y47 HydrophobicContact CG-CD1 4.44Å
2	D	32.3	Very low	29.8	Very low	76 Å²	76	140.9 Å²	140.9	41%	0.406	70%	0.701	S	S	.	*			cis	-148.9	165.7	-13.5	-87.7	-33.8	0	0	0	107.1	V4	D2-V4 VanDerWaalsContact O-CB 3.24Å; D2-V4 WeakPolarHBondContact O-CB 3.47Å; D2-V4 WeakPolarHBondContact O-CG2 3.47Å
3	F	31.4	Very low	30.3	Very low	168 Å²	168	140 Å²	140	74%	0.737	71%	0.714	S	S	*	*				53.6	68.5	58.7	134	42.6	0	0	0	113.6
4	V	32.2	Very low	30.2	Very low	79 Å²	79	135.9 Å²	135.9	48%	0.479	71%	0.711	S	S	.	*	S	Bend	cis	61.6	178.1	3.6	-160.2	0	0	0	0	107.4	D2 H6	D2-V4 VanDerWaalsContact O-CB 3.24Å; D2-V4 WeakPolarHBondContact O-CB 3.47Å; D2-V4 WeakPolarHBondContact O-CG2 3.47Å; V4-H6 HydrophobicContact CG1-CB 4.09Å
5	R	44.7	Very low	30	Very low	201 Å²	201	137.9 Å²	137.9	76%	0.758	72%	0.723	S	S	*	*	S	Bend	cis	56.4	162.4	28.8	-14.5	113.2	-168.2	148.7	-2	110	F7	R5-F7 PolarHBondContact O-N 3.07Å
6	H	43.1	Very low	29.9	Very low	137 Å²	137	134.3 Å²	134.3	63%	0.634	73%	0.729	S	S	*	*			trans	49.1	60	175.3	-73.6	68	0	0	0	116	V4	V4-H6 HydrophobicContact CG1-CB 4.09Å
7	F	23.6	Very low	29.6	Very low	180 Å²	180	132.8 Å²	132.8	79%	0.789	73%	0.731	S	S	*	*				81.4	144.8	77.5	-84.8	-139.6	0	0	0	115.5	R5	R5-F7 PolarHBondContact O-N 3.07Å
8	H	24.3	Very low	29.4	Very low	150 Å²	150	133.8 Å²	133.8	69%	0.694	74%	0.736	S	S	*	*			cis	-156.3	170	-27.8	-150.2	-99	0	0	0	110.7
9	K	24	Very low	29.3	Very low	176 Å²	176	134.9 Å²	134.9	77%	0.765	74%	0.74	S	S	*	*			trans	-59.9	142	176	-162.9	174.7	-172.5	175.9	0	112.1	T11	K9-T11 PolarHBondContact O-N 3.22Å
10	A	26.1	Very low	29.1	Very low	103 Å²	103	134 Å²	134	85%	0.851	74%	0.744	S	S	*	*			trans	-71.2	113	179.6	0	0	0	0	0	112.5
11	T	25.2	Very low	29.2	Very low	122 Å²	122	135 Å²	135	75%	0.748	75%	0.749	S	S	*	*			trans	-142.3	152.1	169	42.2	0	0	0	0	109	K9	K9-T11 PolarHBondContact O-N 3.22Å
12	N	24.3	Very low	29.3	Very low	173 Å²	173	131.9 Å²	131.9	93%	0.925	75%	0.748	S	S	*	*			trans	-63	151.3	-165.5	-68.3	-41.3	0	0	0	115.3
13	C	37	Very low	29.8	Very low	129 Å²	129	132.4 Å²	132.4	87%	0.872	76%	0.758	S	S	*	*			trans	-88.9	152.6	-170.5	-40.3	0	0	0	0	114.7
14	A	28.1	Very low	30.7	Very low	82 Å²	82	128.4 Å²	128.4	68%	0.678	75%	0.749	S	S	*	*			trans	-166.7	129	131.1	0	0	0	0	0	111.4
15	N	28.4	Very low	32.1	Very low	167 Å²	167	128.1 Å²	128.1	89%	0.893	75%	0.751	S	S	*	*			trans	43.3	133.6	154.7	-48.1	-10.8	0	0	0	120.9
16	G	28	Very low	33.4	Very low	79 Å²	79	122.7 Å²	122.7	81%	0.814	73%	0.734	S	S	*	*			cis	146.4	107	-12.6	0	0	0	0	0	115
17	S	25.2	Very low	35	Very low	110 Å²	110	122.8 Å²	122.8	77%	0.769	74%	0.744	S	S	*	*			trans	-169.4	129.6	158.3	56.6	0	0	0	0	112.3
18	D	26.1	Very low	37.7	Very low	151 Å²	151	117.9 Å²	117.9	81%	0.807	73%	0.726	S	S	*	*			trans	57.7	127.7	149.7	-49.5	-14	0	0	0	124
19	D	25.9	Very low	40.1	Very low	154 Å²	154	115.9 Å²	115.9	82%	0.824	72%	0.724	S	S	*	*			trans	44.5	107	144.2	-62.4	-9.6	0	0	0	123.3
20	S	27.1	Very low	42.8	Very low	117 Å²	117	109.5 Å²	109.5	82%	0.818	70%	0.704	S	S	*	*				-177.7	156.7	111.8	35.5	0	0	0	0	113.1
21	D	30	Very low	45.4	Very low	156 Å²	156	108.8 Å²	108.8	83%	0.834	69%	0.685	S	S	*	*			trans	-89.6	153.6	-174.3	-141.9	-31	0	0	0	112.8
22	G	29	Very low	47.9	Very low	59 Å²	59	111.5 Å²	111.5	61%	0.608	69%	0.686	S	S	*	*			trans	-168.2	14.7	-170	0	0	0	0	0	118.8
23	S	41.7	Very low	50.8	Low	88 Å²	88	106.2 Å²	106.2	62%	0.615	67%	0.673	S	S	*	*			trans	-83.5	116.6	179.7	73.4	0	0	0	0	112.9	C25	S23-C25 PolarHBondContact O-N 3.15Å
24	C	50.7	Low	53.2	Low	83 Å²	83	102.2 Å²	102.2	56%	0.561	64%	0.644	S	S	*	*			trans	-67.1	103.3	176.2	-171.3	0	0	0	0	110.8
25	C	61.3	Low	56.2	Low	74 Å²	74	100 Å²	100	50%	0.5	62%	0.623	S	S	.	*			trans	-113.5	117.3	171.6	-72.6	0	0	0	0	109.3	S23 K78	S23-C25 PolarHBondContact O-N 3.15Å; C25-K78 PolarHBondContact SG-NZ 3.1Å
26	E	72.9	Confident	59.1	Low	87 Å²	87	92.3 Å²	92.3	41%	0.407	58%	0.581	S	S	.	*			trans	-91.3	139.8	168.7	-65.1	-105.5	120.5	0	0	109.9	L43 K46 Y47	E26-L43 HydrophobicContact CB-CD1 4.46Å; E26-L43 HydrophobicContact CB-CD2 4.02Å; E26-L43 HydrophobicContact CG-CD2 3.75Å; E26-L43 VanDerWaalsContact OE2-CD2 3.23Å; E26-L43 WeakPolarHBondContact OE2-CD2 3.35Å; E26-K46 IonicContact OE1-NZ 3.89Å; E26-K46 PolarHBondContact OE1-NZ 3.38Å; E26-K46 IonicContact OE2-NZ 3.74Å; E26-K46 PolarHBondContact OE2-NZ 2.98Å; E26-Y47 HydrophobicContact CG-CE2 4.09Å; E26-Y47 PolarHBondContact OE1-OH 3.3Å
27	T	77.3	Confident	62	Low	139 Å²	139	93.7 Å²	93.7	85%	0.853	57%	0.565	S	S	*	*			trans	-96.3	114.9	177	-57.3	0	0	0	0	109.8
28	L	79.5	Confident	65.1	Low	76 Å²	76	93 Å²	93	40%	0.398	55%	0.552	S	S	.	*			trans	-87.6	141.3	168.9	-74.3	174	0	0	0	110.8	A39 L40 L43	L28-A39 HydrophobicContact CD2-CB 4.49Å; L28-A39 WeakPolarHBondContact CD2-O 3.41Å; L28-L40 HydrophobicContact CD1-CD2 3.96Å; L28-L40 HydrophobicContact CD1-CG 4.39Å; L28-L43 HydrophobicContact CD1-CD1 4.08Å; L28-L43 HydrophobicContact CD2-CD1 3.9Å; L28-L43 HydrophobicContact CG-CD1 4.02Å
29	V	73.8	Confident	68	Low	108 Å²	108	86.7 Å²	86.7	66%	0.655	52%	0.522	S	S	*	.			trans	-81.7	119.1	171.2	-172.3	0	0	0	0	108.5	I31	V29-I31 HydrophobicContact CB-CD1 4.44Å; V29-I31 HydrophobicContact CB-CG1 4.32Å; V29-I31 HydrophobicContact CG1-CD1 4.11Å; V29-I31 HydrophobicContact CG1-CG1 3.77Å; V29-I31 PolarHBondContact O-N 3.26Å
30	A	81.1	Confident	71	Confident	43 Å²	43	79.7 Å²	79.7	36%	0.355	48%	0.484	S	S	.	.			trans	-76	113.5	174.3	0	0	0	0	0	109.9	T71	A30-T71 VanDerWaalsContact CB-O 3.3Å; A30-T71 WeakPolarHBondContact CB-O 3.31Å
31	I	80.5	Confident	73.7	Confident	87 Å²	87	76.3 Å²	76.3	45%	0.446	46%	0.463	S	S	.	.			trans	-125.5	125.3	-176.3	-55.5	177	0	0	0	109.2	V29 G33 V34 T71	V29-I31 HydrophobicContact CB-CD1 4.44Å; V29-I31 HydrophobicContact CB-CG1 4.32Å; V29-I31 HydrophobicContact CG1-CD1 4.11Å; V29-I31 HydrophobicContact CG1-CG1 3.77Å; V29-I31 PolarHBondContact O-N 3.26Å; I31-G33 PolarHBondContact O-N 2.9Å; I31-V34 HydrophobicContact CB-CB 4.1Å; I31-V34 HydrophobicContact CB-CG2 3.72Å; I31-V34 HydrophobicContact CG2-CG2 3.67Å; I31-V34 WeakPolarHBondContact O-CB 3.43Å; I31-V34 PolarHBondContact O-N 2.89Å; I31-T71 PolarHBondContact N-OG1 3.29Å; I31-T71 PolarHBondContact O-OG1 3.08Å
32	K	79.2	Confident	76.1	Confident	180 Å²	180	71.3 Å²	71.3	78%	0.783	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	129	179.7	-172.7	179.9	179.6	-177.2	0	110.8	V34	K32-V34 VanDerWaalsContact C-N 3.33Å
33	G	84.3	Confident	78.6	Confident	62 Å²	62	69.4 Å²	69.4	64%	0.639	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-4.1	-174.7	0	0	0	0	0	115.2	I31 D70	I31-G33 PolarHBondContact O-N 2.9Å; G33-D70 WeakPolarHBondContact CA-OD2 3.28Å; G33-D70 PolarHBondContact N-OD2 3.32Å
34	V	86.7	Confident	80.5	Confident	44 Å²	44	66.6 Å²	66.6	27%	0.267	40%	0.403	S	S	.	.			trans	-95.1	126.5	173.3	179.2	0	0	0	0	109.2	I31 K32 D38 A39 T71	I31-V34 HydrophobicContact CB-CB 4.1Å; I31-V34 HydrophobicContact CB-CG2 3.72Å; I31-V34 HydrophobicContact CG2-CG2 3.67Å; I31-V34 WeakPolarHBondContact O-CB 3.43Å; I31-V34 PolarHBondContact O-N 2.89Å; K32-V34 VanDerWaalsContact C-N 3.33Å; V34-D38 HydrophobicContact CG1-CB 4.01Å; V34-A39 HydrophobicContact CG1-CB 4.31Å; V34-T71 WeakPolarHBondContact O-CG2 3.18Å; V34-T71 PolarHBondContact O-N 3.35Å; V34-T71 PolarHBondContact O-OG1 3.35Å
35	T	91.2	Very high	81.8	Confident	37 Å²	37	71.2 Å²	71.2	23%	0.227	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-76.5	158.3	-179.5	78.9	0	0	0	0	112	K37 D38 A39 T69	T35-K37 PolarHBondContact O-N 3.37Å; T35-K37 PolarHBondContact OG1-N 3.26Å; T35-D38 WeakPolarHBondContact CB-OD2 3.05Å; T35-D38 PolarHBondContact O-N 2.89Å; T35-D38 VanDerWaalsContact O-N 3.13Å; T35-D38 PolarHBondContact OG1-N 2.89Å; T35-D38 PolarHBondContact OG1-OD2 3.34Å; T35-A39 PolarHBondContact O-N 3.18Å; T35-T69 CarbonylContact C-O 3.5Å; T35-T69 WeakPolarHBondContact CA-O 3.22Å
36	L	89.1	Confident	82.7	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-59.1	-35.6	175.6	-166.3	61.4	0	0	0	111.5	L40 I56 L65 L67 T69 T71 L74	L36-L40 HydrophobicContact CD1-CD1 4.38Å; L36-L40 HydrophobicContact CG-CD1 4.04Å; L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.42Å; L36-L40 WeakPolarHBondContact O-CD1 3.25Å; L36-L40 VanDerWaalsContact O-CG 3.22Å; L36-L40 WeakPolarHBondContact O-CG 3.13Å; L36-L40 PolarHBondContact O-N 3.41Å; L36-I56 HydrophobicContact CD2-CB 4.46Å; L36-I56 HydrophobicContact CD2-CD1 3.87Å; L36-I56 HydrophobicContact CD2-CG2 4.13Å; L36-I56 HydrophobicContact CG-CD1 4.22Å; L36-L65 HydrophobicContact CD2-CB 3.89Å; L36-L65 HydrophobicContact CD2-CD1 4.25Å; L36-L67 PolarHBondContact N-O 3.39Å; L36-T69 WeakPolarHBondContact CB-O 3.49Å; L36-T69 PolarHBondContact N-O 3.39Å; L36-T71 HydrophobicContact CD1-CG2 4.28Å; L36-L74 HydrophobicContact CD1-CD1 3.7Å
37	K	89.5	Confident	83.1	Confident	108 Å²	108	72.3 Å²	72.3	47%	0.47	41%	0.408	S	S	.	.	H	α-helix	trans	-59.1	-47.1	172.9	-167.5	179.8	-178.8	175.4	0	112.2	T35 L40 A41 I51 L67	T35-K37 PolarHBondContact O-N 3.37Å; T35-K37 PolarHBondContact OG1-N 3.26Å; K37-L40 PolarHBondContact O-N 2.82Å; K37-A41 PolarHBondContact O-N 3.47Å; K37-A41 VanDerWaalsContact O-N 3.12Å; K37-I51 HydrophobicContact CG-CD1 4.14Å; K37-L67 HydrophobicContact CB-CB 4.21Å; K37-L67 PolarHBondContact N-O 2.6Å
38	D	89.9	Confident	83.2	Confident	94 Å²	94	74.4 Å²	74.4	50%	0.503	41%	0.408	S	S	.	.	H	α-helix	trans	-73.4	-42.4	-175.4	-56.5	-46.9	0	0	0	111.5	V34 T35 L40 A41	V34-D38 HydrophobicContact CG1-CB 4.01Å; T35-D38 WeakPolarHBondContact CB-OD2 3.05Å; T35-D38 PolarHBondContact O-N 2.89Å; T35-D38 VanDerWaalsContact O-N 3.13Å; T35-D38 PolarHBondContact OG1-N 2.89Å; T35-D38 PolarHBondContact OG1-OD2 3.34Å; D38-L40 VanDerWaalsContact C-N 3.28Å; D38-L40 PolarHBondContact O-N 2.89Å; D38-A41 VanDerWaalsContact O-CB 3.22Å; D38-A41 WeakPolarHBondContact O-CB 3.43Å; D38-A41 PolarHBondContact O-N 2.81Å; D38-A41 VanDerWaalsContact O-N 3.07Å
39	A	87.9	Confident	83.2	Confident	20 Å²	20	73 Å²	73	17%	0.165	40%	0.398	C	S	.	.	H	α-helix	trans	-62.4	-35.6	174	0	0	0	0	0	112.3	L28 V34 T35 A41 T71	L28-A39 HydrophobicContact CD2-CB 4.49Å; L28-A39 WeakPolarHBondContact CD2-O 3.41Å; V34-A39 HydrophobicContact CG1-CB 4.31Å; T35-A39 PolarHBondContact O-N 3.18Å; A39-A41 VanDerWaalsContact C-N 3.32Å; A39-T71 HydrophobicContact CB-CG2 3.73Å
40	L	87.9	Confident	83.6	Confident	6 Å²	6	71.8 Å²	71.8	3%	0.031	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10	174.5	-73.2	169.4	0	0	0	114	L28 L36 K37 D38 G42 L43 T44 I51 I56 L81	L28-L40 HydrophobicContact CD1-CD2 3.96Å; L28-L40 HydrophobicContact CD1-CG 4.39Å; L36-L40 HydrophobicContact CD1-CD1 4.38Å; L36-L40 HydrophobicContact CG-CD1 4.04Å; L36-L40 VanDerWaalsContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CB 3.42Å; L36-L40 WeakPolarHBondContact O-CD1 3.25Å; L36-L40 VanDerWaalsContact O-CG 3.22Å; L36-L40 WeakPolarHBondContact O-CG 3.13Å; L36-L40 PolarHBondContact O-N 3.41Å; K37-L40 PolarHBondContact O-N 2.82Å; D38-L40 VanDerWaalsContact C-N 3.28Å; D38-L40 PolarHBondContact O-N 2.89Å; L40-G42 VanDerWaalsContact C-N 3.25Å; L40-G42 PolarHBondContact O-N 3.21Å; L40-L43 HydrophobicContact CD2-CB 4.27Å; L40-L43 HydrophobicContact CD2-CD1 3.73Å; L40-L43 WeakPolarHBondContact O-CB 3.26Å; L40-L43 PolarHBondContact O-N 3.42Å; L40-T44 WeakPolarHBondContact O-CG2 3.44Å; L40-T44 PolarHBondContact O-N 3.03Å; L40-T44 PolarHBondContact O-OG1 3.41Å; L40-I51 HydrophobicContact CB-CD1 3.7Å; L40-I51 HydrophobicContact CD1-CD1 4.22Å; L40-I56 HydrophobicContact CD1-CD1 3.4Å; L40-I56 VanDerWaalsContact CD1-CD1 3.4Å; L40-I56 HydrophobicContact CD1-CG1 4.33Å; L40-L81 HydrophobicContact CD2-CD2 4.3Å
41	A	84.3	Confident	83.7	Confident	46 Å²	46	70.8 Å²	70.8	38%	0.38	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-26.6	-177.4	0	0	0	0	0	113.6	K37 D38 A39 T44	K37-A41 PolarHBondContact O-N 3.47Å; K37-A41 VanDerWaalsContact O-N 3.12Å; D38-A41 VanDerWaalsContact O-CB 3.22Å; D38-A41 WeakPolarHBondContact O-CB 3.43Å; D38-A41 PolarHBondContact O-N 2.81Å; D38-A41 VanDerWaalsContact O-N 3.07Å; A39-A41 VanDerWaalsContact C-N 3.32Å; A41-T44 WeakPolarHBondContact CA-OG1 3.2Å; A41-T44 PolarHBondContact O-OG1 3.18Å
42	G	80.6	Confident	83.8	Confident	51 Å²	51	72.5 Å²	72.5	53%	0.526	38%	0.383	S	S	.	.	H	α-helix	trans	-72.1	-41.9	169.2	0	0	0	0	0	112.4	L40 K46	L40-G42 VanDerWaalsContact C-N 3.25Å; L40-G42 PolarHBondContact O-N 3.21Å; G42-K46 WeakPolarHBondContact O-CB 3.24Å; G42-K46 PolarHBondContact O-N 3.28Å
43	L	80.5	Confident	84	Confident	20 Å²	20	71.9 Å²	71.9	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-67.6	-42.1	-179.7	-90.7	170.3	0	0	0	112.8	E26 L28 L40 K45 K46 Y47 F49	E26-L43 HydrophobicContact CB-CD1 4.46Å; E26-L43 HydrophobicContact CB-CD2 4.02Å; E26-L43 HydrophobicContact CG-CD2 3.75Å; E26-L43 VanDerWaalsContact OE2-CD2 3.23Å; E26-L43 WeakPolarHBondContact OE2-CD2 3.35Å; L28-L43 HydrophobicContact CD1-CD1 4.08Å; L28-L43 HydrophobicContact CD2-CD1 3.9Å; L28-L43 HydrophobicContact CG-CD1 4.02Å; L40-L43 HydrophobicContact CD2-CB 4.27Å; L40-L43 HydrophobicContact CD2-CD1 3.73Å; L40-L43 WeakPolarHBondContact O-CB 3.26Å; L40-L43 PolarHBondContact O-N 3.42Å; L43-K45 VanDerWaalsContact C-N 3.34Å; L43-K45 PolarHBondContact O-N 3.31Å; L43-K46 PolarHBondContact O-N 2.93Å; L43-Y47 HydrophobicContact CD2-CD2 3.64Å; L43-Y47 HydrophobicContact CD2-CE2 3.49Å; L43-Y47 VanDerWaalsContact CD2-CE2 3.49Å; L43-Y47 PolarHBondContact O-N 3.15Å; L43-F49 HydrophobicContact CB-CZ 4.4Å
44	T	81.7	Confident	84	Confident	28 Å²	28	69.9 Å²	69.9	17%	0.172	35%	0.35	C	S	.	.	H	α-helix	trans	-64.6	-37.7	177.9	54	0	0	0	0	111.9	L40 A41 Q48 F49 I51	L40-T44 WeakPolarHBondContact O-CG2 3.44Å; L40-T44 PolarHBondContact O-N 3.03Å; L40-T44 PolarHBondContact O-OG1 3.41Å; A41-T44 WeakPolarHBondContact CA-OG1 3.2Å; A41-T44 PolarHBondContact O-OG1 3.18Å; T44-Q48 VanDerWaalsContact O-CA 3.31Å; T44-Q48 WeakPolarHBondContact O-CA 3.48Å; T44-Q48 PolarHBondContact O-N 2.78Å; T44-F49 WeakPolarHBondContact CB-O 3.46Å; T44-F49 HydrophobicContact CG2-CD2 3.83Å; T44-F49 HydrophobicContact CG2-CE2 3.74Å; T44-I51 HydrophobicContact CG2-CB 3.83Å; T44-I51 HydrophobicContact CG2-CD1 4Å; T44-I51 HydrophobicContact CG2-CG1 3.93Å
45	K	78.3	Confident	84	Confident	181 Å²	181	70.1 Å²	70.1	79%	0.787	35%	0.35	S	S	*	.	H	α-helix	trans	-65	-42.9	170.1	-78.9	-174.9	174.6	-178.5	0	112.4	L43	L43-K45 VanDerWaalsContact C-N 3.34Å; L43-K45 PolarHBondContact O-N 3.31Å
46	K	79.8	Confident	83.8	Confident	123 Å²	123	68.6 Å²	68.6	54%	0.535	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-36.7	-177.4	-176.1	174	174.8	-178.2	0	113.5	E26 G42 L43	E26-K46 IonicContact OE1-NZ 3.89Å; E26-K46 PolarHBondContact OE1-NZ 3.38Å; E26-K46 IonicContact OE2-NZ 3.74Å; E26-K46 PolarHBondContact OE2-NZ 2.98Å; G42-K46 WeakPolarHBondContact O-CB 3.24Å; G42-K46 PolarHBondContact O-N 3.28Å; L43-K46 PolarHBondContact O-N 2.93Å
47	Y	81.5	Confident	83.7	Confident	61 Å²	61	69.8 Å²	69.8	24%	0.239	35%	0.345	C	S	.	.	H	α-helix	trans	-115.2	9.9	-173.9	-68.8	-83.3	0	0	0	114.3	M1 E26 L43 F49	M1-Y47 HydrophobicContact CB-CD1 3.99Å; M1-Y47 HydrophobicContact CB-CE1 4.26Å; M1-Y47 HydrophobicContact CG-CD1 4.44Å; E26-Y47 HydrophobicContact CG-CE2 4.09Å; E26-Y47 PolarHBondContact OE1-OH 3.3Å; L43-Y47 HydrophobicContact CD2-CD2 3.64Å; L43-Y47 HydrophobicContact CD2-CE2 3.49Å; L43-Y47 VanDerWaalsContact CD2-CE2 3.49Å; L43-Y47 PolarHBondContact O-N 3.15Å; Y47-F49 VanDerWaalsContact CB-CD1 3.48Å; Y47-F49 HydrophobicContact CD2-CE1 4.28Å; Y47-F49 AromaticContact CG-CE1 3.92Å; Y47-F49 HydrophobicContact CG-CE1 3.92Å; Y47-F49 PolarHBondContact O-N 2.82Å
48	Q	80.5	Confident	83.5	Confident	182 Å²	182	66.2 Å²	66.2	85%	0.85	33%	0.331	S	S	*	.			trans	54.2	20.3	174.5	-56.4	-171.6	7.6	0	0	116.7	T44	T44-Q48 VanDerWaalsContact O-CA 3.31Å; T44-Q48 WeakPolarHBondContact O-CA 3.48Å; T44-Q48 PolarHBondContact O-N 2.78Å
49	F	79.4	Confident	82.8	Confident	47 Å²	47	70.6 Å²	70.6	21%	0.206	35%	0.346	C	S	.	.			trans	-91.9	133.2	177.5	51.9	-120.4	0	0	0	112.3	L43 T44 Y47 I51 I54 L81	L43-F49 HydrophobicContact CB-CZ 4.4Å; T44-F49 WeakPolarHBondContact CB-O 3.46Å; T44-F49 HydrophobicContact CG2-CD2 3.83Å; T44-F49 HydrophobicContact CG2-CE2 3.74Å; Y47-F49 VanDerWaalsContact CB-CD1 3.48Å; Y47-F49 HydrophobicContact CD2-CE1 4.28Å; Y47-F49 AromaticContact CG-CE1 3.92Å; Y47-F49 HydrophobicContact CG-CE1 3.92Å; Y47-F49 PolarHBondContact O-N 2.82Å; F49-I51 PolarHBondContact O-N 2.94Å; F49-I54 HydrophobicContact CB-CD1 3.88Å; F49-I54 HydrophobicContact CD2-CD1 3.28Å; F49-I54 HydrophobicContact CE2-CD1 3.98Å; F49-I54 HydrophobicContact CG-CD1 3.75Å; F49-L81 HydrophobicContact CE2-CD2 4.38Å; F49-L81 HydrophobicContact CZ-CD2 4.44Å
50	N	81.5	Confident	82.2	Confident	83 Å²	83	75.3 Å²	75.3	44%	0.444	38%	0.377	S	S	.	.			trans	-75.1	119	177.3	179.3	-14.5	0	0	0	110.1	E52 R53 I54	N50-E52 PolarHBondContact O-N 3.39Å; N50-E52 VanDerWaalsContact O-N 3.15Å; N50-E52 PolarHBondContact OD1-N 3.34Å; N50-R53 PolarHBondContact O-N 2.79Å; N50-R53 VanDerWaalsContact O-N 3.13Å; N50-I54 WeakPolarHBondContact O-CG1 3.49Å
51	I	83	Confident	81.7	Confident	22 Å²	22	76.8 Å²	76.8	11%	0.113	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-58.1	-28.9	-175.3	-148.4	170.6	0	0	0	114	K37 L40 T44 F49 R53 I54 L67	K37-I51 HydrophobicContact CG-CD1 4.14Å; L40-I51 HydrophobicContact CB-CD1 3.7Å; L40-I51 HydrophobicContact CD1-CD1 4.22Å; T44-I51 HydrophobicContact CG2-CB 3.83Å; T44-I51 HydrophobicContact CG2-CD1 4Å; T44-I51 HydrophobicContact CG2-CG1 3.93Å; F49-I51 PolarHBondContact O-N 2.94Å; I51-R53 VanDerWaalsContact C-N 3.29Å; I51-R53 PolarHBondContact O-N 2.83Å; I51-I54 PolarHBondContact O-N 2.62Å; I51-L67 HydrophobicContact CD1-CD2 3.94Å; I51-L67 HydrophobicContact CG1-CD2 3.89Å
52	E	82.6	Confident	81.6	Confident	123 Å²	123	82 Å²	82	58%	0.575	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-73.1	-24.1	-177.2	-60.5	179.1	158.9	0	0	112.6	N50 I54 K84	N50-E52 PolarHBondContact O-N 3.39Å; N50-E52 VanDerWaalsContact O-N 3.15Å; N50-E52 PolarHBondContact OD1-N 3.34Å; E52-I54 VanDerWaalsContact C-N 3.29Å; E52-K84 WeakPolarHBondContact O-CD 3.4Å; E52-K84 WeakPolarHBondContact O-CE 3.15Å; E52-K84 PolarHBondContact O-NZ 2.83Å
53	R	83.7	Confident	81.6	Confident	166 Å²	166	84.5 Å²	84.5	63%	0.626	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-89.1	12.3	177.9	-64.6	-171.7	175.7	-174.4	-2	113	N50 I51 S83 K84	N50-R53 PolarHBondContact O-N 2.79Å; N50-R53 VanDerWaalsContact O-N 3.13Å; I51-R53 VanDerWaalsContact C-N 3.29Å; I51-R53 PolarHBondContact O-N 2.83Å; R53-S83 WeakPolarHBondContact O-CA 3.5Å; R53-K84 PolarHBondContact O-N 2.82Å
54	I	83.4	Confident	81.9	Confident	20 Å²	20	86 Å²	86	10%	0.103	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.1	-173.6	-52.2	170.5	0	0	0	110	F49 N50 I51 E52 L81 R82	F49-I54 HydrophobicContact CB-CD1 3.88Å; F49-I54 HydrophobicContact CD2-CD1 3.28Å; F49-I54 HydrophobicContact CE2-CD1 3.98Å; F49-I54 HydrophobicContact CG-CD1 3.75Å; N50-I54 WeakPolarHBondContact O-CG1 3.49Å; I51-I54 PolarHBondContact O-N 2.62Å; E52-I54 VanDerWaalsContact C-N 3.29Å; I54-L81 HydrophobicContact CG2-CB 3.82Å; I54-L81 HydrophobicContact CG2-CD2 3.95Å; I54-L81 HydrophobicContact CG2-CG 4.32Å; I54-R82 WeakPolarHBondContact CA-O 3.37Å; I54-R82 WeakPolarHBondContact CG2-O 3.38Å
55	N	87	Confident	82.1	Confident	49 Å²	49	86.5 Å²	86.5	26%	0.262	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	143.4	167.8	-78.3	-16.6	0	0	0	109.2	F57 P64 R82 K84	N55-F57 HydrophobicContact CB-CD2 4.39Å; N55-F57 HydrophobicContact CB-CE2 3.38Å; N55-F57 HydrophobicContact CB-CZ 3.53Å; N55-P64 HydrophobicContact CB-CB 3.96Å; N55-R82 PolarHBondContact N-O 3.31Å; N55-R82 PolarHBondContact O-N 2.7Å; N55-K84 WeakPolarHBondContact OD1-CE 3.21Å
56	I	87.4	Confident	82.6	Confident	5 Å²	5	81.2 Å²	81.2	3%	0.026	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	125	-171	-58.9	154.5	0	0	0	109	L36 L40 P64 L65 L67 V79 F80 L81	L36-I56 HydrophobicContact CD2-CB 4.46Å; L36-I56 HydrophobicContact CD2-CD1 3.87Å; L36-I56 HydrophobicContact CD2-CG2 4.13Å; L36-I56 HydrophobicContact CG-CD1 4.22Å; L40-I56 HydrophobicContact CD1-CD1 3.4Å; L40-I56 VanDerWaalsContact CD1-CD1 3.4Å; L40-I56 HydrophobicContact CD1-CG1 4.33Å; I56-P64 CarbonylContact O-C 3.44Å; I56-P64 VanDerWaalsContact O-CA 3.27Å; I56-P64 WeakPolarHBondContact O-CA 3.48Å; I56-L65 HydrophobicContact CG2-CD1 4.38Å; I56-L65 PolarHBondContact O-N 3.36Å; I56-L67 HydrophobicContact CD1-CD2 3.69Å; I56-V79 HydrophobicContact CG2-CB 4.37Å; I56-V79 HydrophobicContact CG2-CG1 3.37Å; I56-F80 CarbonylContact C-O 3.6Å; I56-F80 WeakPolarHBondContact CA-O 3.49Å; I56-L81 HydrophobicContact CG1-CD2 4.37Å; I56-L81 HydrophobicContact CG1-CG 4.37Å
57	F	86.7	Confident	82.9	Confident	30 Å²	30	77.1 Å²	77.1	13%	0.132	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.8	-168.2	-58.3	-92	0	0	0	112.5	N55 N62 P64 V79 F80 R82	N55-F57 HydrophobicContact CB-CD2 4.39Å; N55-F57 HydrophobicContact CB-CE2 3.38Å; N55-F57 HydrophobicContact CB-CZ 3.53Å; F57-N62 VanDerWaalsContact CE1-O 3.29Å; F57-N62 WeakPolarHBondContact CE1-O 3.45Å; F57-P64 HydrophobicContact CD1-CB 4.31Å; F57-P64 HydrophobicContact CE1-CB 3.87Å; F57-P64 HydrophobicContact CE1-CG 4.37Å; F57-P64 HydrophobicContact CZ-CB 4.09Å; F57-V79 CarbonylContact O-C 3.58Å; F57-V79 WeakPolarHBondContact O-CA 3.35Å; F57-V79 VanDerWaalsContact O-CG1 3.3Å; F57-V79 WeakPolarHBondContact O-CG1 3.48Å; F57-F80 PolarHBondContact N-O 3Å; F57-F80 PolarHBondContact O-N 2.87Å; F57-R82 HydrophobicContact CD2-CB 4.07Å; F57-R82 HydrophobicContact CE2-CB 3.58Å; F57-R82 HydrophobicContact CE2-CG 4.5Å
58	L	85.9	Confident	83.3	Confident	33 Å²	33	81 Å²	81	17%	0.173	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	151.7	166.1	-74.9	168.8	0	0	0	110.1	S60 S61 L65 L74 L77 V79	L58-S60 PolarHBondContact O-N 2.85Å; L58-S61 PolarHBondContact O-N 2.89Å; L58-S61 VanDerWaalsContact O-O 3.09Å; L58-L65 HydrophobicContact CD1-CD1 4.48Å; L58-L65 HydrophobicContact CG-CD1 4.16Å; L58-L74 HydrophobicContact CD1-CD2 4.37Å; L58-L74 HydrophobicContact CD2-CD2 4.26Å; L58-L77 HydrophobicContact CD1-CD1 4.28Å; L58-L77 HydrophobicContact CD2-CB 3.82Å; L58-L77 HydrophobicContact CD2-CD1 3.83Å; L58-L77 HydrophobicContact CD2-CG 4.41Å; L58-V79 HydrophobicContact CD2-CG1 4.32Å
59	K	74.3	Confident	83.5	Confident	187 Å²	187	74 Å²	74	81%	0.813	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-23	-178.8	-153.6	-177.9	177.2	-176	0	114.2	F80	K59-F80 HydrophobicContact CB-CE2 3.81Å; K59-F80 HydrophobicContact CD-CZ 4.49Å; K59-F80 HydrophobicContact CG-CE2 3.98Å; K59-F80 HydrophobicContact CG-CZ 4.27Å
60	S	75.9	Confident	84	Confident	118 Å²	118	73.7 Å²	73.7	83%	0.825	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	2.3	179.4	48.7	0	0	0	0	114.5	L58	L58-S60 PolarHBondContact O-N 2.85Å
61	S	77.9	Confident	84.4	Confident	38 Å²	38	70 Å²	70	27%	0.266	37%	0.366	S	S	.	.			trans	-132.5	123.2	-175.2	-179.8	0	0	0	0	112.4	L58 T63	L58-S61 PolarHBondContact O-N 2.89Å; L58-S61 VanDerWaalsContact O-O 3.09Å; S61-T63 VanDerWaalsContact C-N 3.28Å; S61-T63 PolarHBondContact OG-N 3.08Å; S61-T63 PolarHBondContact OG-O 2.98Å
62	N	80.9	Confident	84.5	Confident	156 Å²	156	71 Å²	71	83%	0.834	38%	0.375	S	S	*	.	S	Bend	trans	-81.7	-6	166.3	-70.7	-31.7	0	0	0	112.9	F57	F57-N62 VanDerWaalsContact CE1-O 3.29Å; F57-N62 WeakPolarHBondContact CE1-O 3.45Å
63	T	82.6	Confident	84.4	Confident	102 Å²	102	72.7 Å²	72.7	63%	0.626	38%	0.381	S	S	*	.	S	Bend	trans	-87.1	130.2	173.2	-50	0	0	0	0	109.4	S61	S61-T63 VanDerWaalsContact C-N 3.28Å; S61-T63 PolarHBondContact OG-N 3.08Å; S61-T63 PolarHBondContact OG-O 2.98Å
64	P	86.2	Confident	84.4	Confident	52 Å²	52	65.8 Å²	65.8	34%	0.338	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-74.2	145.9	178.6	31	-34.7	0	0	0	112.2	N55 I56 F57	N55-P64 HydrophobicContact CB-CB 3.96Å; I56-P64 CarbonylContact O-C 3.44Å; I56-P64 VanDerWaalsContact O-CA 3.27Å; I56-P64 WeakPolarHBondContact O-CA 3.48Å; F57-P64 HydrophobicContact CD1-CB 4.31Å; F57-P64 HydrophobicContact CE1-CB 3.87Å; F57-P64 HydrophobicContact CE1-CG 4.37Å; F57-P64 HydrophobicContact CZ-CB 4.09Å
65	L	86.1	Confident	84.4	Confident	39 Å²	39	67.3 Å²	67.3	20%	0.204	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-73.2	132.7	172.8	-71.9	168.1	0	0	0	110.7	L36 I56 L58 T69 L74 V79	L36-L65 HydrophobicContact CD2-CB 3.89Å; L36-L65 HydrophobicContact CD2-CD1 4.25Å; I56-L65 HydrophobicContact CG2-CD1 4.38Å; I56-L65 PolarHBondContact O-N 3.36Å; L58-L65 HydrophobicContact CD1-CD1 4.48Å; L58-L65 HydrophobicContact CG-CD1 4.16Å; L65-T69 HydrophobicContact CD2-CG2 4.48Å; L65-L74 HydrophobicContact CD1-CD1 4.24Å; L65-L74 HydrophobicContact CD1-CD2 4.03Å; L65-V79 HydrophobicContact CD1-CG1 3.91Å
66	P	87.8	Confident	84	Confident	69 Å²	69	69.1 Å²	69.1	45%	0.448	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-58.2	147.8	167.9	-23.6	33.9	0	0	0	112.1	E68 T69	P66-E68 PolarHBondContact O-N 3.36Å; P66-T69 WeakPolarHBondContact O-CB 3.34Å; P66-T69 PolarHBondContact O-N 3.22Å; P66-T69 PolarHBondContact O-OG1 2.87Å
67	L	86.1	Confident	83.7	Confident	38 Å²	38	73.2 Å²	73.2	20%	0.199	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-22.2	-179.8	-74.8	170.6	0	0	0	112.1	L36 K37 I51 I56 T69	L36-L67 PolarHBondContact N-O 3.39Å; K37-L67 HydrophobicContact CB-CB 4.21Å; K37-L67 PolarHBondContact N-O 2.6Å; I51-L67 HydrophobicContact CD1-CD2 3.94Å; I51-L67 HydrophobicContact CG1-CD2 3.89Å; I56-L67 HydrophobicContact CD1-CD2 3.69Å; L67-T69 VanDerWaalsContact C-N 3.27Å; L67-T69 PolarHBondContact O-N 2.98Å
68	E	89.2	Confident	83.5	Confident	143 Å²	143	78.4 Å²	78.4	67%	0.668	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-5.8	175.4	-41.1	80.9	-104	0	0	114.1	P66 D70	P66-E68 PolarHBondContact O-N 3.36Å; E68-D70 PolarHBondContact O-N 2.92Å
69	T	86.5	Confident	83.5	Confident	33 Å²	33	79.2 Å²	79.2	20%	0.202	46%	0.457	C	S	.	.			trans	-61.6	129.6	-174	-52.8	0	0	0	0	111.9	T35 L36 L65 P66 L67 T71	T35-T69 CarbonylContact C-O 3.5Å; T35-T69 WeakPolarHBondContact CA-O 3.22Å; L36-T69 WeakPolarHBondContact CB-O 3.49Å; L36-T69 PolarHBondContact N-O 3.39Å; L65-T69 HydrophobicContact CD2-CG2 4.48Å; P66-T69 WeakPolarHBondContact O-CB 3.34Å; P66-T69 PolarHBondContact O-N 3.22Å; P66-T69 PolarHBondContact O-OG1 2.87Å; L67-T69 VanDerWaalsContact C-N 3.27Å; L67-T69 PolarHBondContact O-N 2.98Å; T69-T71 PolarHBondContact O-N 2.82Å
70	D	90	Very high	84	Confident	41 Å²	41	75.1 Å²	75.1	22%	0.219	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-64.3	126.6	173.8	-176.6	-45.2	0	0	0	110.9	G33 E68 S72 F73	G33-D70 WeakPolarHBondContact CA-OD2 3.28Å; G33-D70 PolarHBondContact N-OD2 3.32Å; E68-D70 PolarHBondContact O-N 2.92Å; D70-S72 VanDerWaalsContact C-N 3.29Å; D70-S72 PolarHBondContact O-N 2.58Å; D70-S72 VanDerWaalsContact OD1-CB 3.28Å; D70-S72 WeakPolarHBondContact OD1-CB 3.31Å; D70-S72 PolarHBondContact OD1-N 3.49Å; D70-S72 PolarHBondContact OD1-OG 3.27Å; D70-F73 HydrophobicContact CB-CD2 3.99Å; D70-F73 HydrophobicContact CB-CE2 3.91Å
71	T	88.6	Confident	84.6	Confident	6 Å²	6	73.5 Å²	73.5	4%	0.037	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-70.5	-18.3	-174.3	59.5	0	0	0	0	114.6	A30 I31 V34 L36 A39 T69 F73 L74	A30-T71 VanDerWaalsContact CB-O 3.3Å; A30-T71 WeakPolarHBondContact CB-O 3.31Å; I31-T71 PolarHBondContact N-OG1 3.29Å; I31-T71 PolarHBondContact O-OG1 3.08Å; V34-T71 WeakPolarHBondContact O-CG2 3.18Å; V34-T71 PolarHBondContact O-N 3.35Å; V34-T71 PolarHBondContact O-OG1 3.35Å; L36-T71 HydrophobicContact CD1-CG2 4.28Å; A39-T71 HydrophobicContact CB-CG2 3.73Å; T69-T71 PolarHBondContact O-N 2.82Å; T71-F73 PolarHBondContact O-N 3.01Å; T71-L74 WeakPolarHBondContact O-CB 3.16Å; T71-L74 PolarHBondContact O-N 3.27Å
72	S	86.2	Confident	84.8	Confident	42 Å²	42	80.1 Å²	80.1	29%	0.294	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-61.3	-29.2	-179.3	58.8	0	0	0	0	113.8	D70 L74	D70-S72 VanDerWaalsContact C-N 3.29Å; D70-S72 PolarHBondContact O-N 2.58Å; D70-S72 VanDerWaalsContact OD1-CB 3.28Å; D70-S72 WeakPolarHBondContact OD1-CB 3.31Å; D70-S72 PolarHBondContact OD1-N 3.49Å; D70-S72 PolarHBondContact OD1-OG 3.27Å; S72-L74 PolarHBondContact O-N 2.86Å
73	F	79.7	Confident	84.7	Confident	159 Å²	159	76.9 Å²	76.9	70%	0.697	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-73.8	-9.8	175.2	-56.5	-68.2	0	0	0	113.9	D70 T71	D70-F73 HydrophobicContact CB-CD2 3.99Å; D70-F73 HydrophobicContact CB-CE2 3.91Å; T71-F73 PolarHBondContact O-N 3.01Å
74	L	84.7	Confident	84.5	Confident	21 Å²	21	76.4 Å²	76.4	11%	0.11	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-100.8	3.2	-177.8	-56.9	175.9	0	0	0	113.2	L36 L58 L65 T71 S72 G76 L77	L36-L74 HydrophobicContact CD1-CD1 3.7Å; L58-L74 HydrophobicContact CD1-CD2 4.37Å; L58-L74 HydrophobicContact CD2-CD2 4.26Å; L65-L74 HydrophobicContact CD1-CD1 4.24Å; L65-L74 HydrophobicContact CD1-CD2 4.03Å; T71-L74 WeakPolarHBondContact O-CB 3.16Å; T71-L74 PolarHBondContact O-N 3.27Å; S72-L74 PolarHBondContact O-N 2.86Å; L74-G76 PolarHBondContact O-N 3.22Å; L74-L77 HydrophobicContact CD2-CD1 4.35Å; L74-L77 PolarHBondContact O-N 3.24Å
75	G	81.8	Confident	83	Confident	52 Å²	52	82.8 Å²	82.8	54%	0.536	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	119.2	177.7	0	0	0	0	0	112.5	L77	G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.03Å
76	G	79.4	Confident	80.9	Confident	87 Å²	87	86.3 Å²	86.3	90%	0.897	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-1.5	-179.1	0	0	0	0	0	115.9	L74	L74-G76 PolarHBondContact O-N 3.22Å
77	L	81.2	Confident	78.3	Confident	92 Å²	92	89.1 Å²	89.1	48%	0.482	48%	0.484	S	S	.	.			trans	-93.3	138	177.6	-61.6	179.8	0	0	0	111.8	L58 L74 G75	L58-L77 HydrophobicContact CD1-CD1 4.28Å; L58-L77 HydrophobicContact CD2-CB 3.82Å; L58-L77 HydrophobicContact CD2-CD1 3.83Å; L58-L77 HydrophobicContact CD2-CG 4.41Å; L74-L77 HydrophobicContact CD2-CD1 4.35Å; L74-L77 PolarHBondContact O-N 3.24Å; G75-L77 VanDerWaalsContact C-N 3.34Å; G75-L77 PolarHBondContact O-N 3.03Å
78	K	83.3	Confident	75.6	Confident	139 Å²	139	93.3 Å²	93.3	60%	0.604	51%	0.511	S	S	*	.			trans	-83.4	126.6	167	-74.4	-158.6	175.3	-164.1	0	110.4	C25 F80	C25-K78 PolarHBondContact SG-NZ 3.1Å; K78-F80 HydrophobicContact CB-CE2 4.17Å; K78-F80 HydrophobicContact CB-CZ 4.39Å
79	V	84.7	Confident	72.6	Confident	50 Å²	50	94.1 Å²	94.1	30%	0.303	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.8	-179.2	-142.7	0	0	0	0	109.5	I56 F57 L58 L65	I56-V79 HydrophobicContact CG2-CB 4.37Å; I56-V79 HydrophobicContact CG2-CG1 3.37Å; F57-V79 CarbonylContact O-C 3.58Å; F57-V79 WeakPolarHBondContact O-CA 3.35Å; F57-V79 VanDerWaalsContact O-CG1 3.3Å; F57-V79 WeakPolarHBondContact O-CG1 3.48Å; L58-V79 HydrophobicContact CD2-CG1 4.32Å; L65-V79 HydrophobicContact CD1-CG1 3.91Å
80	F	86.3	Confident	69.7	Low	100 Å²	100	98.2 Å²	98.2	44%	0.439	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.4	-171.1	-63.3	-96.3	0	0	0	110.3	I56 F57 K59 K78	I56-F80 CarbonylContact C-O 3.6Å; I56-F80 WeakPolarHBondContact CA-O 3.49Å; F57-F80 PolarHBondContact N-O 3Å; F57-F80 PolarHBondContact O-N 2.87Å; K59-F80 HydrophobicContact CB-CE2 3.81Å; K59-F80 HydrophobicContact CD-CZ 4.49Å; K59-F80 HydrophobicContact CG-CE2 3.98Å; K59-F80 HydrophobicContact CG-CZ 4.27Å; K78-F80 HydrophobicContact CB-CE2 4.17Å; K78-F80 HydrophobicContact CB-CZ 4.39Å
81	L	86.9	Confident	66.7	Low	85 Å²	85	100.7 Å²	100.7	45%	0.445	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	137.4	177.7	-61.5	95.4	0	0	0	110.3	L40 F49 I54 I56	L40-L81 HydrophobicContact CD2-CD2 4.3Å; F49-L81 HydrophobicContact CE2-CD2 4.38Å; F49-L81 HydrophobicContact CZ-CD2 4.44Å; I54-L81 HydrophobicContact CG2-CB 3.82Å; I54-L81 HydrophobicContact CG2-CD2 3.95Å; I54-L81 HydrophobicContact CG2-CG 4.32Å; I56-L81 HydrophobicContact CG1-CD2 4.37Å; I56-L81 HydrophobicContact CG1-CG 4.37Å
82	R	82.6	Confident	63.6	Low	176 Å²	176	110.4 Å²	110.4	66%	0.664	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-137	137.6	178.4	-130.3	-176.3	-161.1	175	5.1	108.8	I54 N55 F57	I54-R82 WeakPolarHBondContact CA-O 3.37Å; I54-R82 WeakPolarHBondContact CG2-O 3.38Å; N55-R82 PolarHBondContact N-O 3.31Å; N55-R82 PolarHBondContact O-N 2.7Å; F57-R82 HydrophobicContact CD2-CB 4.07Å; F57-R82 HydrophobicContact CE2-CB 3.58Å; F57-R82 HydrophobicContact CE2-CG 4.5Å
83	S	79.5	Confident	60.7	Low	89 Å²	89	113 Å²	113	62%	0.622	63%	0.629	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-61.1	143.7	172.8	-166.2	0	0	0	0	110.3	R53 E85	R53-S83 WeakPolarHBondContact O-CA 3.5Å; S83-E85 PolarHBondContact O-N 2.87Å
84	K	77.3	Confident	58.1	Low	92 Å²	92	113.8 Å²	113.8	40%	0.4	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-68.2	123.6	155.6	-70.6	177.3	-175.6	165	0	106.9	E52 R53 N55	E52-K84 WeakPolarHBondContact O-CD 3.4Å; E52-K84 WeakPolarHBondContact O-CE 3.15Å; E52-K84 PolarHBondContact O-NZ 2.83Å; R53-K84 PolarHBondContact O-N 2.82Å; N55-K84 WeakPolarHBondContact OD1-CE 3.21Å
85	E	54.8	Low	55.4	Low	186 Å²	186	117.1 Å²	117.1	87%	0.869	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-68.5	133.3	167.2	-68.7	-178.9	156.8	0	0	108.1	S83 T87	S83-E85 PolarHBondContact O-N 2.87Å; E85-T87 PolarHBondContact O-N 3.08Å
86	V	42.2	Very low	52.7	Low	112 Å²	112	119.4 Å²	119.4	68%	0.679	68%	0.679	S	S	*	*			trans	-82.1	97.7	178	178.7	0	0	0	0	107.6	T88	V86-T88 PolarHBondContact O-N 2.78Å; V86-T88 VanDerWaalsContact O-N 3.08Å
87	T	32.5	Very low	50.2	Low	129 Å²	129	122.5 Å²	122.5	79%	0.791	68%	0.675	S	S	*	*			trans	-59.3	109.4	158.7	35.3	0	0	0	0	107.9	E85 L89	E85-T87 PolarHBondContact O-N 3.08Å; T87-L89 PolarHBondContact O-N 2.93Å
88	T	29.5	Very low	47.8	Very low	125 Å²	125	124.5 Å²	124.5	77%	0.767	69%	0.692	S	S	*	*			trans	-68.3	107.5	-179.8	47.2	0	0	0	0	109.7	V86 S90	V86-T88 PolarHBondContact O-N 2.78Å; V86-T88 VanDerWaalsContact O-N 3.08Å; T88-S90 PolarHBondContact O-N 2.9Å
89	L	26.7	Very low	45.2	Very low	161 Å²	161	125.6 Å²	125.6	84%	0.843	70%	0.703	S	S	*	*			trans	-52.8	111.4	164.4	-77.6	159.1	0	0	0	109.2	T87 S91	T87-L89 PolarHBondContact O-N 2.93Å; L89-S91 PolarHBondContact O-N 3.31Å
90	S	25.4	Very low	42.9	Very low	118 Å²	118	127.9 Å²	127.9	83%	0.825	72%	0.719	S	S	*	*			trans	-77	71.8	168.9	49	0	0	0	0	109.5	T88 K92	T88-S90 PolarHBondContact O-N 2.9Å; S90-K92 PolarHBondContact O-N 2.8Å; S90-K92 VanDerWaalsContact O-N 3.15Å
91	S	26.8	Very low	40.2	Very low	94 Å²	94	129.8 Å²	129.8	66%	0.657	73%	0.734	S	S	*	*			trans	-53.3	119.2	176.7	-62.2	0	0	0	0	110.8	L89 S93	L89-S91 PolarHBondContact O-N 3.31Å; S91-S93 VanDerWaalsContact C-N 3.25Å; S91-S93 PolarHBondContact O-N 2.8Å
92	K	23.6	Very low	37.4	Very low	210 Å²	210	132.1 Å²	132.1	91%	0.913	75%	0.746	S	S	*	*			trans	-70.2	83.3	165.3	-76.3	-177.7	175.7	176.9	0	109.3	S90	S90-K92 PolarHBondContact O-N 2.8Å; S90-K92 VanDerWaalsContact O-N 3.15Å
93	S	26.3	Very low	34.8	Very low	96 Å²	96	128 Å²	128	67%	0.671	75%	0.745	S	S	*	*			trans	-91.8	110.1	170	54.8	0	0	0	0	110.3	S91 A95	S91-S93 VanDerWaalsContact C-N 3.25Å; S91-S93 PolarHBondContact O-N 2.8Å; S93-A95 PolarHBondContact O-N 3.26Å; S93-A95 VanDerWaalsContact O-N 3.13Å
94	N	24.2	Very low	32.1	Very low	175 Å²	175	131.6 Å²	131.6	94%	0.936	76%	0.757	S	S	*	*			trans	-67.6	106.1	166.9	-73.9	-15.1	0	0	0	109.3
95	A	28.5	Very low	29.8	Very low	91 Å²	91	134 Å²	134	75%	0.752	78%	0.78	S	S	*	*			trans	-146.1	106.2	167.7	0	0	0	0	0	108.8	S93	S93-A95 PolarHBondContact O-N 3.26Å; S93-A95 VanDerWaalsContact O-N 3.13Å
96	S	25.7	Very low	28.5	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	77%	0.774	S	S	*	*			trans	-81.3	155.1	170.5	42.9	0	0	0	0	110.7
97	N	27	Very low	27.6	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	77%	0.77	S	S	*	*			trans	72.8	127.6	175.1	-45.4	-28.2	0	0	0	113.6
98	T	29.9	Very low	27.2	Very low	134 Å²	134	132.2 Å²	132.2	82%	0.822	77%	0.773	S	S	*	*			cis	-138.5	164.9	9.7	47.3	0	0	0	0	113.7
99	L	28.1	Very low	27.1	Very low	162 Å²	162	132.6 Å²	132.6	85%	0.848	78%	0.775	S	S	*	*			trans	-115	175	168.3	-109.2	76.1	0	0	0	108.4
100	P	37.5	Very low	27.3	Very low	98 Å²	98	132.8 Å²	132.8	64%	0.636	77%	0.769	S	S	*	*			cis	-137.4	-143.6	-25	36.8	-15.2	0	0	0	111.6
101	N	28.6	Very low	27.4	Very low	140 Å²	140	132.7 Å²	132.7	75%	0.749	77%	0.766	S	S	*	*			trans	85	137.6	162.9	-72.5	-5.4	0	0	0	118
102	N	28.3	Very low	27.3	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	76%	0.759	S	S	*	*			cis	-155.2	163.6	-5.5	-158.7	7.6	0	0	0	113.9
103	S	28	Very low	27.3	Very low	91 Å²	91	130 Å²	130	64%	0.636	75%	0.753	S	S	*	*			trans	54.2	131.6	144.2	58.5	0	0	0	0	122.7
104	N	23.4	Very low	27.2	Very low	163 Å²	163	128.8 Å²	128.8	87%	0.872	75%	0.745	S	S	*	*			trans	-68.8	154.4	167.2	-57.4	-55.7	0	0	0	113.7
105	T	29.7	Very low	27.1	Very low	143 Å²	143	130.5 Å²	130.5	88%	0.877	74%	0.738	S	S	*	*			trans	-143.9	145.4	144.4	-1.7	0	0	0	0	111.2
106	S	26.2	Very low	26.8	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	74%	0.736	S	S	*	*			trans	-106	174.6	166.5	68	0	0	0	0	108.4
107	C	24.8	Very low	26.8	Very low	88 Å²	88	135.5 Å²	135.5	60%	0.595	73%	0.732	S	S	*	*			cis	-163.7	-160.5	21.1	45	0	0	0	0	110
108	F	24	Very low	26.5	Very low	195 Å²	195	134 Å²	134	86%	0.855	72%	0.721	S	S	*	*			trans	75.8	139.4	177.9	-55.4	-74.6	0	0	0	116.2
109	T	25.7	Very low	26.1	Very low	132 Å²	132	137.1 Å²	137.1	81%	0.81	72%	0.717	S	S	*	*			cis	-129.1	158.7	-3.7	47.2	0	0	0	0	113.1
110	K	32.1	Very low	25.8	Very low	166 Å²	166	138.4 Å²	138.4	72%	0.722	72%	0.716	S	S	*	*			trans	-100.2	170.6	166.7	-120	-172.5	179.8	-162.7	0	109.1	D112	K110-D112 WeakPolarHBondContact CE-OD2 3.49Å; K110-D112 IonicContact NZ-OD2 2.96Å; K110-D112 PolarHBondContact NZ-OD2 3.25Å
111	P	27.8	Very low	25	Very low	116 Å²	116	141 Å²	141	75%	0.753	72%	0.724	S	S	*	*			cis	-135.3	170.1	48.8	39.6	-19.8	0	0	0	114.7
112	D	23.5	Very low	24.7	Very low	96 Å²	96	137.9 Å²	137.9	51%	0.513	71%	0.713	S	S	.	*			cis	68.2	126.5	46.8	-109.6	-43.3	0	0	0	111.7	K110	K110-D112 WeakPolarHBondContact CE-OD2 3.49Å; K110-D112 IonicContact NZ-OD2 2.96Å; K110-D112 PolarHBondContact NZ-OD2 3.25Å
113	L	24.6	Very low	24.4	Very low	150 Å²	150	141.4 Å²	141.4	79%	0.785	72%	0.722	S	S	*	*				-156.5	167.8	51.9	-83.4	159.7	0	0	0	115.6
114	S	23.3	Very low	24.2	Very low	72 Å²	72	140.4 Å²	140.4	50%	0.503	73%	0.726	S	S	.	*			trans	-46	173.5	164	47.4	0	0	0	0	118.1
115	W	21.5	Very low	24.3	Very low	211 Å²	211	136.9 Å²	136.9	80%	0.799	71%	0.711	S	S	*	*			cis	-157.1	172.6	38.5	-61.2	78.6	0	0	0	115.4
116	K	23.5	Very low	24.4	Very low	160 Å²	160	134.6 Å²	134.6	70%	0.696	70%	0.696	S	S	*	*			trans	-14.3	169.5	163.5	-41	173.4	-176.8	167.5	0	120.6
117	Q	24.5	Very low	24.3	Very low	136 Å²	136	134.4 Å²	134.4	64%	0.636	70%	0.695	S	S	*	*			cis	-168.9	140.8	23.6	-157.1	145.2	-24.5	0	0	116.5
118	E	21	Very low	24.8	Very low	121 Å²	121	139.9 Å²	139.9	57%	0.565	71%	0.709	S	S	*	*			trans	64.2	148.6	142.9	-83.4	177.1	-124.3	0	0	130.2
119	R	21.7	Very low	25	Very low	199 Å²	199	142 Å²	142	75%	0.751	71%	0.711	S	S	*	*			trans	83.8	128.5	155.7	-67.6	151.3	-153.1	-171.2	9.7	119
120	K	21.2	Very low	24.9	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	71%	0.708	S	S	*	*				76	128.2	61.8	-101	-173.5	179.4	-176.8	0	112
121	L	21.5	Very low	24.9	Very low	152 Å²	152	139.5 Å²	139.5	80%	0.796	71%	0.711	S	S	*	*			cis	-149.9	-169.2	26.5	-90.5	166.6	0	0	0	114.3
122	S	21.8	Very low	24.8	Very low	75 Å²	75	140.8 Å²	140.8	52%	0.524	71%	0.707	S	S	.	*			trans	-32.5	161.5	172.4	50.7	0	0	0	0	119.3
123	F	23.3	Very low	25.1	Very low	207 Å²	207	144.4 Å²	144.4	91%	0.908	72%	0.718	S	S	*	*			cis	-140.1	-159.4	39.3	-68.3	-88.5	0	0	0	112.6
124	G	23.5	Very low	25.1	Very low	70 Å²	70	145.6 Å²	145.6	72%	0.722	72%	0.724	S	S	*	*			cis	-173.3	-151.3	11	0	0	0	0	0	116
125	T	25.4	Very low	25.4	Very low	90 Å²	90	147.7 Å²	147.7	55%	0.552	73%	0.729	S	S	*	*			trans	-109.4	160.3	-165.2	46.6	0	0	0	0	115.7
126	V	31	Very low	25.9	Very low	94 Å²	94	145.2 Å²	145.2	57%	0.57	73%	0.731	S	S	*	*			trans	-144.3	134.7	154.8	176.2	0	0	0	0	109.7	R682	V126-R682 PolarHBondContact O-NE 3.29Å; V126-R682 PolarHBondContact O-NH1 2.77Å
127	S	25.6	Very low	26.3	Very low	104 Å²	104	144 Å²	144	73%	0.727	73%	0.73	S	S	*	*			trans	-122.9	162	167	-174.3	0	0	0	0	109.7
128	K	35.1	Very low	26.6	Very low	202 Å²	202	144.7 Å²	144.7	88%	0.878	74%	0.738	S	S	*	*			trans	-138.5	119.7	172.3	-110.8	-171.8	177	-175.7	0	111
129	R	26.5	Very low	26.9	Very low	240 Å²	240	145.6 Å²	145.6	91%	0.906	75%	0.747	S	S	*	*			trans	-95.3	160.6	169	-93.2	-174.9	174.2	174.2	-0.1	111.3
130	K	25.4	Very low	27.5	Very low	170 Å²	170	141.9 Å²	141.9	74%	0.739	75%	0.752	S	S	*	*			trans	-29.6	135.7	159.6	-164.8	-170	-157.9	-167.3	0	113.8	E132	K130-E132 HydrophobicContact CD-CG 4.19Å; K130-E132 WeakPolarHBondContact CE-OE1 3.5Å; K130-E132 HydrophobicContact CG-CG 4.27Å; K130-E132 IonicContact NZ-OE1 3.51Å; K130-E132 PolarHBondContact NZ-OE1 3.44Å
131	G	30.5	Very low	27.9	Very low	76 Å²	76	139.7 Å²	139.7	78%	0.784	76%	0.755	S	S	*	*			trans	-121.6	150	155.2	0	0	0	0	0	108.6
132	E	26.8	Very low	28.3	Very low	142 Å²	142	136.3 Å²	136.3	66%	0.664	76%	0.756	S	S	*	*			trans	-123.7	166.1	-176.6	-68.4	-173.7	164.6	0	0	112.2	K130	K130-E132 HydrophobicContact CD-CG 4.19Å; K130-E132 WeakPolarHBondContact CE-OE1 3.5Å; K130-E132 HydrophobicContact CG-CG 4.27Å; K130-E132 IonicContact NZ-OE1 3.51Å; K130-E132 PolarHBondContact NZ-OE1 3.44Å
133	K	28.8	Very low	28.6	Very low	172 Å²	172	136.6 Å²	136.6	75%	0.748	77%	0.771	S	S	*	*			trans	76.6	95.3	147.8	-149.9	174	-168.5	174.8	0	117.6	L135	K133-L135 HydrophobicContact CG-CD1 4.27Å; K133-L135 HydrophobicContact CG-CG 4.14Å
134	L	26.4	Very low	28.8	Very low	175 Å²	175	134.9 Å²	134.9	92%	0.916	77%	0.771	S	S	*	*				-114.9	138.3	126.5	-160.6	77.5	0	0	0	107.2
135	L	29.5	Very low	29.1	Very low	116 Å²	116	134.4 Å²	134.4	61%	0.607	77%	0.766	S	S	*	*			trans	-127.7	136.7	177.3	-77.5	175.7	0	0	0	110.6	K133	K133-L135 HydrophobicContact CG-CD1 4.27Å; K133-L135 HydrophobicContact CG-CG 4.14Å
136	L	30.3	Very low	29.2	Very low	159 Å²	159	139.1 Å²	139.1	83%	0.832	78%	0.782	S	S	*	*			trans	-116.8	120	142.6	-65.9	165	0	0	0	103.2
137	I	32.1	Very low	29.3	Very low	134 Å²	134	143.7 Å²	143.7	69%	0.687	79%	0.794	S	S	*	*				59.6	111.1	59.3	-53.8	177.7	0	0	0	108.4
138	N	31.4	Very low	29.5	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	80%	0.798	S	S	*	*			cis	-143.8	163.2	21	-136.8	10.8	0	0	0	114.3
139	D	27.5	Very low	28.9	Very low	140 Å²	140	145.6 Å²	145.6	75%	0.749	80%	0.795	S	S	*	*			trans	-79.2	163.8	176.1	-72.6	-69.4	0	0	0	114.3
140	S	33.7	Very low	29	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	79%	0.794	S	S	*	*			trans	-159.6	140.4	147	-78.4	0	0	0	0	110.5
141	T	30.1	Very low	28.9	Very low	143 Å²	143	142.1 Å²	142.1	88%	0.877	80%	0.797	S	S	*	*			trans	-148.2	136.4	-175.1	-67.1	0	0	0	0	112.2
142	G	29.2	Very low	28.9	Very low	81 Å²	81	145.9 Å²	145.9	84%	0.835	80%	0.8	S	S	*	*			trans	80.3	150.7	-178.7	0	0	0	0	0	113.6
143	G	28.6	Very low	28.9	Very low	80 Å²	80	148 Å²	148	83%	0.825	81%	0.809	S	S	*	*			cis	172.4	178.2	-0.6	0	0	0	0	0	109.4
144	N	28.6	Very low	29	Very low	172 Å²	172	143.2 Å²	143.2	92%	0.92	81%	0.81	S	S	*	*			cis	-164.2	153.9	-8.3	-177.6	41.4	0	0	0	110
145	G	29.6	Very low	29.2	Very low	59 Å²	59	140.9 Å²	140.9	61%	0.608	81%	0.808	S	S	*	*			trans	75.2	170.1	172.3	0	0	0	0	0	116.3
146	E	27.9	Very low	29.2	Very low	190 Å²	190	139.4 Å²	139.4	89%	0.888	81%	0.812	S	S	*	*			cis	-169.2	163.1	-20	-133.8	177.5	-171.8	0	0	108.8
147	K	32.8	Very low	29.1	Very low	190 Å²	190	137.3 Å²	137.3	83%	0.826	81%	0.806	S	S	*	*			trans	102.4	147.2	178.6	-65.7	177	175.6	177.8	0	116.9
148	Q	29.1	Very low	29	Very low	171 Å²	171	139.7 Å²	139.7	80%	0.799	81%	0.814	S	S	*	*			cis	-164.7	150.5	-26.4	-170.3	160.5	-8.7	0	0	107.9
149	E	22.6	Very low	28.8	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	81%	0.81	S	S	*	*			trans	-71.6	149.4	174	-63.9	179.3	116.2	0	0	112.5
150	M	27.9	Very low	28.9	Very low	183 Å²	183	135.8 Å²	135.8	90%	0.901	82%	0.815	S	S	*	*			trans	-148.9	123	148.4	-92.1	-125.1	65.4	0	0	110.1
151	L	23.6	Very low	28.8	Very low	153 Å²	153	133.9 Å²	133.9	80%	0.801	81%	0.807	S	S	*	*			trans	-84	151.4	168	-66.6	159.9	0	0	0	109.6
152	N	30.4	Very low	28.8	Very low	156 Å²	156	135.6 Å²	135.6	83%	0.834	81%	0.807	S	S	*	*			trans	-151.9	164.3	144.1	-151.5	6.4	0	0	0	112.5
153	E	28	Very low	29	Very low	185 Å²	185	137 Å²	137	86%	0.864	80%	0.804	S	S	*	*			trans	-89.1	165.4	-164.1	-59.4	178.2	142.8	0	0	113.6
154	G	30.5	Very low	29.1	Very low	73 Å²	73	136.8 Å²	136.8	75%	0.753	80%	0.802	S	S	*	*			cis	167.2	-137.1	-3.8	0	0	0	0	0	114.9
155	S	30.4	Very low	29.2	Very low	126 Å²	126	136.7 Å²	136.7	88%	0.881	80%	0.798	S	S	*	*			trans	-45	165.4	178.3	-71.4	0	0	0	0	118.1
156	A	29.5	Very low	29.3	Very low	85 Å²	85	140.9 Å²	140.9	70%	0.702	81%	0.807	S	S	*	*			cis	-172.9	163.9	-18.1	0	0	0	0	0	111.4
157	V	26.8	Very low	29.3	Very low	114 Å²	114	136.7 Å²	136.7	69%	0.691	80%	0.798	S	S	*	*			trans	32	124.3	144.6	179	0	0	0	0	120.4
158	H	31.2	Very low	29.2	Very low	184 Å²	184	133.9 Å²	133.9	85%	0.852	80%	0.797	S	S	*	*				-166.3	175.5	117.4	-104.8	-69.8	0	0	0	111.6
159	S	26.9	Very low	29.2	Very low	106 Å²	106	131.1 Å²	131.1	74%	0.741	80%	0.796	S	S	*	*			trans	-141.9	154.9	-158.9	-56	0	0	0	0	116
160	A	30.7	Very low	29.6	Very low	103 Å²	103	126.3 Å²	126.3	85%	0.851	79%	0.794	S	S	*	*			trans	69.9	164.8	160.5	0	0	0	0	0	116.3
161	A	30.5	Very low	29.6	Very low	82 Å²	82	129 Å²	129	68%	0.678	79%	0.794	S	S	*	*			cis	-154.8	170.9	8.1	0	0	0	0	0	112.8
162	M	31	Very low	30	Very low	180 Å²	180	131.2 Å²	131.2	89%	0.887	80%	0.797	S	S	*	*			trans	69.7	151.5	160.2	-49.4	-162.4	80.6	0	0	117.4
163	S	32.2	Very low	29.8	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	79%	0.791	S	S	*	*			cis	-165.8	149.3	-19.1	46.1	0	0	0	0	110.2
164	G	31	Very low	29.9	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	79%	0.794	S	S	*	*			trans	174.6	123.4	169.3	0	0	0	0	0	114.1
165	M	31.7	Very low	29.7	Very low	170 Å²	170	136.8 Å²	136.8	84%	0.837	80%	0.797	S	S	*	*			trans	-82.9	161.4	163	-61.9	127.8	63	0	0	108
166	D	29.9	Very low	29.8	Very low	148 Å²	148	141.6 Å²	141.6	79%	0.791	80%	0.796	S	S	*	*			cis	-157.6	177.8	44.8	-108.5	-54.8	0	0	0	113.8
167	S	28.2	Very low	29.7	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	80%	0.804	S	S	*	*			trans	-85.4	150.1	-176.8	68.2	0	0	0	0	115.4
168	V	32	Very low	29.7	Very low	132 Å²	132	149 Å²	149	80%	0.8	81%	0.814	S	S	*	*				-178.2	154.2	125.8	144	0	0	0	0	112.6
169	S	28.3	Very low	29.6	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	81%	0.807	S	S	*	*			trans	-17.4	131.5	-179.4	61.7	0	0	0	0	120.7
170	G	31.3	Very low	29.7	Very low	74 Å²	74	149.8 Å²	149.8	76%	0.763	81%	0.814	S	S	*	*			trans	-164.6	30.7	171.3	0	0	0	0	0	116.4	K172	G170-K172 PolarHBondContact O-N 3.14Å
171	R	27.4	Very low	29.5	Very low	239 Å²	239	151.6 Å²	151.6	90%	0.902	81%	0.809	S	S	*	*			trans	-71.5	98.9	-175.8	-172.1	-179.3	-174.2	166	3.5	111.5
172	K	31.4	Very low	29.4	Very low	201 Å²	201	152.5 Å²	152.5	87%	0.874	81%	0.811	S	S	*	*			trans	-113.5	132.1	172.6	-154.2	166.9	-170.8	174	0	110.9	G170 R174	G170-K172 PolarHBondContact O-N 3.14Å; K172-R174 PolarHBondContact O-N 2.69Å
173	E	26.3	Very low	29.6	Very low	153 Å²	153	152.9 Å²	152.9	72%	0.715	81%	0.81	S	S	*	*			trans	-59.6	128.2	-168.8	-143	68.6	-176.4	0	0	112.9	T175	E173-T175 PolarHBondContact O-N 3Å
174	R	30.5	Very low	29.9	Very low	242 Å²	242	154 Å²	154	91%	0.913	81%	0.806	S	S	*	*			trans	-89.1	97.5	167.2	-104.8	-178	165.6	153.8	-3.2	109.2	K172 R176	K172-R174 PolarHBondContact O-N 2.69Å; R174-R176 PolarHBondContact O-N 2.62Å; R174-R176 VanDerWaalsContact O-N 3.08Å
175	T	27.4	Very low	29.9	Very low	135 Å²	135	159.1 Å²	159.1	83%	0.828	81%	0.807	S	S	*	*			trans	-55.3	108.8	174.8	26.1	0	0	0	0	111.6	E173	E173-T175 PolarHBondContact O-N 3Å
176	R	31.7	Very low	30.1	Very low	227 Å²	227	154.2 Å²	154.2	86%	0.857	79%	0.788	S	S	*	*			trans	-80.7	121.6	162.1	-91.8	-174.3	166.5	-173.1	-3.3	109.1	R174 Y178	R174-R176 PolarHBondContact O-N 2.62Å; R174-R176 VanDerWaalsContact O-N 3.08Å; R176-Y178 PolarHBondContact O-N 3.08Å
177	S	27.5	Very low	30.3	Very low	123 Å²	123	152.3 Å²	152.3	86%	0.86	78%	0.778	S	S	*	*			trans	-61.4	117.4	179.4	-51.9	0	0	0	0	111.7	G179	S177-G179 PolarHBondContact O-N 2.69Å
178	Y	26.5	Very low	30.7	Very low	232 Å²	232	151.2 Å²	151.2	91%	0.91	77%	0.768	S	S	*	*			trans	-76.2	101.5	174.4	-92.4	-87.7	0	0	0	111.2	R176 R180	R176-Y178 PolarHBondContact O-N 3.08Å; Y178-R180 PolarHBondContact O-N 2.76Å
179	G	29.3	Very low	30.8	Very low	68 Å²	68	153 Å²	153	70%	0.701	77%	0.765	S	S	*	*			trans	-71.2	92	172.2	0	0	0	0	0	112.9	S177 L181	S177-G179 PolarHBondContact O-N 2.69Å; G179-L181 PolarHBondContact O-N 3.21Å
180	R	29.4	Very low	31.7	Very low	238 Å²	238	154.3 Å²	154.3	90%	0.898	76%	0.757	S	S	*	*	S	Bend	trans	52.6	54.4	144.8	-153.1	179.8	-162.3	167.7	5.6	117.2	Y178	Y178-R180 PolarHBondContact O-N 2.76Å
181	L	27	Very low	32.5	Very low	141 Å²	141	152.7 Å²	152.7	74%	0.738	73%	0.732	S	S	*	*			trans	-117	64.3	169.6	-78.7	173.6	0	0	0	112.2	G179 I184	G179-L181 PolarHBondContact O-N 3.21Å; L181-I184 HydrophobicContact CD2-CD1 4.17Å
182	S	27.4	Very low	33.6	Very low	102 Å²	102	145.1 Å²	145.1	71%	0.713	71%	0.713	S	S	*	*			trans	-122.5	35.7	-176.5	67.8	0	0	0	0	113.6
183	Q	34.5	Very low	34.9	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	70%	0.702	S	S	*	*	S	Bend	trans	-135.7	23.6	175.3	-72.8	-165.6	-38.5	0	0	113
184	I	40	Very low	36.8	Very low	131 Å²	131	137.3 Å²	137.3	67%	0.672	68%	0.68	S	S	*	*	S	Bend	trans	-122.5	37	178.3	-34.9	-178.2	0	0	0	111.2	L181	L181-I184 HydrophobicContact CD2-CD1 4.17Å
185	F	30.7	Very low	38.4	Very low	184 Å²	184	127 Å²	127	81%	0.807	65%	0.647	S	S	*	*	S	Bend	trans	-128.9	126.2	166.6	-68.5	-73.3	0	0	0	108.5
186	P	34.7	Very low	40.4	Very low	68 Å²	68	125 Å²	125	44%	0.442	63%	0.631	S	S	.	*			trans	-63.5	146.7	170.5	29.3	-33.8	0	0	0	109	P188 V191	P186-P188 VanDerWaalsContact O-CD 3.32Å; P186-P188 WeakPolarHBondContact O-CD 3.46Å; P186-P188 VanDerWaalsContact O-N 3.09Å; P186-V191 HydrophobicContact CB-CG2 4.17Å; P186-V191 HydrophobicContact CG-CG2 4.09Å
187	N	34	Very low	42.2	Very low	108 Å²	108	118.2 Å²	118.2	58%	0.578	61%	0.61	S	S	*	*			trans	-65.6	110.8	-174.8	-165.5	1.4	0	0	0	109.3	F189 K190	N187-F189 PolarHBondContact O-N 2.95Å; N187-K190 PolarHBondContact O-N 2.78Å
188	P	38.1	Very low	44	Very low	78 Å²	78	112.5 Å²	112.5	51%	0.506	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.1	-31.3	-157.9	20	-33.1	0	0	0	113.7	P186 K190 V191 V192	P186-P188 VanDerWaalsContact O-CD 3.32Å; P186-P188 WeakPolarHBondContact O-CD 3.46Å; P186-P188 VanDerWaalsContact O-N 3.09Å; P188-K190 PolarHBondContact O-N 2.7Å; P188-V191 WeakPolarHBondContact O-CB 3.39Å; P188-V191 PolarHBondContact O-N 3.11Å; P188-V192 PolarHBondContact O-N 2.76Å; P188-V192 VanDerWaalsContact O-N 3.1Å
189	F	33.1	Very low	46.1	Very low	168 Å²	168	103.3 Å²	103.3	74%	0.737	54%	0.537	S	S	*	.	H	α-helix	trans	-58.1	-31.6	175.5	-62.3	-79.4	0	0	0	113.7	N187 V191 D193	N187-F189 PolarHBondContact O-N 2.95Å; F189-V191 VanDerWaalsContact C-N 3.34Å; F189-D193 PolarHBondContact O-N 3.14Å
190	K	47.1	Very low	48	Very low	141 Å²	141	103.8 Å²	103.8	61%	0.613	53%	0.529	S	S	*	.	H	α-helix	trans	-81.4	-11.4	174.8	-71.4	-166.3	174.5	-172.2	0	114	N187 P188 R194	N187-K190 PolarHBondContact O-N 2.78Å; P188-K190 PolarHBondContact O-N 2.7Å; K190-R194 PolarHBondContact O-NH1 3.12Å
191	V	48.3	Very low	49.6	Very low	39 Å²	39	95 Å²	95	24%	0.236	50%	0.5	C	S	.	.	H	α-helix	trans	-87.3	-43.7	175	-172.2	0	0	0	0	109.5	P186 P188 F189 R194 A195	P186-V191 HydrophobicContact CB-CG2 4.17Å; P186-V191 HydrophobicContact CG-CG2 4.09Å; P188-V191 WeakPolarHBondContact O-CB 3.39Å; P188-V191 PolarHBondContact O-N 3.11Å; F189-V191 VanDerWaalsContact C-N 3.34Å; V191-R194 PolarHBondContact O-N 2.79Å; V191-A195 VanDerWaalsContact O-CB 3.3Å; V191-A195 WeakPolarHBondContact O-CB 3.47Å; V191-A195 PolarHBondContact O-N 2.9Å
192	V	50.2	Low	51.2	Low	81 Å²	81	88.5 Å²	88.5	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-59.2	-52.6	177.1	175.8	0	0	0	0	111.4	P188 R194 A195 D196	P188-V192 PolarHBondContact O-N 2.76Å; P188-V192 VanDerWaalsContact O-N 3.1Å; V192-R194 PolarHBondContact O-N 3.49Å; V192-R194 VanDerWaalsContact O-N 3.09Å; V192-A195 CarbonylContact O-C 3.59Å; V192-A195 WeakPolarHBondContact O-CA 3.25Å; V192-A195 WeakPolarHBondContact O-CB 3.32Å; V192-A195 PolarHBondContact O-N 3.15Å; V192-D196 WeakPolarHBondContact CG1-OD2 3.38Å; V192-D196 PolarHBondContact O-N 2.92Å
193	D	59.6	Low	52.6	Low	123 Å²	123	91.4 Å²	91.4	66%	0.658	47%	0.468	S	S	*	.	H	α-helix	trans	-55.6	-32.7	-177.9	-158.9	36.7	0	0	0	113.1	F189 M197	F189-D193 PolarHBondContact O-N 3.14Å; D193-M197 PolarHBondContact O-N 3.38Å
194	R	65.6	Low	53.3	Low	67 Å²	67	90.5 Å²	90.5	25%	0.253	46%	0.457	S	S	.	.	H	α-helix	trans	-83.7	-35	173.1	-63.3	-174.3	-171.6	113.3	-20.7	113.5	K190 V191 V192 D196 M197 L198 D374	K190-R194 PolarHBondContact O-NH1 3.12Å; V191-R194 PolarHBondContact O-N 2.79Å; V192-R194 PolarHBondContact O-N 3.49Å; V192-R194 VanDerWaalsContact O-N 3.09Å; R194-D196 VanDerWaalsContact C-N 3.33Å; R194-M197 PolarHBondContact O-N 3.46Å; R194-L198 WeakPolarHBondContact O-CB 3.46Å; R194-L198 WeakPolarHBondContact O-CG 3.39Å; R194-L198 PolarHBondContact O-N 2.95Å; R194-D374 IonicContact CZ-OD2 2.98Å; R194-D374 IonicContact NH1-OD2 3.81Å; R194-D374 PolarHBondContact NH1-OD2 3.47Å
195	A	64.6	Low	53.6	Low	26 Å²	26	85 Å²	85	22%	0.215	43%	0.428	C	S	.	.	H	α-helix	trans	-66.4	-36.5	177.5	0	0	0	0	0	111.4	V191 V192 L198 D199 W378	V191-A195 VanDerWaalsContact O-CB 3.3Å; V191-A195 WeakPolarHBondContact O-CB 3.47Å; V191-A195 PolarHBondContact O-N 2.9Å; V192-A195 CarbonylContact O-C 3.59Å; V192-A195 WeakPolarHBondContact O-CA 3.25Å; V192-A195 WeakPolarHBondContact O-CB 3.32Å; V192-A195 PolarHBondContact O-N 3.15Å; A195-L198 PolarHBondContact O-N 2.86Å; A195-D199 WeakPolarHBondContact O-CB 3.36Å; A195-D199 PolarHBondContact O-N 2.78Å; A195-W378 PolarHBondContact O-NE1 2.81Å
196	D	69.3	Low	54.7	Low	92 Å²	92	85.4 Å²	85.4	49%	0.492	43%	0.432	S	S	.	.	H	α-helix	trans	-72.6	-35.7	175.7	-65.9	-24.1	0	0	0	111.7	V192 R194 D199 S200	V192-D196 WeakPolarHBondContact CG1-OD2 3.38Å; V192-D196 PolarHBondContact O-N 2.92Å; R194-D196 VanDerWaalsContact C-N 3.33Å; D196-D199 PolarHBondContact O-N 3.41Å; D196-S200 WeakPolarHBondContact O-CB 3.28Å; D196-S200 PolarHBondContact O-N 3.33Å; D196-S200 PolarHBondContact O-OG 3.33Å
197	M	68.6	Low	56	Low	84 Å²	84	84.8 Å²	84.8	41%	0.414	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-43.1	170.7	-176	-179.9	-73.6	0	0	111.9	D193 R194 S200 L201 L282 L287	D193-M197 PolarHBondContact O-N 3.38Å; R194-M197 PolarHBondContact O-N 3.46Å; M197-S200 WeakPolarHBondContact O-CB 3.26Å; M197-S200 PolarHBondContact O-N 2.82Å; M197-L201 PolarHBondContact O-N 3.38Å; M197-L282 HydrophobicContact CG-CD2 4.12Å; M197-L282 HydrophobicContact SD-CD2 3.69Å; M197-L287 HydrophobicContact CE-CD1 4.23Å; M197-L287 HydrophobicContact SD-CD1 3.39Å; M197-L287 WeakPolarHBondContact SD-CD1 3.46Å
198	L	66.1	Low	57.5	Low	4 Å²	4	79.8 Å²	79.8	2%	0.021	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-45.4	172.8	-79.9	159.7	0	0	0	111.2	R194 A195 S200 L201 M202 L282 L375 W378	R194-L198 WeakPolarHBondContact O-CB 3.46Å; R194-L198 WeakPolarHBondContact O-CG 3.39Å; R194-L198 PolarHBondContact O-N 2.95Å; A195-L198 PolarHBondContact O-N 2.86Å; L198-S200 PolarHBondContact O-N 2.97Å; L198-L201 PolarHBondContact O-N 3.1Å; L198-M202 VanDerWaalsContact O-CB 3.23Å; L198-M202 WeakPolarHBondContact O-CB 3.46Å; L198-M202 PolarHBondContact O-N 3.48Å; L198-L282 HydrophobicContact CD2-CD1 3.52Å; L198-L282 HydrophobicContact CG-CD1 4.22Å; L198-L375 HydrophobicContact CD1-CD1 4.04Å; L198-L375 HydrophobicContact CD2-CD1 3.79Å; L198-W378 HydrophobicContact CB-CD2 3.85Å; L198-W378 HydrophobicContact CB-CG 4.06Å; L198-W378 HydrophobicContact CB-CZ2 4.03Å; L198-W378 HydrophobicContact CD1-CB 4.01Å; L198-W378 HydrophobicContact CD1-CD2 4.01Å; L198-W378 HydrophobicContact CD1-CG 3.69Å; L198-W378 HydrophobicContact CD2-CD2 4.43Å; L198-W378 HydrophobicContact CD2-CE3 4.43Å; L198-W378 HydrophobicContact CG-CD2 4.33Å; L198-W378 HydrophobicContact CG-CG 4.42Å
199	D	70.3	Confident	58.9	Low	39 Å²	39	78.9 Å²	78.9	21%	0.209	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-28.6	175.5	-89.2	35.4	0	0	0	112.5	A195 D196 M202 Q203 W378 R382	A195-D199 WeakPolarHBondContact O-CB 3.36Å; A195-D199 PolarHBondContact O-N 2.78Å; D196-D199 PolarHBondContact O-N 3.41Å; D199-M202 CarbonylContact O-C 3.55Å; D199-Q203 WeakPolarHBondContact O-CA 3.4Å; D199-Q203 VanDerWaalsContact O-CB 3.27Å; D199-Q203 WeakPolarHBondContact O-CB 3.44Å; D199-Q203 VanDerWaalsContact O-CG 3.3Å; D199-Q203 WeakPolarHBondContact O-CG 3.28Å; D199-Q203 PolarHBondContact O-N 2.84Å; D199-W378 WeakPolarHBondContact OD1-CZ2 3.37Å; D199-W378 PolarHBondContact OD1-NE1 2.79Å; D199-R382 VanDerWaalsContact CG-NH2 3.29Å; D199-R382 IonicContact OD1-CZ 2.72Å; D199-R382 IonicContact OD1-NE 3.51Å; D199-R382 IonicContact OD1-NH1 2.77Å; D199-R382 PolarHBondContact OD1-NH1 2.93Å; D199-R382 IonicContact OD1-NH2 3.22Å; D199-R382 PolarHBondContact OD1-NH2 2.99Å; D199-R382 IonicContact OD2-CZ 3.22Å; D199-R382 IonicContact OD2-NH1 2.75Å; D199-R382 PolarHBondContact OD2-NH1 2.93Å; D199-R382 IonicContact OD2-NH2 2.87Å; D199-R382 PolarHBondContact OD2-NH2 2.9Å
200	S	68.9	Low	60.8	Low	78 Å²	78	75.8 Å²	75.8	55%	0.545	38%	0.375	S	S	.	.	H	α-helix	trans	-72.8	-43.1	173.6	-60.1	0	0	0	0	112.1	D196 M197 L198 M202	D196-S200 WeakPolarHBondContact O-CB 3.28Å; D196-S200 PolarHBondContact O-N 3.33Å; D196-S200 PolarHBondContact O-OG 3.33Å; M197-S200 WeakPolarHBondContact O-CB 3.26Å; M197-S200 PolarHBondContact O-N 2.82Å; L198-S200 PolarHBondContact O-N 2.97Å; S200-M202 VanDerWaalsContact C-N 3.3Å; S200-M202 PolarHBondContact O-N 2.89Å
201	L	64.1	Low	62.2	Low	53 Å²	53	70.3 Å²	70.3	28%	0.277	35%	0.353	S	S	.	.	H	α-helix	trans	-71.6	-24.3	175	-71.5	173.2	0	0	0	113.1	M197 L198 T281 L282	M197-L201 PolarHBondContact O-N 3.38Å; L198-L201 PolarHBondContact O-N 3.1Å; L201-T281 HydrophobicContact CD2-CG2 4.16Å; L201-L282 HydrophobicContact CD1-CD1 4.11Å; L201-L282 HydrophobicContact CD1-CD2 3.55Å; L201-L282 HydrophobicContact CD1-CG 3.53Å
202	M	60.2	Low	63.2	Low	4 Å²	4	68.5 Å²	68.5	2%	0.02	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	18.3	-173.5	-68.6	-174.6	84.7	0	0	112.8	L198 D199 S200 W204 Q205 L275 C278 W378	L198-M202 VanDerWaalsContact O-CB 3.23Å; L198-M202 WeakPolarHBondContact O-CB 3.46Å; L198-M202 PolarHBondContact O-N 3.48Å; D199-M202 CarbonylContact O-C 3.55Å; S200-M202 VanDerWaalsContact C-N 3.3Å; S200-M202 PolarHBondContact O-N 2.89Å; M202-W204 PolarHBondContact O-N 2.63Å; M202-Q205 HydrophobicContact CB-CG 3.88Å; M202-Q205 VanDerWaalsContact CE-CD 3.42Å; M202-Q205 HydrophobicContact CE-CG 3.81Å; M202-Q205 HydrophobicContact CG-CG 4.41Å; M202-Q205 VanDerWaalsContact O-CB 3.24Å; M202-Q205 WeakPolarHBondContact O-CB 3.11Å; M202-Q205 WeakPolarHBondContact O-CG 3.2Å; M202-Q205 PolarHBondContact O-N 2.74Å; M202-Q205 VanDerWaalsContact O-N 3.12Å; M202-L275 HydrophobicContact CE-CB 3.9Å; M202-L275 HydrophobicContact CE-CD1 3.85Å; M202-L275 HydrophobicContact SD-CD1 4Å; M202-C278 HydrophobicContact CE-CB 4.35Å; M202-C278 HydrophobicContact CG-CB 3.83Å; M202-C278 VanDerWaalsContact CG-SG 3.55Å; M202-C278 HydrophobicContact SD-CB 3.6Å; M202-C278 PolarHBondContact SD-SG 3.3Å; M202-W378 HydrophobicContact CB-CH2 3.57Å; M202-W378 HydrophobicContact CB-CZ2 3.84Å; M202-W378 HydrophobicContact CE-CH2 3.9Å; M202-W378 HydrophobicContact CE-CZ3 4.03Å; M202-W378 HydrophobicContact CG-CH2 3.96Å; M202-W378 HydrophobicContact SD-CH2 3.28Å; M202-W378 WeakPolarHBondContact SD-CH2 3.4Å; M202-W378 HydrophobicContact SD-CZ2 4.24Å; M202-W378 HydrophobicContact SD-CZ3 3.48Å; M202-W378 WeakPolarHBondContact SD-CZ3 3.48Å
203	Q	56.3	Low	64.3	Low	164 Å²	164	64.8 Å²	64.8	77%	0.766	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.9	162.4	-111.2	175.5	31.2	0	0	112.3	D199 Q205	D199-Q203 WeakPolarHBondContact O-CA 3.4Å; D199-Q203 VanDerWaalsContact O-CB 3.27Å; D199-Q203 WeakPolarHBondContact O-CB 3.44Å; D199-Q203 VanDerWaalsContact O-CG 3.3Å; D199-Q203 WeakPolarHBondContact O-CG 3.28Å; D199-Q203 PolarHBondContact O-N 2.84Å; Q203-Q205 VanDerWaalsContact C-N 3.26Å; Q203-Q205 PolarHBondContact O-N 3.09Å
204	W	49.5	Very low	65.3	Low	169 Å²	169	61.7 Å²	61.7	64%	0.64	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.6	170.4	-53.1	80.6	0	0	0	112.9	M202 E206 E207	M202-W204 PolarHBondContact O-N 2.63Å; W204-E206 VanDerWaalsContact C-N 3.34Å; W204-E206 PolarHBondContact O-N 3.04Å; W204-E207 WeakPolarHBondContact O-CB 3.49Å; W204-E207 WeakPolarHBondContact O-CG 3.41Å; W204-E207 PolarHBondContact O-N 3.33Å
205	Q	47.3	Very low	65.8	Low	16 Å²	16	61.2 Å²	61.2	8%	0.075	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-64.6	-6.6	-163.5	-90	-145	-72.9	0	0	120.9	M202 Q203 E207 E274	M202-Q205 HydrophobicContact CB-CG 3.88Å; M202-Q205 VanDerWaalsContact CE-CD 3.42Å; M202-Q205 HydrophobicContact CE-CG 3.81Å; M202-Q205 HydrophobicContact CG-CG 4.41Å; M202-Q205 VanDerWaalsContact O-CB 3.24Å; M202-Q205 WeakPolarHBondContact O-CB 3.11Å; M202-Q205 WeakPolarHBondContact O-CG 3.2Å; M202-Q205 PolarHBondContact O-N 2.74Å; M202-Q205 VanDerWaalsContact O-N 3.12Å; Q203-Q205 VanDerWaalsContact C-N 3.26Å; Q203-Q205 PolarHBondContact O-N 3.09Å; Q205-E207 PolarHBondContact O-N 2.96Å; Q205-E274 VanDerWaalsContact CA-OE1 3.28Å; Q205-E274 WeakPolarHBondContact CA-OE1 3.38Å; Q205-E274 WeakPolarHBondContact CG-OE1 3.43Å; Q205-E274 PolarHBondContact N-OE1 2.9Å
206	E	52	Low	66	Low	191 Å²	191	62 Å²	62	89%	0.893	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-72.3	-5.1	164	-64.7	-167.9	158.1	0	0	111.2	W204 G208	W204-E206 VanDerWaalsContact C-N 3.34Å; W204-E206 PolarHBondContact O-N 3.04Å; E206-G208 VanDerWaalsContact C-N 3.32Å; E206-G208 PolarHBondContact O-N 2.89Å
207	E	63.4	Low	65.5	Low	55 Å²	55	63.3 Å²	63.3	26%	0.257	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-84.6	18.2	173.1	-60.6	-162.1	-177	0	0	115.3	W204 Q205 L209 K210 T211	W204-E207 WeakPolarHBondContact O-CB 3.49Å; W204-E207 WeakPolarHBondContact O-CG 3.41Å; W204-E207 PolarHBondContact O-N 3.33Å; Q205-E207 PolarHBondContact O-N 2.96Å; E207-L209 PolarHBondContact O-N 3.38Å; E207-K210 HydrophobicContact CB-CB 3.98Å; E207-K210 HydrophobicContact CB-CD 4.28Å; E207-K210 HydrophobicContact CB-CG 4.09Å; E207-K210 VanDerWaalsContact CD-NZ 3.3Å; E207-K210 HydrophobicContact CG-CB 4.32Å; E207-K210 HydrophobicContact CG-CD 3.68Å; E207-K210 HydrophobicContact CG-CG 4Å; E207-K210 CarbonylContact O-C 3.55Å; E207-K210 PolarHBondContact O-N 3.19Å; E207-K210 IonicContact OE1-NZ 3.54Å; E207-K210 PolarHBondContact OE1-NZ 2.88Å; E207-K210 IonicContact OE2-NZ 3.38Å; E207-T211 WeakPolarHBondContact O-CB 3.5Å; E207-T211 PolarHBondContact O-N 3.3Å; E207-T211 PolarHBondContact O-OG1 2.97Å
208	G	65	Low	64.3	Low	4 Å²	4	67.9 Å²	67.9	4%	0.041	33%	0.332	C	S	.	.	H	α-helix	trans	-52.3	-39.7	167.2	0	0	0	0	0	112.4	E206 A212 G270 S271	E206-G208 VanDerWaalsContact C-N 3.32Å; E206-G208 PolarHBondContact O-N 2.89Å; G208-A212 PolarHBondContact O-N 3.37Å; G208-A212 VanDerWaalsContact O-N 3.16Å; G208-G270 WeakPolarHBondContact O-CA 3.46Å; G208-S271 WeakPolarHBondContact CA-OG 3.36Å
209	L	67.3	Low	62.7	Low	59 Å²	59	72.8 Å²	72.8	31%	0.309	37%	0.366	S	S	.	.	H	α-helix	trans	-67	-42.4	171.7	177.2	63	0	0	0	112.7	E207 T211 A212 A213 L228 L263	E207-L209 PolarHBondContact O-N 3.38Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-A212 PolarHBondContact O-N 3.36Å; L209-A213 WeakPolarHBondContact O-CB 3.33Å; L209-A213 PolarHBondContact O-N 3.22Å; L209-L228 HydrophobicContact CD1-CB 3.74Å; L209-L228 HydrophobicContact CD1-CD1 3.64Å; L209-L228 HydrophobicContact CD1-CG 4.35Å; L209-L263 HydrophobicContact CD1-CD1 4.33Å
210	K	73.4	Confident	60.9	Low	103 Å²	103	79 Å²	79	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-73	-27.5	-179.6	-45.5	-169.7	-157.2	159.1	0	112.3	E207 A213 S214	E207-K210 HydrophobicContact CB-CB 3.98Å; E207-K210 HydrophobicContact CB-CD 4.28Å; E207-K210 HydrophobicContact CB-CG 4.09Å; E207-K210 VanDerWaalsContact CD-NZ 3.3Å; E207-K210 HydrophobicContact CG-CB 4.32Å; E207-K210 HydrophobicContact CG-CD 3.68Å; E207-K210 HydrophobicContact CG-CG 4Å; E207-K210 CarbonylContact O-C 3.55Å; E207-K210 PolarHBondContact O-N 3.19Å; E207-K210 IonicContact OE1-NZ 3.54Å; E207-K210 PolarHBondContact OE1-NZ 2.88Å; E207-K210 IonicContact OE2-NZ 3.38Å; K210-A213 CarbonylContact O-C 3.51Å; K210-A213 PolarHBondContact O-N 3.07Å; K210-S214 WeakPolarHBondContact O-CB 3.4Å; K210-S214 PolarHBondContact O-N 3.01Å
211	T	75.9	Confident	59.5	Low	26 Å²	26	78.2 Å²	78.2	16%	0.16	39%	0.394	C	S	.	.	H	α-helix	trans	-72	-34	172.6	-57.4	0	0	0	0	111.5	E207 L209 S214 G270 V273 E274	E207-T211 WeakPolarHBondContact O-CB 3.5Å; E207-T211 PolarHBondContact O-N 3.3Å; E207-T211 PolarHBondContact O-OG1 2.97Å; L209-T211 VanDerWaalsContact C-N 3.34Å; T211-S214 PolarHBondContact O-OG 3.41Å; T211-S214 VanDerWaalsContact O-OG 3.05Å; T211-G270 WeakPolarHBondContact CG2-O 3.43Å; T211-V273 HydrophobicContact CG2-CB 4.33Å; T211-V273 HydrophobicContact CG2-CG1 4.13Å; T211-E274 HydrophobicContact CG2-CB 4.15Å
212	A	70.4	Confident	58.8	Low	0 Å²	0	81.1 Å²	81.1	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-68.8	-42.1	166.1	0	0	0	0	0	111.2	G208 L209 S214 F215 L228 I266 L308	G208-A212 PolarHBondContact O-N 3.37Å; G208-A212 VanDerWaalsContact O-N 3.16Å; L209-A212 PolarHBondContact O-N 3.36Å; A212-S214 PolarHBondContact O-N 3.08Å; A212-F215 PolarHBondContact O-N 2.66Å; A212-L228 HydrophobicContact CB-CD1 4.43Å; A212-I266 HydrophobicContact CB-CG2 3.71Å; A212-L308 VanDerWaalsContact O-CD2 3.31Å; A212-L308 WeakPolarHBondContact O-CD2 3.33Å
213	A	73.1	Confident	58.4	Low	4 Å²	4	83.9 Å²	83.9	3%	0.033	43%	0.433	C	S	.	.	H	α-helix	trans	-69.6	-25	179.6	0	0	0	0	0	114.2	L209 K210 F215 L216 L228	L209-A213 WeakPolarHBondContact O-CB 3.33Å; L209-A213 PolarHBondContact O-N 3.22Å; K210-A213 CarbonylContact O-C 3.51Å; K210-A213 PolarHBondContact O-N 3.07Å; A213-F215 PolarHBondContact O-N 3.24Å; A213-L216 WeakPolarHBondContact O-CA 3.25Å; A213-L216 WeakPolarHBondContact O-CB 3.08Å; A213-L216 PolarHBondContact O-N 3.5Å; A213-L228 HydrophobicContact CB-CD1 4.02Å
214	S	79.8	Confident	58.4	Low	58 Å²	58	76.4 Å²	76.4	41%	0.406	40%	0.401	S	S	.	.	H	α-helix	trans	-69.2	-24.1	177	67.1	0	0	0	0	112.2	K210 T211 A212 L216 Q217	K210-S214 WeakPolarHBondContact O-CB 3.4Å; K210-S214 PolarHBondContact O-N 3.01Å; T211-S214 PolarHBondContact O-OG 3.41Å; T211-S214 VanDerWaalsContact O-OG 3.05Å; A212-S214 PolarHBondContact O-N 3.08Å; S214-L216 PolarHBondContact O-N 2.8Å; S214-Q217 WeakPolarHBondContact O-CB 3.35Å; S214-Q217 PolarHBondContact O-N 2.68Å
215	F	76.2	Confident	58.9	Low	56 Å²	56	71.3 Å²	71.3	25%	0.246	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-7.6	166.8	-68.8	-53.8	0	0	0	114.2	A212 A213 V273 C304 R305 L308	A212-F215 PolarHBondContact O-N 2.66Å; A213-F215 PolarHBondContact O-N 3.24Å; F215-V273 HydrophobicContact CE2-CB 4.49Å; F215-V273 HydrophobicContact CE2-CG1 3.88Å; F215-V273 HydrophobicContact CE2-CG2 4.29Å; F215-V273 HydrophobicContact CZ-CG1 3.76Å; F215-C304 HydrophobicContact CD2-CB 4.3Å; F215-C304 HydrophobicContact CE2-CB 3.98Å; F215-R305 HydrophobicContact CB-CG 4.16Å; F215-R305 HydrophobicContact CD1-CG 4.01Å; F215-R305 HydrophobicContact CD2-CG 4.36Å; F215-R305 HydrophobicContact CE1-CG 4.47Å; F215-R305 HydrophobicContact CG-CG 3.94Å; F215-L308 HydrophobicContact CB-CD2 3.57Å
216	L	68.5	Low	60.1	Low	43 Å²	43	76.7 Å²	76.7	23%	0.225	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.6	166.8	-56.6	174.5	0	0	0	112.6	A213 S214 E218 G224 V227 L228 L308 L312	A213-L216 WeakPolarHBondContact O-CA 3.25Å; A213-L216 WeakPolarHBondContact O-CB 3.08Å; A213-L216 PolarHBondContact O-N 3.5Å; S214-L216 PolarHBondContact O-N 2.8Å; L216-E218 VanDerWaalsContact C-N 3.3Å; L216-E218 PolarHBondContact O-N 2.76Å; L216-G224 WeakPolarHBondContact CD1-O 3.29Å; L216-V227 HydrophobicContact CD1-CB 4.38Å; L216-L228 HydrophobicContact CD1-CG 4.37Å; L216-L308 HydrophobicContact CD1-CD1 4.37Å; L216-L308 HydrophobicContact CD2-CD1 3.8Å; L216-L308 HydrophobicContact CD2-CD2 3.67Å; L216-L308 HydrophobicContact CD2-CG 3.64Å; L216-L308 HydrophobicContact CG-CD1 4.11Å; L216-L308 HydrophobicContact CG-CD2 3.98Å; L216-L308 HydrophobicContact CG-CG 4.28Å; L216-L312 HydrophobicContact CD2-CD1 3.71Å; L216-L312 HydrophobicContact CD2-CD2 4.02Å; L216-L312 HydrophobicContact CD2-CG 4.14Å
217	Q	58.7	Low	61.4	Low	119 Å²	119	69 Å²	69	56%	0.556	38%	0.381	S	S	*	.			trans	-88.8	57.5	-167.7	-67.1	-170.8	-37.7	0	0	113.7	S214 S219	S214-Q217 WeakPolarHBondContact O-CB 3.35Å; S214-Q217 PolarHBondContact O-N 2.68Å; Q217-S219 PolarHBondContact O-N 3.24Å
218	E	44.2	Very low	62.3	Low	181 Å²	181	66.5 Å²	66.5	85%	0.846	37%	0.369	S	S	*	.	S	Bend	trans	-84	100.3	153.1	-69.9	-171.1	179.4	0	0	108.5	L216	L216-E218 VanDerWaalsContact C-N 3.3Å; L216-E218 PolarHBondContact O-N 2.76Å
219	S	31.3	Very low	63.3	Low	106 Å²	106	72 Å²	72	74%	0.741	39%	0.392	S	S	*	.	S	Bend	trans	75.9	108.5	-179.1	74.1	0	0	0	0	118.6	Q217 S221	Q217-S219 PolarHBondContact O-N 3.24Å; S219-S221 PolarHBondContact O-N 3.48Å; S219-S221 VanDerWaalsContact O-N 3.12Å
220	N	33.3	Very low	64.4	Low	171 Å²	171	70.6 Å²	70.6	91%	0.914	39%	0.385	S	S	*	.	S	Bend	trans	25.8	66.4	147.6	-62.5	-1.6	0	0	0	119.5
221	S	39.3	Very low	65.3	Low	60 Å²	60	67.2 Å²	67.2	42%	0.42	37%	0.371	S	S	.	.			trans	-149	139.5	158	-166.8	0	0	0	0	112.7	S219 T223	S219-S221 PolarHBondContact O-N 3.48Å; S219-S221 VanDerWaalsContact O-N 3.12Å; S221-T223 PolarHBondContact O-N 2.76Å; S221-T223 PolarHBondContact OG-OG1 2.79Å
222	P	48.6	Very low	65.9	Low	115 Å²	115	73.6 Å²	73.6	75%	0.747	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	2.6	179.1	30.6	-36	0	0	0	114.5	G224	P222-G224 VanDerWaalsContact C-N 3.29Å; P222-G224 PolarHBondContact O-N 3.49Å
223	T	53.6	Low	66.9	Low	61 Å²	61	76.9 Å²	76.9	37%	0.374	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-15.8	-176.6	19	0	0	0	0	115.5	S221 C225 Q226 V227	S221-T223 PolarHBondContact O-N 2.76Å; S221-T223 PolarHBondContact OG-OG1 2.79Å; T223-C225 VanDerWaalsContact C-N 3.32Å; T223-C225 PolarHBondContact O-N 3.5Å; T223-C225 VanDerWaalsContact O-N 3.17Å; T223-Q226 WeakPolarHBondContact O-CA 3.16Å; T223-Q226 WeakPolarHBondContact O-CB 3.49Å; T223-Q226 PolarHBondContact O-N 3.42Å; T223-V227 PolarHBondContact O-N 3.11Å; T223-V227 VanDerWaalsContact O-N 3.1Å
224	G	55.9	Low	67.8	Low	8 Å²	8	76.7 Å²	76.7	8%	0.082	42%	0.418	C	S	.	.	H	α-helix	trans	-51.4	-44.7	-172	0	0	0	0	0	114.5	L216 P222	L216-G224 WeakPolarHBondContact CD1-O 3.29Å; P222-G224 VanDerWaalsContact C-N 3.29Å; P222-G224 PolarHBondContact O-N 3.49Å
225	C	59.3	Low	68.4	Low	62 Å²	62	78.4 Å²	78.4	42%	0.419	42%	0.419	S	S	.	.	H	α-helix	trans	-74.2	-24.2	176.6	-62.7	0	0	0	0	113.7	T223 L228 F229	T223-C225 VanDerWaalsContact C-N 3.32Å; T223-C225 PolarHBondContact O-N 3.5Å; T223-C225 VanDerWaalsContact O-N 3.17Å; C225-L228 PolarHBondContact O-N 2.85Å; C225-F229 PolarHBondContact O-N 3.07Å
226	Q	71.9	Confident	69	Low	128 Å²	128	80.5 Å²	80.5	60%	0.598	44%	0.437	S	S	*	.	H	α-helix	trans	-73.1	-34.3	176.7	-59.7	-179.5	-7.3	0	0	111.5	T223 L228 F229	T223-Q226 WeakPolarHBondContact O-CA 3.16Å; T223-Q226 WeakPolarHBondContact O-CB 3.49Å; T223-Q226 PolarHBondContact O-N 3.42Å; Q226-L228 PolarHBondContact O-N 3.32Å; Q226-F229 VanDerWaalsContact O-CB 3.26Å; Q226-F229 WeakPolarHBondContact O-CB 3.22Å; Q226-F229 PolarHBondContact O-N 3.15Å; Q226-F229 VanDerWaalsContact O-N 3.09Å
227	V	79.3	Confident	70	Confident	30 Å²	30	79 Å²	79	18%	0.182	43%	0.429	C	S	.	.	H	α-helix	trans	-67.4	-23.7	176.3	177.8	0	0	0	0	112.1	L216 T223 W311 L312 H316	L216-V227 HydrophobicContact CD1-CB 4.38Å; T223-V227 PolarHBondContact O-N 3.11Å; T223-V227 VanDerWaalsContact O-N 3.1Å; V227-W311 PolarHBondContact O-NE1 3.01Å; V227-L312 HydrophobicContact CG1-CD2 3.44Å; V227-L312 VanDerWaalsContact CG1-CD2 3.44Å; V227-H316 PolarHBondContact O-CD2 3.03Å
228	L	83.7	Confident	71.5	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	8.2	173.4	-56.9	-175.5	0	0	0	113.4	L209 A212 A213 L216 C225 Q226 L263 L308 W311	L209-L228 HydrophobicContact CD1-CB 3.74Å; L209-L228 HydrophobicContact CD1-CD1 3.64Å; L209-L228 HydrophobicContact CD1-CG 4.35Å; A212-L228 HydrophobicContact CB-CD1 4.43Å; A213-L228 HydrophobicContact CB-CD1 4.02Å; L216-L228 HydrophobicContact CD1-CG 4.37Å; C225-L228 PolarHBondContact O-N 2.85Å; Q226-L228 PolarHBondContact O-N 3.32Å; L228-L263 HydrophobicContact CB-CD1 4.15Å; L228-L263 WeakPolarHBondContact O-CD2 3.48Å; L228-L308 HydrophobicContact CD1-CD1 4.19Å; L228-L308 HydrophobicContact CD2-CD1 3.85Å; L228-W311 HydrophobicContact CD2-CD2 4.49Å; L228-W311 HydrophobicContact CD2-CG 4.17Å
229	F	86	Confident	73.3	Confident	119 Å²	119	71.9 Å²	71.9	52%	0.522	39%	0.393	S	S	.	.			trans	-70.5	135.3	173.8	176.6	-98.1	0	0	0	110.8	C225 Q226 E231 R323	C225-F229 PolarHBondContact O-N 3.07Å; Q226-F229 VanDerWaalsContact O-CB 3.26Å; Q226-F229 WeakPolarHBondContact O-CB 3.22Å; Q226-F229 PolarHBondContact O-N 3.15Å; Q226-F229 VanDerWaalsContact O-N 3.09Å; F229-E231 HydrophobicContact CE1-CG 4.09Å; F229-R323 PolarHBondContact O-NH2 2.9Å
230	L	90	Very high	75.7	Confident	30 Å²	30	70.3 Å²	70.3	16%	0.157	38%	0.382	C	S	.	.			trans	-139.8	139.5	175.3	-170.7	66.6	0	0	0	109	W256 I259 T260 L263 W311 L319	L230-W256 HydrophobicContact CD1-CH2 3.53Å; L230-W256 HydrophobicContact CD1-CZ2 4.17Å; L230-W256 HydrophobicContact CD1-CZ3 3.91Å; L230-W256 HydrophobicContact CG-CH2 4.05Å; L230-W256 HydrophobicContact CG-CZ2 4.21Å; L230-I259 HydrophobicContact CD1-CG2 3.7Å; L230-I259 HydrophobicContact CD2-CG2 3.91Å; L230-I259 HydrophobicContact CG-CG2 4.5Å; L230-T260 HydrophobicContact CD2-CG2 3.82Å; L230-L263 HydrophobicContact CB-CD2 3.53Å; L230-L263 HydrophobicContact CD2-CB 4.45Å; L230-L263 HydrophobicContact CD2-CD2 3.89Å; L230-L263 HydrophobicContact CG-CD2 4.37Å; L230-W311 HydrophobicContact CD1-CH2 4.47Å; L230-W311 HydrophobicContact CD2-CH2 4.46Å; L230-L319 HydrophobicContact CD1-CD1 3.77Å; L230-L319 HydrophobicContact CD1-CD2 3.92Å
231	E	91.3	Very high	77.5	Confident	33 Å²	33	62.4 Å²	62.4	15%	0.154	34%	0.341	C	S	.	.			trans	-72.1	168.3	174.4	-59.2	81	172.7	0	0	110.9	F229 T236 I237 W256 R323	F229-E231 HydrophobicContact CE1-CG 4.09Å; E231-T236 HydrophobicContact CB-CG2 4.3Å; E231-T236 HydrophobicContact CG-CG2 4.06Å; E231-I237 HydrophobicContact CG-CG1 4.17Å; E231-I237 WeakPolarHBondContact OE2-CD1 3.32Å; E231-W256 HydrophobicContact CB-CH2 4.27Å; E231-W256 HydrophobicContact CB-CZ2 4.42Å; E231-W256 VanDerWaalsContact O-CZ2 3.29Å; E231-W256 WeakPolarHBondContact O-CZ2 3.02Å; E231-R323 VanDerWaalsContact CD-NH2 3.32Å; E231-R323 IonicContact OE1-CZ 2.95Å; E231-R323 IonicContact OE1-NE 3.34Å; E231-R323 PolarHBondContact OE1-NE 2.96Å; E231-R323 IonicContact OE1-NH2 3.16Å; E231-R323 PolarHBondContact OE1-NH2 3.46Å; E231-R323 IonicContact OE2-CZ 3.38Å; E231-R323 IonicContact OE2-NE 3.77Å; E231-R323 IonicContact OE2-NH2 2.67Å; E231-R323 PolarHBondContact OE2-NH2 3.26Å
232	D	89	Confident	79.3	Confident	159 Å²	159	67.9 Å²	67.9	85%	0.85	36%	0.361	S	S	*	.	S	Bend	trans	-71.8	-34.9	177.1	-55.9	-69.8	0	0	0	112.8	W256	D232-W256 PolarHBondContact O-NE1 2.93Å
233	H	91.5	Very high	81	Confident	69 Å²	69	70.2 Å²	70.2	32%	0.319	36%	0.361	S	S	.	.			trans	-145.1	146.5	-173.4	-158.4	-127.1	0	0	0	113.4	Q235 T236	H233-Q235 PolarHBondContact CE1-OE1 3.36Å; H233-Q235 PolarHBondContact ND1-OE1 3.16Å; H233-Q235 PolarHBondContact O-N 2.9Å; H233-Q235 VanDerWaalsContact O-N 3.15Å; H233-T236 WeakPolarHBondContact O-CB 3.45Å; H233-T236 PolarHBondContact O-N 3.01Å; H233-T236 PolarHBondContact O-OG1 2.86Å
234	W	92.9	Very high	82.6	Confident	1 Å²	1	68.7 Å²	68.7	0%	0.004	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-59.6	-28.7	-178.1	63.7	-95.3	0	0	0	113.3	T236 I237 V238 L244 Q249 Q252 W256 L329	W234-T236 PolarHBondContact O-N 2.86Å; W234-I237 PolarHBondContact O-N 2.97Å; W234-V238 HydrophobicContact CE3-CB 3.82Å; W234-V238 HydrophobicContact CE3-CG1 4.37Å; W234-V238 HydrophobicContact CE3-CG2 3.88Å; W234-V238 HydrophobicContact CZ3-CB 4.02Å; W234-V238 HydrophobicContact CZ3-CG1 4.13Å; W234-V238 HydrophobicContact CZ3-CG2 4.45Å; W234-V238 WeakPolarHBondContact O-CG2 3.37Å; W234-V238 PolarHBondContact O-N 2.89Å; W234-L244 HydrophobicContact CH2-CD1 4Å; W234-L244 HydrophobicContact CZ3-CD1 3.84Å; W234-Q249 HydrophobicContact CH2-CG 4.2Å; W234-Q249 HydrophobicContact CZ2-CB 4.39Å; W234-Q249 HydrophobicContact CZ2-CG 4.36Å; W234-Q252 HydrophobicContact CD2-CB 3.71Å; W234-Q252 HydrophobicContact CE3-CB 3.91Å; W234-Q252 HydrophobicContact CE3-CG 4.21Å; W234-Q252 HydrophobicContact CG-CB 4.2Å; W234-Q252 HydrophobicContact CH2-CB 4.3Å; W234-Q252 HydrophobicContact CZ2-CB 4.09Å; W234-Q252 HydrophobicContact CZ3-CB 4.21Å; W234-Q252 HydrophobicContact CZ3-CG 4.22Å; W234-W256 HydrophobicContact CB-CB 4.26Å; W234-W256 HydrophobicContact CB-CD2 3.72Å; W234-W256 HydrophobicContact CB-CE3 3.64Å; W234-W256 HydrophobicContact CB-CG 4.01Å; W234-W256 HydrophobicContact CB-CZ3 4.2Å; W234-W256 VanDerWaalsContact N-CE2 3.34Å; W234-L329 HydrophobicContact CB-CD1 4.09Å
235	Q	91	Very high	84.2	Confident	93 Å²	93	71 Å²	71	44%	0.435	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-64.7	-21.8	177.4	-69.5	171.7	-32.7	0	0	113.6	H233 I237	H233-Q235 PolarHBondContact CE1-OE1 3.36Å; H233-Q235 PolarHBondContact ND1-OE1 3.16Å; H233-Q235 PolarHBondContact O-N 2.9Å; H233-Q235 VanDerWaalsContact O-N 3.15Å; Q235-I237 PolarHBondContact O-N 2.95Å
236	T	89.9	Confident	85.7	Confident	101 Å²	101	78.3 Å²	78.3	62%	0.62	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-66.8	-25.7	172.8	-51.1	0	0	0	0	111.6	E231 H233 W234	E231-T236 HydrophobicContact CB-CG2 4.3Å; E231-T236 HydrophobicContact CG-CG2 4.06Å; H233-T236 WeakPolarHBondContact O-CB 3.45Å; H233-T236 PolarHBondContact O-N 3.01Å; H233-T236 PolarHBondContact O-OG1 2.86Å; W234-T236 PolarHBondContact O-N 2.86Å
237	I	90	Very high	86.6	Confident	10 Å²	10	76.3 Å²	76.3	5%	0.051	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-45.2	179.8	-47.2	-178.8	0	0	0	111	E231 W234 Q235 K239 W256 L319 S322 R323	E231-I237 HydrophobicContact CG-CG1 4.17Å; E231-I237 WeakPolarHBondContact OE2-CD1 3.32Å; W234-I237 PolarHBondContact O-N 2.97Å; Q235-I237 PolarHBondContact O-N 2.95Å; I237-K239 PolarHBondContact O-N 2.95Å; I237-W256 HydrophobicContact CD1-CH2 3.78Å; I237-W256 HydrophobicContact CD1-CZ3 3.71Å; I237-L319 HydrophobicContact CD1-CD2 3.86Å; I237-S322 VanDerWaalsContact CG2-C 3.4Å; I237-R323 HydrophobicContact CD1-CG 4.36Å; I237-R323 HydrophobicContact CG2-CB 4.3Å; I237-R323 HydrophobicContact CG2-CG 3.78Å
238	V	90.2	Very high	87.2	Confident	3 Å²	3	78.1 Å²	78.1	2%	0.018	38%	0.38	C	S	.	.	S	Bend	trans	-86	103	-171.7	-178.4	0	0	0	0	110.9	W234 G241 L244 P328	W234-V238 HydrophobicContact CE3-CB 3.82Å; W234-V238 HydrophobicContact CE3-CG1 4.37Å; W234-V238 HydrophobicContact CE3-CG2 3.88Å; W234-V238 HydrophobicContact CZ3-CB 4.02Å; W234-V238 HydrophobicContact CZ3-CG1 4.13Å; W234-V238 HydrophobicContact CZ3-CG2 4.45Å; W234-V238 WeakPolarHBondContact O-CG2 3.37Å; W234-V238 PolarHBondContact O-N 2.89Å; V238-G241 PolarHBondContact O-N 3.06Å; V238-L244 HydrophobicContact CG1-CD1 4.3Å; V238-P328 HydrophobicContact CG1-CB 4.29Å; V238-P328 HydrophobicContact CG1-CG 3.93Å
239	K	82.3	Confident	87.7	Confident	148 Å²	148	79.9 Å²	79.9	64%	0.643	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	138.1	175.3	-63.4	177.1	-172.8	167.7	0	109.5	I237 G241 G326	I237-K239 PolarHBondContact O-N 2.95Å; K239-G241 VanDerWaalsContact C-N 3.26Å; K239-G241 PolarHBondContact O-N 3.34Å; K239-G326 PolarHBondContact N-O 3.28Å
240	S	80	Confident	88.1	Confident	73 Å²	73	79.7 Å²	79.7	51%	0.51	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	27	-175.7	-55.2	0	0	0	0	115.3	E242 Q243	S240-E242 PolarHBondContact O-N 2.84Å; S240-Q243 WeakPolarHBondContact O-CB 3.3Å; S240-Q243 PolarHBondContact O-N 3.16Å
241	G	72.9	Confident	88.3	Confident	5 Å²	5	78.8 Å²	78.8	5%	0.052	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-55.3	-23.9	178.3	0	0	0	0	0	115.6	V238 K239 Q243 L244 Q249	V238-G241 PolarHBondContact O-N 3.06Å; K239-G241 VanDerWaalsContact C-N 3.26Å; K239-G241 PolarHBondContact O-N 3.34Å; G241-Q243 VanDerWaalsContact C-N 3.3Å; G241-Q243 PolarHBondContact O-N 2.91Å; G241-L244 WeakPolarHBondContact O-CB 3.48Å; G241-L244 PolarHBondContact O-N 3.41Å; G241-Q249 PolarHBondContact O-NE2 3.35Å
242	E	76.4	Confident	88.5	Confident	176 Å²	176	77.3 Å²	77.3	82%	0.822	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.3	-26.7	172.9	-60.8	-176.7	160.9	0	0	113.5	S240 L244	S240-E242 PolarHBondContact O-N 2.84Å; E242-L244 VanDerWaalsContact C-N 3.32Å
243	Q	83.8	Confident	88.8	Confident	164 Å²	164	74.3 Å²	74.3	77%	0.766	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-83.5	-9	-179.3	-58.6	178.8	-4.7	0	0	112.8	S240 G241	S240-Q243 WeakPolarHBondContact O-CB 3.3Å; S240-Q243 PolarHBondContact O-N 3.16Å; G241-Q243 VanDerWaalsContact C-N 3.3Å; G241-Q243 PolarHBondContact O-N 2.91Å
244	L	86.4	Confident	89	Confident	29 Å²	29	71.3 Å²	71.3	15%	0.152	34%	0.344	C	S	.	.	S	Bend	trans	-68	145.1	174.3	-64.2	176.7	0	0	0	110.8	W234 V238 G241 E242 Q248 Q249 Q252 P328	W234-L244 HydrophobicContact CH2-CD1 4Å; W234-L244 HydrophobicContact CZ3-CD1 3.84Å; V238-L244 HydrophobicContact CG1-CD1 4.3Å; G241-L244 WeakPolarHBondContact O-CB 3.48Å; G241-L244 PolarHBondContact O-N 3.41Å; E242-L244 VanDerWaalsContact C-N 3.32Å; L244-Q248 HydrophobicContact CB-CB 4.12Å; L244-Q249 HydrophobicContact CB-CG 3.89Å; L244-Q249 PolarHBondContact O-NE2 3.41Å; L244-Q252 HydrophobicContact CD1-CG 4.11Å; L244-P328 HydrophobicContact CD1-CG 4.2Å; L244-P328 HydrophobicContact CD2-CG 3.93Å
245	S	90.3	Very high	89.2	Confident	55 Å²	55	71.3 Å²	71.3	39%	0.385	34%	0.344	S	S	.	.			trans	-62.3	151.1	173.7	69.1	0	0	0	0	111.1	K247 Q248 Q249	S245-K247 PolarHBondContact O-N 2.92Å; S245-Q248 CarbonylContact O-C 3.58Å; S245-Q248 WeakPolarHBondContact O-CA 3.11Å; S245-Q248 WeakPolarHBondContact O-CB 3.37Å; S245-Q248 PolarHBondContact O-N 3.24Å; S245-Q248 WeakPolarHBondContact OG-CG 3.43Å; S245-Q248 PolarHBondContact OG-N 3.03Å; S245-Q248 PolarHBondContact OG-OE1 3.15Å; S245-Q249 PolarHBondContact O-N 3.12Å
246	R	91.2	Very high	89.4	Confident	216 Å²	216	67.6 Å²	67.6	82%	0.815	33%	0.326	S	S	*	.	H	α-helix	trans	-52.1	-27.5	176.4	-74.4	-175.4	176.5	178	-0.8	114.1	K250	R246-K250 WeakPolarHBondContact O-CG 3.42Å; R246-K250 PolarHBondContact O-N 2.98Å
247	K	91.3	Very high	89.8	Confident	86 Å²	86	67.7 Å²	67.7	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-76.3	-42.4	176.4	-177.9	163.8	-176.5	-165.5	0	111.5	S245 K250 Q251 N413 N414 S415 T416	S245-K247 PolarHBondContact O-N 2.92Å; K247-K250 PolarHBondContact O-N 2.82Å; K247-Q251 PolarHBondContact O-N 2.94Å; K247-N413 WeakPolarHBondContact CE-O 3.42Å; K247-N413 PolarHBondContact NZ-O 3.05Å; K247-N414 VanDerWaalsContact CE-O 3.22Å; K247-N414 WeakPolarHBondContact CE-O 3.23Å; K247-N414 WeakPolarHBondContact CG-O 3.42Å; K247-S415 WeakPolarHBondContact CE-O 3.35Å; K247-S415 PolarHBondContact NZ-O 2.93Å; K247-T416 HydrophobicContact CD-CG2 3.56Å; K247-T416 HydrophobicContact CG-CG2 4.12Å
248	Q	91.3	Very high	90.1	Very high	68 Å²	68	67.3 Å²	67.3	32%	0.318	32%	0.318	S	S	.	.	H	α-helix	trans	-64.8	-39.1	171	-71.4	162	-58.6	0	0	112.2	L244 S245 K250 Q251 Q252	L244-Q248 HydrophobicContact CB-CB 4.12Å; S245-Q248 CarbonylContact O-C 3.58Å; S245-Q248 WeakPolarHBondContact O-CA 3.11Å; S245-Q248 WeakPolarHBondContact O-CB 3.37Å; S245-Q248 PolarHBondContact O-N 3.24Å; S245-Q248 WeakPolarHBondContact OG-CG 3.43Å; S245-Q248 PolarHBondContact OG-N 3.03Å; S245-Q248 PolarHBondContact OG-OE1 3.15Å; Q248-K250 VanDerWaalsContact C-N 3.33Å; Q248-K250 PolarHBondContact O-N 2.84Å; Q248-Q251 WeakPolarHBondContact O-CA 3.29Å; Q248-Q251 VanDerWaalsContact O-CB 3.3Å; Q248-Q251 WeakPolarHBondContact O-CB 3.49Å; Q248-Q251 PolarHBondContact O-N 3.36Å; Q248-Q252 WeakPolarHBondContact O-CG 3.31Å; Q248-Q252 PolarHBondContact O-N 2.7Å
249	Q	93.3	Very high	90.4	Very high	40 Å²	40	67.2 Å²	67.2	19%	0.187	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-46.1	174.8	-70.3	173.1	-23.3	0	0	111	W234 G241 L244 S245 Q251 Q252 E253	W234-Q249 HydrophobicContact CH2-CG 4.2Å; W234-Q249 HydrophobicContact CZ2-CB 4.39Å; W234-Q249 HydrophobicContact CZ2-CG 4.36Å; G241-Q249 PolarHBondContact O-NE2 3.35Å; L244-Q249 HydrophobicContact CB-CG 3.89Å; L244-Q249 PolarHBondContact O-NE2 3.41Å; S245-Q249 PolarHBondContact O-N 3.12Å; Q249-Q251 VanDerWaalsContact C-N 3.33Å; Q249-Q251 PolarHBondContact O-N 3.31Å; Q249-Q252 PolarHBondContact O-N 3.42Å; Q249-E253 VanDerWaalsContact O-CG 3.3Å; Q249-E253 WeakPolarHBondContact O-CG 3.34Å; Q249-E253 PolarHBondContact O-N 3.5Å
250	K	94.3	Very high	91.1	Very high	114 Å²	114	61.9 Å²	61.9	50%	0.496	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-30.8	172.5	-72.1	-175.7	172.7	-164.6	0	114.9	R246 K247 Q248 G254 N414	R246-K250 WeakPolarHBondContact O-CG 3.42Å; R246-K250 PolarHBondContact O-N 2.98Å; K247-K250 PolarHBondContact O-N 2.82Å; Q248-K250 VanDerWaalsContact C-N 3.33Å; Q248-K250 PolarHBondContact O-N 2.84Å; K250-G254 PolarHBondContact O-N 3.11Å; K250-N414 HydrophobicContact CB-CB 3.99Å; K250-N414 VanDerWaalsContact CB-OD1 3.3Å; K250-N414 WeakPolarHBondContact CB-OD1 3.41Å
251	Q	94.8	Very high	91.9	Very high	11 Å²	11	60 Å²	60	5%	0.051	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-45.3	172.5	-170.5	-161.9	36.3	0	0	110.3	K247 Q248 Q249 G254 I255 V411 N414 S415 D420	K247-Q251 PolarHBondContact O-N 2.94Å; Q248-Q251 WeakPolarHBondContact O-CA 3.29Å; Q248-Q251 VanDerWaalsContact O-CB 3.3Å; Q248-Q251 WeakPolarHBondContact O-CB 3.49Å; Q248-Q251 PolarHBondContact O-N 3.36Å; Q249-Q251 VanDerWaalsContact C-N 3.33Å; Q249-Q251 PolarHBondContact O-N 3.31Å; Q251-G254 PolarHBondContact O-N 3.02Å; Q251-I255 HydrophobicContact CG-CD1 4.26Å; Q251-I255 WeakPolarHBondContact O-CG1 3.39Å; Q251-I255 PolarHBondContact O-N 2.87Å; Q251-V411 HydrophobicContact CG-CG1 3.83Å; Q251-N414 HydrophobicContact CB-CB 4.1Å; Q251-S415 PolarHBondContact NE2-OG 2.75Å; Q251-D420 PolarHBondContact NE2-OD2 2.87Å
252	Q	95.4	Very high	93	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-42.1	176	-62.8	-63	-72.9	0	0	111.7	W234 L244 Q248 Q249 G254 I255 W256 L329	W234-Q252 HydrophobicContact CD2-CB 3.71Å; W234-Q252 HydrophobicContact CE3-CB 3.91Å; W234-Q252 HydrophobicContact CE3-CG 4.21Å; W234-Q252 HydrophobicContact CG-CB 4.2Å; W234-Q252 HydrophobicContact CH2-CB 4.3Å; W234-Q252 HydrophobicContact CZ2-CB 4.09Å; W234-Q252 HydrophobicContact CZ3-CB 4.21Å; W234-Q252 HydrophobicContact CZ3-CG 4.22Å; L244-Q252 HydrophobicContact CD1-CG 4.11Å; Q248-Q252 WeakPolarHBondContact O-CG 3.31Å; Q248-Q252 PolarHBondContact O-N 2.7Å; Q249-Q252 PolarHBondContact O-N 3.42Å; Q252-G254 PolarHBondContact O-N 3.08Å; Q252-I255 PolarHBondContact O-N 3.35Å; Q252-W256 VanDerWaalsContact O-CB 3.31Å; Q252-W256 WeakPolarHBondContact O-CB 3.47Å; Q252-W256 PolarHBondContact O-N 2.67Å; Q252-L329 PolarHBondContact NE2-O 3.36Å
253	E	95.5	Very high	93.8	Very high	96 Å²	96	52.5 Å²	52.5	45%	0.449	25%	0.246	S	C	.	.	H	α-helix	trans	-56	-46.8	172.1	-72.3	160.8	-164	0	0	111.9	Q249 W256 E257	Q249-E253 VanDerWaalsContact O-CG 3.3Å; Q249-E253 WeakPolarHBondContact O-CG 3.34Å; Q249-E253 PolarHBondContact O-N 3.5Å; E253-W256 WeakPolarHBondContact O-CB 3.17Å; E253-W256 PolarHBondContact O-N 3.4Å; E253-E257 PolarHBondContact O-N 3.12Å
254	G	95.8	Very high	94.2	Very high	7 Å²	7	51 Å²	51	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-69.1	-34.1	178.7	0	0	0	0	0	114.2	K250 Q251 Q252 L258 V411	K250-G254 PolarHBondContact O-N 3.11Å; Q251-G254 PolarHBondContact O-N 3.02Å; Q252-G254 PolarHBondContact O-N 3.08Å; G254-L258 PolarHBondContact O-N 3.21Å; G254-V411 VanDerWaalsContact C-CG2 3.45Å
255	I	96.5	Very high	94.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-69	-39.2	171.6	-63.8	165.6	0	0	0	109.5	Q251 Q252 L258 I259 L318 L329 P331 M334 V411	Q251-I255 HydrophobicContact CG-CD1 4.26Å; Q251-I255 WeakPolarHBondContact O-CG1 3.39Å; Q251-I255 PolarHBondContact O-N 2.87Å; Q252-I255 PolarHBondContact O-N 3.35Å; I255-L258 WeakPolarHBondContact O-CB 3.46Å; I255-L258 PolarHBondContact O-N 3.33Å; I255-I259 HydrophobicContact CG2-CD1 3.94Å; I255-I259 VanDerWaalsContact O-CG1 3.29Å; I255-I259 WeakPolarHBondContact O-CG1 3.41Å; I255-I259 PolarHBondContact O-N 2.76Å; I255-I259 VanDerWaalsContact O-N 3.1Å; I255-L318 HydrophobicContact CG2-CD2 4.07Å; I255-L329 HydrophobicContact CD1-CB 4.34Å; I255-L329 WeakPolarHBondContact CD1-O 3.48Å; I255-L329 HydrophobicContact CG2-CB 3.94Å; I255-L329 HydrophobicContact CG2-CD1 4.04Å; I255-P331 HydrophobicContact CD1-CB 4.15Å; I255-P331 HydrophobicContact CD1-CG 4.32Å; I255-M334 HydrophobicContact CG2-CE 4.18Å; I255-V411 HydrophobicContact CD1-CG1 4.02Å; I255-V411 HydrophobicContact CG1-CB 4.43Å; I255-V411 HydrophobicContact CG1-CG1 3.64Å; I255-V411 HydrophobicContact CG1-CG2 3.8Å
256	W	96.6	Very high	94.7	Very high	16 Å²	16	47.8 Å²	47.8	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-42.8	175.9	-160.8	-115.1	0	0	0	112	L230 E231 D232 W234 I237 Q252 E253 L258 I259 T260 L319 L329	L230-W256 HydrophobicContact CD1-CH2 3.53Å; L230-W256 HydrophobicContact CD1-CZ2 4.17Å; L230-W256 HydrophobicContact CD1-CZ3 3.91Å; L230-W256 HydrophobicContact CG-CH2 4.05Å; L230-W256 HydrophobicContact CG-CZ2 4.21Å; E231-W256 HydrophobicContact CB-CH2 4.27Å; E231-W256 HydrophobicContact CB-CZ2 4.42Å; E231-W256 VanDerWaalsContact O-CZ2 3.29Å; E231-W256 WeakPolarHBondContact O-CZ2 3.02Å; D232-W256 PolarHBondContact O-NE1 2.93Å; W234-W256 HydrophobicContact CB-CB 4.26Å; W234-W256 HydrophobicContact CB-CD2 3.72Å; W234-W256 HydrophobicContact CB-CE3 3.64Å; W234-W256 HydrophobicContact CB-CG 4.01Å; W234-W256 HydrophobicContact CB-CZ3 4.2Å; W234-W256 VanDerWaalsContact N-CE2 3.34Å; I237-W256 HydrophobicContact CD1-CH2 3.78Å; I237-W256 HydrophobicContact CD1-CZ3 3.71Å; Q252-W256 VanDerWaalsContact O-CB 3.31Å; Q252-W256 WeakPolarHBondContact O-CB 3.47Å; Q252-W256 PolarHBondContact O-N 2.67Å; E253-W256 WeakPolarHBondContact O-CB 3.17Å; E253-W256 PolarHBondContact O-N 3.4Å; W256-L258 VanDerWaalsContact C-N 3.33Å; W256-L258 PolarHBondContact O-N 2.97Å; W256-I259 PolarHBondContact O-N 2.59Å; W256-I259 VanDerWaalsContact O-N 3.15Å; W256-T260 HydrophobicContact CD2-CG2 4.35Å; W256-T260 HydrophobicContact CG-CG2 4.27Å; W256-T260 WeakPolarHBondContact O-CG2 3.44Å; W256-T260 PolarHBondContact O-N 2.8Å; W256-T260 PolarHBondContact O-OG1 2.99Å; W256-T260 VanDerWaalsContact O-OG1 3.06Å; W256-L319 HydrophobicContact CZ3-CD2 3.89Å; W256-L329 HydrophobicContact CE3-CD1 3.94Å; W256-L329 HydrophobicContact CZ3-CD1 4.46Å
257	E	97.3	Very high	94.7	Very high	102 Å²	102	39 Å²	39	48%	0.477	19%	0.189	S	C	.	.	H	α-helix	trans	-58.3	-42.8	173.2	-171.8	-172.5	171.8	0	0	111.6	E253 I259 T260 T261 L407	E253-E257 PolarHBondContact O-N 3.12Å; E257-I259 VanDerWaalsContact C-N 3.31Å; E257-I259 PolarHBondContact O-N 2.81Å; E257-T260 PolarHBondContact O-OG1 2.81Å; E257-T261 HydrophobicContact CG-CG2 4.14Å; E257-T261 VanDerWaalsContact O-CB 3.28Å; E257-T261 WeakPolarHBondContact O-CB 3.37Å; E257-T261 VanDerWaalsContact O-CG2 3.24Å; E257-T261 WeakPolarHBondContact O-CG2 3.3Å; E257-T261 PolarHBondContact O-N 2.91Å; E257-T261 PolarHBondContact O-OG1 3.33Å; E257-L407 HydrophobicContact CB-CD2 4.43Å; E257-L407 HydrophobicContact CG-CD2 3.84Å
258	L	96.9	Very high	94.6	Very high	3 Å²	3	37 Å²	37	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-42.7	175.9	176.1	62.2	0	0	0	111.7	G254 I255 W256 E262 M334 F338 R400 Y404 L407 L408	G254-L258 PolarHBondContact O-N 3.21Å; I255-L258 WeakPolarHBondContact O-CB 3.46Å; I255-L258 PolarHBondContact O-N 3.33Å; W256-L258 VanDerWaalsContact C-N 3.33Å; W256-L258 PolarHBondContact O-N 2.97Å; L258-E262 WeakPolarHBondContact O-CB 3.44Å; L258-E262 PolarHBondContact O-N 3.32Å; L258-M334 HydrophobicContact CD2-CE 4.12Å; L258-M334 HydrophobicContact CD2-SD 3.93Å; L258-F338 HydrophobicContact CD2-CZ 4.36Å; L258-R400 PolarHBondContact O-NH2 2.75Å; L258-Y404 HydrophobicContact CD1-CD1 4.06Å; L258-Y404 HydrophobicContact CD1-CE1 4.43Å; L258-L407 HydrophobicContact CD1-CB 4.15Å; L258-L407 HydrophobicContact CD1-CD1 3.79Å; L258-L408 HydrophobicContact CD2-CD2 4.19Å
259	I	96.8	Very high	94.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-71.6	-53	-178.6	-66.3	172.9	0	0	0	111.7	L230 I255 W256 E257 T261 E262 L263 W311 V315 L318 L319 L329	L230-I259 HydrophobicContact CD1-CG2 3.7Å; L230-I259 HydrophobicContact CD2-CG2 3.91Å; L230-I259 HydrophobicContact CG-CG2 4.5Å; I255-I259 HydrophobicContact CG2-CD1 3.94Å; I255-I259 VanDerWaalsContact O-CG1 3.29Å; I255-I259 WeakPolarHBondContact O-CG1 3.41Å; I255-I259 PolarHBondContact O-N 2.76Å; I255-I259 VanDerWaalsContact O-N 3.1Å; W256-I259 PolarHBondContact O-N 2.59Å; W256-I259 VanDerWaalsContact O-N 3.15Å; E257-I259 VanDerWaalsContact C-N 3.31Å; E257-I259 PolarHBondContact O-N 2.81Å; I259-T261 PolarHBondContact O-N 3.02Å; I259-E262 WeakPolarHBondContact O-CB 3.44Å; I259-E262 PolarHBondContact O-N 2.94Å; I259-E262 VanDerWaalsContact O-N 3.14Å; I259-L263 PolarHBondContact O-N 3.01Å; I259-L263 VanDerWaalsContact O-N 3.07Å; I259-W311 HydrophobicContact CG2-CH2 3.94Å; I259-W311 HydrophobicContact CG2-CZ3 4.03Å; I259-V315 HydrophobicContact CB-CG1 4.32Å; I259-V315 HydrophobicContact CD1-CG1 4.4Å; I259-V315 HydrophobicContact CG1-CG1 3.87Å; I259-V315 HydrophobicContact CG2-CG1 3.84Å; I259-L318 HydrophobicContact CD1-CD2 4.1Å; I259-L319 HydrophobicContact CD1-CD2 4.07Å; I259-L319 HydrophobicContact CD1-CG 4.38Å; I259-L319 HydrophobicContact CG2-CD1 4.09Å; I259-L319 HydrophobicContact CG2-CD2 4.36Å; I259-L329 HydrophobicContact CD1-CD1 4.43Å; I259-L329 HydrophobicContact CD1-CD2 4.5Å
260	T	96.1	Very high	94.5	Very high	36 Å²	36	31.9 Å²	31.9	22%	0.221	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-45.3	-178.6	54.8	0	0	0	0	111	L230 W256 E257 E262 L263 E264	L230-T260 HydrophobicContact CD2-CG2 3.82Å; W256-T260 HydrophobicContact CD2-CG2 4.35Å; W256-T260 HydrophobicContact CG-CG2 4.27Å; W256-T260 WeakPolarHBondContact O-CG2 3.44Å; W256-T260 PolarHBondContact O-N 2.8Å; W256-T260 PolarHBondContact O-OG1 2.99Å; W256-T260 VanDerWaalsContact O-OG1 3.06Å; E257-T260 PolarHBondContact O-OG1 2.81Å; T260-E262 PolarHBondContact O-N 3.36Å; T260-L263 PolarHBondContact O-N 3.15Å; T260-E264 WeakPolarHBondContact O-CG 3.45Å; T260-E264 PolarHBondContact O-N 3.42Å
261	T	96.6	Very high	94.3	Very high	34 Å²	34	26.9 Å²	26.9	21%	0.209	14%	0.135	C	C	.	.	H	α-helix	trans	-71.5	-16.2	178.6	64.9	0	0	0	0	113.8	E257 I259 Y265 R400	E257-T261 HydrophobicContact CG-CG2 4.14Å; E257-T261 VanDerWaalsContact O-CB 3.28Å; E257-T261 WeakPolarHBondContact O-CB 3.37Å; E257-T261 VanDerWaalsContact O-CG2 3.24Å; E257-T261 WeakPolarHBondContact O-CG2 3.3Å; E257-T261 PolarHBondContact O-N 2.91Å; E257-T261 PolarHBondContact O-OG1 3.33Å; I259-T261 PolarHBondContact O-N 3.02Å; T261-Y265 WeakPolarHBondContact O-CB 3.22Å; T261-Y265 PolarHBondContact O-N 2.91Å; T261-R400 PolarHBondContact O-NH1 3.3Å; T261-R400 PolarHBondContact OG1-NH1 3.19Å
262	E	96.1	Very high	94.1	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-76.7	-47.2	168.5	-169.2	60.7	-149.7	0	0	110.6	L258 I259 T260 Y265 I266 N307 F310 W311 R400 Y404	L258-E262 WeakPolarHBondContact O-CB 3.44Å; L258-E262 PolarHBondContact O-N 3.32Å; I259-E262 WeakPolarHBondContact O-CB 3.44Å; I259-E262 PolarHBondContact O-N 2.94Å; I259-E262 VanDerWaalsContact O-N 3.14Å; T260-E262 PolarHBondContact O-N 3.36Å; E262-Y265 PolarHBondContact O-N 3.25Å; E262-Y265 VanDerWaalsContact O-N 3.17Å; E262-I266 HydrophobicContact CG-CD1 4.07Å; E262-I266 WeakPolarHBondContact O-CG1 3.47Å; E262-I266 PolarHBondContact O-N 2.9Å; E262-N307 PolarHBondContact OE1-OD1 3.12Å; E262-F310 HydrophobicContact CG-CD1 4.29Å; E262-F310 HydrophobicContact CG-CE1 4.35Å; E262-W311 HydrophobicContact CB-CE3 4.4Å; E262-W311 HydrophobicContact CB-CZ3 4.46Å; E262-W311 HydrophobicContact CG-CE3 4.18Å; E262-R400 IonicContact OE2-CZ 2.71Å; E262-R400 IonicContact OE2-NE 3.98Å; E262-R400 PolarHBondContact OE2-NE 2.87Å; E262-R400 IonicContact OE2-NH2 3.52Å; E262-R400 PolarHBondContact OE2-NH2 3.33Å; E262-Y404 PolarHBondContact OE1-OH 3.38Å; E262-Y404 VanDerWaalsContact OE2-CE1 3.3Å; E262-Y404 WeakPolarHBondContact OE2-CE1 3.43Å; E262-Y404 PolarHBondContact OE2-OH 3.33Å
263	L	93.8	Very high	93.8	Very high	22 Å²	22	26.5 Å²	26.5	12%	0.115	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-45.2	177.5	-175.8	59.1	0	0	0	111.9	L209 L228 L230 I259 T260 Y265 I266 C267 W311	L209-L263 HydrophobicContact CD1-CD1 4.33Å; L228-L263 HydrophobicContact CB-CD1 4.15Å; L228-L263 WeakPolarHBondContact O-CD2 3.48Å; L230-L263 HydrophobicContact CB-CD2 3.53Å; L230-L263 HydrophobicContact CD2-CB 4.45Å; L230-L263 HydrophobicContact CD2-CD2 3.89Å; L230-L263 HydrophobicContact CG-CD2 4.37Å; I259-L263 PolarHBondContact O-N 3.01Å; I259-L263 VanDerWaalsContact O-N 3.07Å; T260-L263 PolarHBondContact O-N 3.15Å; L263-Y265 PolarHBondContact O-N 3.49Å; L263-I266 PolarHBondContact O-N 3.13Å; L263-C267 WeakPolarHBondContact O-CB 3.47Å; L263-C267 PolarHBondContact O-N 3.02Å; L263-C267 PolarHBondContact O-SG 2.99Å; L263-W311 HydrophobicContact CB-CH2 3.9Å; L263-W311 HydrophobicContact CB-CZ3 3.74Å; L263-W311 HydrophobicContact CD1-CH2 4.39Å; L263-W311 HydrophobicContact CD2-CH2 4.24Å; L263-W311 HydrophobicContact CG-CH2 4.4Å
264	E	92.1	Very high	93.4	Very high	134 Å²	134	22.9 Å²	22.9	63%	0.626	12%	0.117	S	C	*	.	H	α-helix	trans	-55.1	-41.1	172.8	-76.8	-173.9	-176.1	0	0	111.9	T260 K268	T260-E264 WeakPolarHBondContact O-CG 3.45Å; T260-E264 PolarHBondContact O-N 3.42Å; E264-K268 WeakPolarHBondContact O-CB 3.14Å; E264-K268 PolarHBondContact O-N 3.09Å
265	Y	94.4	Very high	93	Very high	16 Å²	16	22.5 Å²	22.5	6%	0.063	11%	0.113	C	C	.	.	H	α-helix	trans	-70.5	-41.7	179.4	173.1	-121.2	0	0	0	111.9	T261 E262 L263 K268 L269 N307 Y348 K396 P397 R400	T261-Y265 WeakPolarHBondContact O-CB 3.22Å; T261-Y265 PolarHBondContact O-N 2.91Å; E262-Y265 PolarHBondContact O-N 3.25Å; E262-Y265 VanDerWaalsContact O-N 3.17Å; L263-Y265 PolarHBondContact O-N 3.49Å; Y265-K268 WeakPolarHBondContact O-CB 3.35Å; Y265-K268 PolarHBondContact O-N 2.99Å; Y265-K268 VanDerWaalsContact O-N 3.14Å; Y265-L269 HydrophobicContact CD1-CD1 4.33Å; Y265-L269 HydrophobicContact CD2-CG 4.28Å; Y265-L269 HydrophobicContact CE1-CD1 3.78Å; Y265-L269 HydrophobicContact CE1-CG 4.41Å; Y265-L269 HydrophobicContact CE2-CD1 4.08Å; Y265-L269 HydrophobicContact CE2-CD2 3.84Å; Y265-L269 HydrophobicContact CE2-CG 3.82Å; Y265-L269 WeakPolarHBondContact O-CG 3.3Å; Y265-L269 PolarHBondContact O-N 3.49Å; Y265-N307 HydrophobicContact CE1-CB 4.37Å; Y265-N307 WeakPolarHBondContact CE1-OD1 3.24Å; Y265-Y348 WeakPolarHBondContact CE1-OH 3.39Å; Y265-Y348 PolarHBondContact OH-OH 3.03Å; Y265-K396 HydrophobicContact CE2-CB 4.22Å; Y265-P397 VanDerWaalsContact OH-CA 3.25Å; Y265-P397 WeakPolarHBondContact OH-CA 3.35Å; Y265-P397 WeakPolarHBondContact OH-CB 3.12Å; Y265-R400 HydrophobicContact CD1-CB 4.23Å; Y265-R400 HydrophobicContact CD1-CG 3.66Å; Y265-R400 HydrophobicContact CE1-CB 3.88Å; Y265-R400 HydrophobicContact CE1-CG 3.62Å; Y265-R400 HydrophobicContact CE2-CB 4.28Å; Y265-R400 HydrophobicContact CG-CG 4.25Å
266	I	93.7	Very high	92.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.4	-45.6	173.3	-70.5	167.1	0	0	0	110.8	A212 E262 L263 K268 L269 G270 N307 L308 W311	A212-I266 HydrophobicContact CB-CG2 3.71Å; E262-I266 HydrophobicContact CG-CD1 4.07Å; E262-I266 WeakPolarHBondContact O-CG1 3.47Å; E262-I266 PolarHBondContact O-N 2.9Å; L263-I266 PolarHBondContact O-N 3.13Å; I266-K268 VanDerWaalsContact C-N 3.31Å; I266-K268 PolarHBondContact O-N 2.96Å; I266-L269 WeakPolarHBondContact O-CB 3.36Å; I266-L269 PolarHBondContact O-N 3.02Å; I266-G270 PolarHBondContact O-N 2.93Å; I266-N307 HydrophobicContact CD1-CB 4.37Å; I266-N307 HydrophobicContact CG1-CB 3.88Å; I266-L308 HydrophobicContact CG2-CD1 4.46Å; I266-W311 HydrophobicContact CD1-CB 3.78Å; I266-W311 HydrophobicContact CD1-CD2 4.45Å; I266-W311 HydrophobicContact CD1-CE3 4.25Å; I266-W311 HydrophobicContact CD1-CG 4.3Å
267	C	89.8	Confident	92.2	Very high	32 Å²	32	24.2 Å²	24.2	22%	0.216	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-42.2	172.3	-70.1	0	0	0	0	112	L263 L269 G270 S271	L263-C267 WeakPolarHBondContact O-CB 3.47Å; L263-C267 PolarHBondContact O-N 3.02Å; L263-C267 PolarHBondContact O-SG 2.99Å; C267-L269 PolarHBondContact O-N 2.64Å; C267-G270 PolarHBondContact O-N 3.09Å; C267-S271 PolarHBondContact O-N 2.89Å
268	K	89.9	Confident	91.5	Very high	43 Å²	43	19.9 Å²	19.9	19%	0.187	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-40	176.9	-152.9	77.4	176.5	-176.3	0	112.2	E264 Y265 I266 I272 A384 F385 K396	E264-K268 WeakPolarHBondContact O-CB 3.14Å; E264-K268 PolarHBondContact O-N 3.09Å; Y265-K268 WeakPolarHBondContact O-CB 3.35Å; Y265-K268 PolarHBondContact O-N 2.99Å; Y265-K268 VanDerWaalsContact O-N 3.14Å; I266-K268 VanDerWaalsContact C-N 3.31Å; I266-K268 PolarHBondContact O-N 2.96Å; K268-I272 WeakPolarHBondContact O-CD1 3.48Å; K268-I272 VanDerWaalsContact O-CG1 3.27Å; K268-I272 WeakPolarHBondContact O-CG1 3.49Å; K268-I272 PolarHBondContact O-N 2.77Å; K268-A384 PolarHBondContact NZ-O 3.24Å; K268-F385 PolarHBondContact NZ-O 3.2Å; K268-K396 HydrophobicContact CG-CD 4.09Å
269	L	92.8	Very high	90.9	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-44.5	173.6	-69.1	175	0	0	0	111	Y265 I266 C267 S271 I272 V273 I300 I303 C304 N307 P397	Y265-L269 HydrophobicContact CD1-CD1 4.33Å; Y265-L269 HydrophobicContact CD2-CG 4.28Å; Y265-L269 HydrophobicContact CE1-CD1 3.78Å; Y265-L269 HydrophobicContact CE1-CG 4.41Å; Y265-L269 HydrophobicContact CE2-CD1 4.08Å; Y265-L269 HydrophobicContact CE2-CD2 3.84Å; Y265-L269 HydrophobicContact CE2-CG 3.82Å; Y265-L269 WeakPolarHBondContact O-CG 3.3Å; Y265-L269 PolarHBondContact O-N 3.49Å; I266-L269 WeakPolarHBondContact O-CB 3.36Å; I266-L269 PolarHBondContact O-N 3.02Å; C267-L269 PolarHBondContact O-N 2.64Å; L269-S271 PolarHBondContact O-N 2.76Å; L269-I272 PolarHBondContact O-N 3.46Å; L269-V273 WeakPolarHBondContact O-CG2 3.46Å; L269-V273 PolarHBondContact O-N 3.07Å; L269-I300 HydrophobicContact CD2-CD1 3.6Å; L269-I300 HydrophobicContact CD2-CG1 4.26Å; L269-I303 HydrophobicContact CD1-CG2 4.02Å; L269-I303 HydrophobicContact CD2-CG2 4.01Å; L269-C304 HydrophobicContact CB-CB 4.1Å; L269-N307 HydrophobicContact CD1-CB 4.22Å; L269-P397 HydrophobicContact CD2-CG 4.22Å
270	G	90.5	Very high	90.4	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54.2	-50.5	175.8	0	0	0	0	0	112.3	G208 T211 I266 C267 I272 V273 E274	G208-G270 WeakPolarHBondContact O-CA 3.46Å; T211-G270 WeakPolarHBondContact CG2-O 3.43Å; I266-G270 PolarHBondContact O-N 2.93Å; C267-G270 PolarHBondContact O-N 3.09Å; G270-I272 VanDerWaalsContact C-N 3.25Å; G270-I272 PolarHBondContact O-N 3.28Å; G270-V273 PolarHBondContact O-N 3.4Å; G270-V273 VanDerWaalsContact O-N 3.15Å; G270-E274 WeakPolarHBondContact O-CB 3.28Å; G270-E274 PolarHBondContact O-N 3Å
271	S	88.2	Confident	89.8	Confident	8 Å²	8	24.7 Å²	24.7	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-25.5	175.1	-62.1	0	0	0	0	114.4	G208 C267 L269 L275 F385	G208-S271 WeakPolarHBondContact CA-OG 3.36Å; C267-S271 PolarHBondContact O-N 2.89Å; L269-S271 PolarHBondContact O-N 2.76Å; S271-L275 WeakPolarHBondContact O-CB 3.31Å; S271-L275 PolarHBondContact O-N 3.46Å; S271-L275 VanDerWaalsContact O-N 3.15Å; S271-F385 WeakPolarHBondContact O-CE1 3.35Å; S271-F385 WeakPolarHBondContact O-CZ 3.31Å
272	I	90.5	Very high	89.1	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-78.3	-36.2	175.2	-64.8	162.7	0	0	0	110.7	K268 L269 G270 L275 Q276 F297 I300 F385 L393 L394	K268-I272 WeakPolarHBondContact O-CD1 3.48Å; K268-I272 VanDerWaalsContact O-CG1 3.27Å; K268-I272 WeakPolarHBondContact O-CG1 3.49Å; K268-I272 PolarHBondContact O-N 2.77Å; L269-I272 PolarHBondContact O-N 3.46Å; G270-I272 VanDerWaalsContact C-N 3.25Å; G270-I272 PolarHBondContact O-N 3.28Å; I272-L275 PolarHBondContact O-N 2.86Å; I272-Q276 PolarHBondContact O-N 3.27Å; I272-F297 HydrophobicContact CG2-CD1 3.86Å; I272-F297 HydrophobicContact CG2-CE1 3.98Å; I272-I300 HydrophobicContact CG2-CG1 3.91Å; I272-I300 HydrophobicContact CG2-CG2 4.39Å; I272-F385 HydrophobicContact CG1-CE1 4.3Å; I272-L393 HydrophobicContact CD1-CB 3.98Å; I272-L393 HydrophobicContact CG1-CB 4.43Å; I272-L394 HydrophobicContact CG2-CD2 4.43Å
273	V	90.9	Very high	88.6	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.03	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-37.1	172.2	171.5	0	0	0	0	111.5	T211 F215 L269 G270 Q276 S277 I300 C304	T211-V273 HydrophobicContact CG2-CB 4.33Å; T211-V273 HydrophobicContact CG2-CG1 4.13Å; F215-V273 HydrophobicContact CE2-CB 4.49Å; F215-V273 HydrophobicContact CE2-CG1 3.88Å; F215-V273 HydrophobicContact CE2-CG2 4.29Å; F215-V273 HydrophobicContact CZ-CG1 3.76Å; L269-V273 WeakPolarHBondContact O-CG2 3.46Å; L269-V273 PolarHBondContact O-N 3.07Å; G270-V273 PolarHBondContact O-N 3.4Å; G270-V273 VanDerWaalsContact O-N 3.15Å; V273-Q276 WeakPolarHBondContact O-CB 3.18Å; V273-Q276 PolarHBondContact O-N 2.97Å; V273-S277 WeakPolarHBondContact O-CB 3.45Å; V273-S277 PolarHBondContact O-N 2.83Å; V273-S277 PolarHBondContact O-OG 2.91Å; V273-I300 HydrophobicContact CG2-CG2 4.35Å; V273-C304 HydrophobicContact CG2-CB 4.09Å
274	E	86.7	Confident	88.1	Confident	19 Å²	19	32.2 Å²	32.2	9%	0.089	16%	0.161	C	C	.	.	H	α-helix	trans	-61.1	-46.6	173.1	-167	-171.6	176.1	0	0	110.8	Q205 T211 G270 S277 C278	Q205-E274 VanDerWaalsContact CA-OE1 3.28Å; Q205-E274 WeakPolarHBondContact CA-OE1 3.38Å; Q205-E274 WeakPolarHBondContact CG-OE1 3.43Å; Q205-E274 PolarHBondContact N-OE1 2.9Å; T211-E274 HydrophobicContact CG2-CB 4.15Å; G270-E274 WeakPolarHBondContact O-CB 3.28Å; G270-E274 PolarHBondContact O-N 3Å; E274-S277 WeakPolarHBondContact O-CB 3.49Å; E274-S277 PolarHBondContact O-N 3.5Å; E274-S277 VanDerWaalsContact O-N 3.12Å; E274-C278 PolarHBondContact O-N 3.29Å
275	L	86.1	Confident	87.4	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-45.1	172.4	177.1	65.4	0	0	0	112.5	M202 S271 I272 S277 C278 I279 F297 W378 I379 F385 L390	M202-L275 HydrophobicContact CE-CB 3.9Å; M202-L275 HydrophobicContact CE-CD1 3.85Å; M202-L275 HydrophobicContact SD-CD1 4Å; S271-L275 WeakPolarHBondContact O-CB 3.31Å; S271-L275 PolarHBondContact O-N 3.46Å; S271-L275 VanDerWaalsContact O-N 3.15Å; I272-L275 PolarHBondContact O-N 2.86Å; L275-S277 PolarHBondContact O-N 3.1Å; L275-C278 PolarHBondContact O-N 2.92Å; L275-I279 HydrophobicContact CD1-CD1 3.86Å; L275-I279 HydrophobicContact CD1-CG1 4.29Å; L275-I279 HydrophobicContact CG-CD1 3.92Å; L275-I279 WeakPolarHBondContact O-CD1 3.37Å; L275-I279 VanDerWaalsContact O-CG1 3.27Å; L275-I279 WeakPolarHBondContact O-CG1 3.38Å; L275-I279 PolarHBondContact O-N 2.99Å; L275-I279 VanDerWaalsContact O-N 3.08Å; L275-F297 HydrophobicContact CD2-CE1 4.02Å; L275-F297 HydrophobicContact CD2-CZ 3.96Å; L275-F297 HydrophobicContact CG-CE1 4.21Å; L275-F297 HydrophobicContact CG-CZ 3.89Å; L275-W378 HydrophobicContact CD1-CZ3 4.31Å; L275-I379 HydrophobicContact CD1-CD1 4.15Å; L275-I379 HydrophobicContact CD1-CG1 3.95Å; L275-I379 HydrophobicContact CD2-CD1 3.75Å; L275-I379 HydrophobicContact CD2-CG1 3.91Å; L275-F385 HydrophobicContact CB-CZ 3.96Å; L275-F385 HydrophobicContact CD2-CE1 4.5Å; L275-F385 HydrophobicContact CD2-CE2 4.32Å; L275-F385 HydrophobicContact CD2-CZ 3.98Å; L275-F385 HydrophobicContact CG-CZ 4.45Å; L275-L390 HydrophobicContact CD2-CD1 4.18Å
276	Q	89.2	Confident	86.7	Confident	2 Å²	2	33 Å²	33	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-55.4	-39.8	173.8	-172.8	-177.8	18.8	0	0	110.9	I272 V273 R280 V293 E294 F297 S301	I272-Q276 PolarHBondContact O-N 3.27Å; V273-Q276 WeakPolarHBondContact O-CB 3.18Å; V273-Q276 PolarHBondContact O-N 2.97Å; Q276-R280 WeakPolarHBondContact O-CG 3.4Å; Q276-R280 PolarHBondContact O-N 3.45Å; Q276-V293 HydrophobicContact CG-CG1 3.67Å; Q276-E294 PolarHBondContact NE2-OE2 2.68Å; Q276-F297 HydrophobicContact CB-CB 4.34Å; Q276-F297 HydrophobicContact CB-CD1 4.01Å; Q276-F297 HydrophobicContact CB-CD2 4.02Å; Q276-F297 HydrophobicContact CB-CE1 4.35Å; Q276-F297 HydrophobicContact CB-CE2 4.37Å; Q276-F297 HydrophobicContact CB-CG 3.84Å; Q276-F297 HydrophobicContact CG-CB 3.82Å; Q276-F297 HydrophobicContact CG-CD1 4.4Å; Q276-F297 HydrophobicContact CG-CD2 3.8Å; Q276-F297 HydrophobicContact CG-CG 3.73Å; Q276-S301 PolarHBondContact OE1-OG 3.24Å; Q276-S301 VanDerWaalsContact OE1-OG 3.1Å
277	S	87.2	Confident	85.9	Confident	50 Å²	50	35.6 Å²	35.6	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-74.8	-45	-178.7	-55.9	0	0	0	0	112.7	V273 E274 L275 I279 R280 T281	V273-S277 WeakPolarHBondContact O-CB 3.45Å; V273-S277 PolarHBondContact O-N 2.83Å; V273-S277 PolarHBondContact O-OG 2.91Å; E274-S277 WeakPolarHBondContact O-CB 3.49Å; E274-S277 PolarHBondContact O-N 3.5Å; E274-S277 VanDerWaalsContact O-N 3.12Å; L275-S277 PolarHBondContact O-N 3.1Å; S277-I279 VanDerWaalsContact C-N 3.29Å; S277-I279 PolarHBondContact O-N 3.15Å; S277-R280 WeakPolarHBondContact O-CB 3.13Å; S277-R280 PolarHBondContact O-N 2.88Å; S277-T281 PolarHBondContact O-N 3.03Å; S277-T281 PolarHBondContact O-OG1 3.14Å
278	C	83.1	Confident	85.2	Confident	10 Å²	10	34.5 Å²	34.5	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-55.3	-43.5	173.7	173.1	0	0	0	0	112	M202 E274 L275 R280 T281 L282	M202-C278 HydrophobicContact CE-CB 4.35Å; M202-C278 HydrophobicContact CG-CB 3.83Å; M202-C278 VanDerWaalsContact CG-SG 3.55Å; M202-C278 HydrophobicContact SD-CB 3.6Å; M202-C278 PolarHBondContact SD-SG 3.3Å; E274-C278 PolarHBondContact O-N 3.29Å; L275-C278 PolarHBondContact O-N 2.92Å; C278-R280 VanDerWaalsContact C-N 3.33Å; C278-R280 PolarHBondContact O-N 3.4Å; C278-T281 WeakPolarHBondContact O-CB 3.47Å; C278-T281 PolarHBondContact O-N 3.3Å; C278-T281 VanDerWaalsContact O-N 3.12Å; C278-L282 PolarHBondContact O-N 2.97Å
279	I	84.5	Confident	84.8	Confident	6 Å²	6	36 Å²	36	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-36.7	177.9	-62.5	161	0	0	0	111	L275 S277 T281 L282 Q283 V293 F297 L375	L275-I279 HydrophobicContact CD1-CD1 3.86Å; L275-I279 HydrophobicContact CD1-CG1 4.29Å; L275-I279 HydrophobicContact CG-CD1 3.92Å; L275-I279 WeakPolarHBondContact O-CD1 3.37Å; L275-I279 VanDerWaalsContact O-CG1 3.27Å; L275-I279 WeakPolarHBondContact O-CG1 3.38Å; L275-I279 PolarHBondContact O-N 2.99Å; L275-I279 VanDerWaalsContact O-N 3.08Å; S277-I279 VanDerWaalsContact C-N 3.29Å; S277-I279 PolarHBondContact O-N 3.15Å; I279-T281 VanDerWaalsContact C-N 3.34Å; I279-T281 PolarHBondContact O-N 2.69Å; I279-L282 PolarHBondContact O-N 3.19Å; I279-Q283 WeakPolarHBondContact O-CG 3.05Å; I279-Q283 PolarHBondContact O-N 2.96Å; I279-Q283 VanDerWaalsContact O-N 3.13Å; I279-V293 HydrophobicContact CG2-CG2 3.71Å; I279-F297 HydrophobicContact CD1-CE2 3.6Å; I279-F297 HydrophobicContact CD1-CZ 3.64Å; I279-L375 HydrophobicContact CD1-CD2 3.83Å; I279-L375 HydrophobicContact CG1-CD1 4.42Å; I279-L375 HydrophobicContact CG1-CD2 4.06Å
280	R	86.4	Confident	84.3	Confident	79 Å²	79	40.1 Å²	40.1	30%	0.298	23%	0.231	S	C	.	.	H	α-helix	trans	-64.7	-35	172	-68.4	-166.8	-165.7	105.6	-8.5	112.5	Q276 S277 C278 Q283 Q284 V293 E294	Q276-R280 WeakPolarHBondContact O-CG 3.4Å; Q276-R280 PolarHBondContact O-N 3.45Å; S277-R280 WeakPolarHBondContact O-CB 3.13Å; S277-R280 PolarHBondContact O-N 2.88Å; C278-R280 VanDerWaalsContact C-N 3.33Å; C278-R280 PolarHBondContact O-N 3.4Å; R280-Q283 PolarHBondContact O-N 3.23Å; R280-Q284 PolarHBondContact O-N 3.46Å; R280-V293 HydrophobicContact CG-CB 4.45Å; R280-V293 HydrophobicContact CG-CG1 4Å; R280-V293 HydrophobicContact CG-CG2 4.46Å; R280-E294 IonicContact CZ-OE1 2.9Å; R280-E294 VanDerWaalsContact CZ-OE1 3.23Å; R280-E294 IonicContact NE-OE1 3.69Å; R280-E294 PolarHBondContact NE-OE1 3.08Å; R280-E294 VanDerWaalsContact NH2-CD 3.28Å; R280-E294 IonicContact NH2-OE1 3.33Å; R280-E294 PolarHBondContact NH2-OE1 3.07Å; R280-E294 IonicContact NH2-OE2 2.67Å; R280-E294 PolarHBondContact NH2-OE2 3.31Å
281	T	83.8	Confident	84.2	Confident	55 Å²	55	40.7 Å²	40.7	34%	0.337	23%	0.234	S	C	.	.	H	α-helix	trans	-63.9	-50.2	174.1	-52.8	0	0	0	0	110.8	L201 S277 C278 I279 Q283 Q284 D285	L201-T281 HydrophobicContact CD2-CG2 4.16Å; S277-T281 PolarHBondContact O-N 3.03Å; S277-T281 PolarHBondContact O-OG1 3.14Å; C278-T281 WeakPolarHBondContact O-CB 3.47Å; C278-T281 PolarHBondContact O-N 3.3Å; C278-T281 VanDerWaalsContact O-N 3.12Å; I279-T281 VanDerWaalsContact C-N 3.34Å; I279-T281 PolarHBondContact O-N 2.69Å; T281-Q283 PolarHBondContact O-N 3.09Å; T281-Q283 VanDerWaalsContact O-N 3.15Å; T281-Q284 WeakPolarHBondContact O-CA 3.41Å; T281-Q284 WeakPolarHBondContact O-CB 3.35Å; T281-Q284 PolarHBondContact O-N 2.68Å; T281-D285 PolarHBondContact O-N 3.38Å
282	L	82.5	Confident	84.3	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-56.4	-33.4	176.9	-75.7	165.5	0	0	0	113.1	M197 L198 L201 C278 I279 Q284 D285 G286 L287 F371	M197-L282 HydrophobicContact CG-CD2 4.12Å; M197-L282 HydrophobicContact SD-CD2 3.69Å; L198-L282 HydrophobicContact CD2-CD1 3.52Å; L198-L282 HydrophobicContact CG-CD1 4.22Å; L201-L282 HydrophobicContact CD1-CD1 4.11Å; L201-L282 HydrophobicContact CD1-CD2 3.55Å; L201-L282 HydrophobicContact CD1-CG 3.53Å; C278-L282 PolarHBondContact O-N 2.97Å; I279-L282 PolarHBondContact O-N 3.19Å; L282-Q284 VanDerWaalsContact C-N 3.33Å; L282-D285 CarbonylContact O-C 3.48Å; L282-D285 PolarHBondContact O-N 2.77Å; L282-G286 PolarHBondContact O-N 2.78Å; L282-L287 CarbonylContact C-O 3.31Å; L282-L287 VanDerWaalsContact C-O 3.31Å; L282-L287 HydrophobicContact CB-CB 4.31Å; L282-L287 HydrophobicContact CD2-CB 4.44Å; L282-L287 HydrophobicContact CD2-CD1 3.96Å; L282-L287 WeakPolarHBondContact O-CA 3.47Å; L282-L287 PolarHBondContact O-N 2.98Å; L282-L287 VanDerWaalsContact O-O 3.13Å; L282-F371 HydrophobicContact CD1-CZ 4.33Å
283	Q	85.2	Confident	84.3	Confident	51 Å²	51	42.9 Å²	42.9	24%	0.238	25%	0.245	C	C	.	.	H	α-helix	trans	-69.5	-27.4	175.1	-73.5	-174.5	-28.5	0	0	113.9	I279 R280 T281 G286 L287 G288 L291 V293	I279-Q283 WeakPolarHBondContact O-CG 3.05Å; I279-Q283 PolarHBondContact O-N 2.96Å; I279-Q283 VanDerWaalsContact O-N 3.13Å; R280-Q283 PolarHBondContact O-N 3.23Å; T281-Q283 PolarHBondContact O-N 3.09Å; T281-Q283 VanDerWaalsContact O-N 3.15Å; Q283-G286 PolarHBondContact O-N 3.39Å; Q283-L287 VanDerWaalsContact CA-O 3.31Å; Q283-L287 WeakPolarHBondContact CA-O 3.25Å; Q283-L287 WeakPolarHBondContact CG-O 3.46Å; Q283-L287 PolarHBondContact N-O 2.94Å; Q283-G288 PolarHBondContact NE2-O 2.63Å; Q283-L291 PolarHBondContact NE2-O 3.15Å; Q283-V293 VanDerWaalsContact OE1-CG2 3.3Å
284	Q	83.1	Confident	84.3	Confident	162 Å²	162	47.2 Å²	47.2	76%	0.757	27%	0.265	S	S	*	.	H	α-helix	trans	-71.4	-34.6	171.7	-63.1	169.7	31.2	0	0	110.7	R280 T281 L282 G286	R280-Q284 PolarHBondContact O-N 3.46Å; T281-Q284 WeakPolarHBondContact O-CA 3.41Å; T281-Q284 WeakPolarHBondContact O-CB 3.35Å; T281-Q284 PolarHBondContact O-N 2.68Å; L282-Q284 VanDerWaalsContact C-N 3.33Å; Q284-G286 PolarHBondContact O-N 3.43Å
285	D	78.1	Confident	84.5	Confident	110 Å²	110	48.6 Å²	48.6	59%	0.588	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	4.5	170.1	-58.3	-42.8	0	0	0	113.3	T281 L282 L287	T281-D285 PolarHBondContact O-N 3.38Å; L282-D285 CarbonylContact O-C 3.48Å; L282-D285 PolarHBondContact O-N 2.77Å; D285-L287 VanDerWaalsContact C-N 3.35Å; D285-L287 PolarHBondContact O-N 2.66Å
286	G	79.4	Confident	84.8	Confident	55 Å²	55	48.8 Å²	48.8	57%	0.567	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	2.9	176.8	0	0	0	0	0	115.6	L282 Q283 Q284	L282-G286 PolarHBondContact O-N 2.78Å; Q283-G286 PolarHBondContact O-N 3.39Å; Q284-G286 PolarHBondContact O-N 3.43Å
287	L	76.2	Confident	85	Confident	55 Å²	55	48.8 Å²	48.8	29%	0.288	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	135.4	178.5	-68	172	0	0	0	111.5	M197 L282 Q283 D285 A289 F371	M197-L287 HydrophobicContact CE-CD1 4.23Å; M197-L287 HydrophobicContact SD-CD1 3.39Å; M197-L287 WeakPolarHBondContact SD-CD1 3.46Å; L282-L287 CarbonylContact C-O 3.31Å; L282-L287 VanDerWaalsContact C-O 3.31Å; L282-L287 HydrophobicContact CB-CB 4.31Å; L282-L287 HydrophobicContact CD2-CB 4.44Å; L282-L287 HydrophobicContact CD2-CD1 3.96Å; L282-L287 WeakPolarHBondContact O-CA 3.47Å; L282-L287 PolarHBondContact O-N 2.98Å; L282-L287 VanDerWaalsContact O-O 3.13Å; Q283-L287 VanDerWaalsContact CA-O 3.31Å; Q283-L287 WeakPolarHBondContact CA-O 3.25Å; Q283-L287 WeakPolarHBondContact CG-O 3.46Å; Q283-L287 PolarHBondContact N-O 2.94Å; D285-L287 VanDerWaalsContact C-N 3.35Å; D285-L287 PolarHBondContact O-N 2.66Å; L287-A289 VanDerWaalsContact C-N 3.25Å; L287-A289 PolarHBondContact O-N 3.46Å; L287-F371 HydrophobicContact CB-CE2 4.09Å; L287-F371 HydrophobicContact CB-CZ 4.48Å
288	G	75.9	Confident	85.2	Confident	9 Å²	9	47.5 Å²	47.5	9%	0.093	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.7	17	177.6	0	0	0	0	0	115.3	Q283 E290 L291 F371	Q283-G288 PolarHBondContact NE2-O 2.63Å; G288-E290 PolarHBondContact O-N 2.85Å; G288-L291 WeakPolarHBondContact O-CB 3.43Å; G288-L291 PolarHBondContact O-N 2.91Å; G288-F371 VanDerWaalsContact CA-CE1 3.46Å
289	A	80.4	Confident	85.8	Confident	76 Å²	76	48.2 Å²	48.2	63%	0.628	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-9.5	178.5	0	0	0	0	0	114.9	L287 L291	L287-A289 VanDerWaalsContact C-N 3.25Å; L287-A289 PolarHBondContact O-N 3.46Å; A289-L291 VanDerWaalsContact C-N 3.3Å
290	E	83	Confident	86.3	Confident	87 Å²	87	48 Å²	48	41%	0.407	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.9	171.2	61.9	175.3	149.7	0	0	114.6	G288 Y361 K365 S369	G288-E290 PolarHBondContact O-N 2.85Å; E290-Y361 PolarHBondContact O-OH 3.19Å; E290-K365 WeakPolarHBondContact O-CE 3.43Å; E290-K365 PolarHBondContact O-NZ 3.08Å; E290-S369 VanDerWaalsContact CD-CB 3.45Å; E290-S369 VanDerWaalsContact OE1-CB 3.23Å; E290-S369 WeakPolarHBondContact OE1-CB 3.37Å; E290-S369 PolarHBondContact OE1-OG 3.28Å; E290-S369 WeakPolarHBondContact OE2-CB 3.39Å
291	L	87.3	Confident	86.6	Confident	12 Å²	12	45.2 Å²	45.2	6%	0.063	26%	0.262	C	S	.	.			trans	-97.8	130.7	179.2	-62	171	0	0	0	111.4	Q283 G288 A289 V293 K365 F371 F372 L375	Q283-L291 PolarHBondContact NE2-O 3.15Å; G288-L291 WeakPolarHBondContact O-CB 3.43Å; G288-L291 PolarHBondContact O-N 2.91Å; A289-L291 VanDerWaalsContact C-N 3.3Å; L291-V293 PolarHBondContact O-N 3.01Å; L291-K365 HydrophobicContact CD2-CB 4.13Å; L291-K365 HydrophobicContact CD2-CD 4.06Å; L291-K365 HydrophobicContact CD2-CG 3.92Å; L291-F371 HydrophobicContact CD1-CD1 3.94Å; L291-F371 HydrophobicContact CD1-CE1 3.82Å; L291-F372 HydrophobicContact CD1-CD2 3.7Å; L291-F372 HydrophobicContact CD1-CE2 4.38Å; L291-F372 HydrophobicContact CD2-CB 4.09Å; L291-F372 HydrophobicContact CD2-CD2 3.52Å; L291-F372 HydrophobicContact CD2-CE2 4.08Å; L291-F372 HydrophobicContact CD2-CG 3.87Å; L291-F372 HydrophobicContact CG-CD2 4.27Å; L291-L375 HydrophobicContact CD1-CD2 4.39Å
292	D	90.6	Very high	87.2	Confident	46 Å²	46	46.9 Å²	46.9	25%	0.246	27%	0.266	C	S	.	.			trans	-90.2	95	169	-172.4	-49.7	0	0	0	107.1	E294 T295 V296 Y361 R672	D292-E294 VanDerWaalsContact C-N 3.26Å; D292-E294 PolarHBondContact O-N 3.36Å; D292-T295 CarbonylContact O-C 3.43Å; D292-T295 WeakPolarHBondContact O-CA 3.5Å; D292-T295 WeakPolarHBondContact O-CB 3.37Å; D292-T295 PolarHBondContact O-N 2.86Å; D292-T295 WeakPolarHBondContact OD1-CB 3.33Å; D292-T295 PolarHBondContact OD1-N 2.88Å; D292-T295 PolarHBondContact OD1-OG1 3.1Å; D292-T295 PolarHBondContact OD2-OG1 3.17Å; D292-V296 PolarHBondContact O-N 2.82Å; D292-Y361 HydrophobicContact CB-CE2 4.41Å; D292-Y361 PolarHBondContact N-OH 3.43Å; D292-R672 IonicContact OD2-NH1 2.7Å; D292-R672 PolarHBondContact OD2-NH1 2.79Å
293	V	90.7	Very high	87.9	Confident	8 Å²	8	46.7 Å²	46.7	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-36.5	-173.9	177	0	0	0	0	111.5	Q276 I279 R280 Q283 L291 T295 V296 F297	Q276-V293 HydrophobicContact CG-CG1 3.67Å; I279-V293 HydrophobicContact CG2-CG2 3.71Å; R280-V293 HydrophobicContact CG-CB 4.45Å; R280-V293 HydrophobicContact CG-CG1 4Å; R280-V293 HydrophobicContact CG-CG2 4.46Å; Q283-V293 VanDerWaalsContact OE1-CG2 3.3Å; L291-V293 PolarHBondContact O-N 3.01Å; V293-T295 VanDerWaalsContact C-N 3.3Å; V293-T295 PolarHBondContact O-N 3.24Å; V293-V296 PolarHBondContact O-N 2.75Å; V293-F297 HydrophobicContact CG1-CD2 3.84Å; V293-F297 HydrophobicContact CG1-CE2 4.34Å; V293-F297 WeakPolarHBondContact O-CD2 3.49Å; V293-F297 PolarHBondContact O-N 2.81Å
294	E	90.3	Very high	88.3	Confident	97 Å²	97	44.3 Å²	44.3	45%	0.453	25%	0.254	S	S	.	.	H	α-helix	trans	-69.1	-30.5	176.4	-47.8	-47.5	141.5	0	0	111.5	Q276 R280 D292 S298	Q276-E294 PolarHBondContact NE2-OE2 2.68Å; R280-E294 IonicContact CZ-OE1 2.9Å; R280-E294 VanDerWaalsContact CZ-OE1 3.23Å; R280-E294 IonicContact NE-OE1 3.69Å; R280-E294 PolarHBondContact NE-OE1 3.08Å; R280-E294 VanDerWaalsContact NH2-CD 3.28Å; R280-E294 IonicContact NH2-OE1 3.33Å; R280-E294 PolarHBondContact NH2-OE1 3.07Å; R280-E294 IonicContact NH2-OE2 2.67Å; R280-E294 PolarHBondContact NH2-OE2 3.31Å; D292-E294 VanDerWaalsContact C-N 3.26Å; D292-E294 PolarHBondContact O-N 3.36Å; E294-S298 WeakPolarHBondContact O-CA 3.48Å; E294-S298 PolarHBondContact O-N 2.8Å
295	T	91.6	Very high	88.9	Confident	47 Å²	47	42.4 Å²	42.4	29%	0.288	24%	0.24	S	C	.	.	H	α-helix	trans	-75.8	-27.6	171.9	-56.3	0	0	0	0	113.2	D292 V293 V358 Y361	D292-T295 CarbonylContact O-C 3.43Å; D292-T295 WeakPolarHBondContact O-CA 3.5Å; D292-T295 WeakPolarHBondContact O-CB 3.37Å; D292-T295 PolarHBondContact O-N 2.86Å; D292-T295 WeakPolarHBondContact OD1-CB 3.33Å; D292-T295 PolarHBondContact OD1-N 2.88Å; D292-T295 PolarHBondContact OD1-OG1 3.1Å; D292-T295 PolarHBondContact OD2-OG1 3.17Å; V293-T295 VanDerWaalsContact C-N 3.3Å; V293-T295 PolarHBondContact O-N 3.24Å; T295-V358 WeakPolarHBondContact O-CG2 3.35Å; T295-Y361 HydrophobicContact CG2-CD1 4.14Å; T295-Y361 HydrophobicContact CG2-CD2 3.69Å; T295-Y361 HydrophobicContact CG2-CE2 4.24Å; T295-Y361 HydrophobicContact CG2-CG 3.63Å
296	V	92.1	Very high	89.7	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.024	22%	0.215	C	C	.	.	H	α-helix	trans	-78.1	-41.4	175.8	175.6	0	0	0	0	112.1	D292 V293 V358 Y361 I362 L390 L394	D292-V296 PolarHBondContact O-N 2.82Å; V293-V296 PolarHBondContact O-N 2.75Å; V296-V358 WeakPolarHBondContact O-CG1 3.45Å; V296-Y361 HydrophobicContact CG2-CD1 3.72Å; V296-Y361 HydrophobicContact CG2-CE1 3.54Å; V296-I362 HydrophobicContact CG1-CG1 4.5Å; V296-L390 HydrophobicContact CG1-CD2 3.94Å; V296-L394 WeakPolarHBondContact O-CD1 3.43Å
297	F	93.1	Very high	90.5	Very high	2 Å²	2	35 Å²	35	1%	0.009	19%	0.188	C	C	.	.	H	α-helix	trans	-104.2	-15.5	-171.9	-70.1	-82.9	0	0	0	113.9	I272 L275 Q276 I279 V293 I300 L390 L394	I272-F297 HydrophobicContact CG2-CD1 3.86Å; I272-F297 HydrophobicContact CG2-CE1 3.98Å; L275-F297 HydrophobicContact CD2-CE1 4.02Å; L275-F297 HydrophobicContact CD2-CZ 3.96Å; L275-F297 HydrophobicContact CG-CE1 4.21Å; L275-F297 HydrophobicContact CG-CZ 3.89Å; Q276-F297 HydrophobicContact CB-CB 4.34Å; Q276-F297 HydrophobicContact CB-CD1 4.01Å; Q276-F297 HydrophobicContact CB-CD2 4.02Å; Q276-F297 HydrophobicContact CB-CE1 4.35Å; Q276-F297 HydrophobicContact CB-CE2 4.37Å; Q276-F297 HydrophobicContact CB-CG 3.84Å; Q276-F297 HydrophobicContact CG-CB 3.82Å; Q276-F297 HydrophobicContact CG-CD1 4.4Å; Q276-F297 HydrophobicContact CG-CD2 3.8Å; Q276-F297 HydrophobicContact CG-CG 3.73Å; I279-F297 HydrophobicContact CD1-CE2 3.6Å; I279-F297 HydrophobicContact CD1-CZ 3.64Å; V293-F297 HydrophobicContact CG1-CD2 3.84Å; V293-F297 HydrophobicContact CG1-CE2 4.34Å; V293-F297 WeakPolarHBondContact O-CD2 3.49Å; V293-F297 PolarHBondContact O-N 2.81Å; F297-I300 HydrophobicContact CB-CG2 3.89Å; F297-I300 HydrophobicContact CD1-CG2 4.4Å; F297-I300 WeakPolarHBondContact O-CB 3.33Å; F297-I300 WeakPolarHBondContact O-CG2 3.48Å; F297-I300 PolarHBondContact O-N 3.47Å; F297-L390 HydrophobicContact CE1-CD1 4.16Å; F297-L390 HydrophobicContact CZ-CD1 4.45Å; F297-L394 HydrophobicContact CD1-CD2 4.25Å
298	S	93.1	Very high	91.3	Very high	24 Å²	24	32.6 Å²	32.6	17%	0.168	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	-152.8	-174	-162.8	0	0	0	0	111.2	E294 I300	E294-S298 WeakPolarHBondContact O-CA 3.48Å; E294-S298 PolarHBondContact O-N 2.8Å; S298-I300 PolarHBondContact O-N 3.01Å; S298-I300 VanDerWaalsContact O-N 3.08Å
299	N	94.8	Very high	92.1	Very high	25 Å²	25	33.1 Å²	33.1	13%	0.134	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	34.4	176.9	69.6	-39	0	0	0	113.9	S301 E302 I303 P347 Y351	N299-S301 PolarHBondContact O-N 3.01Å; N299-S301 VanDerWaalsContact O-N 3.1Å; N299-E302 HydrophobicContact CB-CB 4.23Å; N299-E302 HydrophobicContact CB-CG 4.04Å; N299-E302 WeakPolarHBondContact CB-OE2 3.45Å; N299-E302 PolarHBondContact ND2-OE2 2.82Å; N299-E302 WeakPolarHBondContact O-CA 3.49Å; N299-E302 WeakPolarHBondContact O-CB 3.33Å; N299-E302 PolarHBondContact O-N 2.78Å; N299-I303 PolarHBondContact O-N 3.44Å; N299-P347 PolarHBondContact ND2-O 3.22Å; N299-Y351 WeakPolarHBondContact OD1-CA 3.27Å; N299-Y351 VanDerWaalsContact OD1-CB 3.25Å; N299-Y351 WeakPolarHBondContact OD1-CB 3.18Å; N299-Y351 PolarHBondContact OD1-N 3.26Å
300	I	94.8	Very high	92.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.5	-30.5	179.5	-165.9	67.3	0	0	0	113.4	L269 I272 V273 F297 S298 E302 I303 C304 Y351 P397	L269-I300 HydrophobicContact CD2-CD1 3.6Å; L269-I300 HydrophobicContact CD2-CG1 4.26Å; I272-I300 HydrophobicContact CG2-CG1 3.91Å; I272-I300 HydrophobicContact CG2-CG2 4.39Å; V273-I300 HydrophobicContact CG2-CG2 4.35Å; F297-I300 HydrophobicContact CB-CG2 3.89Å; F297-I300 HydrophobicContact CD1-CG2 4.4Å; F297-I300 WeakPolarHBondContact O-CB 3.33Å; F297-I300 WeakPolarHBondContact O-CG2 3.48Å; F297-I300 PolarHBondContact O-N 3.47Å; S298-I300 PolarHBondContact O-N 3.01Å; S298-I300 VanDerWaalsContact O-N 3.08Å; I300-E302 VanDerWaalsContact C-N 3.31Å; I300-E302 PolarHBondContact O-N 2.94Å; I300-I303 HydrophobicContact CD1-CB 4.22Å; I300-I303 HydrophobicContact CD1-CG1 4.45Å; I300-I303 HydrophobicContact CD1-CG2 4.43Å; I300-I303 WeakPolarHBondContact O-CB 3.09Å; I300-I303 PolarHBondContact O-N 3.32Å; I300-C304 PolarHBondContact O-N 2.96Å; I300-Y351 HydrophobicContact CB-CE2 4.04Å; I300-Y351 HydrophobicContact CD1-CE2 3.78Å; I300-Y351 HydrophobicContact CG1-CE2 4.5Å; I300-P397 HydrophobicContact CD1-CG 3.74Å
301	S	93.8	Very high	93.4	Very high	21 Å²	21	25.4 Å²	25.4	15%	0.147	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-32.9	172.8	-70.6	0	0	0	0	112.8	Q276 N299 R305	Q276-S301 PolarHBondContact OE1-OG 3.24Å; Q276-S301 VanDerWaalsContact OE1-OG 3.1Å; N299-S301 PolarHBondContact O-N 3.01Å; N299-S301 VanDerWaalsContact O-N 3.1Å; S301-R305 WeakPolarHBondContact O-CG 3.47Å; S301-R305 PolarHBondContact O-N 3.34Å
302	E	95.2	Very high	93.6	Very high	90 Å²	90	28.2 Å²	28.2	42%	0.421	15%	0.146	S	C	.	.	H	α-helix	trans	-73.7	-36	172.1	-58.5	-177.3	161.8	0	0	111.6	N299 I300 C304 R305 A306 P347	N299-E302 HydrophobicContact CB-CB 4.23Å; N299-E302 HydrophobicContact CB-CG 4.04Å; N299-E302 WeakPolarHBondContact CB-OE2 3.45Å; N299-E302 PolarHBondContact ND2-OE2 2.82Å; N299-E302 WeakPolarHBondContact O-CA 3.49Å; N299-E302 WeakPolarHBondContact O-CB 3.33Å; N299-E302 PolarHBondContact O-N 2.78Å; I300-E302 VanDerWaalsContact C-N 3.31Å; I300-E302 PolarHBondContact O-N 2.94Å; E302-C304 VanDerWaalsContact C-N 3.31Å; E302-C304 PolarHBondContact O-N 3.35Å; E302-R305 PolarHBondContact O-N 2.94Å; E302-A306 WeakPolarHBondContact O-CB 3.03Å; E302-A306 PolarHBondContact O-N 3.08Å; E302-P347 HydrophobicContact CB-CB 3.74Å; E302-P347 HydrophobicContact CB-CG 4.12Å
303	I	96.8	Very high	93.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-41.2	172.5	-55.3	-63.9	0	0	0	110.7	L269 N299 I300 A306 N307 P347 Y348 Y351 P397	L269-I303 HydrophobicContact CD1-CG2 4.02Å; L269-I303 HydrophobicContact CD2-CG2 4.01Å; N299-I303 PolarHBondContact O-N 3.44Å; I300-I303 HydrophobicContact CD1-CB 4.22Å; I300-I303 HydrophobicContact CD1-CG1 4.45Å; I300-I303 HydrophobicContact CD1-CG2 4.43Å; I300-I303 WeakPolarHBondContact O-CB 3.09Å; I300-I303 PolarHBondContact O-N 3.32Å; I303-A306 PolarHBondContact O-N 3.15Å; I303-N307 PolarHBondContact O-N 2.85Å; I303-N307 VanDerWaalsContact O-N 3.16Å; I303-N307 PolarHBondContact O-ND2 3.42Å; I303-P347 HydrophobicContact CD1-CB 4.16Å; I303-Y348 HydrophobicContact CD1-CD1 4.12Å; I303-Y348 HydrophobicContact CD1-CD2 3.72Å; I303-Y348 HydrophobicContact CD1-CE1 4.47Å; I303-Y348 HydrophobicContact CD1-CE2 4.08Å; I303-Y348 HydrophobicContact CD1-CG 3.76Å; I303-Y348 HydrophobicContact CG2-CE1 4.26Å; I303-Y348 HydrophobicContact CG2-CE2 4.02Å; I303-Y351 HydrophobicContact CD1-CG 4.08Å; I303-Y351 HydrophobicContact CG1-CD2 3.91Å; I303-Y351 HydrophobicContact CG1-CG 3.95Å; I303-P397 HydrophobicContact CG2-CB 4.03Å; I303-P397 HydrophobicContact CG2-CG 4.1Å
304	C	95.2	Very high	93.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.5	-51.5	173.9	-167.4	0	0	0	0	111.2	F215 L269 V273 I300 E302 A306 N307 L308	F215-C304 HydrophobicContact CD2-CB 4.3Å; F215-C304 HydrophobicContact CE2-CB 3.98Å; L269-C304 HydrophobicContact CB-CB 4.1Å; V273-C304 HydrophobicContact CG2-CB 4.09Å; I300-C304 PolarHBondContact O-N 2.96Å; E302-C304 VanDerWaalsContact C-N 3.31Å; E302-C304 PolarHBondContact O-N 3.35Å; C304-A306 VanDerWaalsContact C-N 3.32Å; C304-A306 PolarHBondContact O-N 3.25Å; C304-N307 PolarHBondContact O-N 3.41Å; C304-L308 VanDerWaalsContact O-CB 3.23Å; C304-L308 WeakPolarHBondContact O-CB 3.44Å; C304-L308 PolarHBondContact O-N 3.36Å
305	R	94.6	Very high	93.8	Very high	123 Å²	123	23.3 Å²	23.3	46%	0.464	13%	0.126	S	C	.	.	H	α-helix	trans	-61	-35.6	175.6	-65.1	-172.1	-160.2	97.8	-7.4	113.7	F215 S301 E302 G309	F215-R305 HydrophobicContact CB-CG 4.16Å; F215-R305 HydrophobicContact CD1-CG 4.01Å; F215-R305 HydrophobicContact CD2-CG 4.36Å; F215-R305 HydrophobicContact CE1-CG 4.47Å; F215-R305 HydrophobicContact CG-CG 3.94Å; S301-R305 WeakPolarHBondContact O-CG 3.47Å; S301-R305 PolarHBondContact O-N 3.34Å; E302-R305 PolarHBondContact O-N 2.94Å; R305-G309 PolarHBondContact O-N 3.45Å
306	A	95.5	Very high	93.9	Very high	9 Å²	9	22.8 Å²	22.8	7%	0.074	12%	0.121	C	C	.	.	H	α-helix	trans	-65	-45.7	-179.9	0	0	0	0	0	112.4	E302 I303 C304 G309 F310 L344 F345 P347	E302-A306 WeakPolarHBondContact O-CB 3.03Å; E302-A306 PolarHBondContact O-N 3.08Å; I303-A306 PolarHBondContact O-N 3.15Å; C304-A306 VanDerWaalsContact C-N 3.32Å; C304-A306 PolarHBondContact O-N 3.25Å; A306-G309 PolarHBondContact O-N 3.34Å; A306-F310 PolarHBondContact O-N 3.45Å; A306-L344 WeakPolarHBondContact CB-O 3.43Å; A306-F345 HydrophobicContact CB-CD1 4.17Å; A306-P347 HydrophobicContact CB-CG 4.39Å
307	N	95.9	Very high	93.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-74.3	-34.7	177.9	-66.5	-80.2	0	0	0	111.8	E262 Y265 I266 L269 I303 C304 F310 W311 F345 Y348 Y404	E262-N307 PolarHBondContact OE1-OD1 3.12Å; Y265-N307 HydrophobicContact CE1-CB 4.37Å; Y265-N307 WeakPolarHBondContact CE1-OD1 3.24Å; I266-N307 HydrophobicContact CD1-CB 4.37Å; I266-N307 HydrophobicContact CG1-CB 3.88Å; L269-N307 HydrophobicContact CD1-CB 4.22Å; I303-N307 PolarHBondContact O-N 2.85Å; I303-N307 VanDerWaalsContact O-N 3.16Å; I303-N307 PolarHBondContact O-ND2 3.42Å; C304-N307 PolarHBondContact O-N 3.41Å; N307-F310 WeakPolarHBondContact O-CB 3.39Å; N307-F310 PolarHBondContact O-N 2.96Å; N307-W311 PolarHBondContact O-N 3.36Å; N307-F345 WeakPolarHBondContact OD1-CZ 3.34Å; N307-Y348 PolarHBondContact ND2-OH 3.44Å; N307-Y348 PolarHBondContact OD1-OH 2.8Å; N307-Y348 VanDerWaalsContact OD1-OH 3.11Å; N307-Y404 PolarHBondContact OD1-OH 2.69Å
308	L	93.6	Very high	93.9	Very high	5 Å²	5	25.3 Å²	25.3	3%	0.026	14%	0.137	C	C	.	.	H	α-helix	trans	-60.7	-43.8	170.1	-172.1	65.6	0	0	0	111.7	A212 F215 L216 L228 I266 C304 W311 L312	A212-L308 VanDerWaalsContact O-CD2 3.31Å; A212-L308 WeakPolarHBondContact O-CD2 3.33Å; F215-L308 HydrophobicContact CB-CD2 3.57Å; L216-L308 HydrophobicContact CD1-CD1 4.37Å; L216-L308 HydrophobicContact CD2-CD1 3.8Å; L216-L308 HydrophobicContact CD2-CD2 3.67Å; L216-L308 HydrophobicContact CD2-CG 3.64Å; L216-L308 HydrophobicContact CG-CD1 4.11Å; L216-L308 HydrophobicContact CG-CD2 3.98Å; L216-L308 HydrophobicContact CG-CG 4.28Å; L228-L308 HydrophobicContact CD1-CD1 4.19Å; L228-L308 HydrophobicContact CD2-CD1 3.85Å; I266-L308 HydrophobicContact CG2-CD1 4.46Å; C304-L308 VanDerWaalsContact O-CB 3.23Å; C304-L308 WeakPolarHBondContact O-CB 3.44Å; C304-L308 PolarHBondContact O-N 3.36Å; L308-W311 WeakPolarHBondContact O-CB 3.5Å; L308-W311 PolarHBondContact O-N 3.29Å; L308-L312 WeakPolarHBondContact O-CG 3.43Å; L308-L312 PolarHBondContact O-N 3.5Å
309	G	92.5	Very high	93.9	Very high	19 Å²	19	24.1 Å²	24.1	20%	0.196	13%	0.129	C	C	.	.	H	α-helix	trans	-62.9	-40.4	173	0	0	0	0	0	112.8	R305 A306 L312 C313	R305-G309 PolarHBondContact O-N 3.45Å; A306-G309 PolarHBondContact O-N 3.34Å; G309-L312 PolarHBondContact O-N 2.96Å; G309-C313 VanDerWaalsContact O-CB 3.23Å; G309-C313 WeakPolarHBondContact O-CB 3.23Å; G309-C313 PolarHBondContact O-N 2.83Å; G309-C313 PolarHBondContact O-SG 2.74Å
310	F	95.1	Very high	93.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-43.8	171.6	175	-101.5	0	0	0	112	E262 A306 N307 L312 C313 C314 V315 F338 L341 L344 F345 Y404	E262-F310 HydrophobicContact CG-CD1 4.29Å; E262-F310 HydrophobicContact CG-CE1 4.35Å; A306-F310 PolarHBondContact O-N 3.45Å; N307-F310 WeakPolarHBondContact O-CB 3.39Å; N307-F310 PolarHBondContact O-N 2.96Å; F310-L312 PolarHBondContact O-N 3.13Å; F310-C313 PolarHBondContact O-N 3.19Å; F310-C314 HydrophobicContact CD2-CB 3.95Å; F310-C314 HydrophobicContact CE2-CB 3.76Å; F310-C314 HydrophobicContact CG-CB 4.44Å; F310-C314 HydrophobicContact CZ-CB 4.08Å; F310-C314 WeakPolarHBondContact O-CB 3.33Å; F310-C314 PolarHBondContact O-N 3.29Å; F310-V315 HydrophobicContact CE1-CG2 4.08Å; F310-F338 HydrophobicContact CE2-CD2 4.3Å; F310-F338 HydrophobicContact CE2-CE1 4.48Å; F310-F338 HydrophobicContact CE2-CE2 4.12Å; F310-F338 HydrophobicContact CE2-CZ 4.21Å; F310-F338 HydrophobicContact CZ-CD2 4.37Å; F310-F338 HydrophobicContact CZ-CE1 4.26Å; F310-F338 AromaticContact CZ-CE2 3.74Å; F310-F338 HydrophobicContact CZ-CE2 3.74Å; F310-F338 AromaticContact CZ-CZ 3.67Å; F310-F338 HydrophobicContact CZ-CZ 3.67Å; F310-L341 HydrophobicContact CD2-CD2 4.41Å; F310-L341 HydrophobicContact CE2-CD2 4.42Å; F310-L344 HydrophobicContact CD2-CD1 4.48Å; F310-F345 HydrophobicContact CB-CE1 3.76Å; F310-F345 HydrophobicContact CB-CZ 4.14Å; F310-F345 HydrophobicContact CD1-CZ 4.39Å; F310-F345 HydrophobicContact CD2-CZ 4.41Å; F310-F345 HydrophobicContact CG-CE1 4.19Å; F310-F345 HydrophobicContact CG-CZ 4.07Å; F310-Y404 HydrophobicContact CE1-CE1 4.32Å
311	W	94.8	Very high	93.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-56.7	-51.4	174	179.8	-87.4	0	0	0	111.6	V227 L228 L230 I259 E262 L263 I266 N307 L308 C313 V315 H316 L319	V227-W311 PolarHBondContact O-NE1 3.01Å; L228-W311 HydrophobicContact CD2-CD2 4.49Å; L228-W311 HydrophobicContact CD2-CG 4.17Å; L230-W311 HydrophobicContact CD1-CH2 4.47Å; L230-W311 HydrophobicContact CD2-CH2 4.46Å; I259-W311 HydrophobicContact CG2-CH2 3.94Å; I259-W311 HydrophobicContact CG2-CZ3 4.03Å; E262-W311 HydrophobicContact CB-CE3 4.4Å; E262-W311 HydrophobicContact CB-CZ3 4.46Å; E262-W311 HydrophobicContact CG-CE3 4.18Å; L263-W311 HydrophobicContact CB-CH2 3.9Å; L263-W311 HydrophobicContact CB-CZ3 3.74Å; L263-W311 HydrophobicContact CD1-CH2 4.39Å; L263-W311 HydrophobicContact CD2-CH2 4.24Å; L263-W311 HydrophobicContact CG-CH2 4.4Å; I266-W311 HydrophobicContact CD1-CB 3.78Å; I266-W311 HydrophobicContact CD1-CD2 4.45Å; I266-W311 HydrophobicContact CD1-CE3 4.25Å; I266-W311 HydrophobicContact CD1-CG 4.3Å; N307-W311 PolarHBondContact O-N 3.36Å; L308-W311 WeakPolarHBondContact O-CB 3.5Å; L308-W311 PolarHBondContact O-N 3.29Å; W311-C313 PolarHBondContact O-N 3.46Å; W311-V315 HydrophobicContact CD2-CB 4.03Å; W311-V315 HydrophobicContact CD2-CG1 4.01Å; W311-V315 HydrophobicContact CE3-CB 3.81Å; W311-V315 HydrophobicContact CE3-CG1 3.57Å; W311-V315 HydrophobicContact CE3-CG2 4.2Å; W311-V315 HydrophobicContact CG-CB 4.45Å; W311-V315 HydrophobicContact CH2-CG1 3.83Å; W311-V315 HydrophobicContact CZ2-CG1 4.25Å; W311-V315 HydrophobicContact CZ3-CB 4.24Å; W311-V315 HydrophobicContact CZ3-CG1 3.47Å; W311-V315 VanDerWaalsContact CZ3-CG1 3.47Å; W311-V315 PolarHBondContact O-N 3.47Å; W311-H316 PolarHBondContact O-N 3.16Å; W311-L319 HydrophobicContact CH2-CD1 3.97Å; W311-L319 HydrophobicContact CZ2-CD1 3.87Å
312	L	91.6	Very high	93.6	Very high	70 Å²	70	29.4 Å²	29.4	37%	0.366	15%	0.148	S	C	.	.	I	π-helix	trans	-58.9	-41.9	177	-67	175.4	0	0	0	113.3	L216 V227 L308 G309 F310 P317	L216-L312 HydrophobicContact CD2-CD1 3.71Å; L216-L312 HydrophobicContact CD2-CD2 4.02Å; L216-L312 HydrophobicContact CD2-CG 4.14Å; V227-L312 HydrophobicContact CG1-CD2 3.44Å; V227-L312 VanDerWaalsContact CG1-CD2 3.44Å; L308-L312 WeakPolarHBondContact O-CG 3.43Å; L308-L312 PolarHBondContact O-N 3.5Å; G309-L312 PolarHBondContact O-N 2.96Å; F310-L312 PolarHBondContact O-N 3.13Å; L312-P317 WeakPolarHBondContact O-CD 3.46Å; L312-P317 WeakPolarHBondContact O-CG 2.98Å
313	C	89.3	Confident	93.5	Very high	46 Å²	46	28.5 Å²	28.5	31%	0.311	14%	0.141	S	C	.	.	I	π-helix	trans	-91.4	-8.2	-171.6	-73.3	0	0	0	0	115.1	G309 F310 W311 R340	G309-C313 VanDerWaalsContact O-CB 3.23Å; G309-C313 WeakPolarHBondContact O-CB 3.23Å; G309-C313 PolarHBondContact O-N 2.83Å; G309-C313 PolarHBondContact O-SG 2.74Å; F310-C313 PolarHBondContact O-N 3.19Å; W311-C313 PolarHBondContact O-N 3.46Å; C313-R340 PolarHBondContact O-NH2 2.83Å
314	C	93.5	Very high	93.3	Very high	1 Å²	1	35 Å²	35	1%	0.007	17%	0.171	C	C	.	.	I	π-helix	trans	-136.5	-54.6	-171.4	-169.5	0	0	0	0	112.6	F310 M334	F310-C314 HydrophobicContact CD2-CB 3.95Å; F310-C314 HydrophobicContact CE2-CB 3.76Å; F310-C314 HydrophobicContact CG-CB 4.44Å; F310-C314 HydrophobicContact CZ-CB 4.08Å; F310-C314 WeakPolarHBondContact O-CB 3.33Å; F310-C314 PolarHBondContact O-N 3.29Å; C314-M334 VanDerWaalsContact SG-CB 3.57Å; C314-M334 PolarHBondContact SG-O 3.05Å
315	V	93.8	Very high	93.2	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.012	19%	0.187	C	C	.	.	I	π-helix	trans	-85.3	-46.3	-170.7	179.2	0	0	0	0	112.5	I259 F310 W311 L318 L319	I259-V315 HydrophobicContact CB-CG1 4.32Å; I259-V315 HydrophobicContact CD1-CG1 4.4Å; I259-V315 HydrophobicContact CG1-CG1 3.87Å; I259-V315 HydrophobicContact CG2-CG1 3.84Å; F310-V315 HydrophobicContact CE1-CG2 4.08Å; W311-V315 HydrophobicContact CD2-CB 4.03Å; W311-V315 HydrophobicContact CD2-CG1 4.01Å; W311-V315 HydrophobicContact CE3-CB 3.81Å; W311-V315 HydrophobicContact CE3-CG1 3.57Å; W311-V315 HydrophobicContact CE3-CG2 4.2Å; W311-V315 HydrophobicContact CG-CB 4.45Å; W311-V315 HydrophobicContact CH2-CG1 3.83Å; W311-V315 HydrophobicContact CZ2-CG1 4.25Å; W311-V315 HydrophobicContact CZ3-CB 4.24Å; W311-V315 HydrophobicContact CZ3-CG1 3.47Å; W311-V315 VanDerWaalsContact CZ3-CG1 3.47Å; W311-V315 PolarHBondContact O-N 3.47Å; V315-L318 WeakPolarHBondContact O-CB 3.3Å; V315-L318 PolarHBondContact O-N 2.89Å; V315-L319 HydrophobicContact CG1-CD1 3.9Å; V315-L319 HydrophobicContact CG1-CG 4.36Å; V315-L319 PolarHBondContact O-N 3.02Å
316	H	91.9	Very high	93	Very high	36 Å²	36	32 Å²	32	17%	0.167	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-42.2	179.6	-175.6	-88.6	0	0	0	113.2	V227 W311 L318 L319 Q320	V227-H316 PolarHBondContact O-CD2 3.03Å; W311-H316 PolarHBondContact O-N 3.16Å; H316-L318 VanDerWaalsContact C-N 3.35Å; H316-L318 PolarHBondContact O-N 3.1Å; H316-L319 PolarHBondContact O-N 3.48Å; H316-Q320 PolarHBondContact CE1-OE1 3.44Å; H316-Q320 VanDerWaalsContact CE1-OE1 3.23Å; H316-Q320 VanDerWaalsContact O-CB 3.26Å; H316-Q320 WeakPolarHBondContact O-CB 3.43Å; H316-Q320 PolarHBondContact O-N 2.89Å
317	P	91.6	Very high	92.8	Very high	58 Å²	58	36.9 Å²	36.9	38%	0.377	19%	0.187	S	C	.	.	H	α-helix	trans	-63.3	-37.3	176.5	-23.4	35.6	0	0	0	113.3	L312 Y321	L312-P317 WeakPolarHBondContact O-CD 3.46Å; L312-P317 WeakPolarHBondContact O-CG 2.98Å; P317-Y321 WeakPolarHBondContact O-CB 3.49Å; P317-Y321 PolarHBondContact O-N 3.44Å
318	L	94.1	Very high	92.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-52.8	173.3	166.8	59.5	0	0	0	111	I255 I259 V315 H316 Q320 Y321 S322 L329 D330 K333 M334	I255-L318 HydrophobicContact CG2-CD2 4.07Å; I259-L318 HydrophobicContact CD1-CD2 4.1Å; V315-L318 WeakPolarHBondContact O-CB 3.3Å; V315-L318 PolarHBondContact O-N 2.89Å; H316-L318 VanDerWaalsContact C-N 3.35Å; H316-L318 PolarHBondContact O-N 3.1Å; L318-Q320 VanDerWaalsContact C-N 3.33Å; L318-Q320 PolarHBondContact O-N 3.17Å; L318-Y321 PolarHBondContact O-N 3.19Å; L318-S322 PolarHBondContact O-N 3.37Å; L318-S322 VanDerWaalsContact O-N 3.13Å; L318-L329 HydrophobicContact CD1-CB 4.14Å; L318-L329 HydrophobicContact CD1-CD2 4.04Å; L318-L329 HydrophobicContact CG-CD2 4.01Å; L318-D330 WeakPolarHBondContact CD1-O 3.24Å; L318-K333 HydrophobicContact CB-CB 4.48Å; L318-K333 HydrophobicContact CD1-CB 4.49Å; L318-M334 HydrophobicContact CD2-CE 4.02Å; L318-M334 HydrophobicContact CD2-CG 3.78Å; L318-M334 HydrophobicContact CD2-SD 3.75Å
319	L	94	Very high	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-44.6	177.6	-73.3	171.1	0	0	0	111.6	L230 I237 W256 I259 W311 V315 H316 Y321 S322 R323 L329	L230-L319 HydrophobicContact CD1-CD1 3.77Å; L230-L319 HydrophobicContact CD1-CD2 3.92Å; I237-L319 HydrophobicContact CD1-CD2 3.86Å; W256-L319 HydrophobicContact CZ3-CD2 3.89Å; I259-L319 HydrophobicContact CD1-CD2 4.07Å; I259-L319 HydrophobicContact CD1-CG 4.38Å; I259-L319 HydrophobicContact CG2-CD1 4.09Å; I259-L319 HydrophobicContact CG2-CD2 4.36Å; W311-L319 HydrophobicContact CH2-CD1 3.97Å; W311-L319 HydrophobicContact CZ2-CD1 3.87Å; V315-L319 HydrophobicContact CG1-CD1 3.9Å; V315-L319 HydrophobicContact CG1-CG 4.36Å; V315-L319 PolarHBondContact O-N 3.02Å; H316-L319 PolarHBondContact O-N 3.48Å; L319-Y321 PolarHBondContact O-N 3.12Å; L319-S322 PolarHBondContact O-N 3.42Å; L319-R323 VanDerWaalsContact O-CB 3.32Å; L319-R323 WeakPolarHBondContact O-CB 3.36Å; L319-R323 WeakPolarHBondContact O-CG 3.41Å; L319-R323 PolarHBondContact O-N 3.22Å; L319-L329 HydrophobicContact CD2-CD2 4.33Å
320	Q	91.7	Very high	92.7	Very high	83 Å²	83	39.9 Å²	39.9	39%	0.388	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-41.3	-179.5	-173.6	171.5	-0.3	0	0	112.2	H316 L318 R323 Q324	H316-Q320 PolarHBondContact CE1-OE1 3.44Å; H316-Q320 VanDerWaalsContact CE1-OE1 3.23Å; H316-Q320 VanDerWaalsContact O-CB 3.26Å; H316-Q320 WeakPolarHBondContact O-CB 3.43Å; H316-Q320 PolarHBondContact O-N 2.89Å; L318-Q320 VanDerWaalsContact C-N 3.33Å; L318-Q320 PolarHBondContact O-N 3.17Å; Q320-R323 PolarHBondContact O-N 3.07Å; Q320-Q324 WeakPolarHBondContact O-CB 3.41Å; Q320-Q324 VanDerWaalsContact O-CG 3.28Å; Q320-Q324 WeakPolarHBondContact O-CG 3.33Å; Q320-Q324 PolarHBondContact O-N 3.14Å
321	Y	92.1	Very high	92.6	Very high	73 Å²	73	39.8 Å²	39.8	29%	0.286	20%	0.201	S	C	.	.	H	α-helix	trans	-62.7	-45.8	175.3	173.4	-102.7	0	0	0	112.4	P317 L318 L319 Q324 T325 K327	P317-Y321 WeakPolarHBondContact O-CB 3.49Å; P317-Y321 PolarHBondContact O-N 3.44Å; L318-Y321 PolarHBondContact O-N 3.19Å; L319-Y321 PolarHBondContact O-N 3.12Å; Y321-Q324 PolarHBondContact O-N 3.11Å; Y321-T325 HydrophobicContact CD2-CG2 3.96Å; Y321-T325 HydrophobicContact CE2-CG2 3.7Å; Y321-T325 WeakPolarHBondContact O-CB 3.46Å; Y321-T325 WeakPolarHBondContact O-CG2 3.47Å; Y321-T325 PolarHBondContact O-N 2.99Å; Y321-T325 PolarHBondContact O-OG1 3.46Å; Y321-K327 HydrophobicContact CE1-CD 4.46Å; Y321-K327 WeakPolarHBondContact OH-CD 3.29Å; Y321-K327 PolarHBondContact OH-NZ 3.14Å
322	S	93.4	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-39.3	176.2	-75.3	0	0	0	0	112.3	I237 L318 L319 Q324 G326 K327 P328	I237-S322 VanDerWaalsContact CG2-C 3.4Å; L318-S322 PolarHBondContact O-N 3.37Å; L318-S322 VanDerWaalsContact O-N 3.13Å; L319-S322 PolarHBondContact O-N 3.42Å; S322-Q324 VanDerWaalsContact C-N 3.35Å; S322-Q324 PolarHBondContact O-N 3.44Å; S322-G326 WeakPolarHBondContact O-CA 3.45Å; S322-G326 PolarHBondContact O-N 2.93Å; S322-K327 VanDerWaalsContact CB-O 3.31Å; S322-K327 WeakPolarHBondContact CB-O 3.29Å; S322-K327 PolarHBondContact OG-O 3.24Å; S322-P328 PolarHBondContact OG-O 2.88Å
323	R	92.7	Very high	92.6	Very high	71 Å²	71	42.4 Å²	42.4	27%	0.268	21%	0.213	S	C	.	.	H	α-helix	trans	-59.6	-41.9	174.6	-75.4	168.3	175.8	160.2	2.5	112.4	F229 E231 I237 L319 Q320	F229-R323 PolarHBondContact O-NH2 2.9Å; E231-R323 VanDerWaalsContact CD-NH2 3.32Å; E231-R323 IonicContact OE1-CZ 2.95Å; E231-R323 IonicContact OE1-NE 3.34Å; E231-R323 PolarHBondContact OE1-NE 2.96Å; E231-R323 IonicContact OE1-NH2 3.16Å; E231-R323 PolarHBondContact OE1-NH2 3.46Å; E231-R323 IonicContact OE2-CZ 3.38Å; E231-R323 IonicContact OE2-NE 3.77Å; E231-R323 IonicContact OE2-NH2 2.67Å; E231-R323 PolarHBondContact OE2-NH2 3.26Å; I237-R323 HydrophobicContact CD1-CG 4.36Å; I237-R323 HydrophobicContact CG2-CB 4.3Å; I237-R323 HydrophobicContact CG2-CG 3.78Å; L319-R323 VanDerWaalsContact O-CB 3.32Å; L319-R323 WeakPolarHBondContact O-CB 3.36Å; L319-R323 WeakPolarHBondContact O-CG 3.41Å; L319-R323 PolarHBondContact O-N 3.22Å; Q320-R323 PolarHBondContact O-N 3.07Å
324	Q	92.2	Very high	92.9	Very high	137 Å²	137	40.3 Å²	40.3	64%	0.64	20%	0.198	S	C	*	.	H	α-helix	trans	-74.9	-44.3	179.6	-71.9	174.2	-13.8	0	0	112.7	Q320 Y321 S322	Q320-Q324 WeakPolarHBondContact O-CB 3.41Å; Q320-Q324 VanDerWaalsContact O-CG 3.28Å; Q320-Q324 WeakPolarHBondContact O-CG 3.33Å; Q320-Q324 PolarHBondContact O-N 3.14Å; Y321-Q324 PolarHBondContact O-N 3.11Å; S322-Q324 VanDerWaalsContact C-N 3.35Å; S322-Q324 PolarHBondContact O-N 3.44Å
325	T	93	Very high	92.9	Very high	56 Å²	56	43.4 Å²	43.4	34%	0.344	21%	0.213	S	C	.	.	H	α-helix	trans	-90.6	-20.2	-173.5	63.4	0	0	0	0	114.4	Y321 K327	Y321-T325 HydrophobicContact CD2-CG2 3.96Å; Y321-T325 HydrophobicContact CE2-CG2 3.7Å; Y321-T325 WeakPolarHBondContact O-CB 3.46Å; Y321-T325 WeakPolarHBondContact O-CG2 3.47Å; Y321-T325 PolarHBondContact O-N 2.99Å; Y321-T325 PolarHBondContact O-OG1 3.46Å; T325-K327 PolarHBondContact O-N 2.82Å; T325-K327 WeakPolarHBondContact OG1-CB 3.21Å; T325-K327 PolarHBondContact OG1-N 3.35Å
326	G	90.9	Very high	92.8	Very high	5 Å²	5	46.5 Å²	46.5	5%	0.052	23%	0.234	C	C	.	.			trans	69.3	6.9	-168.5	0	0	0	0	0	114.6	K239 S322	K239-G326 PolarHBondContact N-O 3.28Å; S322-G326 WeakPolarHBondContact O-CA 3.45Å; S322-G326 PolarHBondContact O-N 2.93Å
327	K	92.1	Very high	92.9	Very high	111 Å²	111	44.8 Å²	44.8	48%	0.483	23%	0.227	S	C	.	.			trans	-79.2	156.5	-178.6	-68	176.8	-179.7	179.4	0	111.9	Y321 S322 T325	Y321-K327 HydrophobicContact CE1-CD 4.46Å; Y321-K327 WeakPolarHBondContact OH-CD 3.29Å; Y321-K327 PolarHBondContact OH-NZ 3.14Å; S322-K327 VanDerWaalsContact CB-O 3.31Å; S322-K327 WeakPolarHBondContact CB-O 3.29Å; S322-K327 PolarHBondContact OG-O 3.24Å; T325-K327 PolarHBondContact O-N 2.82Å; T325-K327 WeakPolarHBondContact OG1-CB 3.21Å; T325-K327 PolarHBondContact OG1-N 3.35Å
328	P	92.1	Very high	93.1	Very high	49 Å²	49	42 Å²	42	32%	0.318	21%	0.209	S	C	.	.			trans	-48.8	149.2	169.9	-27.6	35.7	0	0	0	113.1	V238 L244 S322 D330	V238-P328 HydrophobicContact CG1-CB 4.29Å; V238-P328 HydrophobicContact CG1-CG 3.93Å; L244-P328 HydrophobicContact CD1-CG 4.2Å; L244-P328 HydrophobicContact CD2-CG 3.93Å; S322-P328 PolarHBondContact OG-O 2.88Å; P328-D330 PolarHBondContact O-N 3.04Å
329	L	94.1	Very high	93.1	Very high	2 Å²	2	45 Å²	45	1%	0.01	23%	0.229	C	C	.	.			trans	-61.7	115.8	174.3	-62.7	163	0	0	0	108.8	W234 Q252 I255 W256 I259 L318 L319	W234-L329 HydrophobicContact CB-CD1 4.09Å; Q252-L329 PolarHBondContact NE2-O 3.36Å; I255-L329 HydrophobicContact CD1-CB 4.34Å; I255-L329 WeakPolarHBondContact CD1-O 3.48Å; I255-L329 HydrophobicContact CG2-CB 3.94Å; I255-L329 HydrophobicContact CG2-CD1 4.04Å; W256-L329 HydrophobicContact CE3-CD1 3.94Å; W256-L329 HydrophobicContact CZ3-CD1 4.46Å; I259-L329 HydrophobicContact CD1-CD1 4.43Å; I259-L329 HydrophobicContact CD1-CD2 4.5Å; L318-L329 HydrophobicContact CD1-CB 4.14Å; L318-L329 HydrophobicContact CD1-CD2 4.04Å; L318-L329 HydrophobicContact CG-CD2 4.01Å; L319-L329 HydrophobicContact CD2-CD2 4.33Å
330	D	92.3	Very high	93.1	Very high	35 Å²	35	49.7 Å²	49.7	19%	0.187	25%	0.247	C	C	.	.			trans	-95.1	107.1	-174.3	171.6	-10.1	0	0	0	110	L318 P328 T332 K333	L318-D330 WeakPolarHBondContact CD1-O 3.24Å; P328-D330 PolarHBondContact O-N 3.04Å; D330-T332 PolarHBondContact O-N 2.83Å; D330-T332 VanDerWaalsContact OD1-CB 3.31Å; D330-T332 WeakPolarHBondContact OD1-CB 3.45Å; D330-T332 WeakPolarHBondContact OD1-CG2 3.42Å; D330-T332 PolarHBondContact OD1-N 2.58Å; D330-T332 PolarHBondContact OD1-OG1 2.77Å; D330-T332 PolarHBondContact OD2-OG1 3.27Å; D330-K333 HydrophobicContact CB-CG 4.2Å; D330-K333 PolarHBondContact O-N 3.38Å; D330-K333 IonicContact OD1-NZ 2.63Å; D330-K333 WeakPolarHBondContact OD2-CE 3.29Å; D330-K333 IonicContact OD2-NZ 2.76Å; D330-K333 PolarHBondContact OD2-NZ 3.36Å
331	P	93.9	Very high	93.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-65.6	-21.3	-174	28	-34.9	0	0	0	113.1	I255 K333 M334 D420 L424 M427	I255-P331 HydrophobicContact CD1-CB 4.15Å; I255-P331 HydrophobicContact CD1-CG 4.32Å; P331-K333 PolarHBondContact O-N 3.39Å; P331-K333 VanDerWaalsContact O-N 3.13Å; P331-M334 HydrophobicContact CB-CE 4.12Å; P331-M334 PolarHBondContact O-N 2.79Å; P331-D420 WeakPolarHBondContact CD-OD1 3.37Å; P331-D420 HydrophobicContact CG-CB 4.07Å; P331-D420 WeakPolarHBondContact CG-OD1 3.44Å; P331-L424 HydrophobicContact CB-CD1 4.4Å; P331-L424 HydrophobicContact CB-CD2 4.22Å; P331-L424 HydrophobicContact CB-CG 4.28Å; P331-L424 HydrophobicContact CG-CD1 4.28Å; P331-M427 HydrophobicContact CB-CE 4.4Å; P331-M427 VanDerWaalsContact O-CE 3.27Å; P331-M427 WeakPolarHBondContact O-CE 3.33Å
332	T	94.1	Very high	93.3	Very high	38 Å²	38	44.6 Å²	44.6	23%	0.233	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-61.8	-23.7	178.5	72.3	0	0	0	0	112.7	D330 M334 E335 A419 S423	D330-T332 PolarHBondContact O-N 2.83Å; D330-T332 VanDerWaalsContact OD1-CB 3.31Å; D330-T332 WeakPolarHBondContact OD1-CB 3.45Å; D330-T332 WeakPolarHBondContact OD1-CG2 3.42Å; D330-T332 PolarHBondContact OD1-N 2.58Å; D330-T332 PolarHBondContact OD1-OG1 2.77Å; D330-T332 PolarHBondContact OD2-OG1 3.27Å; T332-M334 VanDerWaalsContact C-N 3.26Å; T332-M334 PolarHBondContact O-N 2.82Å; T332-E335 WeakPolarHBondContact O-CB 3.31Å; T332-E335 PolarHBondContact O-N 3Å; T332-A419 HydrophobicContact CG2-CB 4.28Å; T332-S423 WeakPolarHBondContact CA-OG 3.46Å
333	K	92.4	Very high	93.3	Very high	87 Å²	87	53.2 Å²	53.2	38%	0.378	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-69.7	-22.8	178	-57.2	-64.2	162.9	-65.8	0	113	L318 D330 P331	L318-K333 HydrophobicContact CB-CB 4.48Å; L318-K333 HydrophobicContact CD1-CB 4.49Å; D330-K333 HydrophobicContact CB-CG 4.2Å; D330-K333 PolarHBondContact O-N 3.38Å; D330-K333 IonicContact OD1-NZ 2.63Å; D330-K333 WeakPolarHBondContact OD2-CE 3.29Å; D330-K333 IonicContact OD2-NZ 2.76Å; D330-K333 PolarHBondContact OD2-NZ 3.36Å; P331-K333 PolarHBondContact O-N 3.39Å; P331-K333 VanDerWaalsContact O-N 3.13Å
334	M	95	Very high	93.4	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-81.1	-17.5	178.2	-67.4	-171.5	-74.1	0	0	113.6	I255 L258 C314 L318 P331 T332 S336 G337 F338 M427	I255-M334 HydrophobicContact CG2-CE 4.18Å; L258-M334 HydrophobicContact CD2-CE 4.12Å; L258-M334 HydrophobicContact CD2-SD 3.93Å; C314-M334 VanDerWaalsContact SG-CB 3.57Å; C314-M334 PolarHBondContact SG-O 3.05Å; L318-M334 HydrophobicContact CD2-CE 4.02Å; L318-M334 HydrophobicContact CD2-CG 3.78Å; L318-M334 HydrophobicContact CD2-SD 3.75Å; P331-M334 HydrophobicContact CB-CE 4.12Å; P331-M334 PolarHBondContact O-N 2.79Å; T332-M334 VanDerWaalsContact C-N 3.26Å; T332-M334 PolarHBondContact O-N 2.82Å; M334-S336 VanDerWaalsContact C-N 3.3Å; M334-S336 PolarHBondContact O-N 3.18Å; M334-G337 WeakPolarHBondContact O-CA 3.34Å; M334-G337 PolarHBondContact O-N 3Å; M334-F338 HydrophobicContact CB-CD2 4.05Å; M334-F338 HydrophobicContact CB-CE2 4.14Å; M334-F338 WeakPolarHBondContact O-CD2 3.36Å; M334-F338 PolarHBondContact O-N 2.91Å; M334-F338 VanDerWaalsContact O-N 3.13Å; M334-F338 HydrophobicContact SD-CE2 4.43Å; M334-M427 VanDerWaalsContact C-SD 3.57Å; M334-M427 HydrophobicContact CB-CE 4.33Å; M334-M427 HydrophobicContact CB-SD 3.66Å
335	E	94.6	Very high	93.7	Very high	67 Å²	67	44.6 Å²	44.6	31%	0.313	22%	0.224	S	C	.	.	H	α-helix	trans	-56	-43.7	-173.3	-164	176	141.6	0	0	112.5	T332 G337 F338 S339 S423 V426 M427	T332-E335 WeakPolarHBondContact O-CB 3.31Å; T332-E335 PolarHBondContact O-N 3Å; E335-G337 PolarHBondContact O-N 3.34Å; E335-F338 PolarHBondContact O-N 2.92Å; E335-S339 WeakPolarHBondContact O-CB 3.43Å; E335-S339 PolarHBondContact O-N 2.74Å; E335-S339 PolarHBondContact O-OG 3.5Å; E335-S339 VanDerWaalsContact O-OG 3.13Å; E335-S423 WeakPolarHBondContact CB-OG 3.35Å; E335-S423 VanDerWaalsContact OE2-CA 3.3Å; E335-S423 WeakPolarHBondContact OE2-CA 3.34Å; E335-S423 WeakPolarHBondContact OE2-CB 3.33Å; E335-S423 PolarHBondContact OE2-OG 3.01Å; E335-V426 HydrophobicContact CG-CG1 4.44Å; E335-M427 HydrophobicContact CB-CG 4.33Å; E335-M427 HydrophobicContact CB-SD 4.38Å; E335-M427 HydrophobicContact CG-CG 4.24Å; E335-M427 PolarHBondContact N-SD 3.01Å
336	S	91.9	Very high	93.8	Very high	67 Å²	67	46 Å²	46	47%	0.469	22%	0.223	S	C	.	.	H	α-helix	trans	-60.5	-27.8	176.6	75.6	0	0	0	0	113.5	M334 R340	M334-S336 VanDerWaalsContact C-N 3.3Å; M334-S336 PolarHBondContact O-N 3.18Å; S336-R340 PolarHBondContact O-NE 3.3Å; S336-R340 PolarHBondContact O-NH2 3.48Å; S336-R340 VanDerWaalsContact O-NH2 3.17Å
337	G	92.8	Very high	94.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-77.9	-47.4	175.9	0	0	0	0	0	112	M334 E335 S339 R340	M334-G337 WeakPolarHBondContact O-CA 3.34Å; M334-G337 PolarHBondContact O-N 3Å; E335-G337 PolarHBondContact O-N 3.34Å; G337-S339 PolarHBondContact O-N 2.88Å; G337-R340 PolarHBondContact O-N 3.35Å; G337-R340 VanDerWaalsContact O-N 3.1Å
338	F	96.3	Very high	94.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-34.4	178.5	-81.2	-84.8	0	0	0	113.2	L258 F310 M334 E335 R340 L341 Y404 L408 M427 A431	L258-F338 HydrophobicContact CD2-CZ 4.36Å; F310-F338 HydrophobicContact CE2-CD2 4.3Å; F310-F338 HydrophobicContact CE2-CE1 4.48Å; F310-F338 HydrophobicContact CE2-CE2 4.12Å; F310-F338 HydrophobicContact CE2-CZ 4.21Å; F310-F338 HydrophobicContact CZ-CD2 4.37Å; F310-F338 HydrophobicContact CZ-CE1 4.26Å; F310-F338 AromaticContact CZ-CE2 3.74Å; F310-F338 HydrophobicContact CZ-CE2 3.74Å; F310-F338 AromaticContact CZ-CZ 3.67Å; F310-F338 HydrophobicContact CZ-CZ 3.67Å; M334-F338 HydrophobicContact CB-CD2 4.05Å; M334-F338 HydrophobicContact CB-CE2 4.14Å; M334-F338 WeakPolarHBondContact O-CD2 3.36Å; M334-F338 PolarHBondContact O-N 2.91Å; M334-F338 VanDerWaalsContact O-N 3.13Å; M334-F338 HydrophobicContact SD-CE2 4.43Å; E335-F338 PolarHBondContact O-N 2.92Å; F338-R340 PolarHBondContact O-N 3.46Å; F338-R340 VanDerWaalsContact O-N 3.16Å; F338-L341 HydrophobicContact CD1-CD1 3.85Å; F338-L341 HydrophobicContact CD1-CG 4.46Å; F338-L341 VanDerWaalsContact O-CG 3.26Å; F338-L341 WeakPolarHBondContact O-CG 3.47Å; F338-L341 PolarHBondContact O-N 2.83Å; F338-Y404 HydrophobicContact CE1-CD1 4.19Å; F338-Y404 HydrophobicContact CE1-CG 4.38Å; F338-Y404 HydrophobicContact CZ-CD1 4.29Å; F338-L408 HydrophobicContact CD1-CD1 4Å; F338-L408 HydrophobicContact CE1-CD1 3.69Å; F338-L408 HydrophobicContact CE1-CG 4.46Å; F338-L408 HydrophobicContact CE2-CD2 4.24Å; F338-L408 HydrophobicContact CZ-CD1 4.03Å; F338-L408 HydrophobicContact CZ-CD2 4.11Å; F338-L408 HydrophobicContact CZ-CG 4.35Å; F338-M427 HydrophobicContact CB-CB 3.89Å; F338-M427 HydrophobicContact CB-CG 3.67Å; F338-M427 HydrophobicContact CB-SD 4.11Å; F338-M427 HydrophobicContact CD1-CB 4.35Å; F338-M427 HydrophobicContact CD2-CB 4.26Å; F338-M427 HydrophobicContact CD2-CG 4.04Å; F338-M427 HydrophobicContact CD2-SD 3.37Å; F338-M427 WeakPolarHBondContact CD2-SD 3.25Å; F338-M427 HydrophobicContact CE2-SD 4.06Å; F338-M427 HydrophobicContact CG-CB 3.91Å; F338-M427 HydrophobicContact CG-CG 3.95Å; F338-M427 HydrophobicContact CG-SD 3.93Å; F338-A431 HydrophobicContact CD1-CB 4.5Å
339	S	94.6	Very high	94.5	Very high	61 Å²	61	40.6 Å²	40.6	43%	0.427	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-9.9	172.8	-63.6	0	0	0	0	114.1	E335 G337	E335-S339 WeakPolarHBondContact O-CB 3.43Å; E335-S339 PolarHBondContact O-N 2.74Å; E335-S339 PolarHBondContact O-OG 3.5Å; E335-S339 VanDerWaalsContact O-OG 3.13Å; G337-S339 PolarHBondContact O-N 2.88Å
340	R	94.1	Very high	94.6	Very high	99 Å²	99	43.5 Å²	43.5	37%	0.374	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	10.7	177.4	-74.4	179.2	-71.8	164.7	-0.9	114	C313 S336 G337 F338 D342 Y343 L344	C313-R340 PolarHBondContact O-NH2 2.83Å; S336-R340 PolarHBondContact O-NE 3.3Å; S336-R340 PolarHBondContact O-NH2 3.48Å; S336-R340 VanDerWaalsContact O-NH2 3.17Å; G337-R340 PolarHBondContact O-N 3.35Å; G337-R340 VanDerWaalsContact O-N 3.1Å; F338-R340 PolarHBondContact O-N 3.46Å; F338-R340 VanDerWaalsContact O-N 3.16Å; R340-D342 PolarHBondContact O-N 2.76Å; R340-Y343 PolarHBondContact O-N 2.89Å; R340-Y343 VanDerWaalsContact O-N 3.08Å; R340-L344 HydrophobicContact CB-CD1 4Å; R340-L344 HydrophobicContact CB-CG 4.23Å; R340-L344 PolarHBondContact O-N 2.87Å
341	L	94.9	Very high	94.8	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-56.6	-43.4	-176.3	-75.3	176.8	0	0	0	113.9	F310 F338 Y343 L344 F345 A431 F434	F310-L341 HydrophobicContact CD2-CD2 4.41Å; F310-L341 HydrophobicContact CE2-CD2 4.42Å; F338-L341 HydrophobicContact CD1-CD1 3.85Å; F338-L341 HydrophobicContact CD1-CG 4.46Å; F338-L341 VanDerWaalsContact O-CG 3.26Å; F338-L341 WeakPolarHBondContact O-CG 3.47Å; F338-L341 PolarHBondContact O-N 2.83Å; L341-Y343 PolarHBondContact O-N 3.44Å; L341-Y343 VanDerWaalsContact O-N 3.15Å; L341-L344 PolarHBondContact O-N 3.19Å; L341-F345 HydrophobicContact CD2-CD2 3.53Å; L341-F345 HydrophobicContact CD2-CE2 3.48Å; L341-F345 VanDerWaalsContact CD2-CE2 3.48Å; L341-F345 HydrophobicContact CD2-CG 4.08Å; L341-F345 HydrophobicContact CD2-CZ 4.03Å; L341-F345 WeakPolarHBondContact O-CA 3.39Å; L341-F345 WeakPolarHBondContact O-CB 3.49Å; L341-F345 PolarHBondContact O-N 3.08Å; L341-A431 HydrophobicContact CD1-CB 4.19Å; L341-F434 HydrophobicContact CB-CB 4.36Å; L341-F434 HydrophobicContact CB-CG 4.4Å
342	D	91.7	Very high	94.9	Very high	46 Å²	46	42.1 Å²	42.1	25%	0.246	21%	0.209	C	C	.	.	H	α-helix	trans	-59.8	-25.6	177.6	-80.8	-79.6	0	0	0	114.4	R340 R437	R340-D342 PolarHBondContact O-N 2.76Å; D342-R437 WeakPolarHBondContact OD1-CD 3.42Å; D342-R437 IonicContact OD1-CZ 2.91Å; D342-R437 IonicContact OD1-NE 2.64Å; D342-R437 IonicContact OD1-NH1 3.31Å; D342-R437 PolarHBondContact OD1-NH1 3.43Å
343	Y	94.4	Very high	94.8	Very high	181 Å²	181	41.1 Å²	41.1	71%	0.71	20%	0.201	S	C	*	.	H	α-helix	trans	-86.2	-55.4	173.4	-178.1	-95.9	0	0	0	111.2	R340 L341 R346	R340-Y343 PolarHBondContact O-N 2.89Å; R340-Y343 VanDerWaalsContact O-N 3.08Å; L341-Y343 PolarHBondContact O-N 3.44Å; L341-Y343 VanDerWaalsContact O-N 3.15Å; Y343-R346 WeakPolarHBondContact O-CB 3.26Å; Y343-R346 PolarHBondContact O-N 3.1Å
344	L	94.8	Very high	94.9	Very high	27 Å²	27	38 Å²	38	14%	0.141	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-44.8	-173.9	-68.1	173	0	0	0	112.4	A306 F310 R340 L341	A306-L344 WeakPolarHBondContact CB-O 3.43Å; F310-L344 HydrophobicContact CD2-CD1 4.48Å; R340-L344 HydrophobicContact CB-CD1 4Å; R340-L344 HydrophobicContact CB-CG 4.23Å; R340-L344 PolarHBondContact O-N 2.87Å; L341-L344 PolarHBondContact O-N 3.19Å
345	F	97.1	Very high	94.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	8.8	-176.7	-71.3	0	0	0	0	113.5	A306 N307 F310 L341 P347 Y348 L401 Y404 F434	A306-F345 HydrophobicContact CB-CD1 4.17Å; N307-F345 WeakPolarHBondContact OD1-CZ 3.34Å; F310-F345 HydrophobicContact CB-CE1 3.76Å; F310-F345 HydrophobicContact CB-CZ 4.14Å; F310-F345 HydrophobicContact CD1-CZ 4.39Å; F310-F345 HydrophobicContact CD2-CZ 4.41Å; F310-F345 HydrophobicContact CG-CE1 4.19Å; F310-F345 HydrophobicContact CG-CZ 4.07Å; L341-F345 HydrophobicContact CD2-CD2 3.53Å; L341-F345 HydrophobicContact CD2-CE2 3.48Å; L341-F345 VanDerWaalsContact CD2-CE2 3.48Å; L341-F345 HydrophobicContact CD2-CG 4.08Å; L341-F345 HydrophobicContact CD2-CZ 4.03Å; L341-F345 WeakPolarHBondContact O-CA 3.39Å; L341-F345 WeakPolarHBondContact O-CB 3.49Å; L341-F345 PolarHBondContact O-N 3.08Å; F345-P347 WeakPolarHBondContact O-CD 3.44Å; F345-Y348 HydrophobicContact CB-CD2 3.7Å; F345-Y348 HydrophobicContact CB-CE2 4.15Å; F345-Y348 HydrophobicContact CD1-CD2 4.34Å; F345-Y348 AromaticContact CD1-CE2 3.96Å; F345-Y348 HydrophobicContact CD1-CE2 3.96Å; F345-Y348 HydrophobicContact CD2-CD2 4.38Å; F345-Y348 HydrophobicContact CD2-CE2 4.12Å; F345-Y348 HydrophobicContact CE1-CE2 4.38Å; F345-Y348 AromaticContact CG-CD2 3.91Å; F345-Y348 HydrophobicContact CG-CD2 3.91Å; F345-Y348 AromaticContact CG-CE2 3.82Å; F345-Y348 HydrophobicContact CG-CE2 3.82Å; F345-Y348 VanDerWaalsContact O-CB 3.29Å; F345-Y348 WeakPolarHBondContact O-CB 3.34Å; F345-Y348 WeakPolarHBondContact O-CD2 3.44Å; F345-Y348 PolarHBondContact O-N 3.24Å; F345-L401 HydrophobicContact CD2-CD2 3.89Å; F345-L401 HydrophobicContact CE2-CD2 4.33Å; F345-Y404 HydrophobicContact CE2-CD2 4.3Å; F345-Y404 AromaticContact CE2-CE2 3.54Å; F345-Y404 HydrophobicContact CE2-CE2 3.54Å; F345-Y404 AromaticContact CE2-CZ 3.87Å; F345-Y404 HydrophobicContact CZ-CE2 4.15Å; F345-Y404 AromaticContact CZ-CZ 4Å; F345-F434 HydrophobicContact CB-CD1 4.39Å; F345-F434 HydrophobicContact CB-CE1 3.67Å; F345-F434 HydrophobicContact CB-CE2 4.18Å; F345-F434 HydrophobicContact CB-CZ 3.56Å; F345-F434 HydrophobicContact CD2-CE1 4.34Å; F345-F434 VanDerWaalsContact O-CZ 3.31Å; F345-F434 WeakPolarHBondContact O-CZ 3.43Å
346	R	95.8	Very high	94.5	Very high	86 Å²	86	38 Å²	38	33%	0.325	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-42.1	-37.7	171.7	-174.6	-179	-178.7	124.1	8.6	114.9	Y343 Y348 I349 Y625	Y343-R346 WeakPolarHBondContact O-CB 3.26Å; Y343-R346 PolarHBondContact O-N 3.1Å; R346-Y348 PolarHBondContact O-N 2.98Å; R346-I349 PolarHBondContact O-N 3.35Å; R346-Y625 PolarHBondContact NH1-OH 2.88Å
347	P	96.8	Very high	94.5	Very high	26 Å²	26	38.6 Å²	38.6	17%	0.169	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.3	176.3	-24.8	37	0	0	0	115.8	N299 E302 I303 A306 F345 I349 P350 Y351	N299-P347 PolarHBondContact ND2-O 3.22Å; E302-P347 HydrophobicContact CB-CB 3.74Å; E302-P347 HydrophobicContact CB-CG 4.12Å; I303-P347 HydrophobicContact CD1-CB 4.16Å; A306-P347 HydrophobicContact CB-CG 4.39Å; F345-P347 WeakPolarHBondContact O-CD 3.44Å; P347-I349 VanDerWaalsContact C-N 3.32Å; P347-I349 PolarHBondContact O-N 3.19Å; P347-P350 WeakPolarHBondContact O-CD 3.49Å; P347-P350 WeakPolarHBondContact O-CG 3.49Å; P347-Y351 PolarHBondContact O-N 3.45Å
348	Y	97.8	Very high	94.5	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-31	177.4	-84.3	-99.9	0	0	0	113.5	Y265 I303 N307 F345 R346 Y351 C352 P397 L401	Y265-Y348 WeakPolarHBondContact CE1-OH 3.39Å; Y265-Y348 PolarHBondContact OH-OH 3.03Å; I303-Y348 HydrophobicContact CD1-CD1 4.12Å; I303-Y348 HydrophobicContact CD1-CD2 3.72Å; I303-Y348 HydrophobicContact CD1-CE1 4.47Å; I303-Y348 HydrophobicContact CD1-CE2 4.08Å; I303-Y348 HydrophobicContact CD1-CG 3.76Å; I303-Y348 HydrophobicContact CG2-CE1 4.26Å; I303-Y348 HydrophobicContact CG2-CE2 4.02Å; N307-Y348 PolarHBondContact ND2-OH 3.44Å; N307-Y348 PolarHBondContact OD1-OH 2.8Å; N307-Y348 VanDerWaalsContact OD1-OH 3.11Å; F345-Y348 HydrophobicContact CB-CD2 3.7Å; F345-Y348 HydrophobicContact CB-CE2 4.15Å; F345-Y348 HydrophobicContact CD1-CD2 4.34Å; F345-Y348 AromaticContact CD1-CE2 3.96Å; F345-Y348 HydrophobicContact CD1-CE2 3.96Å; F345-Y348 HydrophobicContact CD2-CD2 4.38Å; F345-Y348 HydrophobicContact CD2-CE2 4.12Å; F345-Y348 HydrophobicContact CE1-CE2 4.38Å; F345-Y348 AromaticContact CG-CD2 3.91Å; F345-Y348 HydrophobicContact CG-CD2 3.91Å; F345-Y348 AromaticContact CG-CE2 3.82Å; F345-Y348 HydrophobicContact CG-CE2 3.82Å; F345-Y348 VanDerWaalsContact O-CB 3.29Å; F345-Y348 WeakPolarHBondContact O-CB 3.34Å; F345-Y348 WeakPolarHBondContact O-CD2 3.44Å; F345-Y348 PolarHBondContact O-N 3.24Å; R346-Y348 PolarHBondContact O-N 2.98Å; Y348-Y351 PolarHBondContact O-N 2.85Å; Y348-C352 WeakPolarHBondContact O-CB 3.33Å; Y348-C352 PolarHBondContact O-N 3.46Å; Y348-P397 HydrophobicContact CD1-CB 4.17Å; Y348-P397 HydrophobicContact CE1-CB 3.62Å; Y348-P397 WeakPolarHBondContact CE1-O 3.45Å; Y348-L401 HydrophobicContact CD1-CD1 3.63Å; Y348-L401 HydrophobicContact CD1-CD2 3.73Å; Y348-L401 HydrophobicContact CD1-CG 3.67Å; Y348-L401 HydrophobicContact CD2-CD2 4.44Å; Y348-L401 HydrophobicContact CE1-CD1 4.22Å; Y348-L401 HydrophobicContact CE1-CD2 3.69Å; Y348-L401 HydrophobicContact CE1-CG 3.74Å; Y348-L401 HydrophobicContact CE2-CD2 4.43Å; Y348-L401 HydrophobicContact CG-CD1 4.18Å; Y348-L401 HydrophobicContact CG-CD2 4.08Å; Y348-L401 HydrophobicContact CG-CG 4.41Å
349	I	96	Very high	94.3	Very high	25 Å²	25	40 Å²	40	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-58.9	-179.1	-64.5	166.8	0	0	0	110.7	R346 P347 Y351 C352 L353 V438 E441	R346-I349 PolarHBondContact O-N 3.35Å; P347-I349 VanDerWaalsContact C-N 3.32Å; P347-I349 PolarHBondContact O-N 3.19Å; I349-Y351 VanDerWaalsContact C-N 3.31Å; I349-Y351 PolarHBondContact O-N 3.36Å; I349-C352 PolarHBondContact O-N 3.17Å; I349-L353 HydrophobicContact CG2-CD1 3.87Å; I349-L353 WeakPolarHBondContact O-CB 3.43Å; I349-L353 VanDerWaalsContact O-CG 3.23Å; I349-L353 WeakPolarHBondContact O-CG 3.3Å; I349-L353 PolarHBondContact O-N 2.73Å; I349-V438 HydrophobicContact CG1-CG2 4Å; I349-E441 HydrophobicContact CG2-CB 4.29Å; I349-E441 HydrophobicContact CG2-CG 3.99Å
350	P	95.6	Very high	94.2	Very high	63 Å²	63	40.1 Å²	40.1	41%	0.409	20%	0.202	S	C	.	.	H	α-helix	trans	-63.4	-32.6	176.4	24.1	-33.4	0	0	0	113.4	P347 L353 A354	P347-P350 WeakPolarHBondContact O-CD 3.49Å; P347-P350 WeakPolarHBondContact O-CG 3.49Å; P350-L353 PolarHBondContact O-N 2.93Å; P350-A354 WeakPolarHBondContact O-CB 3.34Å; P350-A354 PolarHBondContact O-N 3.45Å
351	Y	96.3	Very high	94.2	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-51.7	177	-173.5	-92.4	0	0	0	112	N299 I300 I303 P347 Y348 I349 A354 H355 L394 P397	N299-Y351 WeakPolarHBondContact OD1-CA 3.27Å; N299-Y351 VanDerWaalsContact OD1-CB 3.25Å; N299-Y351 WeakPolarHBondContact OD1-CB 3.18Å; N299-Y351 PolarHBondContact OD1-N 3.26Å; I300-Y351 HydrophobicContact CB-CE2 4.04Å; I300-Y351 HydrophobicContact CD1-CE2 3.78Å; I300-Y351 HydrophobicContact CG1-CE2 4.5Å; I303-Y351 HydrophobicContact CD1-CG 4.08Å; I303-Y351 HydrophobicContact CG1-CD2 3.91Å; I303-Y351 HydrophobicContact CG1-CG 3.95Å; P347-Y351 PolarHBondContact O-N 3.45Å; Y348-Y351 PolarHBondContact O-N 2.85Å; I349-Y351 VanDerWaalsContact C-N 3.31Å; I349-Y351 PolarHBondContact O-N 3.36Å; Y351-A354 PolarHBondContact O-N 3.16Å; Y351-H355 PolarHBondContact O-N 3.13Å; Y351-L394 WeakPolarHBondContact CE1-O 3.23Å; Y351-L394 WeakPolarHBondContact OH-CA 3.22Å; Y351-L394 WeakPolarHBondContact OH-CD2 3.44Å; Y351-L394 PolarHBondContact OH-O 3.33Å; Y351-P397 HydrophobicContact CD1-CB 3.95Å; Y351-P397 HydrophobicContact CD1-CG 4.25Å; Y351-P397 HydrophobicContact CE1-CB 3.73Å; Y351-P397 HydrophobicContact CE1-CG 3.6Å
352	C	95.4	Very high	94.1	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.014	19%	0.191	C	C	.	.	H	α-helix	trans	-63.6	-42.6	177.8	-78	0	0	0	0	111.4	Y348 I349 A354 H355 V438 L442	Y348-C352 WeakPolarHBondContact O-CB 3.33Å; Y348-C352 PolarHBondContact O-N 3.46Å; I349-C352 PolarHBondContact O-N 3.17Å; C352-A354 VanDerWaalsContact C-N 3.3Å; C352-A354 PolarHBondContact O-N 2.91Å; C352-H355 WeakPolarHBondContact O-CB 3.04Å; C352-H355 PolarHBondContact O-N 2.95Å; C352-H355 VanDerWaalsContact O-N 3.17Å; C352-V438 HydrophobicContact CB-CG1 3.8Å; C352-L442 HydrophobicContact CB-CD1 4.3Å; C352-L442 HydrophobicContact CB-CD2 4.27Å; C352-L442 HydrophobicContact CB-CG 4.42Å; C352-L442 WeakPolarHBondContact O-CD2 3.02Å
353	L	93.5	Very high	94.2	Very high	16 Å²	16	40.1 Å²	40.1	8%	0.084	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-37.8	175.3	-72.7	171.1	0	0	0	112.8	I349 P350 E441 K445	I349-L353 HydrophobicContact CG2-CD1 3.87Å; I349-L353 WeakPolarHBondContact O-CB 3.43Å; I349-L353 VanDerWaalsContact O-CG 3.23Å; I349-L353 WeakPolarHBondContact O-CG 3.3Å; I349-L353 PolarHBondContact O-N 2.73Å; P350-L353 PolarHBondContact O-N 2.93Å; L353-E441 HydrophobicContact CD2-CB 4.28Å; L353-E441 WeakPolarHBondContact CD2-O 3.31Å; L353-K445 HydrophobicContact CB-CD 4.3Å; L353-K445 HydrophobicContact CD2-CB 3.62Å; L353-K445 HydrophobicContact CD2-CD 3.89Å; L353-K445 HydrophobicContact CD2-CG 4.34Å; L353-K445 PolarHBondContact O-NZ 3.43Å
354	A	93.1	Very high	94.1	Very high	23 Å²	23	35 Å²	35	19%	0.19	18%	0.181	C	C	.	.	H	α-helix	trans	-75.4	-21.4	178.2	0	0	0	0	0	113.7	P350 Y351 C352 V356 D357 V358	P350-A354 WeakPolarHBondContact O-CB 3.34Å; P350-A354 PolarHBondContact O-N 3.45Å; Y351-A354 PolarHBondContact O-N 3.16Å; C352-A354 VanDerWaalsContact C-N 3.3Å; C352-A354 PolarHBondContact O-N 2.91Å; A354-V356 VanDerWaalsContact C-N 3.3Å; A354-V356 PolarHBondContact O-N 3.3Å; A354-V356 VanDerWaalsContact O-N 3.13Å; A354-D357 WeakPolarHBondContact O-CB 3.34Å; A354-D357 PolarHBondContact O-N 3.2Å; A354-V358 HydrophobicContact CB-CG2 4.33Å; A354-V358 WeakPolarHBondContact O-CG2 3.35Å; A354-V358 PolarHBondContact O-N 3.43Å
355	H	92.4	Very high	93.9	Very high	8 Å²	8	35 Å²	35	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-56.5	-36.7	-166.5	-171.5	72.7	0	0	0	114.5	Y351 C352 V358 L359 L394	Y351-H355 PolarHBondContact O-N 3.13Å; C352-H355 WeakPolarHBondContact O-CB 3.04Å; C352-H355 PolarHBondContact O-N 2.95Å; C352-H355 VanDerWaalsContact O-N 3.17Å; H355-V358 PolarHBondContact O-N 3Å; H355-L359 WeakPolarHBondContact O-CG 3.25Å; H355-L359 PolarHBondContact O-N 2.87Å; H355-L394 PolarHBondContact CE1-O 3.23Å
356	V	89.4	Confident	93.6	Very high	59 Å²	59	37.9 Å²	37.9	36%	0.358	20%	0.195	S	C	.	.	H	α-helix	trans	-67.3	-38.6	177.5	-179.4	0	0	0	0	111.7	A354 L359 C360	A354-V356 VanDerWaalsContact C-N 3.3Å; A354-V356 PolarHBondContact O-N 3.3Å; A354-V356 VanDerWaalsContact O-N 3.13Å; V356-L359 PolarHBondContact O-N 3.13Å; V356-C360 PolarHBondContact O-N 3.26Å; V356-C360 PolarHBondContact O-SG 2.56Å; V356-C360 VanDerWaalsContact O-SG 3.37Å
357	D	91.2	Very high	93.3	Very high	80 Å²	80	42.1 Å²	42.1	43%	0.428	22%	0.216	S	C	.	.	H	α-helix	trans	-70.2	-41.5	178.2	-56.4	-47.4	0	0	0	110.8	A354 L359 C360 Y361 K445	A354-D357 WeakPolarHBondContact O-CB 3.34Å; A354-D357 PolarHBondContact O-N 3.2Å; D357-L359 PolarHBondContact O-N 3.42Å; D357-C360 WeakPolarHBondContact O-CB 3.44Å; D357-C360 PolarHBondContact O-N 3.13Å; D357-Y361 WeakPolarHBondContact O-CB 3.17Å; D357-Y361 PolarHBondContact O-N 3.49Å; D357-K445 IonicContact OD2-NZ 3.19Å; D357-K445 PolarHBondContact OD2-NZ 3.34Å
358	V	93.9	Very high	93	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-55	-49.6	172.3	175.9	0	0	0	0	110.4	T295 V296 A354 H355 C360 Y361 I362 L394	T295-V358 WeakPolarHBondContact O-CG2 3.35Å; V296-V358 WeakPolarHBondContact O-CG1 3.45Å; A354-V358 HydrophobicContact CB-CG2 4.33Å; A354-V358 WeakPolarHBondContact O-CG2 3.35Å; A354-V358 PolarHBondContact O-N 3.43Å; H355-V358 PolarHBondContact O-N 3Å; V358-C360 PolarHBondContact O-N 3.01Å; V358-Y361 PolarHBondContact O-N 3.38Å; V358-I362 HydrophobicContact CG1-CD1 3.82Å; V358-I362 HydrophobicContact CG1-CG1 4.49Å; V358-I362 VanDerWaalsContact O-CG1 3.27Å; V358-I362 WeakPolarHBondContact O-CG1 3.47Å; V358-I362 PolarHBondContact O-N 3.5Å; V358-L394 HydrophobicContact CG1-CD1 3.94Å
359	L	92.7	Very high	92.6	Very high	19 Å²	19	45.6 Å²	45.6	10%	0.099	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-38.7	177.7	-70.6	180	0	0	0	112.5	H355 V356 D357 R363 T391	H355-L359 WeakPolarHBondContact O-CG 3.25Å; H355-L359 PolarHBondContact O-N 2.87Å; V356-L359 PolarHBondContact O-N 3.13Å; D357-L359 PolarHBondContact O-N 3.42Å; L359-R363 WeakPolarHBondContact O-CB 3.48Å; L359-R363 WeakPolarHBondContact O-CD 3.5Å; L359-R363 WeakPolarHBondContact O-CG 3.33Å; L359-R363 PolarHBondContact O-N 3.33Å; L359-T391 HydrophobicContact CD2-CG2 3.58Å
360	C	92	Very high	92.1	Very high	64 Å²	64	48.6 Å²	48.6	43%	0.432	25%	0.247	S	C	.	.	H	α-helix	trans	-64	-43.5	174	-75	0	0	0	0	112	V356 D357 V358 R363 Q364	V356-C360 PolarHBondContact O-N 3.26Å; V356-C360 PolarHBondContact O-SG 2.56Å; V356-C360 VanDerWaalsContact O-SG 3.37Å; D357-C360 WeakPolarHBondContact O-CB 3.44Å; D357-C360 PolarHBondContact O-N 3.13Å; V358-C360 PolarHBondContact O-N 3.01Å; C360-R363 PolarHBondContact O-N 3.2Å; C360-Q364 PolarHBondContact O-N 3.38Å
361	Y	94.2	Very high	91.6	Very high	40 Å²	40	46.3 Å²	46.3	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-46.9	177.3	-174.7	-90.4	0	0	0	112	E290 D292 T295 V296 D357 V358 R363 Q364 K365	E290-Y361 PolarHBondContact O-OH 3.19Å; D292-Y361 HydrophobicContact CB-CE2 4.41Å; D292-Y361 PolarHBondContact N-OH 3.43Å; T295-Y361 HydrophobicContact CG2-CD1 4.14Å; T295-Y361 HydrophobicContact CG2-CD2 3.69Å; T295-Y361 HydrophobicContact CG2-CE2 4.24Å; T295-Y361 HydrophobicContact CG2-CG 3.63Å; V296-Y361 HydrophobicContact CG2-CD1 3.72Å; V296-Y361 HydrophobicContact CG2-CE1 3.54Å; D357-Y361 WeakPolarHBondContact O-CB 3.17Å; D357-Y361 PolarHBondContact O-N 3.49Å; V358-Y361 PolarHBondContact O-N 3.38Å; Y361-R363 PolarHBondContact O-N 3.37Å; Y361-Q364 WeakPolarHBondContact O-CB 3.2Å; Y361-Q364 PolarHBondContact O-N 3.43Å; Y361-Q364 VanDerWaalsContact O-N 3.13Å; Y361-K365 HydrophobicContact CD1-CG 4.18Å; Y361-K365 HydrophobicContact CE1-CG 3.6Å; Y361-K365 HydrophobicContact CE2-CG 4.37Å; Y361-K365 PolarHBondContact O-N 3.09Å; Y361-K365 WeakPolarHBondContact OH-CE 3.19Å
362	I	92.9	Very high	91.2	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.015	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-45.1	175.1	-66.7	171	0	0	0	110.4	V296 V358 Q364 K365 L366 F372 L390 T391 L394	V296-I362 HydrophobicContact CG1-CG1 4.5Å; V358-I362 HydrophobicContact CG1-CD1 3.82Å; V358-I362 HydrophobicContact CG1-CG1 4.49Å; V358-I362 VanDerWaalsContact O-CG1 3.27Å; V358-I362 WeakPolarHBondContact O-CG1 3.47Å; V358-I362 PolarHBondContact O-N 3.5Å; I362-Q364 VanDerWaalsContact C-N 3.26Å; I362-Q364 PolarHBondContact O-N 3.46Å; I362-K365 PolarHBondContact O-N 3.33Å; I362-L366 HydrophobicContact CG2-CD1 4.08Å; I362-L366 WeakPolarHBondContact O-CB 3.33Å; I362-L366 VanDerWaalsContact O-CG 3.31Å; I362-L366 WeakPolarHBondContact O-CG 3.4Å; I362-L366 PolarHBondContact O-N 3.35Å; I362-F372 HydrophobicContact CB-CE1 4.37Å; I362-F372 HydrophobicContact CG1-CZ 4.2Å; I362-F372 HydrophobicContact CG2-CE1 3.91Å; I362-F372 HydrophobicContact CG2-CZ 4.18Å; I362-L390 HydrophobicContact CD1-CD2 4.31Å; I362-L390 HydrophobicContact CD1-CG 4.5Å; I362-T391 HydrophobicContact CG2-CG2 4.25Å; I362-L394 HydrophobicContact CD1-CD1 3.66Å
363	R	92.3	Very high	90.9	Very high	105 Å²	105	50.1 Å²	50.1	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-28.5	176.2	-73.5	165.9	179.1	-175.9	-1.8	113.2	L359 C360 Y361	L359-R363 WeakPolarHBondContact O-CB 3.48Å; L359-R363 WeakPolarHBondContact O-CD 3.5Å; L359-R363 WeakPolarHBondContact O-CG 3.33Å; L359-R363 PolarHBondContact O-N 3.33Å; C360-R363 PolarHBondContact O-N 3.2Å; Y361-R363 PolarHBondContact O-N 3.37Å
364	Q	93	Very high	90.5	Very high	73 Å²	73	50 Å²	50	34%	0.341	24%	0.244	S	C	.	.	H	α-helix	trans	-76.9	-51.8	173.6	179.1	171.1	-4	0	0	110.8	C360 Y361 I362 L366 K367 E368	C360-Q364 PolarHBondContact O-N 3.38Å; Y361-Q364 WeakPolarHBondContact O-CB 3.2Å; Y361-Q364 PolarHBondContact O-N 3.43Å; Y361-Q364 VanDerWaalsContact O-N 3.13Å; I362-Q364 VanDerWaalsContact C-N 3.26Å; I362-Q364 PolarHBondContact O-N 3.46Å; Q364-L366 VanDerWaalsContact C-N 3.3Å; Q364-L366 PolarHBondContact O-N 3.35Å; Q364-K367 WeakPolarHBondContact O-CA 3.27Å; Q364-K367 WeakPolarHBondContact O-CB 3.47Å; Q364-K367 PolarHBondContact O-N 3.28Å; Q364-E368 HydrophobicContact CG-CG 4.32Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.44Å; Q364-E368 PolarHBondContact NE2-OE1 3.03Å; Q364-E368 PolarHBondContact O-N 3.15Å; Q364-E368 VanDerWaalsContact O-N 3.16Å
365	K	91.7	Very high	90.2	Very high	27 Å²	27	49 Å²	49	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-28.6	-178.4	-73.5	-66.6	171.3	-158.1	0	114.2	E290 L291 Y361 I362 K367 E368 S369 F372	E290-K365 WeakPolarHBondContact O-CE 3.43Å; E290-K365 PolarHBondContact O-NZ 3.08Å; L291-K365 HydrophobicContact CD2-CB 4.13Å; L291-K365 HydrophobicContact CD2-CD 4.06Å; L291-K365 HydrophobicContact CD2-CG 3.92Å; Y361-K365 HydrophobicContact CD1-CG 4.18Å; Y361-K365 HydrophobicContact CE1-CG 3.6Å; Y361-K365 HydrophobicContact CE2-CG 4.37Å; Y361-K365 PolarHBondContact O-N 3.09Å; Y361-K365 WeakPolarHBondContact OH-CE 3.19Å; I362-K365 PolarHBondContact O-N 3.33Å; K365-K367 PolarHBondContact O-N 2.89Å; K365-E368 WeakPolarHBondContact CE-OE2 3.39Å; K365-E368 IonicContact NZ-OE2 3.11Å; K365-E368 PolarHBondContact NZ-OE2 2.9Å; K365-E368 PolarHBondContact O-N 3.16Å; K365-S369 WeakPolarHBondContact O-CB 3.48Å; K365-S369 PolarHBondContact O-N 3.36Å; K365-F372 HydrophobicContact CB-CB 4.5Å; K365-F372 HydrophobicContact CB-CD1 3.63Å; K365-F372 HydrophobicContact CB-CE1 4Å; K365-F372 HydrophobicContact CB-CG 4.11Å
366	L	89.7	Confident	89.9	Confident	61 Å²	61	49.5 Å²	49.5	32%	0.319	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-24.2	168.9	-78.7	170.1	0	0	0	113.7	I362 Q364 F372 R373 I376	I362-L366 HydrophobicContact CG2-CD1 4.08Å; I362-L366 WeakPolarHBondContact O-CB 3.33Å; I362-L366 VanDerWaalsContact O-CG 3.31Å; I362-L366 WeakPolarHBondContact O-CG 3.4Å; I362-L366 PolarHBondContact O-N 3.35Å; Q364-L366 VanDerWaalsContact C-N 3.3Å; Q364-L366 PolarHBondContact O-N 3.35Å; L366-F372 HydrophobicContact CD2-CD1 4.09Å; L366-F372 HydrophobicContact CD2-CE1 4.34Å; L366-F372 HydrophobicContact CG-CD1 4.04Å; L366-F372 HydrophobicContact CG-CE1 4.03Å; L366-R373 HydrophobicContact CD2-CG 4.11Å; L366-R373 VanDerWaalsContact O-CD 3.23Å; L366-R373 WeakPolarHBondContact O-CD 3.5Å; L366-R373 WeakPolarHBondContact O-CG 3.49Å; L366-I376 HydrophobicContact CD2-CB 4.17Å; L366-I376 HydrophobicContact CD2-CG1 4.01Å; L366-I376 HydrophobicContact CD2-CG2 4.13Å
367	K	90.2	Very high	89.7	Confident	176 Å²	176	51.2 Å²	51.2	77%	0.765	25%	0.248	S	C	*	.	H	α-helix	trans	-90.7	-34.8	176.2	-60.1	172.8	-176.5	178.1	0	112.7	Q364 K365	Q364-K367 WeakPolarHBondContact O-CA 3.27Å; Q364-K367 WeakPolarHBondContact O-CB 3.47Å; Q364-K367 PolarHBondContact O-N 3.28Å; K365-K367 PolarHBondContact O-N 2.89Å
368	E	90.5	Very high	89.4	Confident	97 Å²	97	47.9 Å²	47.9	45%	0.453	23%	0.23	S	C	.	.	H	α-helix	trans	-89	-38.1	-172.8	-66.2	176.2	175.7	0	0	113.7	Q364 K365	Q364-E368 HydrophobicContact CG-CG 4.32Å; Q364-E368 WeakPolarHBondContact CG-OE1 3.44Å; Q364-E368 PolarHBondContact NE2-OE1 3.03Å; Q364-E368 PolarHBondContact O-N 3.15Å; Q364-E368 VanDerWaalsContact O-N 3.16Å; K365-E368 WeakPolarHBondContact CE-OE2 3.39Å; K365-E368 IonicContact NZ-OE2 3.11Å; K365-E368 PolarHBondContact NZ-OE2 2.9Å; K365-E368 PolarHBondContact O-N 3.16Å
369	S	88.2	Confident	88.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	23%	0.227	C	C	.	.			trans	-110.1	119	-167.7	176.3	0	0	0	0	111.6	E290 K365 F371 F372 R373	E290-S369 VanDerWaalsContact CD-CB 3.45Å; E290-S369 VanDerWaalsContact OE1-CB 3.23Å; E290-S369 WeakPolarHBondContact OE1-CB 3.37Å; E290-S369 PolarHBondContact OE1-OG 3.28Å; E290-S369 WeakPolarHBondContact OE2-CB 3.39Å; K365-S369 WeakPolarHBondContact O-CB 3.48Å; K365-S369 PolarHBondContact O-N 3.36Å; S369-F371 PolarHBondContact OG-N 3.22Å; S369-F372 WeakPolarHBondContact OG-CB 3.33Å; S369-F372 PolarHBondContact OG-N 2.77Å; S369-R373 PolarHBondContact O-N 3.11Å; S369-R373 PolarHBondContact O-NH1 3.18Å
370	D	86.1	Confident	88.5	Confident	89 Å²	89	49.1 Å²	49.1	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-44	170.7	-73.9	15.8	0	0	0	110.8	F372 R373 D374	D370-F372 VanDerWaalsContact C-N 3.3Å; D370-F372 PolarHBondContact O-N 3.37Å; D370-R373 PolarHBondContact O-N 2.98Å; D370-R373 VanDerWaalsContact O-N 3.11Å; D370-R373 IonicContact OD1-CZ 3.03Å; D370-R373 IonicContact OD1-NH1 2.76Å; D370-R373 PolarHBondContact OD1-NH1 3.49Å; D370-R373 IonicContact OD1-NH2 2.68Å; D370-R373 PolarHBondContact OD1-NH2 2.98Å; D370-R373 IonicContact OD2-NH2 2.67Å; D370-D374 PolarHBondContact O-N 3.3Å
371	F	85.6	Confident	88	Confident	14 Å²	14	49.1 Å²	49.1	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-41.3	176.1	173.9	-92.4	0	0	0	112.1	L282 L287 G288 L291 S369 D374 L375	L282-F371 HydrophobicContact CD1-CZ 4.33Å; L287-F371 HydrophobicContact CB-CE2 4.09Å; L287-F371 HydrophobicContact CB-CZ 4.48Å; G288-F371 VanDerWaalsContact CA-CE1 3.46Å; L291-F371 HydrophobicContact CD1-CD1 3.94Å; L291-F371 HydrophobicContact CD1-CE1 3.82Å; S369-F371 PolarHBondContact OG-N 3.22Å; F371-D374 PolarHBondContact O-N 3.11Å; F371-L375 HydrophobicContact CE1-CD2 4.24Å; F371-L375 VanDerWaalsContact O-CB 3.32Å; F371-L375 WeakPolarHBondContact O-CB 3.33Å; F371-L375 PolarHBondContact O-N 2.93Å
372	F	88.2	Confident	87.2	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-69.8	-32.7	178.3	-165.4	-117.4	0	0	0	112.5	L291 I362 K365 L366 S369 D370 L375 I376 L390	L291-F372 HydrophobicContact CD1-CD2 3.7Å; L291-F372 HydrophobicContact CD1-CE2 4.38Å; L291-F372 HydrophobicContact CD2-CB 4.09Å; L291-F372 HydrophobicContact CD2-CD2 3.52Å; L291-F372 HydrophobicContact CD2-CE2 4.08Å; L291-F372 HydrophobicContact CD2-CG 3.87Å; L291-F372 HydrophobicContact CG-CD2 4.27Å; I362-F372 HydrophobicContact CB-CE1 4.37Å; I362-F372 HydrophobicContact CG1-CZ 4.2Å; I362-F372 HydrophobicContact CG2-CE1 3.91Å; I362-F372 HydrophobicContact CG2-CZ 4.18Å; K365-F372 HydrophobicContact CB-CB 4.5Å; K365-F372 HydrophobicContact CB-CD1 3.63Å; K365-F372 HydrophobicContact CB-CE1 4Å; K365-F372 HydrophobicContact CB-CG 4.11Å; L366-F372 HydrophobicContact CD2-CD1 4.09Å; L366-F372 HydrophobicContact CD2-CE1 4.34Å; L366-F372 HydrophobicContact CG-CD1 4.04Å; L366-F372 HydrophobicContact CG-CE1 4.03Å; S369-F372 WeakPolarHBondContact OG-CB 3.33Å; S369-F372 PolarHBondContact OG-N 2.77Å; D370-F372 VanDerWaalsContact C-N 3.3Å; D370-F372 PolarHBondContact O-N 3.37Å; F372-L375 HydrophobicContact CD2-CD2 4.1Å; F372-L375 HydrophobicContact CE2-CD2 4.4Å; F372-I376 HydrophobicContact CD1-CG1 4.13Å; F372-I376 HydrophobicContact CD2-CG1 4.46Å; F372-I376 HydrophobicContact CE1-CD1 4.18Å; F372-I376 HydrophobicContact CE1-CG1 3.94Å; F372-I376 HydrophobicContact CE2-CD1 4.36Å; F372-I376 HydrophobicContact CE2-CG1 4.27Å; F372-I376 HydrophobicContact CG-CG1 4.4Å; F372-I376 HydrophobicContact CZ-CD1 3.92Å; F372-I376 HydrophobicContact CZ-CG1 4.01Å; F372-I376 VanDerWaalsContact O-CB 3.28Å; F372-I376 WeakPolarHBondContact O-CB 3.3Å; F372-I376 WeakPolarHBondContact O-CG1 3.49Å; F372-I376 PolarHBondContact O-N 3.09Å; F372-L390 HydrophobicContact CZ-CD2 4.24Å
373	R	88.7	Confident	86.4	Confident	86 Å²	86	59.5 Å²	59.5	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-44.8	171.6	-66.9	-165	-54.2	-76.3	5.3	111.4	L366 S369 D370 I376 V377	L366-R373 HydrophobicContact CD2-CG 4.11Å; L366-R373 VanDerWaalsContact O-CD 3.23Å; L366-R373 WeakPolarHBondContact O-CD 3.5Å; L366-R373 WeakPolarHBondContact O-CG 3.49Å; S369-R373 PolarHBondContact O-N 3.11Å; S369-R373 PolarHBondContact O-NH1 3.18Å; D370-R373 PolarHBondContact O-N 2.98Å; D370-R373 VanDerWaalsContact O-N 3.11Å; D370-R373 IonicContact OD1-CZ 3.03Å; D370-R373 IonicContact OD1-NH1 2.76Å; D370-R373 PolarHBondContact OD1-NH1 3.49Å; D370-R373 IonicContact OD1-NH2 2.68Å; D370-R373 PolarHBondContact OD1-NH2 2.98Å; D370-R373 IonicContact OD2-NH2 2.67Å; R373-I376 PolarHBondContact O-N 3.09Å; R373-V377 WeakPolarHBondContact O-CG2 3.13Å; R373-V377 PolarHBondContact O-N 3.38Å
374	D	85.5	Confident	85.5	Confident	15 Å²	15	56.2 Å²	56.2	8%	0.08	27%	0.274	C	S	.	.	H	α-helix	trans	-57.7	-49.3	175.7	-63.5	-21.3	0	0	0	110.6	R194 D370 F371 I376 V377 W378	R194-D374 IonicContact CZ-OD2 2.98Å; R194-D374 IonicContact NH1-OD2 3.81Å; R194-D374 PolarHBondContact NH1-OD2 3.47Å; D370-D374 PolarHBondContact O-N 3.3Å; F371-D374 PolarHBondContact O-N 3.11Å; D374-I376 PolarHBondContact O-N 3.28Å; D374-V377 PolarHBondContact O-N 2.96Å; D374-W378 WeakPolarHBondContact O-CB 3.34Å; D374-W378 PolarHBondContact O-N 2.6Å
375	L	84.9	Confident	84.8	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-41.4	176.4	178.3	65	0	0	0	112.7	L198 I279 L291 F371 F372 W378 I379	L198-L375 HydrophobicContact CD1-CD1 4.04Å; L198-L375 HydrophobicContact CD2-CD1 3.79Å; I279-L375 HydrophobicContact CD1-CD2 3.83Å; I279-L375 HydrophobicContact CG1-CD1 4.42Å; I279-L375 HydrophobicContact CG1-CD2 4.06Å; L291-L375 HydrophobicContact CD1-CD2 4.39Å; F371-L375 HydrophobicContact CE1-CD2 4.24Å; F371-L375 VanDerWaalsContact O-CB 3.32Å; F371-L375 WeakPolarHBondContact O-CB 3.33Å; F371-L375 PolarHBondContact O-N 2.93Å; F372-L375 HydrophobicContact CD2-CD2 4.1Å; F372-L375 HydrophobicContact CE2-CD2 4.4Å; L375-W378 HydrophobicContact CD1-CE3 4.5Å; L375-W378 WeakPolarHBondContact O-CB 3.11Å; L375-W378 PolarHBondContact O-N 3.48Å; L375-I379 HydrophobicContact CD1-CD1 4.32Å; L375-I379 HydrophobicContact CD1-CG1 4.45Å; L375-I379 HydrophobicContact CG-CD1 4.02Å; L375-I379 WeakPolarHBondContact O-CD1 3.41Å; L375-I379 VanDerWaalsContact O-CG1 3.26Å; L375-I379 WeakPolarHBondContact O-CG1 3.33Å; L375-I379 PolarHBondContact O-N 2.96Å
376	I	87.1	Confident	84.1	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.087	28%	0.275	C	S	.	.	H	α-helix	trans	-69.3	-34.5	180	-73.4	-77.4	0	0	0	111.9	L366 F372 R373 D374 I379 Q380 L390	L366-I376 HydrophobicContact CD2-CB 4.17Å; L366-I376 HydrophobicContact CD2-CG1 4.01Å; L366-I376 HydrophobicContact CD2-CG2 4.13Å; F372-I376 HydrophobicContact CD1-CG1 4.13Å; F372-I376 HydrophobicContact CD2-CG1 4.46Å; F372-I376 HydrophobicContact CE1-CD1 4.18Å; F372-I376 HydrophobicContact CE1-CG1 3.94Å; F372-I376 HydrophobicContact CE2-CD1 4.36Å; F372-I376 HydrophobicContact CE2-CG1 4.27Å; F372-I376 HydrophobicContact CG-CG1 4.4Å; F372-I376 HydrophobicContact CZ-CD1 3.92Å; F372-I376 HydrophobicContact CZ-CG1 4.01Å; F372-I376 VanDerWaalsContact O-CB 3.28Å; F372-I376 WeakPolarHBondContact O-CB 3.3Å; F372-I376 WeakPolarHBondContact O-CG1 3.49Å; F372-I376 PolarHBondContact O-N 3.09Å; R373-I376 PolarHBondContact O-N 3.09Å; D374-I376 PolarHBondContact O-N 3.28Å; I376-I379 HydrophobicContact CD1-CD1 4.32Å; I376-Q380 VanDerWaalsContact CG2-NE2 3.28Å; I376-Q380 WeakPolarHBondContact O-CG 3.32Å; I376-Q380 PolarHBondContact O-N 2.76Å; I376-Q380 PolarHBondContact O-NE2 2.95Å; I376-L390 HydrophobicContact CD1-CB 3.55Å; I376-L390 HydrophobicContact CD1-CD2 3.61Å; I376-L390 HydrophobicContact CD1-CG 4.23Å
377	V	85.3	Confident	83.6	Confident	96 Å²	96	60.6 Å²	60.6	58%	0.582	30%	0.297	S	S	*	.	H	α-helix	trans	-68.3	-42.3	170	172.3	0	0	0	0	110.4	R373 D374 Q380 S381	R373-V377 WeakPolarHBondContact O-CG2 3.13Å; R373-V377 PolarHBondContact O-N 3.38Å; D374-V377 PolarHBondContact O-N 2.96Å; V377-Q380 PolarHBondContact O-N 2.86Å; V377-S381 PolarHBondContact O-N 3.27Å
378	W	84.1	Confident	83.3	Confident	10 Å²	10	54.8 Å²	54.8	4%	0.038	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-47.3	177.4	-177.3	92	0	0	0	112.2	A195 L198 D199 M202 L275 D374 L375 Q380 S381 R382	A195-W378 PolarHBondContact O-NE1 2.81Å; L198-W378 HydrophobicContact CB-CD2 3.85Å; L198-W378 HydrophobicContact CB-CG 4.06Å; L198-W378 HydrophobicContact CB-CZ2 4.03Å; L198-W378 HydrophobicContact CD1-CB 4.01Å; L198-W378 HydrophobicContact CD1-CD2 4.01Å; L198-W378 HydrophobicContact CD1-CG 3.69Å; L198-W378 HydrophobicContact CD2-CD2 4.43Å; L198-W378 HydrophobicContact CD2-CE3 4.43Å; L198-W378 HydrophobicContact CG-CD2 4.33Å; L198-W378 HydrophobicContact CG-CG 4.42Å; D199-W378 WeakPolarHBondContact OD1-CZ2 3.37Å; D199-W378 PolarHBondContact OD1-NE1 2.79Å; M202-W378 HydrophobicContact CB-CH2 3.57Å; M202-W378 HydrophobicContact CB-CZ2 3.84Å; M202-W378 HydrophobicContact CE-CH2 3.9Å; M202-W378 HydrophobicContact CE-CZ3 4.03Å; M202-W378 HydrophobicContact CG-CH2 3.96Å; M202-W378 HydrophobicContact SD-CH2 3.28Å; M202-W378 WeakPolarHBondContact SD-CH2 3.4Å; M202-W378 HydrophobicContact SD-CZ2 4.24Å; M202-W378 HydrophobicContact SD-CZ3 3.48Å; M202-W378 WeakPolarHBondContact SD-CZ3 3.48Å; L275-W378 HydrophobicContact CD1-CZ3 4.31Å; D374-W378 WeakPolarHBondContact O-CB 3.34Å; D374-W378 PolarHBondContact O-N 2.6Å; L375-W378 HydrophobicContact CD1-CE3 4.5Å; L375-W378 WeakPolarHBondContact O-CB 3.11Å; L375-W378 PolarHBondContact O-N 3.48Å; W378-Q380 VanDerWaalsContact C-N 3.28Å; W378-Q380 PolarHBondContact O-N 2.81Å; W378-S381 VanDerWaalsContact O-CB 3.3Å; W378-S381 WeakPolarHBondContact O-CB 3.37Å; W378-S381 PolarHBondContact O-N 2.89Å; W378-S381 PolarHBondContact O-OG 2.83Å; W378-R382 HydrophobicContact CE3-CG 4.3Å; W378-R382 HydrophobicContact CH2-CG 3.51Å; W378-R382 VanDerWaalsContact CZ2-CD 3.47Å; W378-R382 HydrophobicContact CZ2-CG 3.82Å; W378-R382 HydrophobicContact CZ3-CG 3.8Å
379	I	83.3	Confident	83.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-54.9	-44.3	175.7	-71	160.9	0	0	0	110.9	L275 L375 I376 S381 R382 F385 L390 L393	L275-I379 HydrophobicContact CD1-CD1 4.15Å; L275-I379 HydrophobicContact CD1-CG1 3.95Å; L275-I379 HydrophobicContact CD2-CD1 3.75Å; L275-I379 HydrophobicContact CD2-CG1 3.91Å; L375-I379 HydrophobicContact CD1-CD1 4.32Å; L375-I379 HydrophobicContact CD1-CG1 4.45Å; L375-I379 HydrophobicContact CG-CD1 4.02Å; L375-I379 WeakPolarHBondContact O-CD1 3.41Å; L375-I379 VanDerWaalsContact O-CG1 3.26Å; L375-I379 WeakPolarHBondContact O-CG1 3.33Å; L375-I379 PolarHBondContact O-N 2.96Å; I376-I379 HydrophobicContact CD1-CD1 4.32Å; I379-S381 VanDerWaalsContact C-N 3.25Å; I379-S381 PolarHBondContact O-N 3.34Å; I379-R382 PolarHBondContact O-N 3.4Å; I379-F385 HydrophobicContact CG2-CD2 3.78Å; I379-F385 HydrophobicContact CG2-CE2 4.31Å; I379-F385 HydrophobicContact CG2-CG 4.19Å; I379-F385 WeakPolarHBondContact O-CD2 3.32Å; I379-L390 HydrophobicContact CD1-CD2 4.37Å; I379-L393 HydrophobicContact CG2-CD1 4.15Å
380	Q	84.4	Confident	83.2	Confident	53 Å²	53	54.7 Å²	54.7	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-67.6	-21.8	179.2	-73.2	164.8	64.9	0	0	113.6	I376 V377 W378 R382 R387 H389	I376-Q380 VanDerWaalsContact CG2-NE2 3.28Å; I376-Q380 WeakPolarHBondContact O-CG 3.32Å; I376-Q380 PolarHBondContact O-N 2.76Å; I376-Q380 PolarHBondContact O-NE2 2.95Å; V377-Q380 PolarHBondContact O-N 2.86Å; W378-Q380 VanDerWaalsContact C-N 3.28Å; W378-Q380 PolarHBondContact O-N 2.81Å; Q380-R382 VanDerWaalsContact C-N 3.34Å; Q380-R387 WeakPolarHBondContact O-CA 3.49Å; Q380-H389 PolarHBondContact NE2-ND1 3.41Å; Q380-H389 PolarHBondContact OE1-CE1 2.96Å; Q380-H389 PolarHBondContact OE1-ND1 3.47Å
381	S	82	Confident	83.5	Confident	64 Å²	64	52.4 Å²	52.4	45%	0.448	26%	0.263	S	S	.	.	H	α-helix	trans	-70.5	-29	175.6	79.2	0	0	0	0	113.2	V377 W378 I379	V377-S381 PolarHBondContact O-N 3.27Å; W378-S381 VanDerWaalsContact O-CB 3.3Å; W378-S381 WeakPolarHBondContact O-CB 3.37Å; W378-S381 PolarHBondContact O-N 2.89Å; W378-S381 PolarHBondContact O-OG 2.83Å; I379-S381 VanDerWaalsContact C-N 3.25Å; I379-S381 PolarHBondContact O-N 3.34Å
382	R	78.5	Confident	83.8	Confident	63 Å²	63	54.5 Å²	54.5	24%	0.238	27%	0.274	C	S	.	.			trans	-76.3	137.7	-168.4	-63.2	-62.7	95.8	169.6	14.2	112.7	D199 W378 I379 Q380 F385 G386	D199-R382 VanDerWaalsContact CG-NH2 3.29Å; D199-R382 IonicContact OD1-CZ 2.72Å; D199-R382 IonicContact OD1-NE 3.51Å; D199-R382 IonicContact OD1-NH1 2.77Å; D199-R382 PolarHBondContact OD1-NH1 2.93Å; D199-R382 IonicContact OD1-NH2 3.22Å; D199-R382 PolarHBondContact OD1-NH2 2.99Å; D199-R382 IonicContact OD2-CZ 3.22Å; D199-R382 IonicContact OD2-NH1 2.75Å; D199-R382 PolarHBondContact OD2-NH1 2.93Å; D199-R382 IonicContact OD2-NH2 2.87Å; D199-R382 PolarHBondContact OD2-NH2 2.9Å; W378-R382 HydrophobicContact CE3-CG 4.3Å; W378-R382 HydrophobicContact CH2-CG 3.51Å; W378-R382 VanDerWaalsContact CZ2-CD 3.47Å; W378-R382 HydrophobicContact CZ2-CG 3.82Å; W378-R382 HydrophobicContact CZ3-CG 3.8Å; I379-R382 PolarHBondContact O-N 3.4Å; Q380-R382 VanDerWaalsContact C-N 3.34Å; R382-F385 HydrophobicContact CB-CD2 3.82Å; R382-F385 HydrophobicContact CB-CE2 4.35Å; R382-F385 HydrophobicContact CG-CD2 4.3Å; R382-F385 HydrophobicContact CG-CE2 4.45Å; R382-G386 PolarHBondContact O-N 2.91Å
383	K	75.8	Confident	84	Confident	198 Å²	198	54.4 Å²	54.4	86%	0.861	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-43.8	174.3	-70.5	-178.2	-179.2	175	0	112.4	F385 G386	K383-F385 VanDerWaalsContact C-N 3.27Å; K383-F385 PolarHBondContact O-N 3.1Å; K383-G386 WeakPolarHBondContact O-CA 3.23Å; K383-G386 PolarHBondContact O-N 2.98Å
384	A	72.6	Confident	84.2	Confident	36 Å²	36	50.3 Å²	50.3	30%	0.298	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.4	-178.1	0	0	0	0	0	112.9	K268 G386	K268-A384 PolarHBondContact NZ-O 3.24Å; A384-G386 VanDerWaalsContact C-N 3.35Å
385	F	79	Confident	84.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-18.4	176.8	-60.5	-51.4	0	0	0	113.6	K268 S271 I272 L275 I379 R382 K383 L393	K268-F385 PolarHBondContact NZ-O 3.2Å; S271-F385 WeakPolarHBondContact O-CE1 3.35Å; S271-F385 WeakPolarHBondContact O-CZ 3.31Å; I272-F385 HydrophobicContact CG1-CE1 4.3Å; L275-F385 HydrophobicContact CB-CZ 3.96Å; L275-F385 HydrophobicContact CD2-CE1 4.5Å; L275-F385 HydrophobicContact CD2-CE2 4.32Å; L275-F385 HydrophobicContact CD2-CZ 3.98Å; L275-F385 HydrophobicContact CG-CZ 4.45Å; I379-F385 HydrophobicContact CG2-CD2 3.78Å; I379-F385 HydrophobicContact CG2-CE2 4.31Å; I379-F385 HydrophobicContact CG2-CG 4.19Å; I379-F385 WeakPolarHBondContact O-CD2 3.32Å; R382-F385 HydrophobicContact CB-CD2 3.82Å; R382-F385 HydrophobicContact CB-CE2 4.35Å; R382-F385 HydrophobicContact CG-CD2 4.3Å; R382-F385 HydrophobicContact CG-CE2 4.45Å; K383-F385 VanDerWaalsContact C-N 3.27Å; K383-F385 PolarHBondContact O-N 3.1Å; F385-L393 HydrophobicContact CB-CD1 3.98Å; F385-L393 HydrophobicContact CB-CD2 4.26Å; F385-L393 HydrophobicContact CD1-CD1 3.5Å; F385-L393 VanDerWaalsContact CD1-CD1 3.5Å; F385-L393 HydrophobicContact CD1-CD2 4.07Å; F385-L393 HydrophobicContact CD1-CG 4.46Å; F385-L393 HydrophobicContact CE1-CD1 4.22Å; F385-L393 HydrophobicContact CG-CD1 3.79Å
386	G	77.3	Confident	85	Confident	45 Å²	45	52.8 Å²	52.8	46%	0.464	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	31.2	176.2	0	0	0	0	0	113.1	R382 K383 A384 L388	R382-G386 PolarHBondContact O-N 2.91Å; K383-G386 WeakPolarHBondContact O-CA 3.23Å; K383-G386 PolarHBondContact O-N 2.98Å; A384-G386 VanDerWaalsContact C-N 3.35Å; G386-L388 PolarHBondContact O-N 2.88Å
387	R	79	Confident	85.4	Confident	208 Å²	208	52 Å²	52	79%	0.785	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	15.3	-174.5	-53.5	178.3	-179	156.3	-0.3	115.6	Q380	Q380-R387 WeakPolarHBondContact O-CA 3.49Å
388	L	83.7	Confident	85.8	Confident	54 Å²	54	48 Å²	48	28%	0.283	24%	0.241	S	C	.	.			trans	-70.5	149.6	174.3	-66.2	176.9	0	0	0	111.3	G386 D392 L393	G386-L388 PolarHBondContact O-N 2.88Å; L388-D392 HydrophobicContact CB-CB 4.33Å; L388-D392 HydrophobicContact CD2-CB 4.43Å; L388-L393 HydrophobicContact CB-CD2 4.03Å; L388-L393 HydrophobicContact CB-CG 4.16Å; L388-L393 HydrophobicContact CD1-CD2 3.88Å
389	H	87.3	Confident	86.3	Confident	93 Å²	93	50.9 Å²	50.9	43%	0.431	26%	0.256	S	S	.	.			trans	-72.4	155.6	168.3	-56.9	-67.9	0	0	0	110.2	Q380 T391 D392 L393	Q380-H389 PolarHBondContact NE2-ND1 3.41Å; Q380-H389 PolarHBondContact OE1-CE1 2.96Å; Q380-H389 PolarHBondContact OE1-ND1 3.47Å; H389-T391 PolarHBondContact O-N 3.29Å; H389-D392 WeakPolarHBondContact CB-OD2 3.16Å; H389-D392 IonicContact CD2-OD2 2.85Å; H389-D392 PolarHBondContact CD2-OD2 3.41Å; H389-D392 IonicContact CG-OD2 2.98Å; H389-D392 PolarHBondContact N-OD2 2.93Å; H389-D392 VanDerWaalsContact N-OD2 3.12Å; H389-D392 WeakPolarHBondContact O-CB 3.37Å; H389-D392 PolarHBondContact O-N 2.55Å; H389-L393 PolarHBondContact O-N 3.48Å; H389-L393 VanDerWaalsContact O-N 3.12Å
390	L	89.5	Confident	86.9	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-34.6	178	-178.4	61.4	0	0	0	112.4	L275 V296 F297 I362 F372 I376 I379 D392 L393 L394	L275-L390 HydrophobicContact CD2-CD1 4.18Å; V296-L390 HydrophobicContact CG1-CD2 3.94Å; F297-L390 HydrophobicContact CE1-CD1 4.16Å; F297-L390 HydrophobicContact CZ-CD1 4.45Å; I362-L390 HydrophobicContact CD1-CD2 4.31Å; I362-L390 HydrophobicContact CD1-CG 4.5Å; F372-L390 HydrophobicContact CZ-CD2 4.24Å; I376-L390 HydrophobicContact CD1-CB 3.55Å; I376-L390 HydrophobicContact CD1-CD2 3.61Å; I376-L390 HydrophobicContact CD1-CG 4.23Å; I379-L390 HydrophobicContact CD1-CD2 4.37Å; L390-D392 VanDerWaalsContact C-N 3.26Å; L390-D392 PolarHBondContact O-N 2.91Å; L390-L393 HydrophobicContact CD1-CD1 4.4Å; L390-L393 PolarHBondContact O-N 3.46Å; L390-L394 HydrophobicContact CD1-CD1 4.07Å; L390-L394 HydrophobicContact CD1-CG 4.17Å; L390-L394 HydrophobicContact CD2-CD1 4.45Å; L390-L394 HydrophobicContact CG-CD1 3.83Å; L390-L394 HydrophobicContact CG-CG 4.37Å; L390-L394 WeakPolarHBondContact O-CB 3.47Å; L390-L394 VanDerWaalsContact O-CG 3.28Å; L390-L394 WeakPolarHBondContact O-CG 3.27Å; L390-L394 PolarHBondContact O-N 3.43Å
391	T	91.8	Very high	87.5	Confident	41 Å²	41	49.4 Å²	49.4	25%	0.252	25%	0.248	S	C	.	.	H	α-helix	trans	-58.5	-37.2	173.5	50	0	0	0	0	112.9	L359 I362 H389 A395	L359-T391 HydrophobicContact CD2-CG2 3.58Å; I362-T391 HydrophobicContact CG2-CG2 4.25Å; H389-T391 PolarHBondContact O-N 3.29Å; T391-A395 WeakPolarHBondContact O-CB 3.31Å; T391-A395 PolarHBondContact O-N 2.98Å
392	D	92.1	Very high	88.1	Confident	58 Å²	58	48 Å²	48	31%	0.31	24%	0.236	S	C	.	.	H	α-helix	trans	-83.6	-30.3	-173.7	-41.7	-26	0	0	0	110.7	L388 H389 L390 K396	L388-D392 HydrophobicContact CB-CB 4.33Å; L388-D392 HydrophobicContact CD2-CB 4.43Å; H389-D392 WeakPolarHBondContact CB-OD2 3.16Å; H389-D392 IonicContact CD2-OD2 2.85Å; H389-D392 PolarHBondContact CD2-OD2 3.41Å; H389-D392 IonicContact CG-OD2 2.98Å; H389-D392 PolarHBondContact N-OD2 2.93Å; H389-D392 VanDerWaalsContact N-OD2 3.12Å; H389-D392 WeakPolarHBondContact O-CB 3.37Å; H389-D392 PolarHBondContact O-N 2.55Å; L390-D392 VanDerWaalsContact C-N 3.26Å; L390-D392 PolarHBondContact O-N 2.91Å; D392-K396 WeakPolarHBondContact O-CG 3.34Å
393	L	91.7	Very high	88.9	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-50.8	167.1	-65.2	174.2	0	0	0	110.7	I272 I379 F385 L388 H389 L390 A395 K396	I272-L393 HydrophobicContact CD1-CB 3.98Å; I272-L393 HydrophobicContact CG1-CB 4.43Å; I379-L393 HydrophobicContact CG2-CD1 4.15Å; F385-L393 HydrophobicContact CB-CD1 3.98Å; F385-L393 HydrophobicContact CB-CD2 4.26Å; F385-L393 HydrophobicContact CD1-CD1 3.5Å; F385-L393 VanDerWaalsContact CD1-CD1 3.5Å; F385-L393 HydrophobicContact CD1-CD2 4.07Å; F385-L393 HydrophobicContact CD1-CG 4.46Å; F385-L393 HydrophobicContact CE1-CD1 4.22Å; F385-L393 HydrophobicContact CG-CD1 3.79Å; L388-L393 HydrophobicContact CB-CD2 4.03Å; L388-L393 HydrophobicContact CB-CG 4.16Å; L388-L393 HydrophobicContact CD1-CD2 3.88Å; H389-L393 PolarHBondContact O-N 3.48Å; H389-L393 VanDerWaalsContact O-N 3.12Å; L390-L393 HydrophobicContact CD1-CD1 4.4Å; L390-L393 PolarHBondContact O-N 3.46Å; L393-A395 PolarHBondContact O-N 3.26Å; L393-K396 VanDerWaalsContact O-CB 3.3Å; L393-K396 WeakPolarHBondContact O-CB 3.18Å; L393-K396 PolarHBondContact O-N 2.82Å
394	L	93.5	Very high	90	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-69	-17.8	-179.1	-66.7	169.6	0	0	0	113.2	I272 V296 F297 Y351 H355 V358 I362 L390	I272-L394 HydrophobicContact CG2-CD2 4.43Å; V296-L394 WeakPolarHBondContact O-CD1 3.43Å; F297-L394 HydrophobicContact CD1-CD2 4.25Å; Y351-L394 WeakPolarHBondContact CE1-O 3.23Å; Y351-L394 WeakPolarHBondContact OH-CA 3.22Å; Y351-L394 WeakPolarHBondContact OH-CD2 3.44Å; Y351-L394 PolarHBondContact OH-O 3.33Å; H355-L394 PolarHBondContact CE1-O 3.23Å; V358-L394 HydrophobicContact CG1-CD1 3.94Å; I362-L394 HydrophobicContact CD1-CD1 3.66Å; L390-L394 HydrophobicContact CD1-CD1 4.07Å; L390-L394 HydrophobicContact CD1-CG 4.17Å; L390-L394 HydrophobicContact CD2-CD1 4.45Å; L390-L394 HydrophobicContact CG-CD1 3.83Å; L390-L394 HydrophobicContact CG-CG 4.37Å; L390-L394 WeakPolarHBondContact O-CB 3.47Å; L390-L394 VanDerWaalsContact O-CG 3.28Å; L390-L394 WeakPolarHBondContact O-CG 3.27Å; L390-L394 PolarHBondContact O-N 3.43Å
395	A	94.1	Very high	91.1	Very high	10 Å²	10	39 Å²	39	8%	0.083	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.7	170.4	0	0	0	0	0	113.6	T391 L393 M398 Q399	T391-A395 WeakPolarHBondContact O-CB 3.31Å; T391-A395 PolarHBondContact O-N 2.98Å; L393-A395 PolarHBondContact O-N 3.26Å; A395-M398 PolarHBondContact O-N 2.97Å; A395-Q399 WeakPolarHBondContact O-CG 3.49Å; A395-Q399 PolarHBondContact O-N 2.99Å
396	K	93.4	Very high	92	Very high	59 Å²	59	42.7 Å²	42.7	26%	0.257	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-38.5	-174.6	-71.4	-163.7	165	-66	0	115.6	Y265 K268 D392 L393 M398 Q399 R400	Y265-K396 HydrophobicContact CE2-CB 4.22Å; K268-K396 HydrophobicContact CG-CD 4.09Å; D392-K396 WeakPolarHBondContact O-CG 3.34Å; L393-K396 VanDerWaalsContact O-CB 3.3Å; L393-K396 WeakPolarHBondContact O-CB 3.18Å; L393-K396 PolarHBondContact O-N 2.82Å; K396-M398 PolarHBondContact O-N 3.43Å; K396-Q399 CarbonylContact O-C 3.45Å; K396-Q399 WeakPolarHBondContact O-CB 3.35Å; K396-Q399 PolarHBondContact O-N 2.77Å; K396-Q399 VanDerWaalsContact O-N 3.15Å; K396-R400 PolarHBondContact O-N 3.16Å
397	P	95.2	Very high	93	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-48.4	175.6	-26.4	36.8	0	0	0	112.2	Y265 L269 I300 I303 Y348 Y351 Q399 R400 L401	Y265-P397 VanDerWaalsContact OH-CA 3.25Å; Y265-P397 WeakPolarHBondContact OH-CA 3.35Å; Y265-P397 WeakPolarHBondContact OH-CB 3.12Å; L269-P397 HydrophobicContact CD2-CG 4.22Å; I300-P397 HydrophobicContact CD1-CG 3.74Å; I303-P397 HydrophobicContact CG2-CB 4.03Å; I303-P397 HydrophobicContact CG2-CG 4.1Å; Y348-P397 HydrophobicContact CD1-CB 4.17Å; Y348-P397 HydrophobicContact CE1-CB 3.62Å; Y348-P397 WeakPolarHBondContact CE1-O 3.45Å; Y351-P397 HydrophobicContact CD1-CB 3.95Å; Y351-P397 HydrophobicContact CD1-CG 4.25Å; Y351-P397 HydrophobicContact CE1-CB 3.73Å; Y351-P397 HydrophobicContact CE1-CG 3.6Å; P397-Q399 PolarHBondContact O-N 2.85Å; P397-R400 PolarHBondContact O-N 3.26Å; P397-R400 VanDerWaalsContact O-N 3.09Å; P397-L401 PolarHBondContact O-N 2.94Å
398	M	93.2	Very high	93.9	Very high	12 Å²	12	31.2 Å²	31.2	6%	0.059	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-38	175	-170.5	165.4	64.4	0	0	111.5	A395 K396 F763 W838	A395-M398 PolarHBondContact O-N 2.97Å; K396-M398 PolarHBondContact O-N 3.43Å; M398-F763 HydrophobicContact CG-CE1 3.37Å; M398-F763 HydrophobicContact CG-CZ 3.66Å; M398-F763 WeakPolarHBondContact O-CE1 3.45Å; M398-F763 HydrophobicContact SD-CE1 4.43Å; M398-F763 HydrophobicContact SD-CZ 4.48Å; M398-W838 HydrophobicContact CE-CH2 4.01Å; M398-W838 HydrophobicContact CE-CZ2 3.54Å; M398-W838 HydrophobicContact SD-CH2 4.44Å; M398-W838 HydrophobicContact SD-CZ2 4.45Å
399	Q	94.5	Very high	94.5	Very high	72 Å²	72	31.9 Å²	31.9	34%	0.336	16%	0.156	S	C	.	.	H	α-helix	trans	-69.5	-38	174	-66.8	165.9	8.4	0	0	113.9	A395 K396 P397 L401 T402	A395-Q399 WeakPolarHBondContact O-CG 3.49Å; A395-Q399 PolarHBondContact O-N 2.99Å; K396-Q399 CarbonylContact O-C 3.45Å; K396-Q399 WeakPolarHBondContact O-CB 3.35Å; K396-Q399 PolarHBondContact O-N 2.77Å; K396-Q399 VanDerWaalsContact O-N 3.15Å; P397-Q399 PolarHBondContact O-N 2.85Å; Q399-L401 PolarHBondContact O-N 3.32Å; Q399-T402 PolarHBondContact O-N 2.77Å; Q399-T402 PolarHBondContact O-OG1 3.43Å; Q399-T402 VanDerWaalsContact O-OG1 3.05Å
400	R	96.8	Very high	94.9	Very high	17 Å²	17	29.2 Å²	29.2	6%	0.064	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-38	-176.7	-174.9	71.5	179.5	162.9	2.3	111.6	L258 T261 E262 Y265 K396 P397 T402 K403 Y404	L258-R400 PolarHBondContact O-NH2 2.75Å; T261-R400 PolarHBondContact O-NH1 3.3Å; T261-R400 PolarHBondContact OG1-NH1 3.19Å; E262-R400 IonicContact OE2-CZ 2.71Å; E262-R400 IonicContact OE2-NE 3.98Å; E262-R400 PolarHBondContact OE2-NE 2.87Å; E262-R400 IonicContact OE2-NH2 3.52Å; E262-R400 PolarHBondContact OE2-NH2 3.33Å; Y265-R400 HydrophobicContact CD1-CB 4.23Å; Y265-R400 HydrophobicContact CD1-CG 3.66Å; Y265-R400 HydrophobicContact CE1-CB 3.88Å; Y265-R400 HydrophobicContact CE1-CG 3.62Å; Y265-R400 HydrophobicContact CE2-CB 4.28Å; Y265-R400 HydrophobicContact CG-CG 4.25Å; K396-R400 PolarHBondContact O-N 3.16Å; P397-R400 PolarHBondContact O-N 3.26Å; P397-R400 VanDerWaalsContact O-N 3.09Å; R400-T402 PolarHBondContact O-N 3.37Å; R400-K403 WeakPolarHBondContact O-CB 3.23Å; R400-K403 PolarHBondContact O-N 3.36Å; R400-Y404 HydrophobicContact CG-CE1 4.47Å; R400-Y404 HydrophobicContact CG-CE2 3.69Å; R400-Y404 VanDerWaalsContact CG-OH 3.28Å; R400-Y404 WeakPolarHBondContact CG-OH 3.27Å; R400-Y404 PolarHBondContact NE-OH 2.91Å; R400-Y404 WeakPolarHBondContact O-CD2 3.29Å
401	L	95.8	Very high	95.2	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-53.7	-39.4	177.8	-66.7	-175.3	0	0	0	113	F345 Y348 P397 Q399 K403 P405 F434 V438	F345-L401 HydrophobicContact CD2-CD2 3.89Å; F345-L401 HydrophobicContact CE2-CD2 4.33Å; Y348-L401 HydrophobicContact CD1-CD1 3.63Å; Y348-L401 HydrophobicContact CD1-CD2 3.73Å; Y348-L401 HydrophobicContact CD1-CG 3.67Å; Y348-L401 HydrophobicContact CD2-CD2 4.44Å; Y348-L401 HydrophobicContact CE1-CD1 4.22Å; Y348-L401 HydrophobicContact CE1-CD2 3.69Å; Y348-L401 HydrophobicContact CE1-CG 3.74Å; Y348-L401 HydrophobicContact CE2-CD2 4.43Å; Y348-L401 HydrophobicContact CG-CD1 4.18Å; Y348-L401 HydrophobicContact CG-CD2 4.08Å; Y348-L401 HydrophobicContact CG-CG 4.41Å; P397-L401 PolarHBondContact O-N 2.94Å; Q399-L401 PolarHBondContact O-N 3.32Å; L401-K403 VanDerWaalsContact C-N 3.29Å; L401-K403 PolarHBondContact O-N 3.23Å; L401-P405 WeakPolarHBondContact O-CD 3.44Å; L401-F434 HydrophobicContact CD1-CE1 4.11Å; L401-F434 HydrophobicContact CD2-CD1 4.07Å; L401-F434 HydrophobicContact CD2-CE1 3.8Å; L401-V438 HydrophobicContact CD1-CB 4.43Å; L401-V438 HydrophobicContact CD1-CG1 4.27Å; L401-V438 HydrophobicContact CD1-CG2 4.08Å
402	T	94.6	Very high	95.4	Very high	33 Å²	33	28.5 Å²	28.5	20%	0.202	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-6.8	178.4	64	0	0	0	0	114.1	Q399 R400 L406 F763	Q399-T402 PolarHBondContact O-N 2.77Å; Q399-T402 PolarHBondContact O-OG1 3.43Å; Q399-T402 VanDerWaalsContact O-OG1 3.05Å; R400-T402 PolarHBondContact O-N 3.37Å; T402-L406 WeakPolarHBondContact O-CD1 3.45Å; T402-L406 WeakPolarHBondContact O-CG 3.46Å; T402-F763 HydrophobicContact CG2-CB 3.83Å; T402-F763 HydrophobicContact CG2-CD1 3.26Å; T402-F763 HydrophobicContact CG2-CE1 3.94Å; T402-F763 HydrophobicContact CG2-CG 3.74Å
403	K	96.8	Very high	95.6	Very high	105 Å²	105	31.3 Å²	31.3	46%	0.457	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-31.7	177	-64.9	-51.5	-170.3	175.9	0	113.3	R400 L401 L406 L407	R400-K403 WeakPolarHBondContact O-CB 3.23Å; R400-K403 PolarHBondContact O-N 3.36Å; L401-K403 VanDerWaalsContact C-N 3.29Å; L401-K403 PolarHBondContact O-N 3.23Å; K403-L406 HydrophobicContact CD-CD1 4.21Å; K403-L406 PolarHBondContact O-N 3.11Å; K403-L406 VanDerWaalsContact O-N 3.11Å; K403-L407 HydrophobicContact CB-CD1 4.14Å; K403-L407 WeakPolarHBondContact O-CG 3.48Å; K403-L407 PolarHBondContact O-N 3.01Å
404	Y	97.7	Very high	95.6	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-56.5	-48.5	-179.6	-60.1	-68.5	0	0	0	113.3	L258 E262 N307 F310 F338 F345 R400 L406 L407 L408	L258-Y404 HydrophobicContact CD1-CD1 4.06Å; L258-Y404 HydrophobicContact CD1-CE1 4.43Å; E262-Y404 PolarHBondContact OE1-OH 3.38Å; E262-Y404 VanDerWaalsContact OE2-CE1 3.3Å; E262-Y404 WeakPolarHBondContact OE2-CE1 3.43Å; E262-Y404 PolarHBondContact OE2-OH 3.33Å; N307-Y404 PolarHBondContact OD1-OH 2.69Å; F310-Y404 HydrophobicContact CE1-CE1 4.32Å; F338-Y404 HydrophobicContact CE1-CD1 4.19Å; F338-Y404 HydrophobicContact CE1-CG 4.38Å; F338-Y404 HydrophobicContact CZ-CD1 4.29Å; F345-Y404 HydrophobicContact CE2-CD2 4.3Å; F345-Y404 AromaticContact CE2-CE2 3.54Å; F345-Y404 HydrophobicContact CE2-CE2 3.54Å; F345-Y404 AromaticContact CE2-CZ 3.87Å; F345-Y404 HydrophobicContact CZ-CE2 4.15Å; F345-Y404 AromaticContact CZ-CZ 4Å; R400-Y404 HydrophobicContact CG-CE1 4.47Å; R400-Y404 HydrophobicContact CG-CE2 3.69Å; R400-Y404 VanDerWaalsContact CG-OH 3.28Å; R400-Y404 WeakPolarHBondContact CG-OH 3.27Å; R400-Y404 PolarHBondContact NE-OH 2.91Å; R400-Y404 WeakPolarHBondContact O-CD2 3.29Å; Y404-L406 VanDerWaalsContact C-N 3.28Å; Y404-L406 PolarHBondContact O-N 2.9Å; Y404-L407 PolarHBondContact O-N 3.27Å; Y404-L408 WeakPolarHBondContact O-CB 3.18Å; Y404-L408 VanDerWaalsContact O-CG 3.26Å; Y404-L408 WeakPolarHBondContact O-CG 3.36Å; Y404-L408 PolarHBondContact O-N 3.06Å
405	P	97	Very high	95.5	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-62.5	-32.7	176.6	-23.4	35.1	0	0	0	113.8	L401 K409 A431 E432	L401-P405 WeakPolarHBondContact O-CD 3.44Å; P405-K409 WeakPolarHBondContact O-CB 3.23Å; P405-K409 WeakPolarHBondContact O-CD 3.41Å; P405-K409 WeakPolarHBondContact O-CG 3.49Å; P405-K409 PolarHBondContact O-N 3.33Å; P405-K409 VanDerWaalsContact O-N 3.11Å; P405-A431 HydrophobicContact CG-CB 3.89Å; P405-E432 HydrophobicContact CB-CG 3.66Å; P405-E432 HydrophobicContact CG-CG 3.68Å
406	L	97.2	Very high	95.2	Very high	78 Å²	78	37.1 Å²	37.1	41%	0.408	19%	0.193	S	C	.	.	H	α-helix	trans	-74.6	-44.6	-178.1	-60.8	176.7	0	0	0	111.7	T402 K403 Y404 K409 A410	T402-L406 WeakPolarHBondContact O-CD1 3.45Å; T402-L406 WeakPolarHBondContact O-CG 3.46Å; K403-L406 HydrophobicContact CD-CD1 4.21Å; K403-L406 PolarHBondContact O-N 3.11Å; K403-L406 VanDerWaalsContact O-N 3.11Å; Y404-L406 VanDerWaalsContact C-N 3.28Å; Y404-L406 PolarHBondContact O-N 2.9Å; L406-K409 PolarHBondContact O-N 2.98Å; L406-A410 PolarHBondContact O-N 2.64Å
407	L	97.4	Very high	95.1	Very high	12 Å²	12	37.7 Å²	37.7	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-46.6	177	-69.3	164.7	0	0	0	110.8	E257 L258 K403 Y404 K409 A410 V411	E257-L407 HydrophobicContact CB-CD2 4.43Å; E257-L407 HydrophobicContact CG-CD2 3.84Å; L258-L407 HydrophobicContact CD1-CB 4.15Å; L258-L407 HydrophobicContact CD1-CD1 3.79Å; K403-L407 HydrophobicContact CB-CD1 4.14Å; K403-L407 WeakPolarHBondContact O-CG 3.48Å; K403-L407 PolarHBondContact O-N 3.01Å; Y404-L407 PolarHBondContact O-N 3.27Å; L407-K409 VanDerWaalsContact C-N 3.31Å; L407-K409 PolarHBondContact O-N 3.18Å; L407-A410 WeakPolarHBondContact O-CB 3.45Å; L407-A410 PolarHBondContact O-N 3.46Å; L407-A410 VanDerWaalsContact O-N 3.1Å; L407-V411 PolarHBondContact O-N 2.56Å; L407-V411 VanDerWaalsContact O-N 3.09Å
408	L	97.9	Very high	95	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-36.3	176.1	-67.3	169.5	0	0	0	112.4	L258 F338 Y404 V411 L412 L424 M427 I428 A431	L258-L408 HydrophobicContact CD2-CD2 4.19Å; F338-L408 HydrophobicContact CD1-CD1 4Å; F338-L408 HydrophobicContact CE1-CD1 3.69Å; F338-L408 HydrophobicContact CE1-CG 4.46Å; F338-L408 HydrophobicContact CE2-CD2 4.24Å; F338-L408 HydrophobicContact CZ-CD1 4.03Å; F338-L408 HydrophobicContact CZ-CD2 4.11Å; F338-L408 HydrophobicContact CZ-CG 4.35Å; Y404-L408 WeakPolarHBondContact O-CB 3.18Å; Y404-L408 VanDerWaalsContact O-CG 3.26Å; Y404-L408 WeakPolarHBondContact O-CG 3.36Å; Y404-L408 PolarHBondContact O-N 3.06Å; L408-V411 PolarHBondContact O-N 3Å; L408-L412 WeakPolarHBondContact O-CB 3.46Å; L408-L412 PolarHBondContact O-N 2.9Å; L408-L424 HydrophobicContact CD2-CD2 3.96Å; L408-M427 HydrophobicContact CD1-CB 3.8Å; L408-M427 HydrophobicContact CD2-CB 4.25Å; L408-M427 HydrophobicContact CD2-CE 4.47Å; L408-M427 HydrophobicContact CD2-SD 4.47Å; L408-I428 HydrophobicContact CB-CD1 4.19Å; L408-I428 HydrophobicContact CB-CG1 3.5Å; L408-I428 HydrophobicContact CD1-CG1 4.22Å; L408-A431 HydrophobicContact CD1-CB 4.4Å
409	K	97.2	Very high	95	Very high	68 Å²	68	44 Å²	44	30%	0.296	24%	0.243	S	C	.	.	H	α-helix	trans	-65.8	-36.4	173	-76.6	170	-169.7	-178	0	112.6	P405 L406 L407 L412 N413 I428 E432	P405-K409 WeakPolarHBondContact O-CB 3.23Å; P405-K409 WeakPolarHBondContact O-CD 3.41Å; P405-K409 WeakPolarHBondContact O-CG 3.49Å; P405-K409 PolarHBondContact O-N 3.33Å; P405-K409 VanDerWaalsContact O-N 3.11Å; L406-K409 PolarHBondContact O-N 2.98Å; L407-K409 VanDerWaalsContact C-N 3.31Å; L407-K409 PolarHBondContact O-N 3.18Å; K409-L412 PolarHBondContact O-N 2.85Å; K409-N413 PolarHBondContact O-N 3.42Å; K409-N413 PolarHBondContact O-ND2 3.36Å; K409-I428 HydrophobicContact CG-CD1 3.64Å; K409-I428 HydrophobicContact CG-CG1 4.19Å; K409-I428 HydrophobicContact CG-CG2 4.48Å; K409-E432 WeakPolarHBondContact CE-OE1 3.45Å; K409-E432 IonicContact NZ-OE1 3.2Å; K409-E432 PolarHBondContact NZ-OE1 3.15Å
410	A	95.5	Very high	95	Very high	37 Å²	37	41.5 Å²	41.5	31%	0.306	23%	0.232	S	C	.	.	H	α-helix	trans	-64	-40.7	174.2	0	0	0	0	0	111.9	L406 L407 N414	L406-A410 PolarHBondContact O-N 2.64Å; L407-A410 WeakPolarHBondContact O-CB 3.45Å; L407-A410 PolarHBondContact O-N 3.46Å; L407-A410 VanDerWaalsContact O-N 3.1Å; A410-N414 PolarHBondContact O-N 3.23Å; A410-N414 PolarHBondContact O-ND2 3.13Å
411	V	96.6	Very high	94.9	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-65.8	-45.5	172.6	-178.3	0	0	0	0	111.2	Q251 G254 I255 L407 L408 N413 N414 S415 L424	Q251-V411 HydrophobicContact CG-CG1 3.83Å; G254-V411 VanDerWaalsContact C-CG2 3.45Å; I255-V411 HydrophobicContact CD1-CG1 4.02Å; I255-V411 HydrophobicContact CG1-CB 4.43Å; I255-V411 HydrophobicContact CG1-CG1 3.64Å; I255-V411 HydrophobicContact CG1-CG2 3.8Å; L407-V411 PolarHBondContact O-N 2.56Å; L407-V411 VanDerWaalsContact O-N 3.09Å; L408-V411 PolarHBondContact O-N 3Å; V411-N413 PolarHBondContact O-N 3.18Å; V411-N414 CarbonylContact O-C 3.6Å; V411-N414 PolarHBondContact O-N 3.06Å; V411-N414 VanDerWaalsContact O-N 3.11Å; V411-S415 PolarHBondContact O-N 3.05Å; V411-S415 PolarHBondContact O-OG 2.74Å; V411-L424 HydrophobicContact CB-CD1 4.46Å; V411-L424 HydrophobicContact CB-CD2 4.05Å; V411-L424 HydrophobicContact CG1-CD1 3.77Å; V411-L424 HydrophobicContact CG1-CD2 3.84Å; V411-L424 HydrophobicContact CG1-CG 4.5Å
412	L	96.4	Very high	95	Very high	28 Å²	28	49.2 Å²	49.2	15%	0.147	27%	0.269	C	S	.	.	H	α-helix	trans	-57.7	-45.7	179.2	177.9	62.7	0	0	0	112.4	L408 K409 N414 S415 V421 L424 R425 I428	L408-L412 WeakPolarHBondContact O-CB 3.46Å; L408-L412 PolarHBondContact O-N 2.9Å; K409-L412 PolarHBondContact O-N 2.85Å; L412-N414 PolarHBondContact O-N 3.04Å; L412-S415 WeakPolarHBondContact O-CB 3.49Å; L412-S415 PolarHBondContact O-N 3.48Å; L412-V421 HydrophobicContact CD1-CB 4.23Å; L412-V421 HydrophobicContact CD1-CG1 4.08Å; L412-V421 HydrophobicContact CD1-CG2 4.08Å; L412-L424 HydrophobicContact CB-CB 4.26Å; L412-L424 HydrophobicContact CB-CD1 4.43Å; L412-L424 HydrophobicContact CD1-CB 4.02Å; L412-R425 HydrophobicContact CD1-CG 4.5Å; L412-R425 HydrophobicContact CD2-CG 4.22Å; L412-I428 HydrophobicContact CB-CD1 4.3Å; L412-I428 HydrophobicContact CD2-CD1 3.66Å
413	N	94.3	Very high	95.1	Very high	116 Å²	116	47.8 Å²	47.8	62%	0.62	26%	0.26	S	S	*	.	H	α-helix	trans	-60	-34.1	178.1	-70.1	-16.9	0	0	0	112.4	K247 K409 V411	K247-N413 WeakPolarHBondContact CE-O 3.42Å; K247-N413 PolarHBondContact NZ-O 3.05Å; K409-N413 PolarHBondContact O-N 3.42Å; K409-N413 PolarHBondContact O-ND2 3.36Å; V411-N413 PolarHBondContact O-N 3.18Å
414	N	92.5	Very high	95.1	Very high	41 Å²	41	42.8 Å²	42.8	22%	0.219	24%	0.239	C	C	.	.	H	α-helix	trans	-91.1	-0	177.7	-66.3	-70.7	0	0	0	113.8	K247 K250 Q251 A410 V411 L412	K247-N414 VanDerWaalsContact CE-O 3.22Å; K247-N414 WeakPolarHBondContact CE-O 3.23Å; K247-N414 WeakPolarHBondContact CG-O 3.42Å; K250-N414 HydrophobicContact CB-CB 3.99Å; K250-N414 VanDerWaalsContact CB-OD1 3.3Å; K250-N414 WeakPolarHBondContact CB-OD1 3.41Å; Q251-N414 HydrophobicContact CB-CB 4.1Å; A410-N414 PolarHBondContact O-N 3.23Å; A410-N414 PolarHBondContact O-ND2 3.13Å; V411-N414 CarbonylContact O-C 3.6Å; V411-N414 PolarHBondContact O-N 3.06Å; V411-N414 VanDerWaalsContact O-N 3.11Å; L412-N414 PolarHBondContact O-N 3.04Å
415	S	92.4	Very high	95.1	Very high	5 Å²	5	49.9 Å²	49.9	4%	0.035	27%	0.265	C	S	.	.			trans	-81.6	152.4	177.2	-60.3	0	0	0	0	112.4	K247 Q251 V411 L412 L424	K247-S415 WeakPolarHBondContact CE-O 3.35Å; K247-S415 PolarHBondContact NZ-O 2.93Å; Q251-S415 PolarHBondContact NE2-OG 2.75Å; V411-S415 PolarHBondContact O-N 3.05Å; V411-S415 PolarHBondContact O-OG 2.74Å; L412-S415 WeakPolarHBondContact O-CB 3.49Å; L412-S415 PolarHBondContact O-N 3.48Å; S415-L424 WeakPolarHBondContact OG-CD1 3.3Å
416	T	87.3	Confident	95.1	Very high	86 Å²	86	52.2 Å²	52.2	53%	0.528	28%	0.279	S	S	.	.			trans	-130.6	-26	175.5	49.4	0	0	0	0	113.9	K247	K247-T416 HydrophobicContact CD-CG2 3.56Å; K247-T416 HydrophobicContact CG-CG2 4.12Å
417	D	91	Very high	95.1	Very high	72 Å²	72	48.5 Å²	48.5	39%	0.385	26%	0.26	S	S	.	.	S	Bend	trans	-73	150.6	176.3	174.7	56.7	0	0	0	112	A419 D420 V421	D417-A419 WeakPolarHBondContact OD2-CA 3.23Å; D417-A419 VanDerWaalsContact OD2-CB 3.23Å; D417-A419 WeakPolarHBondContact OD2-CB 3.07Å; D417-A419 PolarHBondContact OD2-N 2.94Å; D417-D420 HydrophobicContact CB-CB 4.13Å; D417-D420 PolarHBondContact OD2-N 3.11Å; D417-V421 WeakPolarHBondContact O-CB 3.28Å; D417-V421 WeakPolarHBondContact O-CG2 3.31Å; D417-V421 PolarHBondContact O-N 3.36Å; D417-V421 VanDerWaalsContact O-N 3.09Å
418	T	92	Very high	95.2	Very high	97 Å²	97	48.5 Å²	48.5	60%	0.595	26%	0.26	S	S	*	.	H	α-helix	trans	-81.4	-22.8	-176.3	68.7	0	0	0	0	114	K422	T418-K422 VanDerWaalsContact O-CD 3.27Å; T418-K422 WeakPolarHBondContact O-CD 3.34Å; T418-K422 WeakPolarHBondContact O-CG 3.23Å; T418-K422 PolarHBondContact O-N 3.09Å
419	A	94.1	Very high	95.1	Very high	48 Å²	48	53.6 Å²	53.6	40%	0.397	28%	0.284	S	S	.	.	H	α-helix	trans	-78.6	-45.9	170.3	0	0	0	0	0	110.2	T332 D417 V421 K422 S423	T332-A419 HydrophobicContact CG2-CB 4.28Å; D417-A419 WeakPolarHBondContact OD2-CA 3.23Å; D417-A419 VanDerWaalsContact OD2-CB 3.23Å; D417-A419 WeakPolarHBondContact OD2-CB 3.07Å; D417-A419 PolarHBondContact OD2-N 2.94Å; A419-V421 VanDerWaalsContact C-N 3.33Å; A419-V421 PolarHBondContact O-N 2.96Å; A419-K422 PolarHBondContact O-N 3.05Å; A419-K422 VanDerWaalsContact O-N 3.16Å; A419-S423 WeakPolarHBondContact O-CB 3.44Å; A419-S423 PolarHBondContact O-N 3.36Å
420	D	93.9	Very high	95.2	Very high	19 Å²	19	53.3 Å²	53.3	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-49.1	-54	171.2	-75.4	-8.6	0	0	0	111.3	Q251 P331 D417 K422 S423 L424	Q251-D420 PolarHBondContact NE2-OD2 2.87Å; P331-D420 WeakPolarHBondContact CD-OD1 3.37Å; P331-D420 HydrophobicContact CG-CB 4.07Å; P331-D420 WeakPolarHBondContact CG-OD1 3.44Å; D417-D420 HydrophobicContact CB-CB 4.13Å; D417-D420 PolarHBondContact OD2-N 3.11Å; D420-K422 VanDerWaalsContact C-N 3.31Å; D420-K422 PolarHBondContact O-N 3.41Å; D420-S423 PolarHBondContact O-N 2.98Å; D420-L424 HydrophobicContact CB-CD1 4.41Å; D420-L424 VanDerWaalsContact O-CB 3.31Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 WeakPolarHBondContact O-CD1 3.49Å; D420-L424 VanDerWaalsContact O-CG 3.31Å; D420-L424 WeakPolarHBondContact O-CG 3.44Å; D420-L424 PolarHBondContact O-N 3.37Å
421	V	95.8	Very high	95.2	Very high	40 Å²	40	51.7 Å²	51.7	24%	0.242	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-30.1	-176.9	165.4	0	0	0	0	113	L412 D417 A419 R425	L412-V421 HydrophobicContact CD1-CB 4.23Å; L412-V421 HydrophobicContact CD1-CG1 4.08Å; L412-V421 HydrophobicContact CD1-CG2 4.08Å; D417-V421 WeakPolarHBondContact O-CB 3.28Å; D417-V421 WeakPolarHBondContact O-CG2 3.31Å; D417-V421 PolarHBondContact O-N 3.36Å; D417-V421 VanDerWaalsContact O-N 3.09Å; A419-V421 VanDerWaalsContact C-N 3.33Å; A419-V421 PolarHBondContact O-N 2.96Å; V421-R425 VanDerWaalsContact O-CD 3.23Å; V421-R425 WeakPolarHBondContact O-CD 3.47Å; V421-R425 WeakPolarHBondContact O-CG 3.49Å
422	K	96.8	Very high	95.2	Very high	143 Å²	143	54.2 Å²	54.2	62%	0.622	28%	0.281	S	S	*	.	H	α-helix	trans	-73.2	-52.1	173.5	-75.3	167.5	-173.6	173.2	0	110.5	T418 A419 D420 L424 R425 V426	T418-K422 VanDerWaalsContact O-CD 3.27Å; T418-K422 WeakPolarHBondContact O-CD 3.34Å; T418-K422 WeakPolarHBondContact O-CG 3.23Å; T418-K422 PolarHBondContact O-N 3.09Å; A419-K422 PolarHBondContact O-N 3.05Å; A419-K422 VanDerWaalsContact O-N 3.16Å; D420-K422 VanDerWaalsContact C-N 3.31Å; D420-K422 PolarHBondContact O-N 3.41Å; K422-L424 PolarHBondContact O-N 3.1Å; K422-R425 WeakPolarHBondContact O-CB 3.42Å; K422-R425 PolarHBondContact O-N 3.03Å; K422-R425 VanDerWaalsContact O-N 3.11Å; K422-V426 PolarHBondContact O-N 2.78Å
423	S	96.6	Very high	95.2	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-57.6	-48.8	-178.2	-171.8	0	0	0	0	112	T332 E335 A419 D420 R425 V426 M427	T332-S423 WeakPolarHBondContact CA-OG 3.46Å; E335-S423 WeakPolarHBondContact CB-OG 3.35Å; E335-S423 VanDerWaalsContact OE2-CA 3.3Å; E335-S423 WeakPolarHBondContact OE2-CA 3.34Å; E335-S423 WeakPolarHBondContact OE2-CB 3.33Å; E335-S423 PolarHBondContact OE2-OG 3.01Å; A419-S423 WeakPolarHBondContact O-CB 3.44Å; A419-S423 PolarHBondContact O-N 3.36Å; D420-S423 PolarHBondContact O-N 2.98Å; S423-R425 VanDerWaalsContact C-N 3.25Å; S423-R425 PolarHBondContact O-N 3.37Å; S423-V426 PolarHBondContact O-N 3.27Å; S423-V426 VanDerWaalsContact O-N 3.14Å; S423-M427 WeakPolarHBondContact O-CG 3.44Å; S423-M427 PolarHBondContact O-N 3.25Å
424	L	97.6	Very high	95.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-31.5	177.6	-74.5	159.8	0	0	0	113.2	P331 L408 V411 L412 S415 D420 K422 M427 I428	P331-L424 HydrophobicContact CB-CD1 4.4Å; P331-L424 HydrophobicContact CB-CD2 4.22Å; P331-L424 HydrophobicContact CB-CG 4.28Å; P331-L424 HydrophobicContact CG-CD1 4.28Å; L408-L424 HydrophobicContact CD2-CD2 3.96Å; V411-L424 HydrophobicContact CB-CD1 4.46Å; V411-L424 HydrophobicContact CB-CD2 4.05Å; V411-L424 HydrophobicContact CG1-CD1 3.77Å; V411-L424 HydrophobicContact CG1-CD2 3.84Å; V411-L424 HydrophobicContact CG1-CG 4.5Å; L412-L424 HydrophobicContact CB-CB 4.26Å; L412-L424 HydrophobicContact CB-CD1 4.43Å; L412-L424 HydrophobicContact CD1-CB 4.02Å; S415-L424 WeakPolarHBondContact OG-CD1 3.3Å; D420-L424 HydrophobicContact CB-CD1 4.41Å; D420-L424 VanDerWaalsContact O-CB 3.31Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 WeakPolarHBondContact O-CD1 3.49Å; D420-L424 VanDerWaalsContact O-CG 3.31Å; D420-L424 WeakPolarHBondContact O-CG 3.44Å; D420-L424 PolarHBondContact O-N 3.37Å; K422-L424 PolarHBondContact O-N 3.1Å; L424-M427 HydrophobicContact CD2-CE 3.85Å; L424-M427 HydrophobicContact CG-CE 4.12Å; L424-I428 WeakPolarHBondContact O-CB 3.3Å; L424-I428 VanDerWaalsContact O-CD1 3.27Å; L424-I428 WeakPolarHBondContact O-CD1 3.28Å; L424-I428 WeakPolarHBondContact O-CG1 3.46Å; L424-I428 PolarHBondContact O-N 2.96Å
425	R	97.5	Very high	95.4	Very high	153 Å²	153	50 Å²	50	58%	0.577	26%	0.257	S	S	*	.	H	α-helix	trans	-68.8	-45.5	175	-72.7	167.2	-176.4	-86	-0.3	111.7	L412 V421 K422 S423 M427 I428 E429	L412-R425 HydrophobicContact CD1-CG 4.5Å; L412-R425 HydrophobicContact CD2-CG 4.22Å; V421-R425 VanDerWaalsContact O-CD 3.23Å; V421-R425 WeakPolarHBondContact O-CD 3.47Å; V421-R425 WeakPolarHBondContact O-CG 3.49Å; K422-R425 WeakPolarHBondContact O-CB 3.42Å; K422-R425 PolarHBondContact O-N 3.03Å; K422-R425 VanDerWaalsContact O-N 3.11Å; S423-R425 VanDerWaalsContact C-N 3.25Å; S423-R425 PolarHBondContact O-N 3.37Å; R425-M427 VanDerWaalsContact C-N 3.32Å; R425-M427 PolarHBondContact O-N 3.4Å; R425-I428 PolarHBondContact O-N 3.34Å; R425-E429 WeakPolarHBondContact O-CB 3.43Å; R425-E429 PolarHBondContact O-N 2.95Å
426	V	97.4	Very high	95.4	Very high	49 Å²	49	53 Å²	53	30%	0.297	28%	0.279	S	S	.	.	H	α-helix	trans	-60.4	-42.9	175.4	178.7	0	0	0	0	110.7	E335 K422 S423 E429 K430	E335-V426 HydrophobicContact CG-CG1 4.44Å; K422-V426 PolarHBondContact O-N 2.78Å; S423-V426 PolarHBondContact O-N 3.27Å; S423-V426 VanDerWaalsContact O-N 3.14Å; V426-E429 PolarHBondContact O-N 3.17Å; V426-K430 WeakPolarHBondContact O-CG 3.31Å; V426-K430 PolarHBondContact O-N 3.03Å
427	M	97.6	Very high	95.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-38.7	177.5	-64.5	-164.9	-85.1	0	0	113.1	P331 M334 E335 F338 L408 S423 L424 R425 A431	P331-M427 HydrophobicContact CB-CE 4.4Å; P331-M427 VanDerWaalsContact O-CE 3.27Å; P331-M427 WeakPolarHBondContact O-CE 3.33Å; M334-M427 VanDerWaalsContact C-SD 3.57Å; M334-M427 HydrophobicContact CB-CE 4.33Å; M334-M427 HydrophobicContact CB-SD 3.66Å; E335-M427 HydrophobicContact CB-CG 4.33Å; E335-M427 HydrophobicContact CB-SD 4.38Å; E335-M427 HydrophobicContact CG-CG 4.24Å; E335-M427 PolarHBondContact N-SD 3.01Å; F338-M427 HydrophobicContact CB-CB 3.89Å; F338-M427 HydrophobicContact CB-CG 3.67Å; F338-M427 HydrophobicContact CB-SD 4.11Å; F338-M427 HydrophobicContact CD1-CB 4.35Å; F338-M427 HydrophobicContact CD2-CB 4.26Å; F338-M427 HydrophobicContact CD2-CG 4.04Å; F338-M427 HydrophobicContact CD2-SD 3.37Å; F338-M427 WeakPolarHBondContact CD2-SD 3.25Å; F338-M427 HydrophobicContact CE2-SD 4.06Å; F338-M427 HydrophobicContact CG-CB 3.91Å; F338-M427 HydrophobicContact CG-CG 3.95Å; F338-M427 HydrophobicContact CG-SD 3.93Å; L408-M427 HydrophobicContact CD1-CB 3.8Å; L408-M427 HydrophobicContact CD2-CB 4.25Å; L408-M427 HydrophobicContact CD2-CE 4.47Å; L408-M427 HydrophobicContact CD2-SD 4.47Å; S423-M427 WeakPolarHBondContact O-CG 3.44Å; S423-M427 PolarHBondContact O-N 3.25Å; L424-M427 HydrophobicContact CD2-CE 3.85Å; L424-M427 HydrophobicContact CG-CE 4.12Å; R425-M427 VanDerWaalsContact C-N 3.32Å; R425-M427 PolarHBondContact O-N 3.4Å; M427-A431 WeakPolarHBondContact O-CB 3.48Å; M427-A431 PolarHBondContact O-N 3.08Å; M427-A431 VanDerWaalsContact O-N 3.07Å
428	I	98	Very high	95.8	Very high	13 Å²	13	49.3 Å²	49.3	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-47.9	173.7	-71.4	159.3	0	0	0	110.2	L408 K409 L412 L424 R425 K430 A431 E432	L408-I428 HydrophobicContact CB-CD1 4.19Å; L408-I428 HydrophobicContact CB-CG1 3.5Å; L408-I428 HydrophobicContact CD1-CG1 4.22Å; K409-I428 HydrophobicContact CG-CD1 3.64Å; K409-I428 HydrophobicContact CG-CG1 4.19Å; K409-I428 HydrophobicContact CG-CG2 4.48Å; L412-I428 HydrophobicContact CB-CD1 4.3Å; L412-I428 HydrophobicContact CD2-CD1 3.66Å; L424-I428 WeakPolarHBondContact O-CB 3.3Å; L424-I428 VanDerWaalsContact O-CD1 3.27Å; L424-I428 WeakPolarHBondContact O-CD1 3.28Å; L424-I428 WeakPolarHBondContact O-CG1 3.46Å; L424-I428 PolarHBondContact O-N 2.96Å; R425-I428 PolarHBondContact O-N 3.34Å; I428-K430 PolarHBondContact O-N 3.07Å; I428-A431 PolarHBondContact O-N 3.06Å; I428-E432 HydrophobicContact CG2-CG 4.29Å; I428-E432 WeakPolarHBondContact O-CB 3.27Å; I428-E432 WeakPolarHBondContact O-CG 3.44Å; I428-E432 PolarHBondContact O-N 3.13Å
429	E	97.5	Very high	95.8	Very high	107 Å²	107	45.6 Å²	45.6	50%	0.5	23%	0.226	S	C	.	.	H	α-helix	trans	-57.1	-49.3	179.8	-175.7	173.9	-178.2	0	0	111.2	R425 V426 A431 E432 E433	R425-E429 WeakPolarHBondContact O-CB 3.43Å; R425-E429 PolarHBondContact O-N 2.95Å; V426-E429 PolarHBondContact O-N 3.17Å; E429-A431 PolarHBondContact O-N 3.18Å; E429-E432 PolarHBondContact O-N 3.42Å; E429-E433 VanDerWaalsContact O-CB 3.29Å; E429-E433 WeakPolarHBondContact O-CB 3.32Å; E429-E433 PolarHBondContact O-N 3.39Å
430	K	97.4	Very high	95.6	Very high	62 Å²	62	47.8 Å²	47.8	27%	0.27	23%	0.234	S	C	.	.	H	α-helix	trans	-65.2	-34.9	177.9	-68	-72.3	150.3	-161.5	0	113.3	V426 I428 E433 F434	V426-K430 WeakPolarHBondContact O-CG 3.31Å; V426-K430 PolarHBondContact O-N 3.03Å; I428-K430 PolarHBondContact O-N 3.07Å; K430-E433 WeakPolarHBondContact CD-OE2 3.26Å; K430-E433 WeakPolarHBondContact CE-OE2 3.43Å; K430-E433 IonicContact NZ-OE1 3.71Å; K430-E433 IonicContact NZ-OE2 3.65Å; K430-E433 PolarHBondContact NZ-OE2 2.84Å; K430-F434 PolarHBondContact O-N 3.35Å; K430-F434 VanDerWaalsContact O-N 3.12Å
431	A	97.1	Very high	95.5	Very high	3 Å²	3	49.1 Å²	49.1	3%	0.025	24%	0.24	C	C	.	.	H	α-helix	trans	-70.1	-37.2	174.6	0	0	0	0	0	112.6	F338 L341 P405 L408 M427 I428 E429 A435	F338-A431 HydrophobicContact CD1-CB 4.5Å; L341-A431 HydrophobicContact CD1-CB 4.19Å; P405-A431 HydrophobicContact CG-CB 3.89Å; L408-A431 HydrophobicContact CD1-CB 4.4Å; M427-A431 WeakPolarHBondContact O-CB 3.48Å; M427-A431 PolarHBondContact O-N 3.08Å; M427-A431 VanDerWaalsContact O-N 3.07Å; I428-A431 PolarHBondContact O-N 3.06Å; E429-A431 PolarHBondContact O-N 3.18Å; A431-A435 WeakPolarHBondContact O-CB 3.48Å; A431-A435 PolarHBondContact O-N 2.81Å; A431-A435 VanDerWaalsContact O-N 3.14Å
432	E	96.9	Very high	95.3	Very high	53 Å²	53	47.7 Å²	47.7	25%	0.248	23%	0.231	C	C	.	.	H	α-helix	trans	-74.4	-36.3	176.4	-69.8	-172.4	156.2	0	0	112.5	P405 K409 I428 E429 S436 M765	P405-E432 HydrophobicContact CB-CG 3.66Å; P405-E432 HydrophobicContact CG-CG 3.68Å; K409-E432 WeakPolarHBondContact CE-OE1 3.45Å; K409-E432 IonicContact NZ-OE1 3.2Å; K409-E432 PolarHBondContact NZ-OE1 3.15Å; I428-E432 HydrophobicContact CG2-CG 4.29Å; I428-E432 WeakPolarHBondContact O-CB 3.27Å; I428-E432 WeakPolarHBondContact O-CG 3.44Å; I428-E432 PolarHBondContact O-N 3.13Å; E429-E432 PolarHBondContact O-N 3.42Å; E432-S436 WeakPolarHBondContact O-CB 3.4Å; E432-S436 PolarHBondContact O-N 3.38Å; E432-S436 PolarHBondContact O-OG 3.41Å; E432-M765 HydrophobicContact CG-CE 4.06Å; E432-M765 WeakPolarHBondContact OE1-CE 3.35Å
433	E	95.5	Very high	94.9	Very high	82 Å²	82	41.7 Å²	41.7	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-52.3	172.7	-176.8	177.1	-162.2	0	0	111	E429 K430 A435 S436 R437	E429-E433 VanDerWaalsContact O-CB 3.29Å; E429-E433 WeakPolarHBondContact O-CB 3.32Å; E429-E433 PolarHBondContact O-N 3.39Å; K430-E433 WeakPolarHBondContact CD-OE2 3.26Å; K430-E433 WeakPolarHBondContact CE-OE2 3.43Å; K430-E433 IonicContact NZ-OE1 3.71Å; K430-E433 IonicContact NZ-OE2 3.65Å; K430-E433 PolarHBondContact NZ-OE2 2.84Å; E433-A435 PolarHBondContact O-N 2.89Å; E433-S436 WeakPolarHBondContact O-CB 3.2Å; E433-S436 PolarHBondContact O-N 3.47Å; E433-R437 PolarHBondContact O-N 3.02Å
434	F	96.3	Very high	94.7	Very high	3 Å²	3	43.6 Å²	43.6	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-43.3	178.7	-174.4	-96.3	0	0	0	112.5	L341 F345 L401 K430 S436 R437 V438	L341-F434 HydrophobicContact CB-CB 4.36Å; L341-F434 HydrophobicContact CB-CG 4.4Å; F345-F434 HydrophobicContact CB-CD1 4.39Å; F345-F434 HydrophobicContact CB-CE1 3.67Å; F345-F434 HydrophobicContact CB-CE2 4.18Å; F345-F434 HydrophobicContact CB-CZ 3.56Å; F345-F434 HydrophobicContact CD2-CE1 4.34Å; F345-F434 VanDerWaalsContact O-CZ 3.31Å; F345-F434 WeakPolarHBondContact O-CZ 3.43Å; L401-F434 HydrophobicContact CD1-CE1 4.11Å; L401-F434 HydrophobicContact CD2-CD1 4.07Å; L401-F434 HydrophobicContact CD2-CE1 3.8Å; K430-F434 PolarHBondContact O-N 3.35Å; K430-F434 VanDerWaalsContact O-N 3.12Å; F434-S436 VanDerWaalsContact C-N 3.3Å; F434-S436 PolarHBondContact O-N 3.45Å; F434-R437 WeakPolarHBondContact O-CB 3.44Å; F434-R437 PolarHBondContact O-N 3.12Å; F434-V438 HydrophobicContact CD1-CG2 4.33Å; F434-V438 HydrophobicContact CE1-CG2 3.76Å; F434-V438 HydrophobicContact CZ-CG2 3.89Å; F434-V438 PolarHBondContact O-N 3.05Å; F434-V438 VanDerWaalsContact O-N 3.08Å
435	A	94.8	Very high	94.4	Very high	11 Å²	11	44.3 Å²	44.3	9%	0.091	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-37.6	175.6	0	0	0	0	0	112.1	A431 E433 N439	A431-A435 WeakPolarHBondContact O-CB 3.48Å; A431-A435 PolarHBondContact O-N 2.81Å; A431-A435 VanDerWaalsContact O-N 3.14Å; E433-A435 PolarHBondContact O-N 2.89Å; A435-N439 PolarHBondContact O-N 3.01Å; A435-N439 VanDerWaalsContact O-N 3.08Å
436	S	93	Very high	94.1	Very high	70 Å²	70	41.1 Å²	41.1	49%	0.49	21%	0.209	S	C	.	.	H	α-helix	trans	-67.5	-40.5	175.4	-60.7	0	0	0	0	111.8	E432 E433 F434 N439 V440	E432-S436 WeakPolarHBondContact O-CB 3.4Å; E432-S436 PolarHBondContact O-N 3.38Å; E432-S436 PolarHBondContact O-OG 3.41Å; E433-S436 WeakPolarHBondContact O-CB 3.2Å; E433-S436 PolarHBondContact O-N 3.47Å; F434-S436 VanDerWaalsContact C-N 3.3Å; F434-S436 PolarHBondContact O-N 3.45Å; S436-N439 WeakPolarHBondContact O-CB 3.17Å; S436-N439 PolarHBondContact O-N 3.05Å; S436-N439 VanDerWaalsContact O-N 3.15Å; S436-V440 WeakPolarHBondContact O-CG2 3.19Å; S436-V440 PolarHBondContact O-N 3.26Å
437	R	93.5	Very high	93.7	Very high	78 Å²	78	41.4 Å²	41.4	29%	0.294	21%	0.207	S	C	.	.	H	α-helix	trans	-57.5	-49.5	174.1	-174.3	-178.9	-176.7	169.7	7.4	111.6	D342 E433 F434 N439 V440 E441	D342-R437 WeakPolarHBondContact OD1-CD 3.42Å; D342-R437 IonicContact OD1-CZ 2.91Å; D342-R437 IonicContact OD1-NE 2.64Å; D342-R437 IonicContact OD1-NH1 3.31Å; D342-R437 PolarHBondContact OD1-NH1 3.43Å; E433-R437 PolarHBondContact O-N 3.02Å; F434-R437 WeakPolarHBondContact O-CB 3.44Å; F434-R437 PolarHBondContact O-N 3.12Å; R437-N439 VanDerWaalsContact C-N 3.28Å; R437-N439 PolarHBondContact O-N 3.5Å; R437-V440 PolarHBondContact O-N 3.25Å; R437-E441 WeakPolarHBondContact O-CG 3.4Å; R437-E441 PolarHBondContact O-N 3.15Å; R437-E441 VanDerWaalsContact O-N 3.1Å
438	V	93.6	Very high	93.5	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-60.8	-37.4	175.8	176.1	0	0	0	0	111.5	I349 C352 L401 F434 L442 F763	I349-V438 HydrophobicContact CG1-CG2 4Å; C352-V438 HydrophobicContact CB-CG1 3.8Å; L401-V438 HydrophobicContact CD1-CB 4.43Å; L401-V438 HydrophobicContact CD1-CG1 4.27Å; L401-V438 HydrophobicContact CD1-CG2 4.08Å; F434-V438 HydrophobicContact CD1-CG2 4.33Å; F434-V438 HydrophobicContact CE1-CG2 3.76Å; F434-V438 HydrophobicContact CZ-CG2 3.89Å; F434-V438 PolarHBondContact O-N 3.05Å; F434-V438 VanDerWaalsContact O-N 3.08Å; V438-L442 HydrophobicContact CG1-CD1 4.17Å; V438-L442 WeakPolarHBondContact O-CB 3.37Å; V438-L442 WeakPolarHBondContact O-CG 3.41Å; V438-L442 PolarHBondContact O-N 3.12Å; V438-F763 HydrophobicContact CG1-CE2 4.27Å; V438-F763 HydrophobicContact CG1-CZ 4.34Å
439	N	91	Very high	93.3	Very high	20 Å²	20	45.9 Å²	45.9	11%	0.107	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-36.8	175.5	-172.5	91.4	0	0	0	113.2	A435 S436 R437 C443 V759 M762 F763	A435-N439 PolarHBondContact O-N 3.01Å; A435-N439 VanDerWaalsContact O-N 3.08Å; S436-N439 WeakPolarHBondContact O-CB 3.17Å; S436-N439 PolarHBondContact O-N 3.05Å; S436-N439 VanDerWaalsContact O-N 3.15Å; R437-N439 VanDerWaalsContact C-N 3.28Å; R437-N439 PolarHBondContact O-N 3.5Å; N439-C443 WeakPolarHBondContact O-CB 3.45Å; N439-C443 PolarHBondContact O-N 3.37Å; N439-V759 VanDerWaalsContact ND2-CG1 3.29Å; N439-V759 WeakPolarHBondContact ND2-CG1 3.44Å; N439-M762 PolarHBondContact OD1-N 3.44Å; N439-F763 HydrophobicContact CB-CD2 3.86Å; N439-F763 HydrophobicContact CB-CE2 4.14Å
440	V	89.9	Confident	93	Very high	93 Å²	93	43.1 Å²	43.1	56%	0.564	22%	0.219	S	C	*	.	H	α-helix	trans	-66	-46.6	175.9	169.9	0	0	0	0	110.9	S436 R437 L442 C443 F444	S436-V440 WeakPolarHBondContact O-CG2 3.19Å; S436-V440 PolarHBondContact O-N 3.26Å; R437-V440 PolarHBondContact O-N 3.25Å; V440-L442 PolarHBondContact O-N 3.25Å; V440-C443 WeakPolarHBondContact O-CB 3.21Å; V440-C443 PolarHBondContact O-N 2.89Å; V440-C443 VanDerWaalsContact O-N 3.15Å; V440-F444 PolarHBondContact O-N 3.2Å
441	E	91.7	Very high	92.9	Very high	48 Å²	48	40.2 Å²	40.2	22%	0.224	21%	0.207	C	C	.	.	H	α-helix	trans	-58.6	-45.2	175.7	-66.3	-73.5	170.6	0	0	111.6	I349 L353 R437 C443 F444 K445	I349-E441 HydrophobicContact CG2-CB 4.29Å; I349-E441 HydrophobicContact CG2-CG 3.99Å; L353-E441 HydrophobicContact CD2-CB 4.28Å; L353-E441 WeakPolarHBondContact CD2-O 3.31Å; R437-E441 WeakPolarHBondContact O-CG 3.4Å; R437-E441 PolarHBondContact O-N 3.15Å; R437-E441 VanDerWaalsContact O-N 3.1Å; E441-C443 VanDerWaalsContact C-N 3.33Å; E441-C443 PolarHBondContact O-N 3.13Å; E441-F444 PolarHBondContact O-N 3.35Å; E441-K445 PolarHBondContact O-N 3.19Å
442	L	90.8	Very high	92.8	Very high	10 Å²	10	41.5 Å²	41.5	5%	0.052	22%	0.215	C	C	.	.	H	α-helix	trans	-59	-41.7	174.1	-79.6	168.7	0	0	0	112.8	C352 V438 V440 Q446 M762 F763	C352-L442 HydrophobicContact CB-CD1 4.3Å; C352-L442 HydrophobicContact CB-CD2 4.27Å; C352-L442 HydrophobicContact CB-CG 4.42Å; C352-L442 WeakPolarHBondContact O-CD2 3.02Å; V438-L442 HydrophobicContact CG1-CD1 4.17Å; V438-L442 WeakPolarHBondContact O-CB 3.37Å; V438-L442 WeakPolarHBondContact O-CG 3.41Å; V438-L442 PolarHBondContact O-N 3.12Å; V440-L442 PolarHBondContact O-N 3.25Å; L442-Q446 WeakPolarHBondContact O-CB 3.45Å; L442-Q446 PolarHBondContact O-N 2.94Å; L442-M762 HydrophobicContact CB-CE 4.34Å; L442-M762 HydrophobicContact CB-SD 3.95Å; L442-M762 HydrophobicContact CD1-SD 4.14Å; L442-M762 HydrophobicContact CD2-SD 4.27Å; L442-M762 HydrophobicContact CG-SD 4.36Å; L442-F763 HydrophobicContact CD1-CE2 3.89Å; L442-F763 HydrophobicContact CD1-CZ 4.17Å
443	C	89.9	Confident	92.5	Very high	17 Å²	17	41.1 Å²	41.1	12%	0.115	22%	0.218	C	C	.	.	H	α-helix	trans	-68.7	-42.9	179.2	-167.3	0	0	0	0	111.6	N439 V440 E441 Q446 H447	N439-C443 WeakPolarHBondContact O-CB 3.45Å; N439-C443 PolarHBondContact O-N 3.37Å; V440-C443 WeakPolarHBondContact O-CB 3.21Å; V440-C443 PolarHBondContact O-N 2.89Å; V440-C443 VanDerWaalsContact O-N 3.15Å; E441-C443 VanDerWaalsContact C-N 3.33Å; E441-C443 PolarHBondContact O-N 3.13Å; C443-Q446 PolarHBondContact O-N 2.85Å; C443-H447 PolarHBondContact O-CD2 3.17Å; C443-H447 PolarHBondContact O-N 3.21Å
444	F	91.1	Very high	92.4	Very high	42 Å²	42	37.9 Å²	37.9	18%	0.184	20%	0.203	C	C	.	.	H	α-helix	trans	-56.9	-50.6	172.8	-178.2	-80.8	0	0	0	111.1	V440 E441 Q446 H447 Y448 L495 Y629	V440-F444 PolarHBondContact O-N 3.2Å; E441-F444 PolarHBondContact O-N 3.35Å; F444-Q446 PolarHBondContact O-N 3.48Å; F444-H447 PolarHBondContact O-N 2.68Å; F444-Y448 PolarHBondContact O-N 3.22Å; F444-L495 HydrophobicContact CD1-CD2 4.33Å; F444-L495 HydrophobicContact CD2-CB 4.14Å; F444-L495 HydrophobicContact CD2-CD2 4.1Å; F444-L495 HydrophobicContact CE1-CD2 4.2Å; F444-L495 HydrophobicContact CE2-CB 3.69Å; F444-L495 HydrophobicContact CE2-CD2 3.99Å; F444-L495 HydrophobicContact CE2-CG 4.34Å; F444-L495 HydrophobicContact CG-CD2 4.27Å; F444-L495 HydrophobicContact CZ-CB 4.25Å; F444-L495 HydrophobicContact CZ-CD1 4.45Å; F444-L495 HydrophobicContact CZ-CD2 4.03Å; F444-L495 HydrophobicContact CZ-CG 4.49Å; F444-L495 WeakPolarHBondContact O-CD2 3.09Å; F444-Y629 HydrophobicContact CE1-CD2 4.35Å
445	K	91.6	Very high	92.3	Very high	15 Å²	15	40.5 Å²	40.5	7%	0.065	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-44.9	177.2	174.9	171.9	175.2	-179.8	0	111.9	L353 D357 E441 H447 Y448 D449	L353-K445 HydrophobicContact CB-CD 4.3Å; L353-K445 HydrophobicContact CD2-CB 3.62Å; L353-K445 HydrophobicContact CD2-CD 3.89Å; L353-K445 HydrophobicContact CD2-CG 4.34Å; L353-K445 PolarHBondContact O-NZ 3.43Å; D357-K445 IonicContact OD2-NZ 3.19Å; D357-K445 PolarHBondContact OD2-NZ 3.34Å; E441-K445 PolarHBondContact O-N 3.19Å; K445-H447 VanDerWaalsContact C-N 3.26Å; K445-H447 PolarHBondContact O-N 3.31Å; K445-Y448 PolarHBondContact O-N 3.03Å; K445-Y448 VanDerWaalsContact O-N 3.1Å; K445-D449 WeakPolarHBondContact CE-OD2 3.34Å; K445-D449 VanDerWaalsContact CG-OD2 3.3Å; K445-D449 WeakPolarHBondContact CG-OD2 3.25Å; K445-D449 WeakPolarHBondContact O-CB 3.48Å; K445-D449 PolarHBondContact O-N 3.05Å
446	Q	90.7	Very high	92.1	Very high	86 Å²	86	45.8 Å²	45.8	40%	0.402	24%	0.239	S	C	.	.	H	α-helix	trans	-58.2	-39.7	178.3	-173.4	-175.8	0.6	0	0	111.9	L442 C443 F444 T450 M762	L442-Q446 WeakPolarHBondContact O-CB 3.45Å; L442-Q446 PolarHBondContact O-N 2.94Å; C443-Q446 PolarHBondContact O-N 2.85Å; F444-Q446 PolarHBondContact O-N 3.48Å; Q446-T450 WeakPolarHBondContact O-CB 3.45Å; Q446-T450 PolarHBondContact O-N 3.32Å; Q446-T450 VanDerWaalsContact O-N 3.14Å; Q446-T450 PolarHBondContact O-OG1 2.82Å; Q446-M762 HydrophobicContact CB-CE 4.08Å; Q446-M762 HydrophobicContact CG-CE 4.39Å
447	H	90.7	Very high	92	Very high	55 Å²	55	43.2 Å²	43.2	26%	0.255	22%	0.221	S	C	.	.	H	α-helix	trans	-67.3	-44.9	174.1	-66.8	-28.5	0	0	0	111.8	C443 F444 K445 D449 T450 L451 L495	C443-H447 PolarHBondContact O-CD2 3.17Å; C443-H447 PolarHBondContact O-N 3.21Å; F444-H447 PolarHBondContact O-N 2.68Å; K445-H447 VanDerWaalsContact C-N 3.26Å; K445-H447 PolarHBondContact O-N 3.31Å; H447-D449 PolarHBondContact O-N 2.83Å; H447-T450 WeakPolarHBondContact O-CA 2.96Å; H447-T450 WeakPolarHBondContact O-CB 3.49Å; H447-T450 PolarHBondContact O-N 3.02Å; H447-T450 VanDerWaalsContact O-N 3.13Å; H447-L451 WeakPolarHBondContact O-CG 3.47Å; H447-L451 PolarHBondContact O-N 3Å; H447-L495 HydrophobicContact CB-CD2 3.89Å
448	Y	93.4	Very high	91.9	Very high	40 Å²	40	41 Å²	41	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-48	178	-177	-90	0	0	0	112.6	F444 K445 T450 L451 C452 T484 L495 Y629 V631	F444-Y448 PolarHBondContact O-N 3.22Å; K445-Y448 PolarHBondContact O-N 3.03Å; K445-Y448 VanDerWaalsContact O-N 3.1Å; Y448-T450 PolarHBondContact O-N 2.94Å; Y448-L451 PolarHBondContact O-N 3.28Å; Y448-C452 WeakPolarHBondContact CE1-SG 3.41Å; Y448-C452 PolarHBondContact O-N 3.36Å; Y448-C452 PolarHBondContact O-SG 3.39Å; Y448-T484 HydrophobicContact CD2-CG2 4.18Å; Y448-T484 HydrophobicContact CE2-CG2 3.74Å; Y448-L495 HydrophobicContact CD2-CD1 4.23Å; Y448-Y629 HydrophobicContact CD1-CD1 4.41Å; Y448-Y629 HydrophobicContact CE1-CD1 4.25Å; Y448-V631 HydrophobicContact CE2-CG2 4.43Å; Y448-V631 WeakPolarHBondContact OH-CG2 3.45Å
449	D	92.1	Very high	91.7	Very high	67 Å²	67	44.3 Å²	44.3	36%	0.358	23%	0.232	S	C	.	.	H	α-helix	trans	-62.3	-33.4	176.3	-68.4	-22.2	0	0	0	111.4	K445 H447 S453	K445-D449 WeakPolarHBondContact CE-OD2 3.34Å; K445-D449 VanDerWaalsContact CG-OD2 3.3Å; K445-D449 WeakPolarHBondContact CG-OD2 3.25Å; K445-D449 WeakPolarHBondContact O-CB 3.48Å; K445-D449 PolarHBondContact O-N 3.05Å; H447-D449 PolarHBondContact O-N 2.83Å; D449-S453 VanDerWaalsContact O-CB 3.24Å; D449-S453 WeakPolarHBondContact O-CB 3.22Å; D449-S453 PolarHBondContact O-N 3.28Å
450	T	92.8	Very high	91.5	Very high	50 Å²	50	45 Å²	45	31%	0.307	24%	0.239	S	C	.	.	H	α-helix	trans	-66.7	-46.2	174.1	-59.4	0	0	0	0	111.6	Q446 H447 Y448 S453 I454 H498	Q446-T450 WeakPolarHBondContact O-CB 3.45Å; Q446-T450 PolarHBondContact O-N 3.32Å; Q446-T450 VanDerWaalsContact O-N 3.14Å; Q446-T450 PolarHBondContact O-OG1 2.82Å; H447-T450 WeakPolarHBondContact O-CA 2.96Å; H447-T450 WeakPolarHBondContact O-CB 3.49Å; H447-T450 PolarHBondContact O-N 3.02Å; H447-T450 VanDerWaalsContact O-N 3.13Å; Y448-T450 PolarHBondContact O-N 2.94Å; T450-S453 PolarHBondContact O-N 3.44Å; T450-I454 HydrophobicContact CG2-CD1 4.09Å; T450-I454 WeakPolarHBondContact O-CG1 3.34Å; T450-I454 PolarHBondContact O-N 3.12Å; T450-H498 HydrophobicContact CG2-CB 4.17Å
451	L	95.1	Very high	91.5	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-59.4	-48.4	174.7	-62.2	170.7	0	0	0	111.1	H447 Y448 S453 I454 M455 L483 T484 L495 R496 F520	H447-L451 WeakPolarHBondContact O-CG 3.47Å; H447-L451 PolarHBondContact O-N 3Å; Y448-L451 PolarHBondContact O-N 3.28Å; L451-S453 VanDerWaalsContact C-N 3.3Å; L451-S453 PolarHBondContact O-N 2.93Å; L451-I454 PolarHBondContact O-N 3.29Å; L451-I454 VanDerWaalsContact O-N 3.12Å; L451-M455 WeakPolarHBondContact O-CG 3.31Å; L451-M455 PolarHBondContact O-N 3.07Å; L451-L483 HydrophobicContact CB-CB 4.21Å; L451-L483 HydrophobicContact CD2-CB 4.15Å; L451-T484 HydrophobicContact CB-CG2 4.3Å; L451-T484 HydrophobicContact CD1-CG2 4.41Å; L451-L495 HydrophobicContact CD1-CD1 3.64Å; L451-L495 HydrophobicContact CD1-CD2 4.4Å; L451-L495 HydrophobicContact CD1-CG 3.92Å; L451-R496 HydrophobicContact CD1-CB 4.36Å; L451-R496 WeakPolarHBondContact CD1-O 3.48Å; L451-R496 HydrophobicContact CD2-CB 4.34Å; L451-R496 HydrophobicContact CD2-CG 4.24Å; L451-F520 HydrophobicContact CD2-CD1 4Å; L451-F520 HydrophobicContact CD2-CE1 3.88Å
452	C	93.8	Very high	91.3	Very high	29 Å²	29	45.8 Å²	45.8	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-39.4	177.9	-68.9	0	0	0	0	112.2	Y448 M455 Q456	Y448-C452 WeakPolarHBondContact CE1-SG 3.41Å; Y448-C452 PolarHBondContact O-N 3.36Å; Y448-C452 PolarHBondContact O-SG 3.39Å; C452-M455 PolarHBondContact O-N 2.85Å; C452-Q456 VanDerWaalsContact O-CG 3.25Å; C452-Q456 WeakPolarHBondContact O-CG 3.48Å; C452-Q456 PolarHBondContact O-N 3.24Å
453	S	92.1	Very high	91.1	Very high	45 Å²	45	46.8 Å²	46.8	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-37.8	175.4	-170.7	0	0	0	0	112.5	D449 T450 L451 C457	D449-S453 VanDerWaalsContact O-CB 3.24Å; D449-S453 WeakPolarHBondContact O-CB 3.22Å; D449-S453 PolarHBondContact O-N 3.28Å; T450-S453 PolarHBondContact O-N 3.44Å; L451-S453 VanDerWaalsContact C-N 3.3Å; L451-S453 PolarHBondContact O-N 2.93Å; S453-C457 PolarHBondContact O-N 3.34Å; S453-C457 PolarHBondContact O-SG 3.08Å
454	I	93.3	Very high	90.8	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.072	26%	0.258	C	S	.	.	H	α-helix	trans	-70.4	-43.4	174.6	-62.8	162.4	0	0	0	110.8	T450 L451 Q456 C457 I458 L483 H498 F518 F520	T450-I454 HydrophobicContact CG2-CD1 4.09Å; T450-I454 WeakPolarHBondContact O-CG1 3.34Å; T450-I454 PolarHBondContact O-N 3.12Å; L451-I454 PolarHBondContact O-N 3.29Å; L451-I454 VanDerWaalsContact O-N 3.12Å; I454-Q456 VanDerWaalsContact C-N 3.28Å; I454-Q456 PolarHBondContact O-N 2.85Å; I454-C457 WeakPolarHBondContact O-CA 3.43Å; I454-C457 WeakPolarHBondContact O-CB 3.49Å; I454-C457 PolarHBondContact O-N 3.42Å; I454-I458 PolarHBondContact O-N 3.32Å; I454-L483 HydrophobicContact CB-CD1 3.84Å; I454-L483 HydrophobicContact CG2-CD1 3.56Å; I454-H498 HydrophobicContact CD1-CB 4.01Å; I454-H498 WeakPolarHBondContact CD1-CD2 3.48Å; I454-F518 HydrophobicContact CB-CE1 4.49Å; I454-F518 HydrophobicContact CD1-CD1 4.32Å; I454-F518 HydrophobicContact CG1-CD1 4.44Å; I454-F518 HydrophobicContact CG1-CE1 4.17Å; I454-F518 HydrophobicContact CG2-CD1 3.82Å; I454-F518 HydrophobicContact CG2-CE1 3.56Å; I454-F518 HydrophobicContact CG2-CZ 4.16Å; I454-F520 HydrophobicContact CD1-CE1 4.01Å; I454-F520 HydrophobicContact CD1-CZ 4.29Å; I454-F520 HydrophobicContact CG2-CZ 4.37Å
455	M	93.2	Very high	90.4	Very high	58 Å²	58	55.7 Å²	55.7	29%	0.286	29%	0.292	S	S	.	.	H	α-helix	trans	-56.3	-41.6	174.2	-72.1	173.1	68.2	0	0	111.8	L451 C452 C457 I458 D482 L483 T484	L451-M455 WeakPolarHBondContact O-CG 3.31Å; L451-M455 PolarHBondContact O-N 3.07Å; C452-M455 PolarHBondContact O-N 2.85Å; M455-C457 PolarHBondContact O-N 2.59Å; M455-C457 VanDerWaalsContact O-N 3.15Å; M455-I458 PolarHBondContact O-N 2.93Å; M455-D482 HydrophobicContact CE-CB 4.37Å; M455-D482 WeakPolarHBondContact CE-OD1 3.32Å; M455-L483 HydrophobicContact CG-CB 3.74Å; M455-L483 HydrophobicContact CG-CD1 3.77Å; M455-L483 HydrophobicContact CG-CG 3.55Å; M455-L483 HydrophobicContact SD-CB 3.84Å; M455-L483 HydrophobicContact SD-CG 4.28Å; M455-L483 PolarHBondContact SD-N 3.29Å; M455-L483 VanDerWaalsContact SD-N 3.42Å; M455-T484 HydrophobicContact SD-CG2 4.04Å
456	Q	90.8	Very high	90	Very high	123 Å²	123	56.8 Å²	56.8	58%	0.575	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.4	174.9	-72.1	167	21.6	0	0	114.2	C452 I454	C452-Q456 VanDerWaalsContact O-CG 3.25Å; C452-Q456 WeakPolarHBondContact O-CG 3.48Å; C452-Q456 PolarHBondContact O-N 3.24Å; I454-Q456 VanDerWaalsContact C-N 3.28Å; I454-Q456 PolarHBondContact O-N 2.85Å
457	C	91	Very high	89.6	Confident	16 Å²	16	57.4 Å²	57.4	11%	0.108	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-17.8	175	-61.9	0	0	0	0	112.9	S453 I454 M455 R538 V539	S453-C457 PolarHBondContact O-N 3.34Å; S453-C457 PolarHBondContact O-SG 3.08Å; I454-C457 WeakPolarHBondContact O-CA 3.43Å; I454-C457 WeakPolarHBondContact O-CB 3.49Å; I454-C457 PolarHBondContact O-N 3.42Å; M455-C457 PolarHBondContact O-N 2.59Å; M455-C457 VanDerWaalsContact O-N 3.15Å; C457-R538 WeakPolarHBondContact O-CA 3.37Å; C457-V539 PolarHBondContact O-N 3.15Å
458	I	91.8	Very high	89.6	Confident	31 Å²	31	58.8 Å²	58.8	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	130.3	173.9	-59.1	173	0	0	0	108.5	I454 M455 V481 L483 V539 V541	I454-I458 PolarHBondContact O-N 3.32Å; M455-I458 PolarHBondContact O-N 2.93Å; I458-V481 HydrophobicContact CD1-CG1 4.35Å; I458-L483 HydrophobicContact CD1-CD1 4.48Å; I458-V539 CarbonylContact C-O 3.5Å; I458-V539 WeakPolarHBondContact CA-O 3.5Å; I458-V539 HydrophobicContact CG1-CG2 4.2Å; I458-V541 HydrophobicContact CG2-CG2 4.22Å
459	D	88.1	Confident	89.3	Confident	70 Å²	70	62 Å²	62	37%	0.374	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-47.9	-178.7	-165.7	11.6	0	0	0	111.5	I530 R538 V539	D459-I530 HydrophobicContact CB-CD1 3.51Å; D459-I530 VanDerWaalsContact OD2-CD1 3.22Å; D459-I530 WeakPolarHBondContact OD2-CD1 3.3Å; D459-R538 IonicContact OD1-CZ 2.58Å; D459-R538 IonicContact OD1-NH1 3.23Å; D459-R538 PolarHBondContact OD1-NH1 2.95Å; D459-R538 IonicContact OD1-NH2 3Å; D459-R538 PolarHBondContact OD1-NH2 3.46Å; D459-R538 IonicContact OD2-CZ 2.58Å; D459-R538 IonicContact OD2-NH1 3.66Å; D459-R538 PolarHBondContact OD2-NH1 3.4Å; D459-R538 IonicContact OD2-NH2 3.27Å; D459-V539 PolarHBondContact N-O 3.43Å
460	S	86.9	Confident	89.1	Confident	34 Å²	34	65.4 Å²	65.4	24%	0.238	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	160.5	-175.5	57.1	0	0	0	0	111.3	E462 K540 V541	S460-E462 WeakPolarHBondContact CB-OE1 3.19Å; S460-E462 PolarHBondContact OG-OE1 2.9Å; S460-K540 VanDerWaalsContact O-CA 3.28Å; S460-K540 WeakPolarHBondContact O-CA 3.3Å; S460-K540 WeakPolarHBondContact OG-CB 3.22Å; S460-V541 PolarHBondContact O-N 2.95Å
461	Y	90.1	Very high	88.8	Confident	60 Å²	60	66.6 Å²	66.6	24%	0.235	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	106.5	170.2	178.1	-90.1	0	0	0	107.7	V463 A479 V481 V541 P545	Y461-V463 HydrophobicContact CD1-CB 4.26Å; Y461-V463 HydrophobicContact CD1-CG2 4.1Å; Y461-V463 HydrophobicContact CD2-CG2 3.86Å; Y461-V463 HydrophobicContact CE1-CB 3.65Å; Y461-V463 HydrophobicContact CE1-CG2 3.74Å; Y461-V463 HydrophobicContact CE2-CB 4.23Å; Y461-V463 HydrophobicContact CE2-CG2 3.45Å; Y461-V463 VanDerWaalsContact CE2-CG2 3.45Å; Y461-V463 HydrophobicContact CG-CG2 4.16Å; Y461-A479 WeakPolarHBondContact CB-O 3.42Å; Y461-A479 HydrophobicContact CD1-CB 3.96Å; Y461-A479 HydrophobicContact CG-CB 4.43Å; Y461-V481 HydrophobicContact CD2-CG2 3.52Å; Y461-V481 HydrophobicContact CE2-CG2 4.09Å; Y461-V481 HydrophobicContact CG-CG2 4.31Å; Y461-V541 HydrophobicContact CD2-CB 3.65Å; Y461-V541 HydrophobicContact CD2-CG1 3.63Å; Y461-V541 HydrophobicContact CD2-CG2 4.23Å; Y461-V541 HydrophobicContact CE2-CB 4.29Å; Y461-V541 HydrophobicContact CE2-CG1 3.75Å; Y461-V541 HydrophobicContact CG-CB 4.44Å; Y461-P545 HydrophobicContact CE2-CG 4.46Å
462	E	87.6	Confident	88.3	Confident	98 Å²	98	70.2 Å²	70.2	46%	0.458	39%	0.385	S	S	.	.			trans	-122.5	63.6	-171.6	-70.4	175.6	-130.1	0	0	108.8	S460 K540 V541	S460-E462 WeakPolarHBondContact CB-OE1 3.19Å; S460-E462 PolarHBondContact OG-OE1 2.9Å; E462-K540 HydrophobicContact CB-CD 4.31Å; E462-K540 HydrophobicContact CG-CD 4.28Å; E462-K540 WeakPolarHBondContact OE1-CD 3.39Å; E462-K540 IonicContact OE1-NZ 2.99Å; E462-K540 WeakPolarHBondContact OE2-CD 3.5Å; E462-K540 WeakPolarHBondContact OE2-CE 3.48Å; E462-K540 IonicContact OE2-NZ 2.76Å; E462-K540 PolarHBondContact OE2-NZ 3.36Å; E462-V541 CarbonylContact C-O 3.56Å; E462-V541 PolarHBondContact N-O 3.34Å
463	V	86.5	Confident	87.9	Confident	32 Å²	32	75.2 Å²	75.2	19%	0.194	40%	0.404	C	S	.	.			trans	-107.5	-27.6	-177.1	-178.2	0	0	0	0	112.2	Y461 V541 P544	Y461-V463 HydrophobicContact CD1-CB 4.26Å; Y461-V463 HydrophobicContact CD1-CG2 4.1Å; Y461-V463 HydrophobicContact CD2-CG2 3.86Å; Y461-V463 HydrophobicContact CE1-CB 3.65Å; Y461-V463 HydrophobicContact CE1-CG2 3.74Å; Y461-V463 HydrophobicContact CE2-CB 4.23Å; Y461-V463 HydrophobicContact CE2-CG2 3.45Å; Y461-V463 VanDerWaalsContact CE2-CG2 3.45Å; Y461-V463 HydrophobicContact CG-CG2 4.16Å; V463-V541 HydrophobicContact CG2-CG1 3.94Å; V463-P544 HydrophobicContact CG1-CB 4.08Å; V463-P544 HydrophobicContact CG1-CG 4.36Å
464	V	85	Confident	87.6	Confident	80 Å²	80	77.5 Å²	77.5	49%	0.485	41%	0.412	S	S	.	.	S	Bend	trans	-110.9	106.4	-174.1	-179.3	0	0	0	0	109	S466 V475	V464-S466 PolarHBondContact O-N 3.47Å; V464-V475 HydrophobicContact CB-CG1 4.23Å; V464-V475 HydrophobicContact CG1-CG1 4.46Å
465	D	82.1	Confident	87.3	Confident	166 Å²	166	78.8 Å²	78.8	89%	0.888	42%	0.42	S	S	*	.			trans	-64	120.8	170.8	-65.4	-49.8	0	0	0	109.3
466	S	82.8	Confident	86.9	Confident	37 Å²	37	81.9 Å²	81.9	26%	0.259	43%	0.432	S	S	.	.			trans	-99.7	130.6	-176.8	-64.1	0	0	0	0	110.9	V464 N468 E472	V464-S466 PolarHBondContact O-N 3.47Å; S466-N468 VanDerWaalsContact C-N 3.29Å; S466-N468 PolarHBondContact O-N 2.98Å; S466-E472 WeakPolarHBondContact OG-CA 3.28Å
467	A	82.8	Confident	86.5	Confident	99 Å²	99	82 Å²	82	82%	0.818	43%	0.432	S	S	*	.	S	Bend	trans	-71.7	-19	-175.8	0	0	0	0	0	114.4
468	N	89.5	Confident	86.2	Confident	84 Å²	84	89 Å²	89	45%	0.449	46%	0.461	S	S	.	.	S	Bend	trans	-156	165.1	174.8	66.1	15.9	0	0	0	111.9	S466 E470 L471 E472	S466-N468 VanDerWaalsContact C-N 3.29Å; S466-N468 PolarHBondContact O-N 2.98Å; N468-E470 PolarHBondContact O-N 3.23Å; N468-E470 VanDerWaalsContact O-N 3.15Å; N468-E470 PolarHBondContact OD1-N 3.11Å; N468-L471 PolarHBondContact O-N 2.84Å; N468-L471 VanDerWaalsContact OD1-CB 3.28Å; N468-L471 WeakPolarHBondContact OD1-CB 3.45Å; N468-L471 PolarHBondContact OD1-N 3.34Å; N468-E472 PolarHBondContact O-N 2.84Å
469	D	87	Confident	85.9	Confident	109 Å²	109	88.5 Å²	88.5	58%	0.583	46%	0.462	S	S	*	.	H	α-helix	trans	-59.5	-21.9	-179.9	-56.4	27	0	0	0	114.6	K473	D469-K473 WeakPolarHBondContact O-CD 3.48Å; D469-K473 VanDerWaalsContact O-CE 3.31Å; D469-K473 WeakPolarHBondContact O-CE 3.43Å; D469-K473 WeakPolarHBondContact O-CG 3.5Å; D469-K473 PolarHBondContact O-N 3.41Å; D469-K473 PolarHBondContact O-NZ 3.23Å
470	E	88.8	Confident	85.7	Confident	137 Å²	137	92 Å²	92	64%	0.64	48%	0.48	S	S	*	.	H	α-helix	trans	-77.8	-51.7	179.5	-178.2	174.9	-164.9	0	0	110.1	N468 E472 K473 L474	N468-E470 PolarHBondContact O-N 3.23Å; N468-E470 VanDerWaalsContact O-N 3.15Å; N468-E470 PolarHBondContact OD1-N 3.11Å; E470-E472 VanDerWaalsContact C-N 3.26Å; E470-E472 PolarHBondContact O-N 2.87Å; E470-K473 PolarHBondContact O-N 2.91Å; E470-L474 HydrophobicContact CG-CD1 4.4Å; E470-L474 WeakPolarHBondContact O-CG 3.43Å; E470-L474 PolarHBondContact O-N 3.26Å
471	L	85.7	Confident	85.7	Confident	75 Å²	75	91.9 Å²	91.9	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-39.2	172.5	-177.6	61.7	0	0	0	111	N468 K473 L474 V475	N468-L471 PolarHBondContact O-N 2.84Å; N468-L471 VanDerWaalsContact OD1-CB 3.28Å; N468-L471 WeakPolarHBondContact OD1-CB 3.45Å; N468-L471 PolarHBondContact OD1-N 3.34Å; L471-K473 VanDerWaalsContact C-N 3.33Å; L471-K473 PolarHBondContact O-N 3.43Å; L471-L474 PolarHBondContact O-N 3.45Å; L471-V475 HydrophobicContact CD1-CG2 3.99Å; L471-V475 HydrophobicContact CG-CG2 4.17Å; L471-V475 WeakPolarHBondContact O-CB 3.38Å; L471-V475 VanDerWaalsContact O-CG2 3.26Å; L471-V475 WeakPolarHBondContact O-CG2 3.44Å; L471-V475 PolarHBondContact O-N 2.87Å
472	E	85.6	Confident	85.7	Confident	77 Å²	77	92 Å²	92	36%	0.36	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-39.5	177.5	-157.8	-158.3	165.5	0	0	112.1	S466 N468 E470 K476	S466-E472 WeakPolarHBondContact OG-CA 3.28Å; N468-E472 PolarHBondContact O-N 2.84Å; E470-E472 VanDerWaalsContact C-N 3.26Å; E470-E472 PolarHBondContact O-N 2.87Å; E472-K476 VanDerWaalsContact CD-NZ 3.32Å; E472-K476 HydrophobicContact CG-CD 4.3Å; E472-K476 VanDerWaalsContact O-CB 3.24Å; E472-K476 WeakPolarHBondContact O-CB 3.34Å; E472-K476 WeakPolarHBondContact O-CD 3.36Å; E472-K476 WeakPolarHBondContact O-CG 3.31Å; E472-K476 PolarHBondContact O-N 3.05Å; E472-K476 WeakPolarHBondContact OE1-CE 3.39Å; E472-K476 IonicContact OE1-NZ 2.6Å; E472-K476 PolarHBondContact OE1-NZ 3.28Å; E472-K476 IonicContact OE2-NZ 3.78Å
473	K	85.7	Confident	86	Confident	135 Å²	135	87.4 Å²	87.4	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-67.9	-42.6	176.2	-73.8	160.2	-162.7	148.3	0	111.9	D469 E470 L471 K476 E477	D469-K473 WeakPolarHBondContact O-CD 3.48Å; D469-K473 VanDerWaalsContact O-CE 3.31Å; D469-K473 WeakPolarHBondContact O-CE 3.43Å; D469-K473 WeakPolarHBondContact O-CG 3.5Å; D469-K473 PolarHBondContact O-N 3.41Å; D469-K473 PolarHBondContact O-NZ 3.23Å; E470-K473 PolarHBondContact O-N 2.91Å; L471-K473 VanDerWaalsContact C-N 3.33Å; L471-K473 PolarHBondContact O-N 3.43Å; K473-K476 PolarHBondContact O-N 3.29Å; K473-E477 PolarHBondContact O-N 2.93Å
474	L	86	Confident	86.3	Confident	93 Å²	93	87 Å²	87	49%	0.487	46%	0.459	S	S	.	.	H	α-helix	trans	-64.1	-46.7	176.1	-67.6	169.4	0	0	0	111.3	E470 L471 K476 E477 F478	E470-L474 HydrophobicContact CG-CD1 4.4Å; E470-L474 WeakPolarHBondContact O-CG 3.43Å; E470-L474 PolarHBondContact O-N 3.26Å; L471-L474 PolarHBondContact O-N 3.45Å; L474-K476 VanDerWaalsContact C-N 3.32Å; L474-K476 PolarHBondContact O-N 3.02Å; L474-E477 WeakPolarHBondContact O-CB 3.44Å; L474-E477 PolarHBondContact O-N 3.5Å; L474-F478 VanDerWaalsContact O-CD2 3.25Å; L474-F478 WeakPolarHBondContact O-CD2 3.27Å
475	V	86.1	Confident	86.5	Confident	40 Å²	40	85.1 Å²	85.1	24%	0.242	45%	0.449	C	S	.	.	H	α-helix	trans	-61.5	-40.6	176.1	169.8	0	0	0	0	111	V464 L471 E477 F478 A479	V464-V475 HydrophobicContact CB-CG1 4.23Å; V464-V475 HydrophobicContact CG1-CG1 4.46Å; L471-V475 HydrophobicContact CD1-CG2 3.99Å; L471-V475 HydrophobicContact CG-CG2 4.17Å; L471-V475 WeakPolarHBondContact O-CB 3.38Å; L471-V475 VanDerWaalsContact O-CG2 3.26Å; L471-V475 WeakPolarHBondContact O-CG2 3.44Å; L471-V475 PolarHBondContact O-N 2.87Å; V475-E477 PolarHBondContact O-N 2.67Å; V475-F478 PolarHBondContact O-N 3.23Å; V475-F478 VanDerWaalsContact O-N 3.08Å; V475-A479 VanDerWaalsContact O-CB 3.31Å; V475-A479 WeakPolarHBondContact O-CB 3.46Å; V475-A479 PolarHBondContact O-N 3.13Å
476	K	84.1	Confident	86.9	Confident	124 Å²	124	80.6 Å²	80.6	54%	0.539	43%	0.429	S	S	.	.	H	α-helix	trans	-60	-25.5	177.2	-85.3	167.5	167.1	168	0	114.2	E472 K473 L474	E472-K476 VanDerWaalsContact CD-NZ 3.32Å; E472-K476 HydrophobicContact CG-CD 4.3Å; E472-K476 VanDerWaalsContact O-CB 3.24Å; E472-K476 WeakPolarHBondContact O-CB 3.34Å; E472-K476 WeakPolarHBondContact O-CD 3.36Å; E472-K476 WeakPolarHBondContact O-CG 3.31Å; E472-K476 PolarHBondContact O-N 3.05Å; E472-K476 WeakPolarHBondContact OE1-CE 3.39Å; E472-K476 IonicContact OE1-NZ 2.6Å; E472-K476 PolarHBondContact OE1-NZ 3.28Å; E472-K476 IonicContact OE2-NZ 3.78Å; K473-K476 PolarHBondContact O-N 3.29Å; L474-K476 VanDerWaalsContact C-N 3.32Å; L474-K476 PolarHBondContact O-N 3.02Å
477	E	84.3	Confident	87.3	Confident	125 Å²	125	79 Å²	79	58%	0.584	42%	0.417	S	S	*	.	H	α-helix	trans	-69	-37.7	174.4	-168.4	170.8	170.5	0	0	112	K473 L474 V475	K473-E477 PolarHBondContact O-N 2.93Å; L474-E477 WeakPolarHBondContact O-CB 3.44Å; L474-E477 PolarHBondContact O-N 3.5Å; V475-E477 PolarHBondContact O-N 2.67Å
478	F	84.7	Confident	87.6	Confident	164 Å²	164	77.8 Å²	77.8	72%	0.719	40%	0.4	S	S	*	.	H	α-helix	trans	-91.7	-7.7	178.6	-57	-76.7	0	0	0	113.9	L474 V475 L480	L474-F478 VanDerWaalsContact O-CD2 3.25Å; L474-F478 WeakPolarHBondContact O-CD2 3.27Å; V475-F478 PolarHBondContact O-N 3.23Å; V475-F478 VanDerWaalsContact O-N 3.08Å; F478-L480 PolarHBondContact O-N 2.9Å
479	A	84.3	Confident	87.5	Confident	20 Å²	20	76.9 Å²	76.9	17%	0.165	41%	0.411	C	S	.	.			trans	-77.1	34.1	-174.7	0	0	0	0	0	114.7	Y461 V475	Y461-A479 WeakPolarHBondContact CB-O 3.42Å; Y461-A479 HydrophobicContact CD1-CB 3.96Å; Y461-A479 HydrophobicContact CG-CB 4.43Å; V475-A479 VanDerWaalsContact O-CB 3.31Å; V475-A479 WeakPolarHBondContact O-CB 3.46Å; V475-A479 PolarHBondContact O-N 3.13Å
480	L	83.5	Confident	87.5	Confident	143 Å²	143	72.7 Å²	72.7	75%	0.749	39%	0.39	S	S	*	.			trans	-102.5	110.1	-174.5	-66.3	175	0	0	0	111.7	F478 D482	F478-L480 PolarHBondContact O-N 2.9Å; L480-D482 PolarHBondContact O-N 3.33Å
481	V	87.4	Confident	87.2	Confident	31 Å²	31	70.2 Å²	70.2	19%	0.188	38%	0.375	C	S	.	.			trans	-87.5	89.8	176.6	-176.9	0	0	0	0	110.3	I458 Y461 L483 L525 V541	I458-V481 HydrophobicContact CD1-CG1 4.35Å; Y461-V481 HydrophobicContact CD2-CG2 3.52Å; Y461-V481 HydrophobicContact CE2-CG2 4.09Å; Y461-V481 HydrophobicContact CG-CG2 4.31Å; V481-L483 HydrophobicContact CG1-CD2 3.78Å; V481-L483 PolarHBondContact O-N 3.23Å; V481-L525 HydrophobicContact CG1-CD1 4.26Å; V481-V541 HydrophobicContact CG2-CG2 4.35Å
482	D	90.7	Very high	86.9	Confident	64 Å²	64	74.8 Å²	74.8	34%	0.342	39%	0.394	S	S	.	.			trans	-83	108.8	171.2	179.5	17.3	0	0	0	111.6	M455 L480 T484 S485	M455-D482 HydrophobicContact CE-CB 4.37Å; M455-D482 WeakPolarHBondContact CE-OD1 3.32Å; L480-D482 PolarHBondContact O-N 3.33Å; D482-T484 VanDerWaalsContact C-N 3.3Å; D482-T484 WeakPolarHBondContact OD1-CA 3.26Å; D482-T484 WeakPolarHBondContact OD1-CB 3.37Å; D482-T484 PolarHBondContact OD1-N 3.41Å; D482-T484 PolarHBondContact OD1-OG1 3.07Å; D482-T484 PolarHBondContact OD2-OG1 2.86Å; D482-S485 WeakPolarHBondContact O-CB 3.48Å; D482-S485 PolarHBondContact O-OG 3.17Å; D482-S485 PolarHBondContact OD1-N 3.04Å; D482-S485 PolarHBondContact OD2-N 3.01Å
483	L	93.7	Very high	86.5	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-12.7	176.4	-55.4	-175.7	0	0	0	113.4	L451 I454 M455 I458 V481 R496 F520 M523 L525	L451-L483 HydrophobicContact CB-CB 4.21Å; L451-L483 HydrophobicContact CD2-CB 4.15Å; I454-L483 HydrophobicContact CB-CD1 3.84Å; I454-L483 HydrophobicContact CG2-CD1 3.56Å; M455-L483 HydrophobicContact CG-CB 3.74Å; M455-L483 HydrophobicContact CG-CD1 3.77Å; M455-L483 HydrophobicContact CG-CG 3.55Å; M455-L483 HydrophobicContact SD-CB 3.84Å; M455-L483 HydrophobicContact SD-CG 4.28Å; M455-L483 PolarHBondContact SD-N 3.29Å; M455-L483 VanDerWaalsContact SD-N 3.42Å; I458-L483 HydrophobicContact CD1-CD1 4.48Å; V481-L483 HydrophobicContact CG1-CD2 3.78Å; V481-L483 PolarHBondContact O-N 3.23Å; L483-R496 VanDerWaalsContact C-NH1 3.34Å; L483-R496 PolarHBondContact O-NH1 3.24Å; L483-F520 HydrophobicContact CD1-CE1 4.12Å; L483-F520 HydrophobicContact CD1-CZ 3.81Å; L483-F520 HydrophobicContact CD2-CE2 4.46Å; L483-F520 HydrophobicContact CD2-CZ 4.2Å; L483-M523 HydrophobicContact CD2-CE 3.45Å; L483-M523 VanDerWaalsContact CD2-CE 3.45Å; L483-L525 HydrophobicContact CD2-CD1 3.92Å
484	T	92.2	Very high	86.5	Confident	25 Å²	25	69.7 Å²	69.7	15%	0.153	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.5	176.8	66.3	0	0	0	0	113.7	Y448 L451 M455 D482	Y448-T484 HydrophobicContact CD2-CG2 4.18Å; Y448-T484 HydrophobicContact CE2-CG2 3.74Å; L451-T484 HydrophobicContact CB-CG2 4.3Å; L451-T484 HydrophobicContact CD1-CG2 4.41Å; M455-T484 HydrophobicContact SD-CG2 4.04Å; D482-T484 VanDerWaalsContact C-N 3.3Å; D482-T484 WeakPolarHBondContact OD1-CA 3.26Å; D482-T484 WeakPolarHBondContact OD1-CB 3.37Å; D482-T484 PolarHBondContact OD1-N 3.41Å; D482-T484 PolarHBondContact OD1-OG1 3.07Å; D482-T484 PolarHBondContact OD2-OG1 2.86Å
485	S	90.1	Very high	86.6	Confident	40 Å²	40	67 Å²	67	28%	0.28	37%	0.372	S	S	.	.	S	Bend	trans	-52.3	146.4	170.8	61.1	0	0	0	0	112.2	D482 R496	D482-S485 WeakPolarHBondContact O-CB 3.48Å; D482-S485 PolarHBondContact O-OG 3.17Å; D482-S485 PolarHBondContact OD1-N 3.04Å; D482-S485 PolarHBondContact OD2-N 3.01Å; S485-R496 PolarHBondContact O-NH1 3.22Å; S485-R496 PolarHBondContact O-NH2 3.23Å; S485-R496 PolarHBondContact OG-NH1 3.3Å; S485-R496 VanDerWaalsContact OG-NH1 3.14Å
486	P	89	Confident	86.9	Confident	71 Å²	71	65.5 Å²	65.5	46%	0.461	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-54.3	147.2	173.6	-25.5	34.9	0	0	0	112.3	R496	P486-R496 PolarHBondContact O-NH2 3.35Å
487	M	92.1	Very high	87.3	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.02	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-70.4	134.9	172.8	-63.3	-178	-72.1	0	0	109.5	C490 L494 R496 T521 D522 L604	M487-C490 HydrophobicContact CB-CB 3.92Å; M487-C490 HydrophobicContact CE-CB 4.5Å; M487-C490 PolarHBondContact O-N 3.48Å; M487-L494 HydrophobicContact CE-CB 4.02Å; M487-R496 HydrophobicContact CG-CB 4.02Å; M487-R496 HydrophobicContact SD-CB 4.21Å; M487-T521 PolarHBondContact SD-OG1 3.12Å; M487-D522 HydrophobicContact CB-CB 4.05Å; M487-D522 HydrophobicContact CG-CB 3.95Å; M487-D522 WeakPolarHBondContact CG-OD2 3.38Å; M487-D522 HydrophobicContact SD-CB 3.97Å; M487-L604 HydrophobicContact CE-CD1 4.05Å
488	P	89.3	Confident	87.9	Confident	72 Å²	72	58.1 Å²	58.1	47%	0.468	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	150.1	173.1	-24.1	34.5	0	0	0	111.4	C490 D522 Y601	P488-C490 PolarHBondContact O-N 3.21Å; P488-D522 WeakPolarHBondContact CD-OD2 3.27Å; P488-Y601 WeakPolarHBondContact O-CE2 3.4Å; P488-Y601 PolarHBondContact O-OH 2.91Å
489	G	86.6	Confident	88.4	Confident	66 Å²	66	51.5 Å²	51.5	68%	0.68	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	-17.9	-179.7	0	0	0	0	0	116.1
490	C	88.7	Confident	89	Confident	20 Å²	20	51.6 Å²	51.6	14%	0.135	30%	0.297	C	S	.	.	S	Bend	trans	-94.4	165.5	-178.1	-70.6	0	0	0	0	112.6	M487 P488 L494	M487-C490 HydrophobicContact CB-CB 3.92Å; M487-C490 HydrophobicContact CE-CB 4.5Å; M487-C490 PolarHBondContact O-N 3.48Å; P488-C490 PolarHBondContact O-N 3.21Å; C490-L494 HydrophobicContact CB-CD1 4.21Å
491	R	81.2	Confident	89.5	Confident	86 Å²	86	49.8 Å²	49.8	33%	0.325	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-73.6	144.5	-177.6	-49	177.4	98.7	-158.1	0.5	111.5	L494 Y607 D608 Y609	R491-L494 HydrophobicContact CB-CD1 3.9Å; R491-L494 HydrophobicContact CB-CG 4.29Å; R491-L494 HydrophobicContact CG-CD1 4.3Å; R491-L494 WeakPolarHBondContact O-CB 3.5Å; R491-L494 PolarHBondContact O-N 3.1Å; R491-Y607 WeakPolarHBondContact CD-O 3.22Å; R491-D608 IonicContact CZ-OD1 3.82Å; R491-D608 IonicContact NE-OD1 3.7Å; R491-D608 PolarHBondContact NE-OD1 3.09Å; R491-D608 VanDerWaalsContact NH2-C 3.29Å; R491-D608 IonicContact NH2-OD1 2.64Å; R491-D608 PolarHBondContact NH2-OD1 3.34Å; R491-Y609 VanDerWaalsContact CZ-N 3.31Å; R491-Y609 VanDerWaalsContact CZ-O 3.29Å; R491-Y609 PolarHBondContact NH1-O 3.15Å; R491-Y609 VanDerWaalsContact NH2-N 3.19Å; R491-Y609 PolarHBondContact NH2-O 3.42Å
492	Q	79.9	Confident	89.8	Confident	171 Å²	171	48.9 Å²	48.9	80%	0.799	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	141.3	175.3	-63.2	-174.3	7.6	0	0	111	L494	Q492-L494 VanDerWaalsContact C-N 3.33Å
493	G	77.4	Confident	90	Very high	45 Å²	45	51.2 Å²	51.2	46%	0.464	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-14.8	-175.1	0	0	0	0	0	115	L495	G493-L495 PolarHBondContact O-N 3.28Å
494	L	85.4	Confident	90.1	Very high	59 Å²	59	51.3 Å²	51.3	31%	0.309	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-72.2	126	169.7	-66.2	176.9	0	0	0	110.5	M487 C490 R491 Q492 L604	M487-L494 HydrophobicContact CE-CB 4.02Å; C490-L494 HydrophobicContact CB-CD1 4.21Å; R491-L494 HydrophobicContact CB-CD1 3.9Å; R491-L494 HydrophobicContact CB-CG 4.29Å; R491-L494 HydrophobicContact CG-CD1 4.3Å; R491-L494 WeakPolarHBondContact O-CB 3.5Å; R491-L494 PolarHBondContact O-N 3.1Å; Q492-L494 VanDerWaalsContact C-N 3.33Å; L494-L604 HydrophobicContact CD1-CB 4.34Å; L494-L604 HydrophobicContact CD1-CD2 4.17Å; L494-L604 HydrophobicContact CD2-CD2 4.27Å
495	L	88.2	Confident	90.3	Very high	37 Å²	37	54.6 Å²	54.6	19%	0.194	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-95.8	132.3	-175	-169.9	67.9	0	0	0	111.7	F444 H447 Y448 L451 G493	F444-L495 HydrophobicContact CD1-CD2 4.33Å; F444-L495 HydrophobicContact CD2-CB 4.14Å; F444-L495 HydrophobicContact CD2-CD2 4.1Å; F444-L495 HydrophobicContact CE1-CD2 4.2Å; F444-L495 HydrophobicContact CE2-CB 3.69Å; F444-L495 HydrophobicContact CE2-CD2 3.99Å; F444-L495 HydrophobicContact CE2-CG 4.34Å; F444-L495 HydrophobicContact CG-CD2 4.27Å; F444-L495 HydrophobicContact CZ-CB 4.25Å; F444-L495 HydrophobicContact CZ-CD1 4.45Å; F444-L495 HydrophobicContact CZ-CD2 4.03Å; F444-L495 HydrophobicContact CZ-CG 4.49Å; F444-L495 WeakPolarHBondContact O-CD2 3.09Å; H447-L495 HydrophobicContact CB-CD2 3.89Å; Y448-L495 HydrophobicContact CD2-CD1 4.23Å; L451-L495 HydrophobicContact CD1-CD1 3.64Å; L451-L495 HydrophobicContact CD1-CD2 4.4Å; L451-L495 HydrophobicContact CD1-CG 3.92Å; G493-L495 PolarHBondContact O-N 3.28Å
496	R	92.8	Very high	90.6	Very high	8 Å²	8	52.9 Å²	52.9	3%	0.03	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-58	131.7	172.7	-178.9	175.9	-68.8	105.5	3.4	111.2	L451 L483 S485 P486 M487 F520 D522	L451-R496 HydrophobicContact CD1-CB 4.36Å; L451-R496 WeakPolarHBondContact CD1-O 3.48Å; L451-R496 HydrophobicContact CD2-CB 4.34Å; L451-R496 HydrophobicContact CD2-CG 4.24Å; L483-R496 VanDerWaalsContact C-NH1 3.34Å; L483-R496 PolarHBondContact O-NH1 3.24Å; S485-R496 PolarHBondContact O-NH1 3.22Å; S485-R496 PolarHBondContact O-NH2 3.23Å; S485-R496 PolarHBondContact OG-NH1 3.3Å; S485-R496 VanDerWaalsContact OG-NH1 3.14Å; P486-R496 PolarHBondContact O-NH2 3.35Å; M487-R496 HydrophobicContact CG-CB 4.02Å; M487-R496 HydrophobicContact SD-CB 4.21Å; R496-F520 HydrophobicContact CG-CB 3.76Å; R496-F520 HydrophobicContact CG-CD1 4.01Å; R496-F520 HydrophobicContact CG-CG 4.13Å; R496-D522 WeakPolarHBondContact CD-OD1 3.45Å; R496-D522 WeakPolarHBondContact CG-OD1 3.28Å; R496-D522 IonicContact CZ-OD1 3.91Å; R496-D522 IonicContact CZ-OD2 2.63Å; R496-D522 VanDerWaalsContact CZ-OD2 3.31Å; R496-D522 VanDerWaalsContact NE-CG 3.32Å; R496-D522 IonicContact NE-OD1 3.77Å; R496-D522 PolarHBondContact NE-OD1 2.85Å; R496-D522 IonicContact NE-OD2 3.67Å; R496-D522 PolarHBondContact NE-OD2 3.46Å; R496-D522 VanDerWaalsContact NE-OD2 3.11Å; R496-D522 IonicContact NH2-OD1 2.66Å; R496-D522 IonicContact NH2-OD2 2.68Å; R496-D522 PolarHBondContact NH2-OD2 2.91Å
497	R	92.8	Very high	90.8	Very high	47 Å²	47	54.8 Å²	54.8	18%	0.177	28%	0.284	C	S	.	.			trans	-107.2	129.1	178.8	-166.9	173.8	74.6	87.1	-13	110.5	L499 F520 T521 E600	R497-L499 HydrophobicContact CG-CD2 4.4Å; R497-L499 VanDerWaalsContact NH2-CD2 3.25Å; R497-F520 CarbonylContact O-C 3.57Å; R497-F520 WeakPolarHBondContact O-CA 3.28Å; R497-F520 WeakPolarHBondContact O-CB 3.46Å; R497-T521 HydrophobicContact CB-CG2 3.77Å; R497-T521 PolarHBondContact N-OG1 3.3Å; R497-T521 VanDerWaalsContact N-OG1 3.11Å; R497-T521 PolarHBondContact O-N 3.05Å; R497-E600 IonicContact CZ-OE1 2.69Å; R497-E600 IonicContact CZ-OE2 2.88Å; R497-E600 IonicContact NE-OE1 3.1Å; R497-E600 IonicContact NE-OE2 2.69Å; R497-E600 PolarHBondContact NE-OE2 3.14Å; R497-E600 IonicContact NH2-OE1 2.6Å; R497-E600 PolarHBondContact NH2-OE1 2.93Å; R497-E600 IonicContact NH2-OE2 2.74Å; R497-E600 PolarHBondContact NH2-OE2 2.97Å
498	H	95.1	Very high	90.6	Very high	48 Å²	48	58 Å²	58	22%	0.222	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	125.6	169.8	169.2	-83.1	0	0	0	109.9	T450 I454 R501 F520	T450-H498 HydrophobicContact CG2-CB 4.17Å; I454-H498 HydrophobicContact CD1-CB 4.01Å; I454-H498 WeakPolarHBondContact CD1-CD2 3.48Å; H498-R501 WeakPolarHBondContact NE2-CB 3.48Å; H498-F520 HydrophobicContact CB-CD1 3.91Å; H498-F520 HydrophobicContact CB-CE1 3.93Å
499	L	95.8	Very high	90.3	Very high	25 Å²	25	57.7 Å²	57.7	13%	0.131	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-62.8	-177.3	-53	-175	0	0	0	110.9	R497 L519 T521 A597	R497-L499 HydrophobicContact CG-CD2 4.4Å; R497-L499 VanDerWaalsContact NH2-CD2 3.25Å; L499-L519 WeakPolarHBondContact CB-O 3.47Å; L499-L519 HydrophobicContact CD1-CD2 4.48Å; L499-L519 HydrophobicContact CD1-CG 4.25Å; L499-L519 PolarHBondContact N-O 3.17Å; L499-T521 HydrophobicContact CD2-CG2 4.27Å; L499-A597 HydrophobicContact CD1-CB 3.5Å
500	I	96.6	Very high	89.9	Confident	21 Å²	21	64.7 Å²	64.7	11%	0.108	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144.3	-175.3	-176.1	166.3	0	0	0	111.6	L519 R589 W590 N593	I500-L519 HydrophobicContact CG2-CB 3.81Å; I500-L519 HydrophobicContact CG2-CD2 4.05Å; I500-L519 HydrophobicContact CG2-CG 4.46Å; I500-L519 PolarHBondContact N-O 3.4Å; I500-L519 PolarHBondContact O-N 3.33Å; I500-R589 HydrophobicContact CD1-CG 3.95Å; I500-W590 HydrophobicContact CD1-CD2 4.23Å; I500-W590 HydrophobicContact CD1-CG 4.47Å; I500-W590 HydrophobicContact CG1-CH2 4.47Å; I500-W590 HydrophobicContact CG1-CZ2 4.28Å; I500-W590 HydrophobicContact CG2-CD2 4.34Å; I500-W590 HydrophobicContact CG2-CE3 3.79Å; I500-W590 HydrophobicContact CG2-CH2 4.08Å; I500-W590 HydrophobicContact CG2-CZ3 3.64Å; I500-N593 HydrophobicContact CB-CB 4.38Å; I500-N593 HydrophobicContact CG2-CB 3.63Å
501	R	94.7	Very high	89.7	Confident	106 Å²	106	68.1 Å²	68.1	40%	0.4	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.2	168.9	174.5	-165.3	165	-155.7	-19.9	108.7	H498 I516 C517 F518	H498-R501 WeakPolarHBondContact NE2-CB 3.48Å; R501-I516 HydrophobicContact CG-CG2 4.06Å; R501-C517 VanDerWaalsContact CA-O 3.3Å; R501-C517 WeakPolarHBondContact CA-O 3.39Å; R501-F518 HydrophobicContact CB-CD1 4.02Å; R501-F518 HydrophobicContact CB-CE1 4.35Å; R501-F518 VanDerWaalsContact CD-CE1 3.46Å; R501-F518 HydrophobicContact CG-CD1 3.85Å; R501-F518 HydrophobicContact CG-CE1 3.79Å; R501-F518 HydrophobicContact CG-CG 4.34Å; R501-F518 HydrophobicContact CG-CZ 4.2Å
502	G	94.1	Very high	90.2	Very high	11 Å²	11	70.2 Å²	70.2	11%	0.113	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	165.7	175.6	0	0	0	0	0	113.2	I516 C517	G502-I516 WeakPolarHBondContact O-CA 3.45Å; G502-C517 PolarHBondContact N-O 2.99Å; G502-C517 VanDerWaalsContact N-O 3.16Å; G502-C517 PolarHBondContact O-N 3.33Å
503	E	94.7	Very high	90.8	Very high	114 Å²	114	64.1 Å²	64.1	53%	0.533	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	108.9	175.8	-56.2	-170.4	168.8	0	0	107.8	V515 I516 R532	E503-V515 CarbonylContact C-O 3.5Å; E503-V515 WeakPolarHBondContact CA-O 3.47Å; E503-I516 HydrophobicContact CG-CG1 4.29Å; E503-R532 IonicContact OE1-NH2 2.76Å
504	L	96.2	Very high	91.7	Very high	2 Å²	2	66.6 Å²	66.6	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	163.1	-173.6	-64.3	-179.7	0	0	0	110.9	V515 C517 F562 F579 T581 W590	L504-V515 HydrophobicContact CB-CG2 4.15Å; L504-V515 PolarHBondContact N-O 2.62Å; L504-V515 VanDerWaalsContact O-CG2 3.29Å; L504-V515 WeakPolarHBondContact O-CG2 3.49Å; L504-V515 PolarHBondContact O-N 3.33Å; L504-V515 VanDerWaalsContact O-O 3.14Å; L504-C517 HydrophobicContact CD1-CB 4.09Å; L504-F562 HydrophobicContact CD1-CE1 4.31Å; L504-F562 HydrophobicContact CD1-CZ 4.11Å; L504-F579 HydrophobicContact CB-CD1 4.14Å; L504-F579 HydrophobicContact CD1-CB 4.17Å; L504-F579 HydrophobicContact CD1-CD1 3.9Å; L504-F579 HydrophobicContact CD1-CG 4.29Å; L504-T581 HydrophobicContact CD2-CG2 3.69Å; L504-W590 HydrophobicContact CD1-CD2 4.28Å; L504-W590 HydrophobicContact CD1-CH2 4.33Å; L504-W590 HydrophobicContact CD1-CZ2 3.81Å; L504-W590 HydrophobicContact CG-CZ2 4.21Å
505	K	95.7	Very high	92.2	Very high	94 Å²	94	64 Å²	64	41%	0.409	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	106	170.9	-49.4	-169.1	174.4	-80.9	0	110.3	T513 D514 L580	K505-T513 CarbonylContact C-O 3.51Å; K505-D514 WeakPolarHBondContact CD-OD1 3.38Å; K505-D514 VanDerWaalsContact CG-OD1 3.31Å; K505-D514 WeakPolarHBondContact CG-OD1 3.2Å; K505-D514 IonicContact NZ-OD1 3.24Å; K505-D514 PolarHBondContact NZ-OD1 3.45Å; K505-D514 IonicContact NZ-OD2 2.8Å; K505-D514 PolarHBondContact NZ-OD2 3.12Å; K505-D514 VanDerWaalsContact NZ-OD2 3.16Å; K505-L580 HydrophobicContact CB-CB 4.25Å; K505-L580 PolarHBondContact N-O 3.44Å; K505-L580 PolarHBondContact O-N 3.43Å
506	L	96.1	Very high	92.6	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.016	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	129	175.1	172.5	60.6	0	0	0	110	E508 K512 T513 V515 V526 C577 F579	L506-E508 HydrophobicContact CD1-CG 3.96Å; L506-E508 HydrophobicContact CD2-CG 4.39Å; L506-E508 HydrophobicContact CG-CG 4.09Å; L506-K512 CarbonylContact O-C 3.48Å; L506-K512 WeakPolarHBondContact O-CA 3.37Å; L506-T513 PolarHBondContact N-O 3.39Å; L506-T513 PolarHBondContact O-N 2.81Å; L506-V515 HydrophobicContact CB-CG1 4.07Å; L506-V515 HydrophobicContact CB-CG2 3.86Å; L506-V515 HydrophobicContact CD2-CG1 4.35Å; L506-V526 HydrophobicContact CD2-CG1 4.29Å; L506-C577 HydrophobicContact CD1-CB 3.78Å; L506-C577 VanDerWaalsContact CD1-SG 3.54Å; L506-F579 HydrophobicContact CB-CD1 4.43Å; L506-F579 HydrophobicContact CB-CE1 4.21Å; L506-F579 HydrophobicContact CD1-CD1 4.42Å; L506-F579 HydrophobicContact CD1-CE1 3.94Å; L506-F579 HydrophobicContact CD1-CE2 4.3Å; L506-F579 HydrophobicContact CD1-CZ 3.87Å
507	R	94.3	Very high	92.8	Very high	111 Å²	111	62 Å²	62	42%	0.419	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	107.6	174.9	-177.8	-170.1	178.4	-167.7	-1.9	109.4	S509 K512 V578	R507-S509 WeakPolarHBondContact CG-O 3.35Å; R507-S509 PolarHBondContact NE-O 3.06Å; R507-K512 HydrophobicContact CB-CG 4.49Å; R507-K512 HydrophobicContact CG-CG 4.49Å; R507-V578 HydrophobicContact CB-CB 4.3Å; R507-V578 PolarHBondContact N-O 3.48Å; R507-V578 PolarHBondContact O-N 2.95Å
508	E	87.3	Confident	93	Very high	73 Å²	73	60.1 Å²	60.1	34%	0.341	29%	0.285	S	S	.	.	S	Bend	trans	-97.9	-22.3	174.4	-63	171.5	156.1	0	0	111.5	L506 R543 Y575 C577	L506-E508 HydrophobicContact CD1-CG 3.96Å; L506-E508 HydrophobicContact CD2-CG 4.39Å; L506-E508 HydrophobicContact CG-CG 4.09Å; E508-R543 VanDerWaalsContact CD-NH2 3.28Å; E508-R543 IonicContact OE1-CZ 3.29Å; E508-R543 VanDerWaalsContact OE1-CZ 3.29Å; E508-R543 IonicContact OE1-NE 2.78Å; E508-R543 PolarHBondContact OE1-NE 3.13Å; E508-R543 IonicContact OE1-NH2 2.94Å; E508-R543 PolarHBondContact OE1-NH2 2.8Å; E508-R543 IonicContact OE2-CZ 3.87Å; E508-R543 IonicContact OE2-NH2 2.82Å; E508-R543 PolarHBondContact OE2-NH2 2.59Å; E508-Y575 HydrophobicContact CG-CE2 4.28Å; E508-Y575 WeakPolarHBondContact OE1-CE2 3.2Å; E508-Y575 PolarHBondContact OE1-OH 3.27Å; E508-C577 HydrophobicContact CG-CB 3.94Å
509	S	82.8	Confident	93.1	Very high	65 Å²	65	57.8 Å²	57.8	46%	0.455	27%	0.274	S	S	.	.	S	Bend	trans	-152.8	-136.7	-174.2	-173.5	0	0	0	0	109.9	R507	R507-S509 WeakPolarHBondContact CG-O 3.35Å; R507-S509 PolarHBondContact NE-O 3.06Å
510	Y	77.8	Confident	93.2	Very high	212 Å²	212	56.6 Å²	56.6	83%	0.831	27%	0.268	S	S	*	.	S	Bend	trans	-74.3	-27.1	168.9	-58	-79.7	0	0	0	112.5
511	T	85	Confident	93.1	Very high	93 Å²	93	55.7 Å²	55.7	57%	0.571	26%	0.263	S	S	*	.			trans	-71.3	145.4	175.3	46	0	0	0	0	111.9
512	K	91.1	Very high	93.2	Very high	129 Å²	129	50.8 Å²	50.8	56%	0.561	25%	0.245	S	C	*	.			trans	-121.9	128.6	170	-63.1	-178	-177.7	-178.5	0	108.3	L506 R507 L580	L506-K512 CarbonylContact O-C 3.48Å; L506-K512 WeakPolarHBondContact O-CA 3.37Å; R507-K512 HydrophobicContact CB-CG 4.49Å; R507-K512 HydrophobicContact CG-CG 4.49Å; K512-L580 HydrophobicContact CD-CD1 4.32Å
513	T	94.1	Very high	93.3	Very high	43 Å²	43	51.2 Å²	51.2	26%	0.264	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125	-178.9	-57.8	0	0	0	0	109.3	K505 L506 V515	K505-T513 CarbonylContact C-O 3.51Å; L506-T513 PolarHBondContact N-O 3.39Å; L506-T513 PolarHBondContact O-N 2.81Å; T513-V515 HydrophobicContact CG2-CG1 4.01Å; T513-V515 PolarHBondContact O-N 2.94Å
514	D	95.1	Very high	93.4	Very high	97 Å²	97	45.8 Å²	45.8	52%	0.519	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	124.5	174	-65.1	-18.6	0	0	0	109.6	K505	K505-D514 WeakPolarHBondContact CD-OD1 3.38Å; K505-D514 VanDerWaalsContact CG-OD1 3.31Å; K505-D514 WeakPolarHBondContact CG-OD1 3.2Å; K505-D514 IonicContact NZ-OD1 3.24Å; K505-D514 PolarHBondContact NZ-OD1 3.45Å; K505-D514 IonicContact NZ-OD2 2.8Å; K505-D514 PolarHBondContact NZ-OD2 3.12Å; K505-D514 VanDerWaalsContact NZ-OD2 3.16Å
515	V	96.1	Very high	93.4	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.024	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.3	-172.1	-67.3	0	0	0	0	111.3	E503 L504 L506 T513 V526 C527 I542 F579	E503-V515 CarbonylContact C-O 3.5Å; E503-V515 WeakPolarHBondContact CA-O 3.47Å; L504-V515 HydrophobicContact CB-CG2 4.15Å; L504-V515 PolarHBondContact N-O 2.62Å; L504-V515 VanDerWaalsContact O-CG2 3.29Å; L504-V515 WeakPolarHBondContact O-CG2 3.49Å; L504-V515 PolarHBondContact O-N 3.33Å; L504-V515 VanDerWaalsContact O-O 3.14Å; L506-V515 HydrophobicContact CB-CG1 4.07Å; L506-V515 HydrophobicContact CB-CG2 3.86Å; L506-V515 HydrophobicContact CD2-CG1 4.35Å; T513-V515 HydrophobicContact CG2-CG1 4.01Å; T513-V515 PolarHBondContact O-N 2.94Å; V515-V526 HydrophobicContact CB-CG1 4.01Å; V515-V526 HydrophobicContact CG1-CG1 3.97Å; V515-V526 HydrophobicContact CG2-CG1 4.19Å; V515-C527 CarbonylContact C-O 3.57Å; V515-C527 VanDerWaalsContact CA-O 3.3Å; V515-C527 WeakPolarHBondContact CA-O 3.22Å; V515-C527 WeakPolarHBondContact CB-O 3.15Å; V515-I542 HydrophobicContact CG1-CD1 3.89Å; V515-F579 HydrophobicContact CG2-CD1 4.47Å; V515-F579 HydrophobicContact CG2-CE1 4.25Å
516	I	95.7	Very high	93.5	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	115.8	168.4	-55.2	-171.1	0	0	0	106.9	R501 G502 E503 F518 C527 Q529 V539	R501-I516 HydrophobicContact CG-CG2 4.06Å; G502-I516 WeakPolarHBondContact O-CA 3.45Å; E503-I516 HydrophobicContact CG-CG1 4.29Å; I516-F518 HydrophobicContact CB-CE2 4.49Å; I516-F518 HydrophobicContact CG2-CD2 4.39Å; I516-F518 HydrophobicContact CG2-CE2 3.72Å; I516-F518 HydrophobicContact CG2-CZ 4.08Å; I516-C527 PolarHBondContact N-O 3.26Å; I516-C527 WeakPolarHBondContact O-CA 3.3Å; I516-C527 WeakPolarHBondContact O-CB 3.48Å; I516-C527 PolarHBondContact O-N 3.21Å; I516-Q529 HydrophobicContact CD1-CB 3.94Å; I516-Q529 HydrophobicContact CD1-CG 4.18Å; I516-Q529 HydrophobicContact CG1-CB 4.42Å; I516-V539 HydrophobicContact CB-CG1 4.49Å; I516-V539 HydrophobicContact CD1-CG1 3.95Å
517	C	96.9	Very high	93.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.6	179.9	-59.6	0	0	0	0	110.5	R501 G502 L504 F524 L525 W590	R501-C517 VanDerWaalsContact CA-O 3.3Å; R501-C517 WeakPolarHBondContact CA-O 3.39Å; G502-C517 PolarHBondContact N-O 2.99Å; G502-C517 VanDerWaalsContact N-O 3.16Å; G502-C517 PolarHBondContact O-N 3.33Å; L504-C517 HydrophobicContact CD1-CB 4.09Å; C517-F524 HydrophobicContact CB-CE2 3.72Å; C517-F524 HydrophobicContact CB-CZ 3.87Å; C517-L525 VanDerWaalsContact CA-O 3.32Å; C517-L525 WeakPolarHBondContact CA-O 3.5Å; C517-W590 HydrophobicContact CB-CH2 3.78Å; C517-W590 HydrophobicContact CB-CZ2 4.32Å
518	F	97.1	Very high	93.5	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.031	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.4	174.9	-59.6	-107.2	0	0	0	108.4	I454 R501 I516 F520 F524 L525 C527 V539	I454-F518 HydrophobicContact CB-CE1 4.49Å; I454-F518 HydrophobicContact CD1-CD1 4.32Å; I454-F518 HydrophobicContact CG1-CD1 4.44Å; I454-F518 HydrophobicContact CG1-CE1 4.17Å; I454-F518 HydrophobicContact CG2-CD1 3.82Å; I454-F518 HydrophobicContact CG2-CE1 3.56Å; I454-F518 HydrophobicContact CG2-CZ 4.16Å; R501-F518 HydrophobicContact CB-CD1 4.02Å; R501-F518 HydrophobicContact CB-CE1 4.35Å; R501-F518 VanDerWaalsContact CD-CE1 3.46Å; R501-F518 HydrophobicContact CG-CD1 3.85Å; R501-F518 HydrophobicContact CG-CE1 3.79Å; R501-F518 HydrophobicContact CG-CG 4.34Å; R501-F518 HydrophobicContact CG-CZ 4.2Å; I516-F518 HydrophobicContact CB-CE2 4.49Å; I516-F518 HydrophobicContact CG2-CD2 4.39Å; I516-F518 HydrophobicContact CG2-CE2 3.72Å; I516-F518 HydrophobicContact CG2-CZ 4.08Å; F518-F520 HydrophobicContact CB-CD2 4.5Å; F518-F520 HydrophobicContact CB-CE2 3.62Å; F518-F520 HydrophobicContact CB-CZ 3.93Å; F518-F524 WeakPolarHBondContact O-CD2 3.29Å; F518-L525 HydrophobicContact CB-CB 4.4Å; F518-L525 PolarHBondContact N-O 2.99Å; F518-L525 PolarHBondContact O-N 2.94Å; F518-C527 HydrophobicContact CE2-CB 4.5Å; F518-V539 HydrophobicContact CE2-CG2 4.36Å
519	L	98	Very high	93.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.3	172.8	178.2	62.7	0	0	0	109.6	L499 I500 F524 I548 W590 N593 F594 A597	L499-L519 WeakPolarHBondContact CB-O 3.47Å; L499-L519 HydrophobicContact CD1-CD2 4.48Å; L499-L519 HydrophobicContact CD1-CG 4.25Å; L499-L519 PolarHBondContact N-O 3.17Å; I500-L519 HydrophobicContact CG2-CB 3.81Å; I500-L519 HydrophobicContact CG2-CD2 4.05Å; I500-L519 HydrophobicContact CG2-CG 4.46Å; I500-L519 PolarHBondContact N-O 3.4Å; I500-L519 PolarHBondContact O-N 3.33Å; L519-F524 HydrophobicContact CB-CD2 4.09Å; L519-F524 HydrophobicContact CD1-CB 4.07Å; L519-F524 HydrophobicContact CD1-CD2 4.17Å; L519-I548 HydrophobicContact CD1-CD1 4.09Å; L519-W590 HydrophobicContact CB-CZ3 3.92Å; L519-N593 HydrophobicContact CD2-CB 4.02Å; L519-F594 HydrophobicContact CD1-CD1 3.88Å; L519-F594 HydrophobicContact CD1-CE1 3.74Å; L519-F594 HydrophobicContact CD2-CB 4.45Å; L519-F594 HydrophobicContact CD2-CD1 3.74Å; L519-F594 HydrophobicContact CD2-CD2 4.31Å; L519-F594 HydrophobicContact CD2-CE1 4.02Å; L519-F594 HydrophobicContact CD2-CG 3.89Å; L519-F594 HydrophobicContact CD2-CZ 4.41Å; L519-F594 HydrophobicContact CG-CD1 4.49Å; L519-F594 HydrophobicContact CG-CE1 4.48Å; L519-A597 HydrophobicContact CD1-CB 4.32Å; L519-A597 HydrophobicContact CD2-CB 4.46Å; L519-A597 HydrophobicContact CG-CB 4.5Å
520	F	97.3	Very high	93.9	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	176.7	174	-52.8	-93.9	0	0	0	109.2	L451 I454 L483 R496 R497 H498 F518 D522 M523 L525	L451-F520 HydrophobicContact CD2-CD1 4Å; L451-F520 HydrophobicContact CD2-CE1 3.88Å; I454-F520 HydrophobicContact CD1-CE1 4.01Å; I454-F520 HydrophobicContact CD1-CZ 4.29Å; I454-F520 HydrophobicContact CG2-CZ 4.37Å; L483-F520 HydrophobicContact CD1-CE1 4.12Å; L483-F520 HydrophobicContact CD1-CZ 3.81Å; L483-F520 HydrophobicContact CD2-CE2 4.46Å; L483-F520 HydrophobicContact CD2-CZ 4.2Å; R496-F520 HydrophobicContact CG-CB 3.76Å; R496-F520 HydrophobicContact CG-CD1 4.01Å; R496-F520 HydrophobicContact CG-CG 4.13Å; R497-F520 CarbonylContact O-C 3.57Å; R497-F520 WeakPolarHBondContact O-CA 3.28Å; R497-F520 WeakPolarHBondContact O-CB 3.46Å; H498-F520 HydrophobicContact CB-CD1 3.91Å; H498-F520 HydrophobicContact CB-CE1 3.93Å; F518-F520 HydrophobicContact CB-CD2 4.5Å; F518-F520 HydrophobicContact CB-CE2 3.62Å; F518-F520 HydrophobicContact CB-CZ 3.93Å; F520-D522 PolarHBondContact O-N 3.04Å; F520-M523 HydrophobicContact CB-CB 4.46Å; F520-M523 HydrophobicContact CD2-CB 4.44Å; F520-M523 HydrophobicContact CD2-CE 3.84Å; F520-M523 WeakPolarHBondContact CD2-O 3.36Å; F520-M523 HydrophobicContact CE2-CE 4.03Å; F520-M523 HydrophobicContact CG-CE 4.42Å; F520-M523 PolarHBondContact N-O 3.15Å; F520-L525 HydrophobicContact CE2-CD1 3.91Å; F520-L525 HydrophobicContact CE2-CG 4.12Å
521	T	95.8	Very high	94	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.172	C	C	.	.	S	Bend	trans	-54.6	-47.3	175.6	35	0	0	0	0	113.7	M487 R497 L499 I548 E600	M487-T521 PolarHBondContact SD-OG1 3.12Å; R497-T521 HydrophobicContact CB-CG2 3.77Å; R497-T521 PolarHBondContact N-OG1 3.3Å; R497-T521 VanDerWaalsContact N-OG1 3.11Å; R497-T521 PolarHBondContact O-N 3.05Å; L499-T521 HydrophobicContact CD2-CG2 4.27Å; T521-I548 WeakPolarHBondContact O-CG2 3.48Å; T521-E600 HydrophobicContact CG2-CB 4.21Å; T521-E600 WeakPolarHBondContact CG2-OE2 3.24Å
522	D	95.5	Very high	93.4	Very high	3 Å²	3	36 Å²	36	2%	0.016	18%	0.175	C	C	.	.	S	Bend	trans	-103.9	-13.2	-175.5	66.9	-35.6	0	0	0	114.4	M487 P488 R496 F520 H547 I548 Y601	M487-D522 HydrophobicContact CB-CB 4.05Å; M487-D522 HydrophobicContact CG-CB 3.95Å; M487-D522 WeakPolarHBondContact CG-OD2 3.38Å; M487-D522 HydrophobicContact SD-CB 3.97Å; P488-D522 WeakPolarHBondContact CD-OD2 3.27Å; R496-D522 WeakPolarHBondContact CD-OD1 3.45Å; R496-D522 WeakPolarHBondContact CG-OD1 3.28Å; R496-D522 IonicContact CZ-OD1 3.91Å; R496-D522 IonicContact CZ-OD2 2.63Å; R496-D522 VanDerWaalsContact CZ-OD2 3.31Å; R496-D522 VanDerWaalsContact NE-CG 3.32Å; R496-D522 IonicContact NE-OD1 3.77Å; R496-D522 PolarHBondContact NE-OD1 2.85Å; R496-D522 IonicContact NE-OD2 3.67Å; R496-D522 PolarHBondContact NE-OD2 3.46Å; R496-D522 VanDerWaalsContact NE-OD2 3.11Å; R496-D522 IonicContact NH2-OD1 2.66Å; R496-D522 IonicContact NH2-OD2 2.68Å; R496-D522 PolarHBondContact NH2-OD2 2.91Å; F520-D522 PolarHBondContact O-N 3.04Å; D522-H547 WeakPolarHBondContact O-CA 3.41Å; D522-H547 PolarHBondContact O-CD2 3.39Å; D522-H547 VanDerWaalsContact O-CD2 3.22Å; D522-I548 PolarHBondContact O-N 3.06Å; D522-Y601 HydrophobicContact CB-CD2 3.69Å; D522-Y601 HydrophobicContact CB-CE2 3.96Å
523	M	96	Very high	92.2	Very high	21 Å²	21	36 Å²	36	10%	0.103	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.6	-158.9	-179.3	175.1	62.8	0	0	113.2	L483 F520 L525 P545 Y546	L483-M523 HydrophobicContact CD2-CE 3.45Å; L483-M523 VanDerWaalsContact CD2-CE 3.45Å; F520-M523 HydrophobicContact CB-CB 4.46Å; F520-M523 HydrophobicContact CD2-CB 4.44Å; F520-M523 HydrophobicContact CD2-CE 3.84Å; F520-M523 WeakPolarHBondContact CD2-O 3.36Å; F520-M523 HydrophobicContact CE2-CE 4.03Å; F520-M523 HydrophobicContact CG-CE 4.42Å; F520-M523 PolarHBondContact N-O 3.15Å; M523-L525 HydrophobicContact CE-CD1 4.16Å; M523-L525 HydrophobicContact CE-CD2 4.4Å; M523-L525 HydrophobicContact CE-CG 4.15Å; M523-L525 HydrophobicContact CG-CD2 4.28Å; M523-L525 HydrophobicContact CG-CG 4.37Å; M523-L525 HydrophobicContact SD-CD2 3.94Å; M523-L525 HydrophobicContact SD-CG 4.26Å; M523-P545 HydrophobicContact CG-CB 4.01Å; M523-P545 HydrophobicContact SD-CB 3.68Å; M523-Y546 CarbonylContact C-O 3.59Å; M523-Y546 WeakPolarHBondContact CA-O 3.47Å
524	F	97.8	Very high	91.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.9	169.8	179.6	-118.3	0	0	0	110.6	C517 F518 L519 V526 Y546 I551 F564 F579 W590 F594	C517-F524 HydrophobicContact CB-CE2 3.72Å; C517-F524 HydrophobicContact CB-CZ 3.87Å; F518-F524 WeakPolarHBondContact O-CD2 3.29Å; L519-F524 HydrophobicContact CB-CD2 4.09Å; L519-F524 HydrophobicContact CD1-CB 4.07Å; L519-F524 HydrophobicContact CD1-CD2 4.17Å; F524-V526 HydrophobicContact CD1-CG2 4.08Å; F524-V526 HydrophobicContact CE1-CG2 3.51Å; F524-V526 HydrophobicContact CZ-CG2 3.98Å; F524-Y546 AromaticContact CD1-CD2 3.85Å; F524-Y546 HydrophobicContact CD1-CD2 3.85Å; F524-Y546 PolarHBondContact N-O 3.27Å; F524-Y546 PolarHBondContact O-N 3.2Å; F524-I551 HydrophobicContact CB-CD1 3.76Å; F524-F564 HydrophobicContact CD1-CD2 4.37Å; F524-F564 AromaticContact CD1-CE2 3.46Å; F524-F564 HydrophobicContact CD1-CE2 3.46Å; F524-F564 VanDerWaalsContact CD1-CE2 3.46Å; F524-F564 AromaticContact CD1-CZ 3.87Å; F524-F564 HydrophobicContact CD1-CZ 3.87Å; F524-F564 HydrophobicContact CE1-CD2 4.11Å; F524-F564 AromaticContact CE1-CE2 3.62Å; F524-F564 HydrophobicContact CE1-CE2 3.62Å; F524-F564 HydrophobicContact CE1-CZ 4.17Å; F524-F564 HydrophobicContact CG-CE2 4.46Å; F524-F579 HydrophobicContact CE1-CE1 4.45Å; F524-F579 AromaticContact CE1-CE2 3.98Å; F524-F579 HydrophobicContact CE1-CE2 3.98Å; F524-F579 AromaticContact CE1-CZ 3.74Å; F524-F579 HydrophobicContact CE1-CZ 3.74Å; F524-F579 HydrophobicContact CZ-CE1 4.26Å; F524-F579 HydrophobicContact CZ-CE2 4.3Å; F524-F579 AromaticContact CZ-CZ 3.98Å; F524-F579 HydrophobicContact CZ-CZ 3.98Å; F524-W590 HydrophobicContact CD2-CZ3 4.48Å; F524-W590 HydrophobicContact CE2-CH2 4.31Å; F524-W590 AromaticContact CE2-CZ3 3.78Å; F524-W590 HydrophobicContact CE2-CZ3 3.78Å; F524-F594 HydrophobicContact CB-CE1 4.35Å; F524-F594 HydrophobicContact CD1-CZ 4.34Å; F524-F594 HydrophobicContact CD2-CE1 4.02Å; F524-F594 AromaticContact CD2-CZ 3.79Å; F524-F594 HydrophobicContact CD2-CZ 3.79Å; F524-F594 HydrophobicContact CE1-CZ 4.29Å; F524-F594 HydrophobicContact CE2-CE1 4.43Å; F524-F594 AromaticContact CE2-CZ 3.73Å; F524-F594 HydrophobicContact CE2-CZ 3.73Å; F524-F594 HydrophobicContact CG-CE1 4.07Å; F524-F594 HydrophobicContact CG-CZ 4.1Å; F524-F594 AromaticContact CZ-CZ 3.99Å; F524-F594 HydrophobicContact CZ-CZ 3.99Å
525	L	96.8	Very high	89.8	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136.5	176.9	-66.4	-177.5	0	0	0	111.2	V481 L483 C517 F518 F520 M523 P545	V481-L525 HydrophobicContact CG1-CD1 4.26Å; L483-L525 HydrophobicContact CD2-CD1 3.92Å; C517-L525 VanDerWaalsContact CA-O 3.32Å; C517-L525 WeakPolarHBondContact CA-O 3.5Å; F518-L525 HydrophobicContact CB-CB 4.4Å; F518-L525 PolarHBondContact N-O 2.99Å; F518-L525 PolarHBondContact O-N 2.94Å; F520-L525 HydrophobicContact CE2-CD1 3.91Å; F520-L525 HydrophobicContact CE2-CG 4.12Å; M523-L525 HydrophobicContact CE-CD1 4.16Å; M523-L525 HydrophobicContact CE-CD2 4.4Å; M523-L525 HydrophobicContact CE-CG 4.15Å; M523-L525 HydrophobicContact CG-CD2 4.28Å; M523-L525 HydrophobicContact CG-CG 4.37Å; M523-L525 HydrophobicContact SD-CD2 3.94Å; M523-L525 HydrophobicContact SD-CG 4.26Å; L525-P545 HydrophobicContact CD2-CB 3.67Å; L525-P545 HydrophobicContact CD2-CG 3.82Å
526	V	96.8	Very high	88.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.6	174.3	-176.1	0	0	0	0	109	L506 V515 F524 I542 R543 Y546 F579	L506-V526 HydrophobicContact CD2-CG1 4.29Å; V515-V526 HydrophobicContact CB-CG1 4.01Å; V515-V526 HydrophobicContact CG1-CG1 3.97Å; V515-V526 HydrophobicContact CG2-CG1 4.19Å; F524-V526 HydrophobicContact CD1-CG2 4.08Å; F524-V526 HydrophobicContact CE1-CG2 3.51Å; F524-V526 HydrophobicContact CZ-CG2 3.98Å; V526-I542 HydrophobicContact CG1-CG1 4.45Å; V526-I542 WeakPolarHBondContact O-CG1 3.33Å; V526-I542 PolarHBondContact O-N 3.24Å; V526-I542 VanDerWaalsContact O-N 3.14Å; V526-R543 HydrophobicContact CB-CB 4.16Å; V526-R543 HydrophobicContact CB-CG 4.39Å; V526-R543 HydrophobicContact CG1-CG 4.49Å; V526-Y546 HydrophobicContact CG2-CD2 4.45Å; V526-Y546 HydrophobicContact CG2-CE2 3.97Å; V526-F579 HydrophobicContact CG1-CE1 4.26Å; V526-F579 HydrophobicContact CG2-CE1 4.12Å; V526-F579 HydrophobicContact CG2-CZ 3.77Å
527	C	95.9	Very high	87.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	153	-174.5	-53.7	0	0	0	0	111.3	V515 I516 F518 V539 K540	V515-C527 CarbonylContact C-O 3.57Å; V515-C527 VanDerWaalsContact CA-O 3.3Å; V515-C527 WeakPolarHBondContact CA-O 3.22Å; V515-C527 WeakPolarHBondContact CB-O 3.15Å; I516-C527 PolarHBondContact N-O 3.26Å; I516-C527 WeakPolarHBondContact O-CA 3.3Å; I516-C527 WeakPolarHBondContact O-CB 3.48Å; I516-C527 PolarHBondContact O-N 3.21Å; F518-C527 HydrophobicContact CE2-CB 4.5Å; C527-V539 HydrophobicContact CB-CB 3.87Å; C527-V539 HydrophobicContact CB-CG2 3.94Å; C527-K540 CarbonylContact C-O 3.57Å; C527-K540 WeakPolarHBondContact CA-O 3.45Å; C527-K540 VanDerWaalsContact CB-O 3.25Å; C527-K540 WeakPolarHBondContact CB-O 3.46Å
528	K	94.4	Very high	87.5	Confident	97 Å²	97	50.8 Å²	50.8	42%	0.422	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.6	168.2	-169.9	169.3	-177.5	174.9	0	109.5	V539 K540 I542	K528-V539 WeakPolarHBondContact O-CA 3.42Å; K528-K540 HydrophobicContact CB-CG 4.27Å; K528-K540 PolarHBondContact N-O 3Å; K528-K540 PolarHBondContact O-N 3.32Å; K528-I542 HydrophobicContact CB-CD1 4.19Å; K528-I542 HydrophobicContact CB-CG1 4.39Å; K528-I542 HydrophobicContact CB-CG2 3.68Å
529	Q	91.7	Very high	87.3	Confident	59 Å²	59	50.5 Å²	50.5	28%	0.276	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	135.3	174.2	-164.5	-179.6	-7.4	0	0	110.5	I516 A531 P537	I516-Q529 HydrophobicContact CD1-CB 3.94Å; I516-Q529 HydrophobicContact CD1-CG 4.18Å; I516-Q529 HydrophobicContact CG1-CB 4.42Å; Q529-A531 PolarHBondContact NE2-O 3.26Å; Q529-P537 HydrophobicContact CG-CB 4.36Å
530	I	87.6	Confident	87	Confident	79 Å²	79	53.1 Å²	53.1	41%	0.405	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-51.4	176.4	-49.6	167.2	0	0	0	109.7	D459 R538 K540	D459-I530 HydrophobicContact CB-CD1 3.51Å; D459-I530 VanDerWaalsContact OD2-CD1 3.22Å; D459-I530 WeakPolarHBondContact OD2-CD1 3.3Å; I530-R538 PolarHBondContact N-O 3.42Å; I530-K540 HydrophobicContact CD1-CB 3.91Å; I530-K540 HydrophobicContact CD1-CD 4.39Å; I530-K540 HydrophobicContact CD1-CG 4.1Å; I530-K540 HydrophobicContact CG1-CB 4.18Å; I530-K540 HydrophobicContact CG1-CD 4.21Å; I530-K540 HydrophobicContact CG1-CG 3.84Å
531	A	79.8	Confident	86.9	Confident	48 Å²	48	53.1 Å²	53.1	40%	0.397	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	179.8	-172.9	0	0	0	0	0	111.5	Q529 R538	Q529-A531 PolarHBondContact NE2-O 3.26Å; A531-R538 PolarHBondContact O-N 2.91Å
532	R	72.9	Confident	86.8	Confident	164 Å²	164	54.2 Å²	54.2	62%	0.619	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.2	161	-64.9	-172.9	169.9	131.5	0.9	108	E503 P537	E503-R532 IonicContact OE1-NH2 2.76Å; R532-P537 HydrophobicContact CG-CB 4.41Å
533	K	65.5	Low	86.8	Confident	127 Å²	127	57.7 Å²	57.7	55%	0.552	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	90.3	174.1	-173.5	178.4	177.7	-178.2	0	107.6	R536 R538 A678	K533-R536 PolarHBondContact N-O 3.07Å; K533-R538 HydrophobicContact CB-CG 4.35Å; K533-A678 PolarHBondContact NZ-O 2.98Å
534	G	72.4	Confident	86.7	Confident	63 Å²	63	59 Å²	59	65%	0.649	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-145.6	-161.2	0	0	0	0	0	110.6	R536	G534-R536 PolarHBondContact O-N 3.12Å
535	D	66.3	Low	86.5	Confident	172 Å²	172	61.5 Å²	61.5	92%	0.92	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-11.2	-175.8	-56.2	-37.3	0	0	0	114.3
536	R	70.9	Confident	86.5	Confident	126 Å²	126	61.6 Å²	61.6	48%	0.475	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.5	178.8	-63.8	-167.9	-176	-173.2	3.9	111.5	K533 G534	K533-R536 PolarHBondContact N-O 3.07Å; G534-R536 PolarHBondContact O-N 3.12Å
537	P	78.2	Confident	86.4	Confident	15 Å²	15	63.6 Å²	63.6	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	137.2	171.7	30.4	-31	0	0	0	110.2	Q529 R532	Q529-P537 HydrophobicContact CG-CB 4.36Å; R532-P537 HydrophobicContact CG-CB 4.41Å
538	R	90.1	Very high	86.4	Confident	84 Å²	84	63.6 Å²	63.6	32%	0.317	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132	170.7	-55.3	-162.3	79	-140.8	-1.3	109.3	C457 D459 I530 A531 K533	C457-R538 WeakPolarHBondContact O-CA 3.37Å; D459-R538 IonicContact OD1-CZ 2.58Å; D459-R538 IonicContact OD1-NH1 3.23Å; D459-R538 PolarHBondContact OD1-NH1 2.95Å; D459-R538 IonicContact OD1-NH2 3Å; D459-R538 PolarHBondContact OD1-NH2 3.46Å; D459-R538 IonicContact OD2-CZ 2.58Å; D459-R538 IonicContact OD2-NH1 3.66Å; D459-R538 PolarHBondContact OD2-NH1 3.4Å; D459-R538 IonicContact OD2-NH2 3.27Å; I530-R538 PolarHBondContact N-O 3.42Å; A531-R538 PolarHBondContact O-N 2.91Å; K533-R538 HydrophobicContact CB-CG 4.35Å
539	V	93.5	Very high	86.4	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.9	-175.6	-54.6	0	0	0	0	111	C457 I458 D459 I516 F518 C527 K528	C457-V539 PolarHBondContact O-N 3.15Å; I458-V539 CarbonylContact C-O 3.5Å; I458-V539 WeakPolarHBondContact CA-O 3.5Å; I458-V539 HydrophobicContact CG1-CG2 4.2Å; D459-V539 PolarHBondContact N-O 3.43Å; I516-V539 HydrophobicContact CB-CG1 4.49Å; I516-V539 HydrophobicContact CD1-CG1 3.95Å; F518-V539 HydrophobicContact CE2-CG2 4.36Å; C527-V539 HydrophobicContact CB-CB 3.87Å; C527-V539 HydrophobicContact CB-CG2 3.94Å; K528-V539 WeakPolarHBondContact O-CA 3.42Å
540	K	93.1	Very high	86.5	Confident	54 Å²	54	64.4 Å²	64.4	24%	0.235	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	142.4	166.2	53.4	179	178.1	-178.7	0	111.1	S460 E462 C527 K528 I530 I542	S460-K540 VanDerWaalsContact O-CA 3.28Å; S460-K540 WeakPolarHBondContact O-CA 3.3Å; S460-K540 WeakPolarHBondContact OG-CB 3.22Å; E462-K540 HydrophobicContact CB-CD 4.31Å; E462-K540 HydrophobicContact CG-CD 4.28Å; E462-K540 WeakPolarHBondContact OE1-CD 3.39Å; E462-K540 IonicContact OE1-NZ 2.99Å; E462-K540 WeakPolarHBondContact OE2-CD 3.5Å; E462-K540 WeakPolarHBondContact OE2-CE 3.48Å; E462-K540 IonicContact OE2-NZ 2.76Å; E462-K540 PolarHBondContact OE2-NZ 3.36Å; C527-K540 CarbonylContact C-O 3.57Å; C527-K540 WeakPolarHBondContact CA-O 3.45Å; C527-K540 VanDerWaalsContact CB-O 3.25Å; C527-K540 WeakPolarHBondContact CB-O 3.46Å; K528-K540 HydrophobicContact CB-CG 4.27Å; K528-K540 PolarHBondContact N-O 3Å; K528-K540 PolarHBondContact O-N 3.32Å; I530-K540 HydrophobicContact CD1-CB 3.91Å; I530-K540 HydrophobicContact CD1-CD 4.39Å; I530-K540 HydrophobicContact CD1-CG 4.1Å; I530-K540 HydrophobicContact CG1-CB 4.18Å; I530-K540 HydrophobicContact CG1-CD 4.21Å; I530-K540 HydrophobicContact CG1-CG 3.84Å; K540-I542 HydrophobicContact CD-CG2 4.4Å; K540-I542 HydrophobicContact CG-CG2 4Å
541	V	94.9	Very high	87	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	128.3	172.7	-176.3	0	0	0	0	108.3	I458 S460 Y461 E462 V463 V481 R543	I458-V541 HydrophobicContact CG2-CG2 4.22Å; S460-V541 PolarHBondContact O-N 2.95Å; Y461-V541 HydrophobicContact CD2-CB 3.65Å; Y461-V541 HydrophobicContact CD2-CG1 3.63Å; Y461-V541 HydrophobicContact CD2-CG2 4.23Å; Y461-V541 HydrophobicContact CE2-CB 4.29Å; Y461-V541 HydrophobicContact CE2-CG1 3.75Å; Y461-V541 HydrophobicContact CG-CB 4.44Å; E462-V541 CarbonylContact C-O 3.56Å; E462-V541 PolarHBondContact N-O 3.34Å; V463-V541 HydrophobicContact CG2-CG1 3.94Å; V481-V541 HydrophobicContact CG2-CG2 4.35Å; V541-R543 WeakPolarHBondContact CG1-O 3.39Å
542	I	94	Very high	87.7	Confident	24 Å²	24	61.6 Å²	61.6	12%	0.123	30%	0.302	C	S	.	.			trans	-122.1	-2.3	-173.6	60	152.7	0	0	0	114.4	V515 V526 K528 K540	V515-I542 HydrophobicContact CG1-CD1 3.89Å; V526-I542 HydrophobicContact CG1-CG1 4.45Å; V526-I542 WeakPolarHBondContact O-CG1 3.33Å; V526-I542 PolarHBondContact O-N 3.24Å; V526-I542 VanDerWaalsContact O-N 3.14Å; K528-I542 HydrophobicContact CB-CD1 4.19Å; K528-I542 HydrophobicContact CB-CG1 4.39Å; K528-I542 HydrophobicContact CB-CG2 3.68Å; K540-I542 HydrophobicContact CD-CG2 4.4Å; K540-I542 HydrophobicContact CG-CG2 4Å
543	R	94.1	Very high	88.9	Confident	77 Å²	77	55.1 Å²	55.1	29%	0.291	28%	0.28	S	S	.	.	S	Bend	trans	-139.7	150.9	173.4	-68.6	-69.6	170.6	-117.2	16.3	107.8	E508 V526 V541 Y546	E508-R543 VanDerWaalsContact CD-NH2 3.28Å; E508-R543 IonicContact OE1-CZ 3.29Å; E508-R543 VanDerWaalsContact OE1-CZ 3.29Å; E508-R543 IonicContact OE1-NE 2.78Å; E508-R543 PolarHBondContact OE1-NE 3.13Å; E508-R543 IonicContact OE1-NH2 2.94Å; E508-R543 PolarHBondContact OE1-NH2 2.8Å; E508-R543 IonicContact OE2-CZ 3.87Å; E508-R543 IonicContact OE2-NH2 2.82Å; E508-R543 PolarHBondContact OE2-NH2 2.59Å; V526-R543 HydrophobicContact CB-CB 4.16Å; V526-R543 HydrophobicContact CB-CG 4.39Å; V526-R543 HydrophobicContact CG1-CG 4.49Å; V541-R543 WeakPolarHBondContact CG1-O 3.39Å; R543-Y546 HydrophobicContact CB-CE2 3.93Å; R543-Y546 WeakPolarHBondContact CB-OH 3.35Å
544	P	93.6	Very high	90.3	Very high	48 Å²	48	55.4 Å²	55.4	31%	0.312	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-63	155.4	-178.2	28.4	-35.2	0	0	0	110.4	V463 Y546	V463-P544 HydrophobicContact CG1-CB 4.08Å; V463-P544 HydrophobicContact CG1-CG 4.36Å; P544-Y546 HydrophobicContact CG-CE1 4.33Å; P544-Y546 WeakPolarHBondContact O-CD2 3.47Å; P544-Y546 WeakPolarHBondContact O-CE2 3.44Å; P544-Y546 PolarHBondContact O-N 2.97Å
545	P	94.9	Very high	91.4	Very high	52 Å²	52	56.3 Å²	56.3	34%	0.338	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-62.7	125.3	174.5	-19.1	33	0	0	0	110.5	Y461 M523 L525	Y461-P545 HydrophobicContact CE2-CG 4.46Å; M523-P545 HydrophobicContact CG-CB 4.01Å; M523-P545 HydrophobicContact SD-CB 3.68Å; L525-P545 HydrophobicContact CD2-CB 3.67Å; L525-P545 HydrophobicContact CD2-CG 3.82Å
546	Y	96	Very high	92.6	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.4	-178.7	-57.6	-76.9	0	0	0	110.1	M523 F524 V526 R543 P544 F564 Q566 Y575	M523-Y546 CarbonylContact C-O 3.59Å; M523-Y546 WeakPolarHBondContact CA-O 3.47Å; F524-Y546 AromaticContact CD1-CD2 3.85Å; F524-Y546 HydrophobicContact CD1-CD2 3.85Å; F524-Y546 PolarHBondContact N-O 3.27Å; F524-Y546 PolarHBondContact O-N 3.2Å; V526-Y546 HydrophobicContact CG2-CD2 4.45Å; V526-Y546 HydrophobicContact CG2-CE2 3.97Å; R543-Y546 HydrophobicContact CB-CE2 3.93Å; R543-Y546 WeakPolarHBondContact CB-OH 3.35Å; P544-Y546 HydrophobicContact CG-CE1 4.33Å; P544-Y546 WeakPolarHBondContact O-CD2 3.47Å; P544-Y546 WeakPolarHBondContact O-CE2 3.44Å; P544-Y546 PolarHBondContact O-N 2.97Å; Y546-F564 HydrophobicContact CD1-CE1 4.27Å; Y546-F564 HydrophobicContact CD1-CZ 4.09Å; Y546-F564 HydrophobicContact CD2-CE1 4.39Å; Y546-F564 AromaticContact CD2-CZ 3.82Å; Y546-F564 HydrophobicContact CD2-CZ 3.82Å; Y546-F564 HydrophobicContact CE1-CE1 4.2Å; Y546-F564 HydrophobicContact CE1-CZ 4.42Å; Y546-F564 HydrophobicContact CE2-CE1 4.32Å; Y546-F564 HydrophobicContact CE2-CZ 4.17Å; Y546-F564 HydrophobicContact CG-CE1 4.35Å; Y546-F564 AromaticContact CG-CZ 3.76Å; Y546-F564 HydrophobicContact CG-CZ 3.76Å; Y546-Q566 HydrophobicContact CD1-CB 4.19Å; Y546-Q566 HydrophobicContact CD1-CG 3.95Å; Y546-Q566 HydrophobicContact CE1-CB 4.26Å; Y546-Q566 HydrophobicContact CE1-CG 4.3Å; Y546-Q566 VanDerWaalsContact CE1-OE1 3.31Å; Y546-Y575 HydrophobicContact CE1-CD1 4.17Å; Y546-Y575 HydrophobicContact CE1-CE1 4.42Å; Y546-Y575 VanDerWaalsContact OH-CE1 3.25Å; Y546-Y575 WeakPolarHBondContact OH-CE1 3.43Å
547	H	95.5	Very high	93.3	Very high	41 Å²	41	56.3 Å²	56.3	19%	0.19	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.8	176.9	-168.5	-112.9	0	0	0	111.6	D522 E549 N550 I551 Y601	D522-H547 WeakPolarHBondContact O-CA 3.41Å; D522-H547 PolarHBondContact O-CD2 3.39Å; D522-H547 VanDerWaalsContact O-CD2 3.22Å; H547-E549 VanDerWaalsContact C-N 3.35Å; H547-E549 IonicContact CE1-OE2 2.59Å; H547-E549 PolarHBondContact CE1-OE2 3.28Å; H547-E549 VanDerWaalsContact CE1-OE2 3.27Å; H547-E549 IonicContact ND1-OE2 3.99Å; H547-E549 PolarHBondContact O-N 3.44Å; H547-N550 PolarHBondContact O-N 3Å; H547-I551 WeakPolarHBondContact O-CG1 3.4Å; H547-Y601 AromaticContact CE1-CE2 3.89Å; H547-Y601 AromaticContact CE1-CZ 3.47Å; H547-Y601 VanDerWaalsContact CE1-CZ 3.47Å; H547-Y601 PolarHBondContact CE1-OH 3.29Å; H547-Y601 VanDerWaalsContact CE1-OH 3.27Å; H547-Y601 AromaticContact NE2-CE2 3.51Å; H547-Y601 AromaticContact NE2-CZ 3.58Å; H547-Y601 PolarHBondContact NE2-OH 3.5Å
548	I	95.9	Very high	93.4	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-61.4	-35.9	-164.2	-167.8	58	0	0	0	114.6	L519 T521 D522 N550 I551 F594 A597 K598 Y601	L519-I548 HydrophobicContact CD1-CD1 4.09Å; T521-I548 WeakPolarHBondContact O-CG2 3.48Å; D522-I548 PolarHBondContact O-N 3.06Å; I548-N550 VanDerWaalsContact C-N 3.27Å; I548-N550 PolarHBondContact O-N 2.78Å; I548-I551 HydrophobicContact CD1-CD1 4.31Å; I548-I551 PolarHBondContact O-N 3.4Å; I548-F594 HydrophobicContact CD1-CD1 3.96Å; I548-A597 HydrophobicContact CD1-CB 3.72Å; I548-A597 HydrophobicContact CG1-CB 3.76Å; I548-K598 HydrophobicContact CD1-CG 4.24Å; I548-K598 HydrophobicContact CG1-CG 3.72Å; I548-K598 WeakPolarHBondContact O-CE 3.4Å; I548-Y601 HydrophobicContact CG2-CD1 4.03Å; I548-Y601 HydrophobicContact CG2-CD2 4.05Å; I548-Y601 HydrophobicContact CG2-CG 3.64Å
549	E	93.3	Very high	93.2	Very high	110 Å²	110	63.8 Å²	63.8	51%	0.514	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-63.3	-35.6	177.5	-62.7	-174.4	111.7	0	0	112.2	H547 I551 Y601	H547-E549 VanDerWaalsContact C-N 3.35Å; H547-E549 IonicContact CE1-OE2 2.59Å; H547-E549 PolarHBondContact CE1-OE2 3.28Å; H547-E549 VanDerWaalsContact CE1-OE2 3.27Å; H547-E549 IonicContact ND1-OE2 3.99Å; H547-E549 PolarHBondContact O-N 3.44Å; E549-I551 PolarHBondContact O-N 2.8Å; E549-Y601 HydrophobicContact CG-CD1 3.76Å; E549-Y601 HydrophobicContact CG-CE1 3.52Å
550	N	95.1	Very high	93.1	Very high	64 Å²	64	67 Å²	67	34%	0.342	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-84.5	6.4	-176.1	-67.3	-23.6	0	0	0	112.7	H547 I548 Q566 M567	H547-N550 PolarHBondContact O-N 3Å; I548-N550 VanDerWaalsContact C-N 3.27Å; I548-N550 PolarHBondContact O-N 2.78Å; N550-Q566 CarbonylContact O-C 3.57Å; N550-Q566 WeakPolarHBondContact O-CA 3.48Å; N550-M567 PolarHBondContact O-N 3.31Å
551	I	96.3	Very high	93.2	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.8	179.7	-63.5	169.3	0	0	0	110.2	F524 H547 I548 E549 V553 F564 V565 F594 K598	F524-I551 HydrophobicContact CB-CD1 3.76Å; H547-I551 WeakPolarHBondContact O-CG1 3.4Å; I548-I551 HydrophobicContact CD1-CD1 4.31Å; I548-I551 PolarHBondContact O-N 3.4Å; E549-I551 PolarHBondContact O-N 2.8Å; I551-V553 HydrophobicContact CG2-CG1 3.9Å; I551-F564 HydrophobicContact CB-CE2 4.35Å; I551-F564 HydrophobicContact CD1-CE2 3.95Å; I551-F564 HydrophobicContact CD1-CZ 4.14Å; I551-F564 HydrophobicContact CG1-CE2 3.98Å; I551-F564 HydrophobicContact CG1-CZ 3.93Å; I551-F564 HydrophobicContact CG2-CD2 3.82Å; I551-F564 HydrophobicContact CG2-CE2 3.45Å; I551-F564 VanDerWaalsContact CG2-CE2 3.45Å; I551-F564 HydrophobicContact CG2-CZ 4.11Å; I551-V565 CarbonylContact C-O 3.59Å; I551-V565 WeakPolarHBondContact CA-O 3.42Å; I551-F594 HydrophobicContact CD1-CE1 4.46Å; I551-F594 HydrophobicContact CG2-CE1 4.34Å; I551-K598 VanDerWaalsContact O-CE 3.32Å; I551-K598 WeakPolarHBondContact O-CE 3.28Å; I551-K598 PolarHBondContact O-NZ 3.44Å
552	I	96.2	Very high	93.3	Very high	67 Å²	67	64.5 Å²	64.5	34%	0.344	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	121.3	165.2	-57.8	179.7	0	0	0	108.3	V565 M567	I552-V565 HydrophobicContact CB-CB 4.4Å; I552-V565 PolarHBondContact N-O 2.71Å; I552-V565 PolarHBondContact O-N 3.15Å; I552-M567 HydrophobicContact CD1-CE 4.44Å; I552-M567 HydrophobicContact CD1-CG 4.04Å; I552-M567 HydrophobicContact CD1-SD 3.71Å; I552-M567 HydrophobicContact CG1-CG 4.2Å; I552-M567 HydrophobicContact CG1-SD 4.28Å
553	V	97	Very high	93.4	Very high	27 Å²	27	66.4 Å²	66.4	16%	0.164	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	142.8	172.7	-71	0	0	0	0	111.3	I551 F562 M563 F564 L591 F594	I551-V553 HydrophobicContact CG2-CG1 3.9Å; V553-F562 HydrophobicContact CB-CD2 4.29Å; V553-F562 HydrophobicContact CG1-CD2 3.86Å; V553-F562 HydrophobicContact CG1-CE2 4.1Å; V553-M563 VanDerWaalsContact CA-O 3.26Å; V553-M563 WeakPolarHBondContact CA-O 3.38Å; V553-F564 HydrophobicContact CG1-CB 4.41Å; V553-F564 HydrophobicContact CG1-CD2 3.85Å; V553-L591 HydrophobicContact CB-CD2 3.93Å; V553-L591 HydrophobicContact CG2-CD2 3.85Å; V553-F594 HydrophobicContact CB-CD2 4.46Å; V553-F594 HydrophobicContact CG1-CD1 4.48Å; V553-F594 HydrophobicContact CG1-CD2 4.03Å; V553-F594 HydrophobicContact CG1-CE1 4.44Å; V553-F594 HydrophobicContact CG1-CE2 4.01Å; V553-F594 HydrophobicContact CG1-CG 4.3Å; V553-F594 HydrophobicContact CG1-CZ 4.22Å; V553-F594 HydrophobicContact CG2-CB 3.72Å; V553-F594 HydrophobicContact CG2-CD2 3.96Å; V553-F594 HydrophobicContact CG2-CG 3.84Å
554	K	95	Very high	93.6	Very high	134 Å²	134	62.8 Å²	62.8	58%	0.583	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146	144.7	172.7	-65.2	-172.3	176.2	-179.1	0	110.7	F562 M563	K554-F562 CarbonylContact O-C 3.59Å; K554-F562 VanDerWaalsContact O-CA 3.28Å; K554-F562 WeakPolarHBondContact O-CA 3.28Å; K554-F562 WeakPolarHBondContact O-CB 3.41Å; K554-M563 HydrophobicContact CB-CE 4.12Å; K554-M563 HydrophobicContact CD-CE 4.25Å; K554-M563 HydrophobicContact CG-CE 4.17Å; K554-M563 PolarHBondContact N-O 2.97Å; K554-M563 VanDerWaalsContact N-O 3.08Å; K554-M563 PolarHBondContact O-N 2.75Å
555	Q	95.2	Very high	93.7	Very high	81 Å²	81	61.2 Å²	61.2	38%	0.379	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	144.3	174.9	-169	-178.2	4.8	0	0	112.1	T587 Y588 L591	Q555-T587 HydrophobicContact CG-CG2 4.46Å; Q555-Y588 VanDerWaalsContact NE2-CZ 3.29Å; Q555-Y588 PolarHBondContact NE2-OH 3.28Å; Q555-L591 HydrophobicContact CB-CD1 3.75Å; Q555-L591 HydrophobicContact CG-CD1 4.28Å
556	L	91.8	Very high	93.8	Very high	46 Å²	46	61 Å²	61	24%	0.241	29%	0.288	C	S	.	.			trans	-89.1	137.3	168.4	-64.4	174.9	0	0	0	110.8	T559 G561 M563 V578	L556-T559 WeakPolarHBondContact CD1-OG1 3.46Å; L556-G561 PolarHBondContact N-O 3.33Å; L556-G561 VanDerWaalsContact N-O 3.07Å; L556-M563 HydrophobicContact CD2-CB 4.14Å; L556-V578 HydrophobicContact CD1-CB 4.31Å; L556-V578 HydrophobicContact CD1-CG1 3.46Å; L556-V578 VanDerWaalsContact CD1-CG1 3.46Å; L556-V578 HydrophobicContact CD1-CG2 3.88Å; L556-V578 HydrophobicContact CD2-CG2 4.49Å
557	R	86.4	Confident	93.8	Very high	252 Å²	252	62.2 Å²	62.2	95%	0.951	29%	0.294	S	S	*	.	S	Bend	trans	-73.8	-29	-177.9	-65.3	179.9	179.9	168.8	-1.5	114
558	E	79.9	Confident	93.7	Very high	187 Å²	187	62.7 Å²	62.7	87%	0.874	30%	0.298	S	S	*	.	S	Bend	trans	-108.8	-9.1	-165.4	-66.5	168.6	-158.6	0	0	113.6
559	T	86.3	Confident	93.5	Very high	70 Å²	70	70.5 Å²	70.5	43%	0.429	33%	0.334	S	S	.	.	S	Bend	trans	-151.4	142.6	-173.2	57	0	0	0	0	112.2	L556 G561	L556-T559 WeakPolarHBondContact CD1-OG1 3.46Å; T559-G561 PolarHBondContact O-N 2.85Å
560	N	91.7	Very high	93.5	Very high	69 Å²	69	72.6 Å²	72.6	37%	0.369	34%	0.342	S	S	.	.	S	Bend	trans	-55.6	107.2	168.4	-64.8	-6.1	0	0	0	110.5	L580 T581 G582	N560-L580 WeakPolarHBondContact O-CA 3.45Å; N560-L580 WeakPolarHBondContact O-CD2 3.48Å; N560-T581 WeakPolarHBondContact CB-OG1 3.44Å; N560-T581 PolarHBondContact O-N 3.45Å; N560-T581 PolarHBondContact O-OG1 3.1Å; N560-G582 PolarHBondContact ND2-O 2.83Å
561	G	94.7	Very high	93.3	Very high	1 Å²	1	79.8 Å²	79.8	1%	0.01	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.6	174.6	-176.4	0	0	0	0	0	114.1	L556 T559 F579 T581 T587	L556-G561 PolarHBondContact N-O 3.33Å; L556-G561 VanDerWaalsContact N-O 3.07Å; T559-G561 PolarHBondContact O-N 2.85Å; G561-F579 CarbonylContact C-O 3.39Å; G561-F579 WeakPolarHBondContact CA-O 3.31Å; G561-T581 PolarHBondContact N-OG1 3.17Å; G561-T587 PolarHBondContact N-OG1 2.87Å; G561-T587 VanDerWaalsContact O-CG2 3.3Å; G561-T587 WeakPolarHBondContact O-CG2 3.45Å
562	F	97	Very high	93.3	Very high	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.1	179	55.6	-89.2	0	0	0	111.6	L504 V553 K554 F564 V578 F579 W590 L591 F594	L504-F562 HydrophobicContact CD1-CE1 4.31Å; L504-F562 HydrophobicContact CD1-CZ 4.11Å; V553-F562 HydrophobicContact CB-CD2 4.29Å; V553-F562 HydrophobicContact CG1-CD2 3.86Å; V553-F562 HydrophobicContact CG1-CE2 4.1Å; K554-F562 CarbonylContact O-C 3.59Å; K554-F562 VanDerWaalsContact O-CA 3.28Å; K554-F562 WeakPolarHBondContact O-CA 3.28Å; K554-F562 WeakPolarHBondContact O-CB 3.41Å; F562-F564 HydrophobicContact CD2-CB 4.46Å; F562-V578 WeakPolarHBondContact O-CA 3.36Å; F562-F579 HydrophobicContact CD1-CB 4.33Å; F562-F579 HydrophobicContact CD2-CB 4.2Å; F562-F579 HydrophobicContact CD2-CD2 4.25Å; F562-F579 HydrophobicContact CE1-CB 3.86Å; F562-F579 HydrophobicContact CE2-CB 3.72Å; F562-F579 AromaticContact CE2-CD2 3.56Å; F562-F579 HydrophobicContact CE2-CD2 3.56Å; F562-F579 HydrophobicContact CE2-CE2 4.47Å; F562-F579 AromaticContact CE2-CG 3.88Å; F562-F579 HydrophobicContact CE2-CG 3.88Å; F562-F579 HydrophobicContact CG-CB 4.48Å; F562-F579 HydrophobicContact CZ-CB 3.53Å; F562-F579 HydrophobicContact CZ-CD2 4.03Å; F562-F579 AromaticContact CZ-CG 3.89Å; F562-F579 HydrophobicContact CZ-CG 3.89Å; F562-F579 PolarHBondContact N-O 2.98Å; F562-F579 PolarHBondContact O-N 3.16Å; F562-W590 HydrophobicContact CD1-CB 4.29Å; F562-W590 HydrophobicContact CE1-CB 3.72Å; F562-W590 HydrophobicContact CE1-CD2 4.46Å; F562-W590 AromaticContact CE1-CG 3.95Å; F562-W590 HydrophobicContact CE1-CG 3.95Å; F562-W590 HydrophobicContact CZ-CB 4.39Å; F562-W590 HydrophobicContact CZ-CG 4.5Å; F562-L591 HydrophobicContact CB-CD2 3.96Å; F562-L591 HydrophobicContact CB-CG 4.47Å; F562-L591 HydrophobicContact CG-CD2 4.42Å; F562-F594 AromaticContact CE2-CE2 3.71Å; F562-F594 HydrophobicContact CE2-CE2 3.71Å; F562-F594 HydrophobicContact CE2-CZ 4.28Å; F562-F594 AromaticContact CZ-CE2 3.76Å; F562-F594 HydrophobicContact CZ-CE2 3.76Å; F562-F594 HydrophobicContact CZ-CZ 4.49Å
563	M	96	Very high	93.2	Very high	64 Å²	64	84.3 Å²	84.3	32%	0.315	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	138.1	161.3	-177.6	-167.9	77.7	0	0	108.5	V553 K554 L556 V565	V553-M563 VanDerWaalsContact CA-O 3.26Å; V553-M563 WeakPolarHBondContact CA-O 3.38Å; K554-M563 HydrophobicContact CB-CE 4.12Å; K554-M563 HydrophobicContact CD-CE 4.25Å; K554-M563 HydrophobicContact CG-CE 4.17Å; K554-M563 PolarHBondContact N-O 2.97Å; K554-M563 VanDerWaalsContact N-O 3.08Å; K554-M563 PolarHBondContact O-N 2.75Å; L556-M563 HydrophobicContact CD2-CB 4.14Å; M563-V565 HydrophobicContact CE-CG2 3.86Å; M563-V565 HydrophobicContact CG-CG2 4.18Å; M563-V565 HydrophobicContact SD-CG2 4.13Å
564	F	97.1	Very high	93.1	Very high	0 Å²	0	86 Å²	86	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.7	173.2	175.3	-81.3	0	0	0	108.8	F524 Y546 I551 V553 F562 Q566 Y575 A576 C577 F579	F524-F564 HydrophobicContact CD1-CD2 4.37Å; F524-F564 AromaticContact CD1-CE2 3.46Å; F524-F564 HydrophobicContact CD1-CE2 3.46Å; F524-F564 VanDerWaalsContact CD1-CE2 3.46Å; F524-F564 AromaticContact CD1-CZ 3.87Å; F524-F564 HydrophobicContact CD1-CZ 3.87Å; F524-F564 HydrophobicContact CE1-CD2 4.11Å; F524-F564 AromaticContact CE1-CE2 3.62Å; F524-F564 HydrophobicContact CE1-CE2 3.62Å; F524-F564 HydrophobicContact CE1-CZ 4.17Å; F524-F564 HydrophobicContact CG-CE2 4.46Å; Y546-F564 HydrophobicContact CD1-CE1 4.27Å; Y546-F564 HydrophobicContact CD1-CZ 4.09Å; Y546-F564 HydrophobicContact CD2-CE1 4.39Å; Y546-F564 AromaticContact CD2-CZ 3.82Å; Y546-F564 HydrophobicContact CD2-CZ 3.82Å; Y546-F564 HydrophobicContact CE1-CE1 4.2Å; Y546-F564 HydrophobicContact CE1-CZ 4.42Å; Y546-F564 HydrophobicContact CE2-CE1 4.32Å; Y546-F564 HydrophobicContact CE2-CZ 4.17Å; Y546-F564 HydrophobicContact CG-CE1 4.35Å; Y546-F564 AromaticContact CG-CZ 3.76Å; Y546-F564 HydrophobicContact CG-CZ 3.76Å; I551-F564 HydrophobicContact CB-CE2 4.35Å; I551-F564 HydrophobicContact CD1-CE2 3.95Å; I551-F564 HydrophobicContact CD1-CZ 4.14Å; I551-F564 HydrophobicContact CG1-CE2 3.98Å; I551-F564 HydrophobicContact CG1-CZ 3.93Å; I551-F564 HydrophobicContact CG2-CD2 3.82Å; I551-F564 HydrophobicContact CG2-CE2 3.45Å; I551-F564 VanDerWaalsContact CG2-CE2 3.45Å; I551-F564 HydrophobicContact CG2-CZ 4.11Å; V553-F564 HydrophobicContact CG1-CB 4.41Å; V553-F564 HydrophobicContact CG1-CD2 3.85Å; F562-F564 HydrophobicContact CD2-CB 4.46Å; F564-Q566 HydrophobicContact CE1-CB 4.35Å; F564-Y575 HydrophobicContact CD1-CD1 4.38Å; F564-Y575 HydrophobicContact CD1-CE1 4.1Å; F564-Y575 HydrophobicContact CE1-CD1 4.16Å; F564-Y575 HydrophobicContact CE1-CE1 4.05Å; F564-A576 CarbonylContact O-C 3.6Å; F564-A576 WeakPolarHBondContact O-CA 3.32Å; F564-C577 PolarHBondContact N-O 3.22Å; F564-C577 PolarHBondContact O-N 2.95Å; F564-C577 VanDerWaalsContact O-O 3.14Å; F564-F579 HydrophobicContact CB-CD2 3.75Å; F564-F579 HydrophobicContact CB-CE2 3.73Å; F564-F579 HydrophobicContact CD1-CE2 4.18Å; F564-F579 HydrophobicContact CD2-CD2 4.45Å; F564-F579 AromaticContact CD2-CE2 3.94Å; F564-F579 HydrophobicContact CD2-CE2 3.94Å; F564-F579 HydrophobicContact CG-CD2 4.22Å; F564-F579 AromaticContact CG-CE2 3.71Å; F564-F579 HydrophobicContact CG-CE2 3.71Å
565	V	96.9	Very high	93	Very high	16 Å²	16	82 Å²	82	10%	0.097	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	127	176.1	-179	0	0	0	0	108.7	I551 I552 M563 M567 P573 Y575 A576	I551-V565 CarbonylContact C-O 3.59Å; I551-V565 WeakPolarHBondContact CA-O 3.42Å; I552-V565 HydrophobicContact CB-CB 4.4Å; I552-V565 PolarHBondContact N-O 2.71Å; I552-V565 PolarHBondContact O-N 3.15Å; M563-V565 HydrophobicContact CE-CG2 3.86Å; M563-V565 HydrophobicContact CG-CG2 4.18Å; M563-V565 HydrophobicContact SD-CG2 4.13Å; V565-M567 HydrophobicContact CG1-SD 3.78Å; V565-P573 HydrophobicContact CG1-CB 3.79Å; V565-P573 HydrophobicContact CG1-CG 4.19Å; V565-Y575 WeakPolarHBondContact CA-O 3.42Å; V565-A576 HydrophobicContact CG2-CB 4Å
566	Q	96.2	Very high	93	Very high	48 Å²	48	81 Å²	81	22%	0.224	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128	167.3	-177.9	-168.6	12.2	0	0	109	Y546 N550 F564 P573 A574 Y575	Y546-Q566 HydrophobicContact CD1-CB 4.19Å; Y546-Q566 HydrophobicContact CD1-CG 3.95Å; Y546-Q566 HydrophobicContact CE1-CB 4.26Å; Y546-Q566 HydrophobicContact CE1-CG 4.3Å; Y546-Q566 VanDerWaalsContact CE1-OE1 3.31Å; N550-Q566 CarbonylContact O-C 3.57Å; N550-Q566 WeakPolarHBondContact O-CA 3.48Å; F564-Q566 HydrophobicContact CE1-CB 4.35Å; Q566-P573 WeakPolarHBondContact O-CA 3.42Å; Q566-A574 PolarHBondContact O-N 2.81Å; Q566-Y575 HydrophobicContact CB-CD1 4.3Å; Q566-Y575 PolarHBondContact N-O 3.03Å; Q566-Y575 PolarHBondContact O-N 3.39Å
567	M	96.4	Very high	93.2	Very high	29 Å²	29	79.2 Å²	79.2	14%	0.143	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	147.7	169.6	-47	-54.9	-68.1	0	0	109.9	N550 I552 V565 R571 V572 P573	N550-M567 PolarHBondContact O-N 3.31Å; I552-M567 HydrophobicContact CD1-CE 4.44Å; I552-M567 HydrophobicContact CD1-CG 4.04Å; I552-M567 HydrophobicContact CD1-SD 3.71Å; I552-M567 HydrophobicContact CG1-CG 4.2Å; I552-M567 HydrophobicContact CG1-SD 4.28Å; V565-M567 HydrophobicContact CG1-SD 3.78Å; M567-R571 WeakPolarHBondContact CE-O 3.46Å; M567-V572 CarbonylContact C-O 3.59Å; M567-V572 WeakPolarHBondContact CA-O 3.41Å; M567-P573 HydrophobicContact CE-CG 3.96Å; M567-P573 HydrophobicContact SD-CG 4.17Å
568	N	93.7	Very high	93.6	Very high	51 Å²	51	68.6 Å²	68.6	27%	0.273	35%	0.354	S	S	.	.			trans	-85.6	177.1	163.6	63.7	15.4	0	0	0	111.5	F570 R571 V572 A574	N568-F570 PolarHBondContact O-N 2.88Å; N568-F570 WeakPolarHBondContact OD1-CA 3.45Å; N568-F570 WeakPolarHBondContact OD1-CB 3.41Å; N568-F570 PolarHBondContact OD1-N 3.42Å; N568-F570 VanDerWaalsContact OD1-N 3.15Å; N568-R571 WeakPolarHBondContact O-CA 3.26Å; N568-R571 PolarHBondContact O-N 3.05Å; N568-R571 PolarHBondContact OD1-N 2.93Å; N568-V572 PolarHBondContact N-O 2.89Å; N568-V572 PolarHBondContact OD1-N 3.14Å; N568-V572 PolarHBondContact OD1-O 2.86Å; N568-V572 VanDerWaalsContact OD1-O 3.1Å; N568-A574 HydrophobicContact CB-CB 4.18Å
569	E	90.6	Very high	94.5	Very high	164 Å²	164	59.7 Å²	59.7	77%	0.766	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-31.2	174.6	64.5	-156.1	169	0	0	114	R571	E569-R571 PolarHBondContact O-N 3.25Å
570	F	94.2	Very high	94.9	Very high	153 Å²	153	57.5 Å²	57.5	67%	0.671	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	5.6	174.5	-54.7	-75.5	0	0	0	113.8	N568 V572	N568-F570 PolarHBondContact O-N 2.88Å; N568-F570 WeakPolarHBondContact OD1-CA 3.45Å; N568-F570 WeakPolarHBondContact OD1-CB 3.41Å; N568-F570 PolarHBondContact OD1-N 3.42Å; N568-F570 VanDerWaalsContact OD1-N 3.15Å; F570-V572 HydrophobicContact CB-CG2 4.32Å; F570-V572 PolarHBondContact O-N 3.27Å
571	R	90.7	Very high	95.1	Very high	216 Å²	216	55 Å²	55	82%	0.815	29%	0.286	S	S	*	.	S	Bend	trans	57.4	32	-175.4	-57	-174.4	174.6	-155.6	-3.9	113.8	M567 N568 E569	M567-R571 WeakPolarHBondContact CE-O 3.46Å; N568-R571 WeakPolarHBondContact O-CA 3.26Å; N568-R571 PolarHBondContact O-N 3.05Å; N568-R571 PolarHBondContact OD1-N 2.93Å; E569-R571 PolarHBondContact O-N 3.25Å
572	V	95.5	Very high	95	Very high	80 Å²	80	57.6 Å²	57.6	49%	0.485	31%	0.313	S	S	.	.	S	Bend	trans	-104.5	142.2	171.8	-177.6	0	0	0	0	109.4	M567 N568 F570 A574	M567-V572 CarbonylContact C-O 3.59Å; M567-V572 WeakPolarHBondContact CA-O 3.41Å; N568-V572 PolarHBondContact N-O 2.89Å; N568-V572 PolarHBondContact OD1-N 3.14Å; N568-V572 PolarHBondContact OD1-O 2.86Å; N568-V572 VanDerWaalsContact OD1-O 3.1Å; F570-V572 HydrophobicContact CB-CG2 4.32Å; F570-V572 PolarHBondContact O-N 3.27Å; V572-A574 PolarHBondContact O-N 3.29Å
573	P	95.3	Very high	94.9	Very high	83 Å²	83	60.8 Å²	60.8	54%	0.539	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	118.6	173.6	-25.9	36.6	0	0	0	111.9	V565 Q566 M567	V565-P573 HydrophobicContact CG1-CB 3.79Å; V565-P573 HydrophobicContact CG1-CG 4.19Å; Q566-P573 WeakPolarHBondContact O-CA 3.42Å; M567-P573 HydrophobicContact CE-CG 3.96Å; M567-P573 HydrophobicContact SD-CG 4.17Å
574	A	93.8	Very high	94.8	Very high	63 Å²	63	61.4 Å²	61.4	52%	0.521	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-32.2	176.4	0	0	0	0	0	112.3	Q566 N568 V572	Q566-A574 PolarHBondContact O-N 2.81Å; N568-A574 HydrophobicContact CB-CB 4.18Å; V572-A574 PolarHBondContact O-N 3.29Å
575	Y	94.6	Very high	94.7	Very high	50 Å²	50	68 Å²	68	20%	0.196	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	144.5	-178.6	163.9	-93.9	0	0	0	109.5	E508 Y546 F564 V565 Q566 C577	E508-Y575 HydrophobicContact CG-CE2 4.28Å; E508-Y575 WeakPolarHBondContact OE1-CE2 3.2Å; E508-Y575 PolarHBondContact OE1-OH 3.27Å; Y546-Y575 HydrophobicContact CE1-CD1 4.17Å; Y546-Y575 HydrophobicContact CE1-CE1 4.42Å; Y546-Y575 VanDerWaalsContact OH-CE1 3.25Å; Y546-Y575 WeakPolarHBondContact OH-CE1 3.43Å; F564-Y575 HydrophobicContact CD1-CD1 4.38Å; F564-Y575 HydrophobicContact CD1-CE1 4.1Å; F564-Y575 HydrophobicContact CE1-CD1 4.16Å; F564-Y575 HydrophobicContact CE1-CE1 4.05Å; V565-Y575 WeakPolarHBondContact CA-O 3.42Å; Q566-Y575 HydrophobicContact CB-CD1 4.3Å; Q566-Y575 PolarHBondContact N-O 3.03Å; Q566-Y575 PolarHBondContact O-N 3.39Å; Y575-C577 HydrophobicContact CE1-CB 4.11Å; Y575-C577 VanDerWaalsContact CE1-SG 3.58Å; Y575-C577 WeakPolarHBondContact OH-CB 3.42Å; Y575-C577 PolarHBondContact OH-SG 2.74Å; Y575-C577 VanDerWaalsContact OH-SG 3.36Å
576	A	94.8	Very high	94.6	Very high	58 Å²	58	69.2 Å²	69.2	48%	0.479	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	142	178.1	0	0	0	0	0	111	F564 V565	F564-A576 CarbonylContact O-C 3.6Å; F564-A576 WeakPolarHBondContact O-CA 3.32Å; V565-A576 HydrophobicContact CG2-CB 4Å
577	C	95.2	Very high	94.6	Very high	9 Å²	9	67 Å²	67	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	179.8	178.7	67.6	0	0	0	0	111.7	L506 E508 F564 Y575 F579	L506-C577 HydrophobicContact CD1-CB 3.78Å; L506-C577 VanDerWaalsContact CD1-SG 3.54Å; E508-C577 HydrophobicContact CG-CB 3.94Å; F564-C577 PolarHBondContact N-O 3.22Å; F564-C577 PolarHBondContact O-N 2.95Å; F564-C577 VanDerWaalsContact O-O 3.14Å; Y575-C577 HydrophobicContact CE1-CB 4.11Å; Y575-C577 VanDerWaalsContact CE1-SG 3.58Å; Y575-C577 WeakPolarHBondContact OH-CB 3.42Å; Y575-C577 PolarHBondContact OH-SG 2.74Å; Y575-C577 VanDerWaalsContact OH-SG 3.36Å; C577-F579 VanDerWaalsContact SG-CE2 3.51Å
578	V	96	Very high	94.6	Very high	29 Å²	29	71.1 Å²	71.1	18%	0.176	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	133.5	172.4	163.6	0	0	0	0	109.5	R507 L556 F562 L580	R507-V578 HydrophobicContact CB-CB 4.3Å; R507-V578 PolarHBondContact N-O 3.48Å; R507-V578 PolarHBondContact O-N 2.95Å; L556-V578 HydrophobicContact CD1-CB 4.31Å; L556-V578 HydrophobicContact CD1-CG1 3.46Å; L556-V578 VanDerWaalsContact CD1-CG1 3.46Å; L556-V578 HydrophobicContact CD1-CG2 3.88Å; L556-V578 HydrophobicContact CD2-CG2 4.49Å; F562-V578 WeakPolarHBondContact O-CA 3.36Å; V578-L580 HydrophobicContact CG1-CD2 3.57Å; V578-L580 HydrophobicContact CG1-CG 4Å
579	F	96.9	Very high	94.8	Very high	1 Å²	1	74.6 Å²	74.6	0%	0.004	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.7	164.8	-70.1	-89.3	0	0	0	109.3	L504 L506 V515 F524 V526 G561 F562 F564 C577	L504-F579 HydrophobicContact CB-CD1 4.14Å; L504-F579 HydrophobicContact CD1-CB 4.17Å; L504-F579 HydrophobicContact CD1-CD1 3.9Å; L504-F579 HydrophobicContact CD1-CG 4.29Å; L506-F579 HydrophobicContact CB-CD1 4.43Å; L506-F579 HydrophobicContact CB-CE1 4.21Å; L506-F579 HydrophobicContact CD1-CD1 4.42Å; L506-F579 HydrophobicContact CD1-CE1 3.94Å; L506-F579 HydrophobicContact CD1-CE2 4.3Å; L506-F579 HydrophobicContact CD1-CZ 3.87Å; V515-F579 HydrophobicContact CG2-CD1 4.47Å; V515-F579 HydrophobicContact CG2-CE1 4.25Å; F524-F579 HydrophobicContact CE1-CE1 4.45Å; F524-F579 AromaticContact CE1-CE2 3.98Å; F524-F579 HydrophobicContact CE1-CE2 3.98Å; F524-F579 AromaticContact CE1-CZ 3.74Å; F524-F579 HydrophobicContact CE1-CZ 3.74Å; F524-F579 HydrophobicContact CZ-CE1 4.26Å; F524-F579 HydrophobicContact CZ-CE2 4.3Å; F524-F579 AromaticContact CZ-CZ 3.98Å; F524-F579 HydrophobicContact CZ-CZ 3.98Å; V526-F579 HydrophobicContact CG1-CE1 4.26Å; V526-F579 HydrophobicContact CG2-CE1 4.12Å; V526-F579 HydrophobicContact CG2-CZ 3.77Å; G561-F579 CarbonylContact C-O 3.39Å; G561-F579 WeakPolarHBondContact CA-O 3.31Å; F562-F579 HydrophobicContact CD1-CB 4.33Å; F562-F579 HydrophobicContact CD2-CB 4.2Å; F562-F579 HydrophobicContact CD2-CD2 4.25Å; F562-F579 HydrophobicContact CE1-CB 3.86Å; F562-F579 HydrophobicContact CE2-CB 3.72Å; F562-F579 AromaticContact CE2-CD2 3.56Å; F562-F579 HydrophobicContact CE2-CD2 3.56Å; F562-F579 HydrophobicContact CE2-CE2 4.47Å; F562-F579 AromaticContact CE2-CG 3.88Å; F562-F579 HydrophobicContact CE2-CG 3.88Å; F562-F579 HydrophobicContact CG-CB 4.48Å; F562-F579 HydrophobicContact CZ-CB 3.53Å; F562-F579 HydrophobicContact CZ-CD2 4.03Å; F562-F579 AromaticContact CZ-CG 3.89Å; F562-F579 HydrophobicContact CZ-CG 3.89Å; F562-F579 PolarHBondContact N-O 2.98Å; F562-F579 PolarHBondContact O-N 3.16Å; F564-F579 HydrophobicContact CB-CD2 3.75Å; F564-F579 HydrophobicContact CB-CE2 3.73Å; F564-F579 HydrophobicContact CD1-CE2 4.18Å; F564-F579 HydrophobicContact CD2-CD2 4.45Å; F564-F579 AromaticContact CD2-CE2 3.94Å; F564-F579 HydrophobicContact CD2-CE2 3.94Å; F564-F579 HydrophobicContact CG-CD2 4.22Å; F564-F579 AromaticContact CG-CE2 3.71Å; F564-F579 HydrophobicContact CG-CE2 3.71Å; C577-F579 VanDerWaalsContact SG-CE2 3.51Å
580	L	96	Very high	95.1	Very high	23 Å²	23	66.8 Å²	66.8	12%	0.12	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	140.8	172.8	-54.7	173.8	0	0	0	110.3	K505 K512 N560 V578	K505-L580 HydrophobicContact CB-CB 4.25Å; K505-L580 PolarHBondContact N-O 3.44Å; K505-L580 PolarHBondContact O-N 3.43Å; K512-L580 HydrophobicContact CD-CD1 4.32Å; N560-L580 WeakPolarHBondContact O-CA 3.45Å; N560-L580 WeakPolarHBondContact O-CD2 3.48Å; V578-L580 HydrophobicContact CG1-CD2 3.57Å; V578-L580 HydrophobicContact CG1-CG 4Å
581	T	95.9	Very high	95.3	Very high	17 Å²	17	61 Å²	61	10%	0.104	33%	0.325	C	S	.	.			trans	-108.7	168.1	-177.7	46.8	0	0	0	0	110.8	L504 N560 G561 T583 E586 T587	L504-T581 HydrophobicContact CD2-CG2 3.69Å; N560-T581 WeakPolarHBondContact CB-OG1 3.44Å; N560-T581 PolarHBondContact O-N 3.45Å; N560-T581 PolarHBondContact O-OG1 3.1Å; G561-T581 PolarHBondContact N-OG1 3.17Å; T581-T583 PolarHBondContact OG1-O 3.36Å; T581-E586 HydrophobicContact CG2-CB 4.47Å; T581-E586 HydrophobicContact CG2-CG 3.95Å; T581-T587 PolarHBondContact OG1-OG1 3.26Å
582	G	92.6	Very high	95.6	Very high	56 Å²	56	56.1 Å²	56.1	58%	0.577	31%	0.311	S	S	*	.	S	Bend	trans	-71.2	-44.4	170.4	0	0	0	0	0	112.2	N560 E586	N560-G582 PolarHBondContact ND2-O 2.83Å; G582-E586 PolarHBondContact N-OE2 3.47Å
583	T	94.3	Very high	95.8	Very high	67 Å²	67	53.5 Å²	53.5	41%	0.411	30%	0.295	S	S	.	.	S	Bend	trans	-132	162.3	-175.8	70.1	0	0	0	0	113.4	T581 E585 E586 T587	T581-T583 PolarHBondContact OG1-O 3.36Å; T583-E585 VanDerWaalsContact C-N 3.32Å; T583-E586 PolarHBondContact O-N 3.48Å; T583-E586 WeakPolarHBondContact OG1-CB 3.35Å; T583-E586 PolarHBondContact OG1-N 2.89Å; T583-E586 VanDerWaalsContact OG1-N 3.09Å; T583-T587 PolarHBondContact O-N 2.93Å; T583-T587 VanDerWaalsContact O-N 3.11Å; T583-T587 PolarHBondContact O-OG1 3.31Å
584	L	93.9	Very high	95.9	Very high	77 Å²	77	49.6 Å²	49.6	40%	0.403	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-38.8	172.3	-173.4	62.2	0	0	0	111.6	E586 T587 Y588	L584-E586 PolarHBondContact O-N 2.87Å; L584-T587 WeakPolarHBondContact O-CA 3.47Å; L584-T587 WeakPolarHBondContact O-CB 3.31Å; L584-T587 PolarHBondContact O-N 3.22Å; L584-T587 VanDerWaalsContact O-N 3.08Å; L584-Y588 HydrophobicContact CD1-CE2 4.02Å; L584-Y588 HydrophobicContact CD2-CE2 4.05Å; L584-Y588 HydrophobicContact CG-CD2 4.16Å; L584-Y588 HydrophobicContact CG-CE2 3.64Å; L584-Y588 WeakPolarHBondContact O-CD2 3.49Å; L584-Y588 PolarHBondContact O-N 3.15Å
585	E	94.6	Very high	96	Very high	139 Å²	139	51.4 Å²	51.4	65%	0.65	27%	0.267	S	S	*	.	H	α-helix	trans	-58.2	-44.4	173.4	-62.4	172.8	-170	0	0	112.6	T583 T587 Y588 R589	T583-E585 VanDerWaalsContact C-N 3.32Å; E585-T587 VanDerWaalsContact C-N 3.26Å; E585-T587 PolarHBondContact O-N 2.76Å; E585-Y588 PolarHBondContact O-N 3.07Å; E585-R589 WeakPolarHBondContact O-CB 3.47Å; E585-R589 PolarHBondContact O-N 2.83Å
586	E	95.8	Very high	96.2	Very high	41 Å²	41	51.7 Å²	51.7	19%	0.192	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-36.4	175.3	179	175.9	-138.6	0	0	111	T581 G582 T583 L584 R589 W590	T581-E586 HydrophobicContact CG2-CB 4.47Å; T581-E586 HydrophobicContact CG2-CG 3.95Å; G582-E586 PolarHBondContact N-OE2 3.47Å; T583-E586 PolarHBondContact O-N 3.48Å; T583-E586 WeakPolarHBondContact OG1-CB 3.35Å; T583-E586 PolarHBondContact OG1-N 2.89Å; T583-E586 VanDerWaalsContact OG1-N 3.09Å; L584-E586 PolarHBondContact O-N 2.87Å; E586-R589 PolarHBondContact O-N 3.31Å; E586-W590 VanDerWaalsContact O-CD1 3.25Å; E586-W590 PolarHBondContact O-N 3.24Å
587	T	96.6	Very high	96.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-48.5	174.6	-44.2	0	0	0	0	111.7	Q555 G561 T581 T583 L584 E585 W590 L591	Q555-T587 HydrophobicContact CG-CG2 4.46Å; G561-T587 PolarHBondContact N-OG1 2.87Å; G561-T587 VanDerWaalsContact O-CG2 3.3Å; G561-T587 WeakPolarHBondContact O-CG2 3.45Å; T581-T587 PolarHBondContact OG1-OG1 3.26Å; T583-T587 PolarHBondContact O-N 2.93Å; T583-T587 VanDerWaalsContact O-N 3.11Å; T583-T587 PolarHBondContact O-OG1 3.31Å; L584-T587 WeakPolarHBondContact O-CA 3.47Å; L584-T587 WeakPolarHBondContact O-CB 3.31Å; L584-T587 PolarHBondContact O-N 3.22Å; L584-T587 VanDerWaalsContact O-N 3.08Å; E585-T587 VanDerWaalsContact C-N 3.26Å; E585-T587 PolarHBondContact O-N 2.76Å; T587-W590 PolarHBondContact O-N 3.36Å; T587-L591 HydrophobicContact CG2-CD1 4.28Å; T587-L591 WeakPolarHBondContact O-CG 3.3Å; T587-L591 PolarHBondContact O-N 3.42Å; T587-L591 VanDerWaalsContact O-N 3.12Å
588	Y	96.5	Very high	96.3	Very high	117 Å²	117	51.5 Å²	51.5	46%	0.459	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-42.9	176.7	-69.9	-55.8	0	0	0	111.9	Q555 L584 E585 W590 L591 E592	Q555-Y588 VanDerWaalsContact NE2-CZ 3.29Å; Q555-Y588 PolarHBondContact NE2-OH 3.28Å; L584-Y588 HydrophobicContact CD1-CE2 4.02Å; L584-Y588 HydrophobicContact CD2-CE2 4.05Å; L584-Y588 HydrophobicContact CG-CD2 4.16Å; L584-Y588 HydrophobicContact CG-CE2 3.64Å; L584-Y588 WeakPolarHBondContact O-CD2 3.49Å; L584-Y588 PolarHBondContact O-N 3.15Å; E585-Y588 PolarHBondContact O-N 3.07Å; Y588-W590 VanDerWaalsContact C-N 3.32Å; Y588-W590 PolarHBondContact O-N 3.38Å; Y588-L591 PolarHBondContact O-N 3.06Å; Y588-L591 VanDerWaalsContact O-N 3.15Å; Y588-E592 VanDerWaalsContact O-CB 3.31Å; Y588-E592 WeakPolarHBondContact O-CB 3.43Å; Y588-E592 PolarHBondContact O-N 3.45Å
589	R	97.3	Very high	96.3	Very high	123 Å²	123	54.2 Å²	54.2	46%	0.464	27%	0.269	S	S	.	.	H	α-helix	trans	-58.6	-40.3	176.9	-170	-176.9	-63.1	134.5	6.9	112.6	I500 E585 E586 N593	I500-R589 HydrophobicContact CD1-CG 3.95Å; E585-R589 WeakPolarHBondContact O-CB 3.47Å; E585-R589 PolarHBondContact O-N 2.83Å; E586-R589 PolarHBondContact O-N 3.31Å; R589-N593 WeakPolarHBondContact O-CB 3.49Å; R589-N593 PolarHBondContact O-N 3.32Å; R589-N593 PolarHBondContact O-ND2 3.39Å
590	W	97.9	Very high	96.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-46.7	174	-86.5	101.9	0	0	0	112	I500 L504 C517 L519 F524 F562 E586 T587 Y588 E592 N593 F594	I500-W590 HydrophobicContact CD1-CD2 4.23Å; I500-W590 HydrophobicContact CD1-CG 4.47Å; I500-W590 HydrophobicContact CG1-CH2 4.47Å; I500-W590 HydrophobicContact CG1-CZ2 4.28Å; I500-W590 HydrophobicContact CG2-CD2 4.34Å; I500-W590 HydrophobicContact CG2-CE3 3.79Å; I500-W590 HydrophobicContact CG2-CH2 4.08Å; I500-W590 HydrophobicContact CG2-CZ3 3.64Å; L504-W590 HydrophobicContact CD1-CD2 4.28Å; L504-W590 HydrophobicContact CD1-CH2 4.33Å; L504-W590 HydrophobicContact CD1-CZ2 3.81Å; L504-W590 HydrophobicContact CG-CZ2 4.21Å; C517-W590 HydrophobicContact CB-CH2 3.78Å; C517-W590 HydrophobicContact CB-CZ2 4.32Å; L519-W590 HydrophobicContact CB-CZ3 3.92Å; F524-W590 HydrophobicContact CD2-CZ3 4.48Å; F524-W590 HydrophobicContact CE2-CH2 4.31Å; F524-W590 AromaticContact CE2-CZ3 3.78Å; F524-W590 HydrophobicContact CE2-CZ3 3.78Å; F562-W590 HydrophobicContact CD1-CB 4.29Å; F562-W590 HydrophobicContact CE1-CB 3.72Å; F562-W590 HydrophobicContact CE1-CD2 4.46Å; F562-W590 AromaticContact CE1-CG 3.95Å; F562-W590 HydrophobicContact CE1-CG 3.95Å; F562-W590 HydrophobicContact CZ-CB 4.39Å; F562-W590 HydrophobicContact CZ-CG 4.5Å; E586-W590 VanDerWaalsContact O-CD1 3.25Å; E586-W590 PolarHBondContact O-N 3.24Å; T587-W590 PolarHBondContact O-N 3.36Å; Y588-W590 VanDerWaalsContact C-N 3.32Å; Y588-W590 PolarHBondContact O-N 3.38Å; W590-E592 PolarHBondContact O-N 2.84Å; W590-N593 PolarHBondContact O-N 3.04Å; W590-F594 AromaticContact CE3-CE2 3.91Å; W590-F594 HydrophobicContact CE3-CE2 3.91Å; W590-F594 HydrophobicContact CE3-CZ 4.47Å; W590-F594 WeakPolarHBondContact O-CD2 3.26Å; W590-F594 PolarHBondContact O-N 2.85Å
591	L	97.4	Very high	96.1	Very high	32 Å²	32	54.2 Å²	54.2	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-41.6	179.4	-69	168	0	0	0	112.4	V553 Q555 F562 T587 Y588 F594 Q595	V553-L591 HydrophobicContact CB-CD2 3.93Å; V553-L591 HydrophobicContact CG2-CD2 3.85Å; Q555-L591 HydrophobicContact CB-CD1 3.75Å; Q555-L591 HydrophobicContact CG-CD1 4.28Å; F562-L591 HydrophobicContact CB-CD2 3.96Å; F562-L591 HydrophobicContact CB-CG 4.47Å; F562-L591 HydrophobicContact CG-CD2 4.42Å; T587-L591 HydrophobicContact CG2-CD1 4.28Å; T587-L591 WeakPolarHBondContact O-CG 3.3Å; T587-L591 PolarHBondContact O-N 3.42Å; T587-L591 VanDerWaalsContact O-N 3.12Å; Y588-L591 PolarHBondContact O-N 3.06Å; Y588-L591 VanDerWaalsContact O-N 3.15Å; L591-F594 PolarHBondContact O-N 2.83Å; L591-Q595 PolarHBondContact O-N 3.25Å
592	E	97.6	Very high	95.9	Very high	114 Å²	114	56.6 Å²	56.6	53%	0.533	29%	0.286	S	S	.	.	H	α-helix	trans	-57.7	-48.6	171.5	175.7	-174.1	-137.6	0	0	111.3	Y588 W590 F594 Q595 I596	Y588-E592 VanDerWaalsContact O-CB 3.31Å; Y588-E592 WeakPolarHBondContact O-CB 3.43Å; Y588-E592 PolarHBondContact O-N 3.45Å; W590-E592 PolarHBondContact O-N 2.84Å; E592-F594 VanDerWaalsContact C-N 3.34Å; E592-F594 PolarHBondContact O-N 3.17Å; E592-Q595 WeakPolarHBondContact O-CB 3.16Å; E592-Q595 PolarHBondContact O-N 2.82Å; E592-Q595 VanDerWaalsContact O-N 3.09Å; E592-I596 HydrophobicContact CG-CD1 3.96Å; E592-I596 WeakPolarHBondContact O-CG1 3.09Å; E592-I596 PolarHBondContact O-N 3.47Å
593	N	98.1	Very high	95.9	Very high	25 Å²	25	56.7 Å²	56.7	13%	0.134	27%	0.269	C	S	.	.	H	α-helix	trans	-67.3	-32.1	179.1	-82.5	-105.5	0	0	0	112.6	I500 L519 R589 W590 Q595 A597	I500-N593 HydrophobicContact CB-CB 4.38Å; I500-N593 HydrophobicContact CG2-CB 3.63Å; L519-N593 HydrophobicContact CD2-CB 4.02Å; R589-N593 WeakPolarHBondContact O-CB 3.49Å; R589-N593 PolarHBondContact O-N 3.32Å; R589-N593 PolarHBondContact O-ND2 3.39Å; W590-N593 PolarHBondContact O-N 3.04Å; N593-Q595 VanDerWaalsContact C-N 3.34Å; N593-A597 WeakPolarHBondContact O-CB 3.28Å; N593-A597 PolarHBondContact O-N 2.71Å
594	F	98.1	Very high	95.6	Very high	1 Å²	1	54.6 Å²	54.6	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-32.9	170.4	-83.8	-67.6	0	0	0	112.8	L519 F524 I548 I551 V553 F562 W590 L591 E592 K598	L519-F594 HydrophobicContact CD1-CD1 3.88Å; L519-F594 HydrophobicContact CD1-CE1 3.74Å; L519-F594 HydrophobicContact CD2-CB 4.45Å; L519-F594 HydrophobicContact CD2-CD1 3.74Å; L519-F594 HydrophobicContact CD2-CD2 4.31Å; L519-F594 HydrophobicContact CD2-CE1 4.02Å; L519-F594 HydrophobicContact CD2-CG 3.89Å; L519-F594 HydrophobicContact CD2-CZ 4.41Å; L519-F594 HydrophobicContact CG-CD1 4.49Å; L519-F594 HydrophobicContact CG-CE1 4.48Å; F524-F594 HydrophobicContact CB-CE1 4.35Å; F524-F594 HydrophobicContact CD1-CZ 4.34Å; F524-F594 HydrophobicContact CD2-CE1 4.02Å; F524-F594 AromaticContact CD2-CZ 3.79Å; F524-F594 HydrophobicContact CD2-CZ 3.79Å; F524-F594 HydrophobicContact CE1-CZ 4.29Å; F524-F594 HydrophobicContact CE2-CE1 4.43Å; F524-F594 AromaticContact CE2-CZ 3.73Å; F524-F594 HydrophobicContact CE2-CZ 3.73Å; F524-F594 HydrophobicContact CG-CE1 4.07Å; F524-F594 HydrophobicContact CG-CZ 4.1Å; F524-F594 AromaticContact CZ-CZ 3.99Å; F524-F594 HydrophobicContact CZ-CZ 3.99Å; I548-F594 HydrophobicContact CD1-CD1 3.96Å; I551-F594 HydrophobicContact CD1-CE1 4.46Å; I551-F594 HydrophobicContact CG2-CE1 4.34Å; V553-F594 HydrophobicContact CB-CD2 4.46Å; V553-F594 HydrophobicContact CG1-CD1 4.48Å; V553-F594 HydrophobicContact CG1-CD2 4.03Å; V553-F594 HydrophobicContact CG1-CE1 4.44Å; V553-F594 HydrophobicContact CG1-CE2 4.01Å; V553-F594 HydrophobicContact CG1-CG 4.3Å; V553-F594 HydrophobicContact CG1-CZ 4.22Å; V553-F594 HydrophobicContact CG2-CB 3.72Å; V553-F594 HydrophobicContact CG2-CD2 3.96Å; V553-F594 HydrophobicContact CG2-CG 3.84Å; F562-F594 AromaticContact CE2-CE2 3.71Å; F562-F594 HydrophobicContact CE2-CE2 3.71Å; F562-F594 HydrophobicContact CE2-CZ 4.28Å; F562-F594 AromaticContact CZ-CE2 3.76Å; F562-F594 HydrophobicContact CZ-CE2 3.76Å; F562-F594 HydrophobicContact CZ-CZ 4.49Å; W590-F594 AromaticContact CE3-CE2 3.91Å; W590-F594 HydrophobicContact CE3-CE2 3.91Å; W590-F594 HydrophobicContact CE3-CZ 4.47Å; W590-F594 WeakPolarHBondContact O-CD2 3.26Å; W590-F594 PolarHBondContact O-N 2.85Å; L591-F594 PolarHBondContact O-N 2.83Å; E592-F594 VanDerWaalsContact C-N 3.34Å; E592-F594 PolarHBondContact O-N 3.17Å; F594-K598 WeakPolarHBondContact O-CG 3.37Å; F594-K598 PolarHBondContact O-N 2.89Å
595	Q	97	Very high	95.4	Very high	101 Å²	101	53 Å²	53	47%	0.472	25%	0.25	S	S	.	.	H	α-helix	trans	-71.8	-47.3	174.8	-174.7	61.8	21.6	0	0	111	L591 E592 N593 A597 K598 E599	L591-Q595 PolarHBondContact O-N 3.25Å; E592-Q595 WeakPolarHBondContact O-CB 3.16Å; E592-Q595 PolarHBondContact O-N 2.82Å; E592-Q595 VanDerWaalsContact O-N 3.09Å; N593-Q595 VanDerWaalsContact C-N 3.34Å; Q595-A597 VanDerWaalsContact C-N 3.29Å; Q595-A597 PolarHBondContact O-N 3.19Å; Q595-K598 PolarHBondContact O-N 3.4Å; Q595-K598 VanDerWaalsContact O-N 3.1Å; Q595-E599 WeakPolarHBondContact CG-OE1 3.48Å; Q595-E599 PolarHBondContact NE2-OE1 2.85Å; Q595-E599 PolarHBondContact O-N 3.39Å
596	I	97.2	Very high	94.9	Very high	55 Å²	55	49.7 Å²	49.7	28%	0.282	25%	0.247	S	C	.	.	H	α-helix	trans	-55.7	-44	174.3	-67.8	166.7	0	0	0	111	E592 K598 E599 E600	E592-I596 HydrophobicContact CG-CD1 3.96Å; E592-I596 WeakPolarHBondContact O-CG1 3.09Å; E592-I596 PolarHBondContact O-N 3.47Å; I596-K598 VanDerWaalsContact C-N 3.32Å; I596-K598 PolarHBondContact O-N 3.28Å; I596-E599 PolarHBondContact O-N 2.85Å; I596-E600 HydrophobicContact CG2-CG 4.47Å; I596-E600 VanDerWaalsContact CG2-OE1 3.28Å; I596-E600 WeakPolarHBondContact CG2-OE1 3.42Å; I596-E600 WeakPolarHBondContact O-CB 3.23Å; I596-E600 PolarHBondContact O-N 3.06Å
597	A	97.4	Very high	93.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-56.6	-45.1	176.6	0	0	0	0	0	112.3	L499 L519 I548 N593 Q595 Y601	L499-A597 HydrophobicContact CD1-CB 3.5Å; L519-A597 HydrophobicContact CD1-CB 4.32Å; L519-A597 HydrophobicContact CD2-CB 4.46Å; L519-A597 HydrophobicContact CG-CB 4.5Å; I548-A597 HydrophobicContact CD1-CB 3.72Å; I548-A597 HydrophobicContact CG1-CB 3.76Å; N593-A597 WeakPolarHBondContact O-CB 3.28Å; N593-A597 PolarHBondContact O-N 2.71Å; Q595-A597 VanDerWaalsContact C-N 3.29Å; Q595-A597 PolarHBondContact O-N 3.19Å; A597-Y601 VanDerWaalsContact O-CB 3.22Å; A597-Y601 WeakPolarHBondContact O-CB 3.3Å; A597-Y601 PolarHBondContact O-N 3.13Å
598	K	96	Very high	91.2	Very high	64 Å²	64	60.2 Å²	60.2	28%	0.278	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-41.5	179	-74.3	-178.9	172.3	-151.6	0	113	I548 I551 F594 Q595 I596 S602	I548-K598 HydrophobicContact CD1-CG 4.24Å; I548-K598 HydrophobicContact CG1-CG 3.72Å; I548-K598 WeakPolarHBondContact O-CE 3.4Å; I551-K598 VanDerWaalsContact O-CE 3.32Å; I551-K598 WeakPolarHBondContact O-CE 3.28Å; I551-K598 PolarHBondContact O-NZ 3.44Å; F594-K598 WeakPolarHBondContact O-CG 3.37Å; F594-K598 PolarHBondContact O-N 2.89Å; Q595-K598 PolarHBondContact O-N 3.4Å; Q595-K598 VanDerWaalsContact O-N 3.1Å; I596-K598 VanDerWaalsContact C-N 3.32Å; I596-K598 PolarHBondContact O-N 3.28Å; K598-S602 WeakPolarHBondContact O-CB 3.48Å; K598-S602 PolarHBondContact O-N 2.83Å
599	E	95.4	Very high	88.7	Confident	86 Å²	86	62.6 Å²	62.6	40%	0.402	31%	0.305	S	S	.	.	H	α-helix	trans	-67.1	-46.1	178.7	-71.2	174.6	-170	0	0	111.1	Q595 I596 Y603	Q595-E599 WeakPolarHBondContact CG-OE1 3.48Å; Q595-E599 PolarHBondContact NE2-OE1 2.85Å; Q595-E599 PolarHBondContact O-N 3.39Å; I596-E599 PolarHBondContact O-N 2.85Å; E599-Y603 WeakPolarHBondContact O-CB 3.24Å; E599-Y603 PolarHBondContact O-N 3.25Å
600	E	93.3	Very high	85.6	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-64.5	-44.8	175	-78.9	178.4	-146.8	0	0	112.2	R497 T521 I596 Y603 L604	R497-E600 IonicContact CZ-OE1 2.69Å; R497-E600 IonicContact CZ-OE2 2.88Å; R497-E600 IonicContact NE-OE1 3.1Å; R497-E600 IonicContact NE-OE2 2.69Å; R497-E600 PolarHBondContact NE-OE2 3.14Å; R497-E600 IonicContact NH2-OE1 2.6Å; R497-E600 PolarHBondContact NH2-OE1 2.93Å; R497-E600 IonicContact NH2-OE2 2.74Å; R497-E600 PolarHBondContact NH2-OE2 2.97Å; T521-E600 HydrophobicContact CG2-CB 4.21Å; T521-E600 WeakPolarHBondContact CG2-OE2 3.24Å; I596-E600 HydrophobicContact CG2-CG 4.47Å; I596-E600 VanDerWaalsContact CG2-OE1 3.28Å; I596-E600 WeakPolarHBondContact CG2-OE1 3.42Å; I596-E600 WeakPolarHBondContact O-CB 3.23Å; I596-E600 PolarHBondContact O-N 3.06Å; E600-Y603 PolarHBondContact O-N 3.33Å; E600-L604 WeakPolarHBondContact O-CB 3.46Å; E600-L604 WeakPolarHBondContact O-CD1 3.35Å; E600-L604 WeakPolarHBondContact O-CG 3.38Å; E600-L604 PolarHBondContact O-N 3.01Å
601	Y	94.7	Very high	82.5	Confident	9 Å²	9	65.3 Å²	65.3	4%	0.035	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-45.4	177.3	178	-86	0	0	0	112	P488 D522 H547 I548 E549 A597 Y603 L604 S605	P488-Y601 WeakPolarHBondContact O-CE2 3.4Å; P488-Y601 PolarHBondContact O-OH 2.91Å; D522-Y601 HydrophobicContact CB-CD2 3.69Å; D522-Y601 HydrophobicContact CB-CE2 3.96Å; H547-Y601 AromaticContact CE1-CE2 3.89Å; H547-Y601 AromaticContact CE1-CZ 3.47Å; H547-Y601 VanDerWaalsContact CE1-CZ 3.47Å; H547-Y601 PolarHBondContact CE1-OH 3.29Å; H547-Y601 VanDerWaalsContact CE1-OH 3.27Å; H547-Y601 AromaticContact NE2-CE2 3.51Å; H547-Y601 AromaticContact NE2-CZ 3.58Å; H547-Y601 PolarHBondContact NE2-OH 3.5Å; I548-Y601 HydrophobicContact CG2-CD1 4.03Å; I548-Y601 HydrophobicContact CG2-CD2 4.05Å; I548-Y601 HydrophobicContact CG2-CG 3.64Å; E549-Y601 HydrophobicContact CG-CD1 3.76Å; E549-Y601 HydrophobicContact CG-CE1 3.52Å; A597-Y601 VanDerWaalsContact O-CB 3.22Å; A597-Y601 WeakPolarHBondContact O-CB 3.3Å; A597-Y601 PolarHBondContact O-N 3.13Å; Y601-Y603 VanDerWaalsContact C-N 3.31Å; Y601-Y603 PolarHBondContact O-N 2.67Å; Y601-L604 PolarHBondContact O-N 3.46Å; Y601-L604 VanDerWaalsContact O-N 3.15Å; Y601-S605 WeakPolarHBondContact O-CB 3.3Å; Y601-S605 PolarHBondContact O-N 2.88Å; Y601-S605 PolarHBondContact O-OG 3.3Å; Y601-S605 VanDerWaalsContact O-OG 3.08Å
602	S	93.1	Very high	79.5	Confident	68 Å²	68	71.1 Å²	71.1	48%	0.476	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-40.6	177.3	-176.4	0	0	0	0	111.9	K598 S605 A606	K598-S602 WeakPolarHBondContact O-CB 3.48Å; K598-S602 PolarHBondContact O-N 2.83Å; S602-S605 PolarHBondContact O-OG 3.43Å; S602-A606 WeakPolarHBondContact O-CB 3.32Å; S602-A606 PolarHBondContact O-N 3.46Å; S602-A606 VanDerWaalsContact O-N 3.12Å
603	Y	91.3	Very high	76.6	Confident	58 Å²	58	72.8 Å²	72.8	23%	0.227	38%	0.381	C	S	.	.	H	α-helix	trans	-64.4	-43.8	173.2	-178	-96.2	0	0	0	112.3	E599 E600 Y601 Y607 F757	E599-Y603 WeakPolarHBondContact O-CB 3.24Å; E599-Y603 PolarHBondContact O-N 3.25Å; E600-Y603 PolarHBondContact O-N 3.33Å; Y601-Y603 VanDerWaalsContact C-N 3.31Å; Y601-Y603 PolarHBondContact O-N 2.67Å; Y603-Y607 AromaticContact CD2-CD2 3.85Å; Y603-Y607 HydrophobicContact CD2-CD2 3.85Å; Y603-Y607 AromaticContact CD2-CE2 3.54Å; Y603-Y607 HydrophobicContact CD2-CE2 3.54Å; Y603-Y607 AromaticContact CE2-CD2 3.77Å; Y603-Y607 HydrophobicContact CE2-CD2 3.77Å; Y603-Y607 HydrophobicContact CE2-CE1 4.22Å; Y603-Y607 AromaticContact CE2-CE2 3.36Å; Y603-Y607 HydrophobicContact CE2-CE2 3.36Å; Y603-Y607 HydrophobicContact CE2-CG 4.35Å; Y603-Y607 AromaticContact CE2-CZ 3.6Å; Y603-Y607 HydrophobicContact CG-CD2 4.38Å; Y603-Y607 HydrophobicContact CG-CE2 4.47Å; Y603-Y607 VanDerWaalsContact O-CD2 3.29Å; Y603-Y607 WeakPolarHBondContact O-CD2 3.38Å; Y603-Y607 PolarHBondContact O-N 3.09Å; Y603-F757 HydrophobicContact CE1-CE2 4.44Å; Y603-F757 HydrophobicContact CE1-CZ 4.46Å
604	L	89.6	Confident	73.3	Confident	23 Å²	23	74.4 Å²	74.4	12%	0.12	40%	0.404	C	S	.	.	H	α-helix	trans	-75.5	-23	-176.3	-68.4	170.1	0	0	0	114.2	M487 L494 E600 Y601 F757	M487-L604 HydrophobicContact CE-CD1 4.05Å; L494-L604 HydrophobicContact CD1-CB 4.34Å; L494-L604 HydrophobicContact CD1-CD2 4.17Å; L494-L604 HydrophobicContact CD2-CD2 4.27Å; E600-L604 WeakPolarHBondContact O-CB 3.46Å; E600-L604 WeakPolarHBondContact O-CD1 3.35Å; E600-L604 WeakPolarHBondContact O-CG 3.38Å; E600-L604 PolarHBondContact O-N 3.01Å; Y601-L604 PolarHBondContact O-N 3.46Å; Y601-L604 VanDerWaalsContact O-N 3.15Å; L604-F757 HydrophobicContact CD2-CZ 4.25Å
605	S	89	Confident	70	Confident	42 Å²	42	84.4 Å²	84.4	29%	0.294	44%	0.443	S	S	.	.	H	α-helix	trans	-88.6	-28.6	174.1	64.4	0	0	0	0	113.3	Y601 S602	Y601-S605 WeakPolarHBondContact O-CB 3.3Å; Y601-S605 PolarHBondContact O-N 2.88Å; Y601-S605 PolarHBondContact O-OG 3.3Å; Y601-S605 VanDerWaalsContact O-OG 3.08Å; S602-S605 PolarHBondContact O-OG 3.43Å
606	A	82.9	Confident	66.7	Low	71 Å²	71	84 Å²	84	59%	0.587	46%	0.457	S	S	*	.	H	α-helix	trans	-79.5	-24.5	-178.9	0	0	0	0	0	115.2	S602 D608	S602-A606 WeakPolarHBondContact O-CB 3.32Å; S602-A606 PolarHBondContact O-N 3.46Å; S602-A606 VanDerWaalsContact O-N 3.12Å; A606-D608 PolarHBondContact O-N 3.41Å
607	Y	65.5	Low	63.5	Low	133 Å²	133	86.9 Å²	86.9	52%	0.522	47%	0.473	S	S	.	.			trans	-91.8	72.9	-168.5	-88.8	-102.9	0	0	0	114.7	R491 Y603 Y609	R491-Y607 WeakPolarHBondContact CD-O 3.22Å; Y603-Y607 AromaticContact CD2-CD2 3.85Å; Y603-Y607 HydrophobicContact CD2-CD2 3.85Å; Y603-Y607 AromaticContact CD2-CE2 3.54Å; Y603-Y607 HydrophobicContact CD2-CE2 3.54Å; Y603-Y607 AromaticContact CE2-CD2 3.77Å; Y603-Y607 HydrophobicContact CE2-CD2 3.77Å; Y603-Y607 HydrophobicContact CE2-CE1 4.22Å; Y603-Y607 AromaticContact CE2-CE2 3.36Å; Y603-Y607 HydrophobicContact CE2-CE2 3.36Å; Y603-Y607 HydrophobicContact CE2-CG 4.35Å; Y603-Y607 AromaticContact CE2-CZ 3.6Å; Y603-Y607 HydrophobicContact CG-CD2 4.38Å; Y603-Y607 HydrophobicContact CG-CE2 4.47Å; Y603-Y607 VanDerWaalsContact O-CD2 3.29Å; Y603-Y607 WeakPolarHBondContact O-CD2 3.38Å; Y603-Y607 PolarHBondContact O-N 3.09Å; Y607-Y609 VanDerWaalsContact C-N 3.35Å; Y607-Y609 PolarHBondContact O-N 3.28Å; Y607-Y609 VanDerWaalsContact O-N 3.08Å
608	D	50.4	Low	60.4	Low	128 Å²	128	95.9 Å²	95.9	68%	0.684	52%	0.515	S	S	*	.			trans	-86.1	61.4	179.8	-154	11	0	0	0	114.4	R491 A606 P610	R491-D608 IonicContact CZ-OD1 3.82Å; R491-D608 IonicContact NE-OD1 3.7Å; R491-D608 PolarHBondContact NE-OD1 3.09Å; R491-D608 VanDerWaalsContact NH2-C 3.29Å; R491-D608 IonicContact NH2-OD1 2.64Å; R491-D608 PolarHBondContact NH2-OD1 3.34Å; A606-D608 PolarHBondContact O-N 3.41Å; D608-P610 WeakPolarHBondContact O-CD 3.42Å
609	Y	44.7	Very low	57.4	Low	168 Å²	168	100.5 Å²	100.5	66%	0.659	54%	0.536	S	S	*	.			trans	-90.5	113.7	-178	-136.6	-74.6	0	0	0	113.8	R491 Y607 S611	R491-Y609 VanDerWaalsContact CZ-N 3.31Å; R491-Y609 VanDerWaalsContact CZ-O 3.29Å; R491-Y609 PolarHBondContact NH1-O 3.15Å; R491-Y609 VanDerWaalsContact NH2-N 3.19Å; R491-Y609 PolarHBondContact NH2-O 3.42Å; Y607-Y609 VanDerWaalsContact C-N 3.35Å; Y607-Y609 PolarHBondContact O-N 3.28Å; Y607-Y609 VanDerWaalsContact O-N 3.08Å; Y609-S611 PolarHBondContact O-N 3.47Å
610	P	32.2	Very low	54.2	Low	117 Å²	117	100 Å²	100	76%	0.76	55%	0.553	S	S	*	*	S	Bend	trans	-88.5	84.2	-175.9	34.2	-34.7	0	0	0	112.7	D608	D608-P610 WeakPolarHBondContact O-CD 3.42Å
611	S	32.4	Very low	51.1	Low	62 Å²	62	104.1 Å²	104.1	43%	0.434	58%	0.579	S	S	.	*			trans	-159.5	-32	174.6	56.9	0	0	0	0	117.7	Y609 I613 G614	Y609-S611 PolarHBondContact O-N 3.47Å; S611-I613 PolarHBondContact O-N 3.41Å; S611-G614 WeakPolarHBondContact O-CA 3.48Å; S611-G614 PolarHBondContact O-N 2.85Å
612	L	34.3	Very low	47.7	Very low	155 Å²	155	113 Å²	113	81%	0.812	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	4.3	-164.5	-115.4	158.6	0	0	0	117.1
613	I	37.1	Very low	44.6	Very low	149 Å²	149	117.1 Å²	117.1	76%	0.764	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-9.2	165.6	-67.1	172.6	0	0	0	110.9	S611	S611-I613 PolarHBondContact O-N 3.41Å
614	G	27.3	Very low	41.5	Very low	58 Å²	58	116.9 Å²	116.9	60%	0.598	64%	0.642	S	S	*	*			trans	-106.4	31.6	-168.6	0	0	0	0	0	115.6	S611 A616	S611-G614 WeakPolarHBondContact O-CA 3.48Å; S611-G614 PolarHBondContact O-N 2.85Å; G614-A616 PolarHBondContact O-N 3.29Å
615	Y	29.6	Very low	38.8	Very low	211 Å²	211	121.6 Å²	121.6	83%	0.827	66%	0.659	S	S	*	*			trans	-75.2	72.4	159.9	-85.4	-75	0	0	0	109.7	D617	Y615-D617 PolarHBondContact O-N 2.97Å
616	A	27.7	Very low	35.9	Very low	94 Å²	94	124.5 Å²	124.5	78%	0.777	68%	0.677	S	S	*	*			trans	-76.4	96.5	160.4	0	0	0	0	0	107.6	G614	G614-A616 PolarHBondContact O-N 3.29Å
617	D	29.7	Very low	33.6	Very low	115 Å²	115	124.2 Å²	124.2	62%	0.615	67%	0.665	S	S	*	*			trans	-61.5	155	166.8	-169.1	8.6	0	0	0	110	Y615 F619	Y615-D617 PolarHBondContact O-N 2.97Å; D617-F619 PolarHBondContact O-N 3.44Å
618	E	33.3	Very low	32	Very low	189 Å²	189	129.3 Å²	129.3	88%	0.883	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-3.3	-167.4	-62.4	-170.7	138	0	0	114	G620	E618-G620 VanDerWaalsContact C-N 3.35Å; E618-G620 PolarHBondContact O-N 2.84Å
619	F	32.1	Very low	31.1	Very low	161 Å²	161	126.9 Å²	126.9	71%	0.706	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	26.2	-178.5	-59.9	-78.2	0	0	0	114.8	D617 T621	D617-F619 PolarHBondContact O-N 3.44Å; F619-T621 PolarHBondContact O-N 3.12Å; F619-T621 PolarHBondContact O-OG1 3.45Å
620	G	27.2	Very low	30.4	Very low	74 Å²	74	125.3 Å²	125.3	76%	0.763	67%	0.665	S	S	*	*			trans	58.6	18.9	158.2	0	0	0	0	0	117.4	E618	E618-G620 VanDerWaalsContact C-N 3.35Å; E618-G620 PolarHBondContact O-N 2.84Å
621	T	28.2	Very low	30.4	Very low	102 Å²	102	122.7 Å²	122.7	63%	0.626	65%	0.647	S	S	*	*			trans	-95.4	103.5	-172.9	-58.4	0	0	0	0	110.6	F619 R623	F619-T621 PolarHBondContact O-N 3.12Å; F619-T621 PolarHBondContact O-OG1 3.45Å; T621-R623 VanDerWaalsContact C-N 3.35Å; T621-R623 HydrophobicContact CG2-CG 4.18Å; T621-R623 PolarHBondContact O-N 2.66Å
622	E	23.8	Very low	30.1	Very low	196 Å²	196	125.2 Å²	125.2	92%	0.916	66%	0.662	S	S	*	*			trans	-61.6	91.5	172.6	-75.8	-162.6	151.3	0	0	111.7
623	R	29.1	Very low	29.9	Very low	153 Å²	153	125.1 Å²	125.1	58%	0.577	66%	0.661	S	S	*	*			trans	-137.1	66.4	164.8	-70	-170.6	-174.7	-162.5	2.2	110.3	T621 Y625	T621-R623 VanDerWaalsContact C-N 3.35Å; T621-R623 HydrophobicContact CG2-CG 4.18Å; T621-R623 PolarHBondContact O-N 2.66Å; R623-Y625 WeakPolarHBondContact O-CD2 3.5Å; R623-Y625 WeakPolarHBondContact O-CE2 3.33Å; R623-Y625 PolarHBondContact O-N 3.44Å; R623-Y625 VanDerWaalsContact O-N 3.07Å
624	G	26.5	Very low	29.5	Very low	54 Å²	54	122 Å²	122	56%	0.557	67%	0.665	S	S	*	*			trans	-54.1	113	146	0	0	0	0	0	107	P626	G624-P626 WeakPolarHBondContact O-CD 3.29Å
625	Y	31.7	Very low	29.5	Very low	121 Å²	121	122 Å²	122	48%	0.475	67%	0.666	S	S	.	*			trans	-72.7	112.3	-173.4	-71.9	-110.9	0	0	0	108.1	R346 R623 L627	R346-Y625 PolarHBondContact NH1-OH 2.88Å; R623-Y625 WeakPolarHBondContact O-CD2 3.5Å; R623-Y625 WeakPolarHBondContact O-CE2 3.33Å; R623-Y625 PolarHBondContact O-N 3.44Å; R623-Y625 VanDerWaalsContact O-N 3.07Å; Y625-L627 PolarHBondContact O-N 2.85Å; Y625-L627 VanDerWaalsContact O-N 3.12Å
626	P	27.3	Very low	29.5	Very low	104 Å²	104	121.1 Å²	121.1	68%	0.675	67%	0.669	S	S	*	*			trans	-66.3	119	167.7	28.9	-32	0	0	0	106.8	G624 R628	G624-P626 WeakPolarHBondContact O-CD 3.29Å; P626-R628 PolarHBondContact O-N 2.98Å
627	L	34.9	Very low	29.6	Very low	65 Å²	65	122.2 Å²	122.2	34%	0.34	67%	0.668	S	S	.	*			trans	-53.6	108	163	-79.7	167	0	0	0	106.3	Y625 Y629 M630	Y625-L627 PolarHBondContact O-N 2.85Å; Y625-L627 VanDerWaalsContact O-N 3.12Å; L627-Y629 PolarHBondContact O-N 2.8Å; L627-M630 WeakPolarHBondContact O-CG 3.39Å; L627-M630 PolarHBondContact O-N 2.91Å
628	R	32.5	Very low	29.5	Very low	240 Å²	240	122.6 Å²	122.6	91%	0.906	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	14	-169.2	-151.4	178.1	179.8	-173.6	0.1	113.5	P626	P626-R628 PolarHBondContact O-N 2.98Å
629	Y	32.2	Very low	29.2	Very low	77 Å²	77	117.2 Å²	117.2	30%	0.302	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.6	13.1	171.5	-63.4	-72.1	0	0	0	112.7	F444 Y448 L627 V631	F444-Y629 HydrophobicContact CE1-CD2 4.35Å; Y448-Y629 HydrophobicContact CD1-CD1 4.41Å; Y448-Y629 HydrophobicContact CE1-CD1 4.25Å; L627-Y629 PolarHBondContact O-N 2.8Å; Y629-V631 PolarHBondContact O-N 2.9Å
630	M	28.5	Very low	29	Very low	134 Å²	134	113.2 Å²	113.2	66%	0.66	68%	0.677	S	S	*	*			trans	-61.6	105.2	161.5	-72.7	-165.9	78.9	0	0	109.2	L627	L627-M630 WeakPolarHBondContact O-CG 3.39Å; L627-M630 PolarHBondContact O-N 2.91Å
631	V	32.6	Very low	29	Very low	62 Å²	62	116 Å²	116	38%	0.376	68%	0.684	S	S	.	*			trans	-57	131.2	166.6	178.7	0	0	0	0	107.8	Y448 Y629 I633	Y448-V631 HydrophobicContact CE2-CG2 4.43Å; Y448-V631 WeakPolarHBondContact OH-CG2 3.45Å; Y629-V631 PolarHBondContact O-N 2.9Å; V631-I633 PolarHBondContact O-N 3.1Å; V631-I633 VanDerWaalsContact O-N 3.08Å
632	P	26.2	Very low	29.1	Very low	116 Å²	116	118 Å²	118	75%	0.753	69%	0.691	S	S	*	*			trans	-61.5	116	175.3	-22.4	33.4	0	0	0	110.1	G634	P632-G634 PolarHBondContact O-N 2.96Å
633	I	30.7	Very low	29.3	Very low	153 Å²	153	114.2 Å²	114.2	79%	0.785	68%	0.682	S	S	*	*			trans	-74.5	71.2	170.9	-54.9	-179.4	0	0	0	107.7	V631 G635	V631-I633 PolarHBondContact O-N 3.1Å; V631-I633 VanDerWaalsContact O-N 3.08Å; I633-G635 PolarHBondContact O-N 3.25Å
634	G	27.7	Very low	29.3	Very low	82 Å²	82	114.2 Å²	114.2	85%	0.845	69%	0.691	S	S	*	*			trans	-92.9	59.8	-176.2	0	0	0	0	0	112.1	P632	P632-G634 PolarHBondContact O-N 2.96Å
635	G	28.5	Very low	29.5	Very low	60 Å²	60	123.3 Å²	123.3	62%	0.619	71%	0.709	S	S	*	*			trans	-142.2	90.4	178.3	0	0	0	0	0	111.5	I633	I633-G635 PolarHBondContact O-N 3.25Å
636	E	28.4	Very low	29.5	Very low	192 Å²	192	126.3 Å²	126.3	90%	0.897	73%	0.727	S	S	*	*			trans	-72.9	132	163	-71.6	-162.6	139.7	0	0	109.4
637	P	31.4	Very low	29.5	Very low	116 Å²	116	133 Å²	133	75%	0.753	74%	0.738	S	S	*	*			trans	-72	134.1	174.6	29.3	-33.4	0	0	0	110.6	G639	P637-G639 PolarHBondContact O-N 2.92Å
638	P	27.8	Very low	29.5	Very low	124 Å²	124	140.1 Å²	140.1	81%	0.805	77%	0.767	S	S	*	*			trans	-76.3	84.1	-172.7	29.5	-35.4	0	0	0	114.1
639	G	26.4	Very low	29.4	Very low	75 Å²	75	132 Å²	132	77%	0.773	76%	0.757	S	S	*	*			trans	85.7	178.5	148.5	0	0	0	0	0	118.8	P637	P637-G639 PolarHBondContact O-N 2.92Å
640	G	27	Very low	29.4	Very low	78 Å²	78	136.7 Å²	136.7	80%	0.804	79%	0.788	S	S	*	*			trans	103.4	27.8	158.8	0	0	0	0	0	119.7	N642	G640-N642 PolarHBondContact O-N 3.06Å
641	S	28.4	Very low	29.4	Very low	132 Å²	132	133.5 Å²	133.5	92%	0.923	79%	0.789	S	S	*	*			trans	-81.9	81.9	170.6	-161.5	0	0	0	0	112.4
642	N	30.2	Very low	29.4	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	81%	0.812	S	S	*	*			trans	-87.8	126.7	168.4	-107.8	-15.2	0	0	0	110.8	G640	G640-N642 PolarHBondContact O-N 3.06Å
643	T	27.3	Very low	29.5	Very low	116 Å²	116	139.3 Å²	139.3	71%	0.712	82%	0.817	S	S	*	*			trans	38.1	102.8	150.8	58.3	0	0	0	0	118.8
644	I	29.9	Very low	29.5	Very low	152 Å²	152	136.8 Å²	136.8	78%	0.779	82%	0.819	S	S	*	*				-175.7	127	108.4	-89.6	151	0	0	0	108.8
645	R	29.9	Very low	29.7	Very low	246 Å²	246	138.3 Å²	138.3	93%	0.928	82%	0.816	S	S	*	*			trans	-127.5	127.5	165.5	-81.1	-170.9	176.3	-171.7	-0.2	108.8
646	H	32.6	Very low	29.8	Very low	183 Å²	183	139.9 Å²	139.9	85%	0.847	82%	0.824	S	S	*	*			trans	-74.3	151.4	167.4	-92.8	-103.2	0	0	0	111.2
647	R	27.1	Very low	29.7	Very low	244 Å²	244	138.9 Å²	138.9	92%	0.921	82%	0.824	S	S	*	*			trans	-90.6	133.1	-173.3	-81.3	173.9	155.6	179.1	-7.4	113.8
648	K	33.6	Very low	29.6	Very low	215 Å²	215	141.9 Å²	141.9	94%	0.935	83%	0.825	S	S	*	*			trans	-176.9	138.3	137.6	-103.8	179.1	177.6	-175.5	0	107.1
649	G	30.8	Very low	29.7	Very low	69 Å²	69	145.7 Å²	145.7	71%	0.711	82%	0.823	S	S	*	*			cis	-154.5	-170.4	-5.9	0	0	0	0	0	110.7
650	D	31.4	Very low	29.5	Very low	176 Å²	176	150.1 Å²	150.1	94%	0.941	83%	0.828	S	S	*	*			trans	-68.2	161.8	-171.9	-46.8	-85.8	0	0	0	114.3
651	G	29.7	Very low	29.6	Very low	67 Å²	67	152.2 Å²	152.2	69%	0.691	83%	0.826	S	S	*	*			cis	173.3	-165.9	-0.1	0	0	0	0	0	113
652	A	33.1	Very low	29.6	Very low	102 Å²	102	154.1 Å²	154.1	84%	0.843	83%	0.825	S	S	*	*			trans	67.3	156.8	179.1	0	0	0	0	0	117.4
653	K	27.9	Very low	29.4	Very low	198 Å²	198	150.9 Å²	150.9	86%	0.861	82%	0.819	S	S	*	*			cis	-173.8	135.1	-46.8	-116.1	178.6	-179.3	-179.3	0	107.8
654	A	30	Very low	29.3	Very low	101 Å²	101	154.7 Å²	154.7	84%	0.835	83%	0.825	S	S	*	*			trans	63.6	152.2	176.1	0	0	0	0	0	115.7
655	S	33.2	Very low	29.2	Very low	113 Å²	113	152.8 Å²	152.8	79%	0.79	83%	0.826	S	S	*	*			cis	-133.2	131.4	-3.3	-88.2	0	0	0	0	108.6
656	A	28.7	Very low	29.1	Very low	93 Å²	93	148.2 Å²	148.2	77%	0.769	82%	0.82	S	S	*	*				77.1	84.7	71.8	0	0	0	0	0	115.6
657	L	26.3	Very low	28.7	Very low	172 Å²	172	151 Å²	151	90%	0.901	82%	0.823	S	S	*	*			trans	59.8	104.2	135	-165.7	79.4	0	0	0	120.4
658	K	30.7	Very low	28.8	Very low	178 Å²	178	145 Å²	145	77%	0.774	81%	0.813	S	S	*	*			trans	-149.2	103.5	144	-155.6	166.4	-176.4	178.7	0	114.8
659	R	29.2	Very low	28.3	Very low	204 Å²	204	140.8 Å²	140.8	77%	0.77	80%	0.799	S	S	*	*			trans	65.6	100.1	152.8	-61.9	177.4	-172.9	-169.6	-1.5	119.4
660	L	23.5	Very low	28.1	Very low	168 Å²	168	143.8 Å²	143.8	88%	0.88	81%	0.806	S	S	*	*				-53.1	128	126.6	-81.5	152.9	0	0	0	109.4
661	T	28.5	Very low	27.9	Very low	123 Å²	123	144.4 Å²	144.4	76%	0.755	80%	0.801	S	S	*	*				158.9	104.3	125.1	48.1	0	0	0	0	109.3
662	D	28.6	Very low	27.8	Very low	171 Å²	171	150 Å²	150	91%	0.914	80%	0.801	S	S	*	*				-157.4	163.7	123.9	-118.6	-35.7	0	0	0	110.5
663	A	26.1	Very low	27.5	Very low	77 Å²	77	156.4 Å²	156.4	64%	0.636	80%	0.804	S	S	*	*			trans	-149	154.6	-174.9	0	0	0	0	0	113.2
664	K	25.3	Very low	27.5	Very low	196 Å²	196	153.2 Å²	153.2	85%	0.852	80%	0.801	S	S	*	*			trans	93.8	148.9	179.7	-54.5	155.8	-175.4	168.5	0	114.2
665	S	27	Very low	27.4	Very low	113 Å²	113	153 Å²	153	79%	0.79	79%	0.793	S	S	*	*			trans	55.1	119.8	-170.2	29.5	0	0	0	0	113.2
666	D	28.4	Very low	27.2	Very low	149 Å²	149	155.4 Å²	155.4	80%	0.797	79%	0.794	S	S	*	*			cis	-112.3	153.6	37	-87.2	-50.3	0	0	0	118.4
667	R	23.8	Very low	27.1	Very low	243 Å²	243	154.3 Å²	154.3	92%	0.917	79%	0.792	S	S	*	*			trans	-136.1	91.8	165.6	-95.6	-173.9	164.4	-168.7	-3.4	108.2
668	V	28.8	Very low	27.1	Very low	118 Å²	118	149.7 Å²	149.7	72%	0.715	78%	0.778	S	S	*	*			trans	-121.5	86.3	177.3	-171.7	0	0	0	0	111.5
669	I	24.1	Very low	27	Very low	126 Å²	126	146.1 Å²	146.1	65%	0.646	77%	0.771	S	S	*	*			trans	45.5	115.7	137.2	-56.9	164.9	0	0	0	119.1	F671	I669-F671 HydrophobicContact CG2-CB 4.09Å; I669-F671 HydrophobicContact CG2-CD2 3.88Å; I669-F671 HydrophobicContact CG2-CG 4.49Å
670	P	25.6	Very low	26.9	Very low	132 Å²	132	144 Å²	144	86%	0.857	78%	0.775	S	S	*	*			trans	-105.4	112.6	142	33.2	-26.3	0	0	0	111.9
671	F	27.7	Very low	27	Very low	189 Å²	189	146 Å²	146	83%	0.829	77%	0.772	S	S	*	*			trans	-131.1	150.4	165.8	-100.4	-82.6	0	0	0	107.5	I669	I669-F671 HydrophobicContact CG2-CB 4.09Å; I669-F671 HydrophobicContact CG2-CD2 3.88Å; I669-F671 HydrophobicContact CG2-CG 4.49Å
672	R	28	Very low	27	Very low	184 Å²	184	148.4 Å²	148.4	69%	0.694	77%	0.768	S	S	*	*			cis	-115.3	145.3	1.8	-70.5	171.6	166.1	176.3	-5.5	110.7	D292	D292-R672 IonicContact OD2-NH1 2.7Å; D292-R672 PolarHBondContact OD2-NH1 2.79Å
673	R	26.8	Very low	27	Very low	237 Å²	237	144.2 Å²	144.2	89%	0.894	75%	0.752	S	S	*	*			trans	-87.2	125.3	144.2	-89.6	-176.2	176.3	167.4	-0.2	108
674	T	27.2	Very low	26.9	Very low	130 Å²	130	149.7 Å²	149.7	80%	0.798	76%	0.764	S	S	*	*			trans	-99	66.4	163.1	34.1	0	0	0	0	110
675	S	28.7	Very low	27	Very low	97 Å²	97	145 Å²	145	68%	0.678	76%	0.756	S	S	*	*			trans	-77.9	118.8	169.9	52.6	0	0	0	0	110.4	G677	S675-G677 PolarHBondContact O-N 2.61Å
676	M	28.5	Very low	26.9	Very low	164 Å²	164	144.7 Å²	144.7	81%	0.808	76%	0.76	S	S	*	*			trans	-74.4	115.4	154.9	-71.6	-140.8	-57.3	0	0	109.1
677	G	26.8	Very low	26.8	Very low	70 Å²	70	143 Å²	143	72%	0.722	76%	0.76	S	S	*	*			trans	-67.4	175.3	156.1	0	0	0	0	0	111.2	S675	S675-G677 PolarHBondContact O-N 2.61Å
678	A	25.6	Very low	26.9	Very low	75 Å²	75	136.2 Å²	136.2	62%	0.62	75%	0.75	S	S	*	*			cis	-115.3	152.3	17.5	0	0	0	0	0	115	K533	K533-A678 PolarHBondContact NZ-O 2.98Å
679	V	29.5	Very low	26.9	Very low	103 Å²	103	136.5 Å²	136.5	62%	0.624	75%	0.752	S	S	*	*			trans	-137.1	101.7	158.8	-179.9	0	0	0	0	106.1	Y681	V679-Y681 HydrophobicContact CG1-CD2 4.07Å; V679-Y681 HydrophobicContact CG1-CE2 4.42Å
680	D	27.1	Very low	27.1	Very low	158 Å²	158	137.5 Å²	137.5	85%	0.845	76%	0.758	S	S	*	*			trans	-75.6	140.6	165.8	-70.4	-58.3	0	0	0	109.6
681	Y	25.8	Very low	27.3	Very low	211 Å²	211	139.1 Å²	139.1	83%	0.827	76%	0.759	S	S	*	*			trans	-121.6	129	-178	-122.9	-82.3	0	0	0	110.2	V679	V679-Y681 HydrophobicContact CG1-CD2 4.07Å; V679-Y681 HydrophobicContact CG1-CE2 4.42Å
682	R	28.5	Very low	27.3	Very low	174 Å²	174	135.9 Å²	135.9	66%	0.657	75%	0.75	S	S	*	*			trans	-151.5	99.8	160.1	-112.6	-178.1	176.3	176.1	-1.2	108	V126	V126-R682 PolarHBondContact O-NE 3.29Å; V126-R682 PolarHBondContact O-NH1 2.77Å
683	S	27.5	Very low	27.5	Very low	83 Å²	83	134 Å²	134	58%	0.58	75%	0.753	S	S	*	*				81	114.5	86.4	-63.5	0	0	0	0	112.4
684	E	23.7	Very low	27.7	Very low	192 Å²	192	130.4 Å²	130.4	90%	0.897	75%	0.746	S	S	*	*			trans	-78.9	155.7	172.3	-58.3	166.4	134.6	0	0	111.4
685	S	27.4	Very low	28	Very low	98 Å²	98	135.4 Å²	135.4	69%	0.685	75%	0.75	S	S	*	*			trans	-166.1	126.8	153.5	59.1	0	0	0	0	109.1
686	A	25.6	Very low	28.1	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	76%	0.756	S	S	*	*			trans	-80.7	158.7	178.4	0	0	0	0	0	112.7
687	S	26.8	Very low	28.1	Very low	114 Å²	114	137.6 Å²	137.6	80%	0.797	76%	0.757	S	S	*	*			trans	-160.1	161.1	133.7	-157.3	0	0	0	0	111.6
688	S	24.9	Very low	28.4	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	76%	0.761	S	S	*	*			trans	-62.5	158.3	176.7	58.8	0	0	0	0	112.5
689	T	29.7	Very low	28.8	Very low	124 Å²	124	143.2 Å²	143.2	76%	0.761	77%	0.769	S	S	*	*				-149	146.3	81.2	39.6	0	0	0	0	114.3
690	L	27.2	Very low	29.1	Very low	147 Å²	147	146.3 Å²	146.3	77%	0.77	78%	0.779	S	S	*	*			trans	16.2	122.3	145.4	-62.8	164.3	0	0	0	118.3
691	D	31	Very low	29.2	Very low	166 Å²	166	144.9 Å²	144.9	89%	0.888	77%	0.771	S	S	*	*				-142.1	158.7	118.8	-141.7	-26.7	0	0	0	110.6
692	I	27.9	Very low	29.4	Very low	121 Å²	121	140.5 Å²	140.5	62%	0.621	77%	0.767	S	S	*	*			trans	-114.6	128.2	-164.9	-64	166.6	0	0	0	109.6
693	N	32.4	Very low	29.5	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	77%	0.77	S	S	*	*			trans	-177	141.6	131.4	-101.4	-61.9	0	0	0	116.1
694	H	30.1	Very low	29.6	Very low	160 Å²	160	139.9 Å²	139.9	74%	0.741	78%	0.784	S	S	*	*			trans	-32.6	136.5	176.7	-55.3	-75.6	0	0	0	120.8
695	R	34	Very low	29.8	Very low	236 Å²	236	135.9 Å²	135.9	89%	0.891	78%	0.777	S	S	*	*				-176.7	100.5	102.5	-93.1	164.2	-171	-161.8	2.9	109.5
696	K	30.7	Very low	29.9	Very low	185 Å²	185	136.5 Å²	136.5	80%	0.804	78%	0.782	S	S	*	*				91.7	93.8	75.5	-173.6	176.7	-175.5	178.4	0	111.9
697	C	28	Very low	30.1	Very low	122 Å²	122	136.1 Å²	136.1	82%	0.824	77%	0.773	S	S	*	*			trans	-125.3	129.2	172.6	-51.8	0	0	0	0	109.4
698	N	33.5	Very low	30.2	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	78%	0.775	S	S	*	*			trans	-123.3	145.1	164.9	-69.6	37.9	0	0	0	106.2
699	S	33	Very low	30.3	Very low	114 Å²	114	145.7 Å²	145.7	80%	0.797	78%	0.781	S	S	*	*			cis	-147.1	155	-0.5	-175.4	0	0	0	0	110.7
700	M	35.4	Very low	30.2	Very low	168 Å²	168	144 Å²	144	83%	0.828	78%	0.775	S	S	*	*			trans	-66	173.7	160.3	-72.1	164.1	63	0	0	112.6
701	D	29.4	Very low	30.2	Very low	127 Å²	127	145.9 Å²	145.9	68%	0.679	78%	0.777	S	S	*	*			cis	-177.7	141.2	-41	-147.2	-21.9	0	0	0	109.3
702	T	30.2	Very low	30.2	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	76%	0.762	S	S	*	*			trans	58	172.6	168.8	77.2	0	0	0	0	117.9
703	T	30.6	Very low	30.3	Very low	119 Å²	119	145.7 Å²	145.7	73%	0.73	76%	0.761	S	S	*	*			cis	-144.1	161.3	3.1	33.4	0	0	0	0	111.8
704	S	30.3	Very low	30.1	Very low	125 Å²	125	145.3 Å²	145.3	87%	0.874	76%	0.755	S	S	*	*			trans	77.7	168.5	149.7	80.7	0	0	0	0	120.4
705	S	26.8	Very low	30.2	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	75%	0.752	S	S	*	*			trans	-148.6	151.8	-156.5	56.5	0	0	0	0	113.9
706	S	29.5	Very low	30	Very low	111 Å²	111	142.4 Å²	142.4	78%	0.776	75%	0.752	S	S	*	*				169.5	140.2	126.6	-83.2	0	0	0	0	117.1
707	S	30.5	Very low	30	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	75%	0.75	S	S	*	*			trans	70.9	123.2	141.5	-74.4	0	0	0	0	124.2
708	R	28.2	Very low	30.2	Very low	221 Å²	221	137 Å²	137	83%	0.834	74%	0.739	S	S	*	*			trans	76.5	116.4	136.4	-69.2	177.3	-177	-163.7	-0.2	117.2
709	K	27.7	Very low	30	Very low	194 Å²	194	138 Å²	138	84%	0.843	74%	0.739	S	S	*	*				72.7	136.7	85.4	-77.5	-164.7	-177.9	-166	0	112.8
710	S	27.6	Very low	29.9	Very low	90 Å²	90	141.1 Å²	141.1	63%	0.629	74%	0.741	S	S	*	*			cis	-176.3	165.3	0.7	42.5	0	0	0	0	111.9
711	F	28.3	Very low	29.8	Very low	185 Å²	185	139.3 Å²	139.3	81%	0.811	74%	0.742	S	S	*	*			trans	70.3	145.8	171.7	-79.7	-140.5	0	0	0	114.4
712	E	30	Very low	29.6	Very low	122 Å²	122	138.2 Å²	138.2	57%	0.57	74%	0.744	S	S	*	*			cis	-156.8	-175.3	-3.2	-124.5	-174.3	-169.8	0	0	108.2
713	R	29.4	Very low	29.7	Very low	162 Å²	162	138.7 Å²	138.7	61%	0.611	75%	0.747	S	S	*	*			cis	-151	-177.1	7.9	-149.7	172.5	166.2	78.1	21.8	112.2
714	E	29.4	Very low	29.6	Very low	137 Å²	137	138.3 Å²	138.3	64%	0.64	74%	0.744	S	S	*	*			trans	-32.3	155.5	167.3	-66.8	160.1	166.4	0	0	118.1
715	S	32.3	Very low	29.6	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	74%	0.736	S	S	*	*				-161.7	139.7	52.2	-59.5	0	0	0	0	117
716	R	29.3	Very low	29.7	Very low	237 Å²	237	138.3 Å²	138.3	89%	0.894	73%	0.73	S	S	*	*			trans	61.7	142.8	149.6	-63.6	171	-175.3	-178.2	-0.1	117.7
717	S	31.4	Very low	29.8	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	73%	0.733	S	S	*	*			cis	-170.2	171.2	-6.1	46.3	0	0	0	0	107.7
718	S	31.5	Very low	29.5	Very low	85 Å²	85	144.9 Å²	144.9	59%	0.594	74%	0.735	S	S	*	*			cis	-157.4	173.2	10.8	-142.1	0	0	0	0	113.5
719	E	29.2	Very low	29.5	Very low	168 Å²	168	141.2 Å²	141.2	79%	0.785	73%	0.727	S	S	*	*			trans	34	115	149.2	-70	147	135.2	0	0	123
720	Q	30.2	Very low	29.4	Very low	181 Å²	181	138.1 Å²	138.1	85%	0.846	72%	0.716	S	S	*	*				-99.8	170.3	116.2	-78	-166.8	-24.1	0	0	109.1
721	P	33.8	Very low	29.4	Very low	129 Å²	129	142.5 Å²	142.5	84%	0.838	72%	0.718	S	S	*	*			trans	-134.2	167.8	131.1	38.4	-29.6	0	0	0	114.6
722	S	26	Very low	29.3	Very low	104 Å²	104	142.8 Å²	142.8	73%	0.727	72%	0.719	S	S	*	*			trans	-138.1	158.5	-178.2	57.1	0	0	0	0	111.9
723	T	31.6	Very low	29.2	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	73%	0.731	S	S	*	*			trans	-161.3	135.9	159.3	28.8	0	0	0	0	107.2
724	V	28.6	Very low	29	Very low	112 Å²	112	146.1 Å²	146.1	68%	0.679	74%	0.743	S	S	*	*				72.9	123.4	53.4	178.2	0	0	0	0	109.4
725	D	29.8	Very low	29.3	Very low	131 Å²	131	144.6 Å²	144.6	70%	0.701	75%	0.745	S	S	*	*			cis	-131.8	151.8	44.3	-92.7	-61.9	0	0	0	114.9
726	T	29	Very low	29	Very low	102 Å²	102	148.7 Å²	148.7	63%	0.626	76%	0.756	S	S	*	*				56.5	132	76.8	85	0	0	0	0	114.6
727	H	31.5	Very low	28.9	Very low	181 Å²	181	145 Å²	145	84%	0.838	75%	0.753	S	S	*	*				-156.4	-177.6	55.5	-117.7	-95.5	0	0	0	114.8
728	K	25.6	Very low	28.9	Very low	165 Å²	165	145 Å²	145	72%	0.717	75%	0.75	S	S	*	*			trans	-93	-172	168.8	-50.4	-179	-176.1	172.3	0	111.3
729	E	26.6	Very low	28.9	Very low	144 Å²	144	147.7 Å²	147.7	67%	0.673	76%	0.758	S	S	*	*			cis	-164.6	148.3	18.6	-151	143.3	-136.9	0	0	112.9
730	E	26.4	Very low	28.7	Very low	129 Å²	129	147.2 Å²	147.2	60%	0.603	76%	0.756	S	S	*	*			trans	53.6	130.7	148	-75.9	-160.2	139.9	0	0	128.7
731	R	27.1	Very low	28.7	Very low	181 Å²	181	148.2 Å²	148.2	68%	0.683	76%	0.76	S	S	*	*			trans	64.6	124.3	136.9	-61.9	172.8	-164.1	173.7	18.3	122.5
732	F	27.7	Very low	28.2	Very low	191 Å²	191	152.1 Å²	152.1	84%	0.838	76%	0.758	S	S	*	*				-171.2	176.4	93	-112.6	-82.1	0	0	0	113.6
733	L	26	Very low	28.3	Very low	154 Å²	154	156.5 Å²	156.5	81%	0.806	77%	0.767	S	S	*	*			trans	-89.8	160.3	-179	-54.3	159.2	0	0	0	110.4
734	K	25.2	Very low	28	Very low	200 Å²	200	156 Å²	156	87%	0.87	76%	0.764	S	S	*	*				-165.5	179.2	50.4	-116.5	-166.8	172.3	178.3	0	110.9
735	P	35.7	Very low	28	Very low	106 Å²	106	154.9 Å²	154.9	69%	0.688	77%	0.766	S	S	*	*			trans	-101.4	168.2	-164.6	40	-38.3	0	0	0	117.1
736	M	27	Very low	28	Very low	182 Å²	182	154.1 Å²	154.1	90%	0.897	77%	0.769	S	S	*	*			trans	-146.2	154.7	158.7	-89.3	-65.9	112.4	0	0	111.3
737	L	27.9	Very low	27.8	Very low	161 Å²	161	159 Å²	159	84%	0.843	78%	0.784	S	S	*	*			trans	-101.4	169.2	167.5	-76.6	162.8	0	0	0	109.6
738	P	31.3	Very low	27.5	Very low	108 Å²	108	161.3 Å²	161.3	70%	0.701	79%	0.786	S	S	*	*				-150.3	163.2	101.4	39.1	-23	0	0	0	116.9
739	N	30.3	Very low	27.6	Very low	142 Å²	142	157.1 Å²	157.1	76%	0.759	78%	0.777	S	S	*	*			trans	58.6	126	157.4	-56.7	-11.7	0	0	0	119.4
740	H	25.9	Very low	27.6	Very low	159 Å²	159	155.9 Å²	155.9	74%	0.736	78%	0.782	S	S	*	*				72.1	93.3	55.7	-87.4	-49.6	0	0	0	115.5
741	E	29.1	Very low	27.6	Very low	202 Å²	202	157.6 Å²	157.6	94%	0.944	79%	0.788	S	S	*	*				-128	164.4	123.9	-72.3	-154.9	122.5	0	0	109
742	R	24.2	Very low	27.5	Very low	210 Å²	210	153.2 Å²	153.2	79%	0.792	78%	0.784	S	S	*	*			trans	-147.7	72.2	-161.6	-169.7	-167.8	-168.8	175.5	4.3	112.2	T744	R742-T744 PolarHBondContact O-N 3.22Å
743	E	28	Very low	27.6	Very low	196 Å²	196	150.4 Å²	150.4	92%	0.916	78%	0.777	S	S	*	*			trans	-83.1	109.8	179.3	-162.9	172.9	-144.1	0	0	112	A745	E743-A745 PolarHBondContact O-N 2.72Å
744	T	25.4	Very low	27.6	Very low	121 Å²	121	146.5 Å²	146.5	74%	0.742	76%	0.761	S	S	*	*			trans	-85.6	83.5	-179.9	50.8	0	0	0	0	111.6	R742	R742-T744 PolarHBondContact O-N 3.22Å
745	A	28.8	Very low	27.9	Very low	87 Å²	87	144 Å²	144	72%	0.719	76%	0.758	S	S	*	*			trans	-64.7	138	169.4	0	0	0	0	0	111.2	E743	E743-A745 PolarHBondContact O-N 2.72Å
746	P	28.8	Very low	27.7	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	75%	0.75	S	S	*	*			trans	-71.4	145.3	-176.5	29	-35.3	0	0	0	112	R748	P746-R748 PolarHBondContact O-N 2.77Å
747	Q	25.4	Very low	28	Very low	204 Å²	204	140.4 Å²	140.4	95%	0.953	73%	0.726	S	S	*	*			trans	-60.9	112.7	175.6	-72.7	-167.5	-8.6	0	0	111.1
748	R	24.8	Very low	28.2	Very low	229 Å²	229	137 Å²	137	86%	0.864	71%	0.714	S	S	*	*			trans	-79.5	143.8	160.5	-71.6	-177.5	173.6	173.9	-0.1	109	P746	P746-R748 PolarHBondContact O-N 2.77Å
749	S	27.5	Very low	28.2	Very low	78 Å²	78	134.6 Å²	134.6	55%	0.545	70%	0.697	S	S	.	*			trans	-63.8	148.1	176.9	50.3	0	0	0	0	111.6	F751	S749-F751 PolarHBondContact O-N 2.89Å; S749-F751 VanDerWaalsContact O-N 3.09Å
750	P	26.3	Very low	28.6	Very low	118 Å²	118	135.6 Å²	135.6	77%	0.766	70%	0.697	S	S	*	*	S	Bend	trans	-64.3	-12.7	178.1	-23.3	34.9	0	0	0	114.6	S752	P750-S752 PolarHBondContact O-N 3.17Å
751	F	26.6	Very low	29.2	Very low	165 Å²	165	134 Å²	134	72%	0.724	69%	0.685	S	S	*	*			trans	-85.1	54	-173.1	-63	-73.5	0	0	0	113.2	S749	S749-F751 PolarHBondContact O-N 2.89Å; S749-F751 VanDerWaalsContact O-N 3.09Å
752	S	25.8	Very low	29.8	Very low	88 Å²	88	126.4 Å²	126.4	62%	0.615	65%	0.65	S	S	*	*			trans	-143.3	59.4	165.5	52.8	0	0	0	0	112.3	P750 P754	P750-S752 PolarHBondContact O-N 3.17Å; S752-P754 WeakPolarHBondContact O-CD 3.27Å
753	L	30.1	Very low	30.5	Very low	132 Å²	132	117.4 Å²	117.4	69%	0.691	62%	0.616	S	S	*	*			trans	-53.3	123.7	161.6	-74.7	175.6	0	0	0	108.7
754	P	25.6	Very low	30.9	Very low	72 Å²	72	113.3 Å²	113.3	47%	0.468	61%	0.607	S	S	.	*			trans	-65	146.4	176.6	27.1	-34	0	0	0	110	S752 F756	S752-P754 WeakPolarHBondContact O-CD 3.27Å; P754-F756 HydrophobicContact CB-CD2 3.84Å; P754-F756 HydrophobicContact CB-CE2 4.19Å; P754-F756 HydrophobicContact CG-CD2 3.83Å; P754-F756 HydrophobicContact CG-CE2 4.29Å; P754-F756 PolarHBondContact O-N 3.33Å
755	N	31	Very low	31.3	Very low	148 Å²	148	110.2 Å²	110.2	79%	0.791	59%	0.585	S	S	*	*	S	Bend	trans	-73.9	48	-176.7	-67.3	-76.8	0	0	0	113.2	F757	N755-F757 PolarHBondContact O-N 2.96Å
756	F	31.9	Very low	31.7	Very low	120 Å²	120	114.8 Å²	114.8	53%	0.526	59%	0.591	S	S	.	*			trans	-70.4	-20.7	173	-89.3	-83.5	0	0	0	112.9	P754 P758	P754-F756 HydrophobicContact CB-CD2 3.84Å; P754-F756 HydrophobicContact CB-CE2 4.19Å; P754-F756 HydrophobicContact CG-CD2 3.83Å; P754-F756 HydrophobicContact CG-CE2 4.29Å; P754-F756 PolarHBondContact O-N 3.33Å; F756-P758 WeakPolarHBondContact O-CD 3.36Å
757	F	33.7	Very low	31.7	Very low	92 Å²	92	116.6 Å²	116.6	40%	0.404	59%	0.591	S	S	.	*	S	Bend	trans	-84	110.8	164.8	-60.7	-72	0	0	0	109.3	Y603 L604 N755 V759	Y603-F757 HydrophobicContact CE1-CE2 4.44Å; Y603-F757 HydrophobicContact CE1-CZ 4.46Å; L604-F757 HydrophobicContact CD2-CZ 4.25Å; N755-F757 PolarHBondContact O-N 2.96Å; F757-V759 HydrophobicContact CB-CG2 3.7Å; F757-V759 PolarHBondContact O-N 3.04Å
758	P	31.2	Very low	31.9	Very low	90 Å²	90	114.7 Å²	114.7	58%	0.584	59%	0.587	S	S	*	*			trans	-72.2	67.5	162.8	32.6	-36.1	0	0	0	108.8	F756 H760	F756-P758 WeakPolarHBondContact O-CD 3.36Å; P758-H760 PolarHBondContact O-N 3.39Å
759	V	32.5	Very low	32.1	Very low	58 Å²	58	109.1 Å²	109.1	35%	0.352	58%	0.58	S	S	.	*			trans	-59.1	110.3	173.2	-179.4	0	0	0	0	106.8	N439 F757 R761	N439-V759 VanDerWaalsContact ND2-CG1 3.29Å; N439-V759 WeakPolarHBondContact ND2-CG1 3.44Å; F757-V759 HydrophobicContact CB-CG2 3.7Å; F757-V759 PolarHBondContact O-N 3.04Å; V759-R761 PolarHBondContact O-N 3.21Å
760	H	37.6	Very low	32.1	Very low	163 Å²	163	113.8 Å²	113.8	76%	0.755	59%	0.591	S	S	*	*			trans	-65.8	87.5	172.5	-121.8	-70.4	0	0	0	107.4	P758 M762	P758-H760 PolarHBondContact O-N 3.39Å; H760-M762 PolarHBondContact O-N 3.28Å
761	R	38.4	Very low	32	Very low	126 Å²	126	117.4 Å²	117.4	48%	0.475	60%	0.597	S	S	.	*			trans	-52.7	101.5	-173.5	-74.6	-171.2	-177.9	-175.9	-0.4	109.8	V759 F763 M765	V759-R761 PolarHBondContact O-N 3.21Å; R761-F763 WeakPolarHBondContact CB-O 3.3Å; R761-F763 PolarHBondContact O-N 3.15Å; R761-M765 PolarHBondContact NH1-O 3.04Å
762	M	43.3	Very low	32.1	Very low	42 Å²	42	117.2 Å²	117.2	21%	0.207	60%	0.598	C	S	.	*	S	Bend	trans	-65.3	-28.7	173.8	-69	-157.4	-172.2	0	0	110.4	N439 L442 Q446 H760 P764 W838	N439-M762 PolarHBondContact OD1-N 3.44Å; L442-M762 HydrophobicContact CB-CE 4.34Å; L442-M762 HydrophobicContact CB-SD 3.95Å; L442-M762 HydrophobicContact CD1-SD 4.14Å; L442-M762 HydrophobicContact CD2-SD 4.27Å; L442-M762 HydrophobicContact CG-SD 4.36Å; Q446-M762 HydrophobicContact CB-CE 4.08Å; Q446-M762 HydrophobicContact CG-CE 4.39Å; H760-M762 PolarHBondContact O-N 3.28Å; M762-P764 WeakPolarHBondContact O-CD 3.33Å; M762-W838 HydrophobicContact CB-CH2 4.36Å; M762-W838 HydrophobicContact SD-CH2 4.44Å; M762-W838 HydrophobicContact SD-CZ3 4.36Å
763	F	37.9	Very low	32.1	Very low	20 Å²	20	118.2 Å²	118.2	9%	0.088	61%	0.605	C	S	.	*	S	Bend	trans	-102.1	106.6	166.4	-55.5	-73.2	0	0	0	110.6	M398 T402 V438 N439 L442 R761 M765	M398-F763 HydrophobicContact CG-CE1 3.37Å; M398-F763 HydrophobicContact CG-CZ 3.66Å; M398-F763 WeakPolarHBondContact O-CE1 3.45Å; M398-F763 HydrophobicContact SD-CE1 4.43Å; M398-F763 HydrophobicContact SD-CZ 4.48Å; T402-F763 HydrophobicContact CG2-CB 3.83Å; T402-F763 HydrophobicContact CG2-CD1 3.26Å; T402-F763 HydrophobicContact CG2-CE1 3.94Å; T402-F763 HydrophobicContact CG2-CG 3.74Å; V438-F763 HydrophobicContact CG1-CE2 4.27Å; V438-F763 HydrophobicContact CG1-CZ 4.34Å; N439-F763 HydrophobicContact CB-CD2 3.86Å; N439-F763 HydrophobicContact CB-CE2 4.14Å; L442-F763 HydrophobicContact CD1-CE2 3.89Å; L442-F763 HydrophobicContact CD1-CZ 4.17Å; R761-F763 WeakPolarHBondContact CB-O 3.3Å; R761-F763 PolarHBondContact O-N 3.15Å; F763-M765 VanDerWaalsContact C-N 3.26Å; F763-M765 PolarHBondContact O-N 3.24Å
764	P	35.7	Very low	32.1	Very low	110 Å²	110	120.9 Å²	120.9	71%	0.714	61%	0.614	S	S	*	*			trans	-70.6	84.7	171.6	29.7	-34.2	0	0	0	110.2	M762 E766	M762-P764 WeakPolarHBondContact O-CD 3.33Å; P764-E766 PolarHBondContact O-N 3.32Å
765	M	34.6	Very low	32.2	Very low	57 Å²	57	126.7 Å²	126.7	28%	0.281	64%	0.635	S	S	.	*			trans	-62.9	111	161	-77.9	-66.9	-77.5	0	0	108.1	E432 R761 F763 M767	E432-M765 HydrophobicContact CG-CE 4.06Å; E432-M765 WeakPolarHBondContact OE1-CE 3.35Å; R761-M765 PolarHBondContact NH1-O 3.04Å; F763-M765 VanDerWaalsContact C-N 3.26Å; F763-M765 PolarHBondContact O-N 3.24Å; M765-M767 PolarHBondContact O-N 3.26Å
766	E	37.3	Very low	32.2	Very low	183 Å²	183	124.9 Å²	124.9	86%	0.855	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-65.6	124.1	176.4	-69	-173.2	140.2	0	0	109.9	P764	P764-E766 PolarHBondContact O-N 3.32Å
767	M	28.6	Very low	32.1	Very low	153 Å²	153	122.6 Å²	122.6	75%	0.754	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-75.8	128.6	161.8	-59.1	-65	-68.8	0	0	106.9	M765	M765-M767 PolarHBondContact O-N 3.26Å
768	L	29.2	Very low	32	Very low	165 Å²	165	127.2 Å²	127.2	86%	0.864	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-52.2	138.4	174.4	-103.3	138.5	0	0	0	110.5	K770	L768-K770 PolarHBondContact O-N 3.22Å
769	P	30.4	Very low	32	Very low	111 Å²	111	128.1 Å²	128.1	72%	0.721	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-57.2	134.5	171.3	-22.3	33.2	0	0	0	110.3	E771	P769-E771 PolarHBondContact O-N 3.24Å
770	K	26.6	Very low	31.9	Very low	177 Å²	177	133.1 Å²	133.1	77%	0.77	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-67.7	130.3	159.7	-72.7	-175.6	175.5	-177.1	0	107.6	L768 H772	L768-K770 PolarHBondContact O-N 3.22Å; K770-H772 PolarHBondContact O-N 3.17Å
771	E	24.4	Very low	31.4	Very low	193 Å²	193	134.6 Å²	134.6	90%	0.902	71%	0.709	S	S	*	*			trans	-67.1	101.1	174.8	-66.4	-170.3	145	0	0	109.9	P769 S773	P769-E771 PolarHBondContact O-N 3.24Å; E771-S773 PolarHBondContact O-N 3.05Å
772	H	28.2	Very low	31.1	Very low	162 Å²	162	136.3 Å²	136.3	75%	0.75	73%	0.726	S	S	*	*			trans	-91.5	89	165.4	-79.1	-87.3	0	0	0	108.5	K770 E774	K770-H772 PolarHBondContact O-N 3.17Å; H772-E774 PolarHBondContact O-N 2.88Å; H772-E774 VanDerWaalsContact O-N 3.09Å
773	S	25.5	Very low	30.6	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	75%	0.752	S	S	*	*			trans	-76.8	84.5	172.9	59.9	0	0	0	0	110.5	E771 Q775	E771-S773 PolarHBondContact O-N 3.05Å; S773-Q775 PolarHBondContact O-N 3.17Å
774	E	30	Very low	30.3	Very low	188 Å²	188	148.1 Å²	148.1	88%	0.879	78%	0.784	S	S	*	*			trans	-71.1	114.5	169.5	-69.8	-167.2	142.2	0	0	110.1	H772	H772-E774 PolarHBondContact O-N 2.88Å; H772-E774 VanDerWaalsContact O-N 3.09Å
775	Q	28.2	Very low	30.2	Very low	194 Å²	194	147.4 Å²	147.4	91%	0.907	78%	0.782	S	S	*	*			trans	-77.9	129	173.9	-67.5	177.5	-41.5	0	0	109.9	S773	S773-Q775 PolarHBondContact O-N 3.17Å
776	A	31.3	Very low	30.1	Very low	109 Å²	109	153.5 Å²	153.5	90%	0.901	81%	0.81	S	S	*	*			trans	-122.1	101.8	171.8	0	0	0	0	0	110.9
777	G	30.5	Very low	29.7	Very low	72 Å²	72	149.9 Å²	149.9	74%	0.742	81%	0.811	S	S	*	*			trans	-151.8	161.6	166.9	0	0	0	0	0	109.5
778	Q	31.8	Very low	29.7	Very low	190 Å²	190	146.3 Å²	146.3	89%	0.888	81%	0.814	S	S	*	*			cis	-167.6	139.5	-3.1	-172.1	-179.6	55.7	0	0	109
779	S	30.4	Very low	29.9	Very low	109 Å²	109	143.1 Å²	143.1	76%	0.762	81%	0.811	S	S	*	*			trans	170.9	151.4	160.1	-85.7	0	0	0	0	110.6
780	I	30.3	Very low	29.9	Very low	162 Å²	162	143.9 Å²	143.9	83%	0.831	81%	0.814	S	S	*	*			cis	-150.4	165.5	-12.8	-113.1	163.2	0	0	0	108
781	K	27.3	Very low	30.2	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	81%	0.813	S	S	*	*			trans	-86.4	154.5	-171.7	-68.2	177.9	176.3	176.4	0	116.1
782	I	31.4	Very low	30.5	Very low	161 Å²	161	137.8 Å²	137.8	83%	0.826	81%	0.81	S	S	*	*			trans	-165.1	140.8	142.8	-109	158.7	0	0	0	107.5
783	I	32.5	Very low	30.6	Very low	145 Å²	145	133.9 Å²	133.9	74%	0.744	81%	0.814	S	S	*	*			cis	-147	-118.5	-10.1	-163.6	167.9	0	0	0	112.5
784	E	32.5	Very low	31	Very low	166 Å²	166	133.4 Å²	133.4	78%	0.776	81%	0.81	S	S	*	*			trans	-124	172.7	-171.9	-80.1	176.8	130	0	0	110.8
785	S	32.8	Very low	31.1	Very low	95 Å²	95	131 Å²	131	66%	0.664	80%	0.803	S	S	*	*			cis	-166.2	-170	-12.2	48.7	0	0	0	0	107
786	Q	32.9	Very low	31.3	Very low	185 Å²	185	131.4 Å²	131.4	86%	0.864	80%	0.798	S	S	*	*			cis	-139.5	-153.6	10	-58.3	-178.1	14.6	0	0	110.4
787	A	28	Very low	31.5	Very low	106 Å²	106	132.6 Å²	132.6	88%	0.876	79%	0.794	S	S	*	*			trans	-160.5	163	177.9	0	0	0	0	0	114.8
788	G	30.7	Very low	31.5	Very low	79 Å²	79	132.5 Å²	132.5	81%	0.814	79%	0.793	S	S	*	*			trans	131.2	163.1	166.2	0	0	0	0	0	114.5
789	A	33	Very low	31.6	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	79%	0.793	S	S	*	*			cis	-163.2	157.9	-24.8	0	0	0	0	0	110.8
790	T	29.1	Very low	31.7	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	80%	0.801	S	S	*	*			trans	-22	149	168.7	54.8	0	0	0	0	118.9
791	T	32.6	Very low	31.7	Very low	123 Å²	123	132.4 Å²	132.4	76%	0.755	80%	0.797	S	S	*	*				-170.5	152.9	63.1	46	0	0	0	0	117.1
792	S	31.1	Very low	31.8	Very low	118 Å²	118	131.5 Å²	131.5	83%	0.825	80%	0.795	S	S	*	*			trans	64.9	128.8	138	65.8	0	0	0	0	126.5
793	G	31.2	Very low	31.8	Very low	81 Å²	81	130.5 Å²	130.5	84%	0.835	79%	0.791	S	S	*	*			trans	123.4	152.4	145.5	0	0	0	0	0	117.1
794	S	34.6	Very low	31.4	Very low	99 Å²	99	128.9 Å²	128.9	69%	0.692	79%	0.792	S	S	*	*			cis	-175.1	108.4	-25.6	170.2	0	0	0	0	113.3
795	N	30.4	Very low	31.7	Very low	137 Å²	137	126.4 Å²	126.4	73%	0.733	79%	0.791	S	S	*	*			trans	66.3	166.3	148.9	-65.3	-0.6	0	0	0	124.5
796	Y	32.9	Very low	31.6	Very low	202 Å²	202	127.7 Å²	127.7	79%	0.792	80%	0.799	S	S	*	*			trans	82.6	106.6	173.3	-54.7	-72	0	0	0	116.7
797	T	35.3	Very low	31.4	Very low	135 Å²	135	123.9 Å²	123.9	83%	0.828	79%	0.793	S	S	*	*				79.4	130.6	62.5	62.8	0	0	0	0	114.6
798	G	31.8	Very low	31.6	Very low	70 Å²	70	131 Å²	131	72%	0.722	80%	0.797	S	S	*	*			cis	178.8	-173.7	-0.6	0	0	0	0	0	113.6
799	E	33.3	Very low	31.4	Very low	186 Å²	186	137.9 Å²	137.9	87%	0.869	80%	0.799	S	S	*	*			trans	63.7	114.8	161.3	-63	171.5	-175.4	0	0	120
800	E	31.6	Very low	31.3	Very low	200 Å²	200	141.3 Å²	141.3	94%	0.935	80%	0.803	S	S	*	*				78.9	139.1	98.6	-64.4	-150.4	169.1	0	0	116.7
801	G	30.4	Very low	31.2	Very low	72 Å²	72	142.1 Å²	142.1	74%	0.742	80%	0.798	S	S	*	*			cis	179.7	-172.3	-3.1	0	0	0	0	0	114.7
802	H	30.5	Very low	31.2	Very low	177 Å²	177	147.6 Å²	147.6	82%	0.819	81%	0.805	S	S	*	*			trans	77.2	103.4	159.9	-105.7	-104.5	0	0	0	125.7
803	L	29.7	Very low	31	Very low	139 Å²	139	151.8 Å²	151.8	73%	0.728	80%	0.802	S	S	*	*			trans	35.7	117.4	133	-51.7	-177.6	0	0	0	125.6
804	S	25.2	Very low	31	Very low	111 Å²	111	159.1 Å²	159.1	78%	0.776	81%	0.806	S	S	*	*				46.3	162.1	113.1	-113.6	0	0	0	0	124
805	P	39.5	Very low	30.8	Very low	115 Å²	115	162.9 Å²	162.9	75%	0.747	81%	0.812	S	S	*	*			cis	-138.8	-178.7	-44.9	37	-18.1	0	0	0	114.6
806	S	30.7	Very low	30.9	Very low	121 Å²	121	162.6 Å²	162.6	85%	0.846	82%	0.816	S	S	*	*				153.8	154	127.1	-163.3	0	0	0	0	117.1
807	S	27.5	Very low	30.7	Very low	105 Å²	105	156.6 Å²	156.6	73%	0.734	81%	0.808	S	S	*	*			trans	-61.6	151.6	-163.9	-51.9	0	0	0	0	120.7
808	R	33.4	Very low	30.4	Very low	256 Å²	256	158.1 Å²	158.1	97%	0.966	81%	0.811	S	S	*	*				-154.3	167.2	126.7	-129.2	168.5	-80	-159	-1.9	113.6
809	R	25.9	Very low	30.3	Very low	224 Å²	224	158 Å²	158	85%	0.845	81%	0.81	S	S	*	*			trans	-131	133.7	-159.6	167.3	-171.5	-179.3	178.4	2.1	111.8
810	L	30.8	Very low	30.3	Very low	169 Å²	169	156.8 Å²	156.8	89%	0.885	81%	0.808	S	S	*	*			trans	-158	158.4	150.4	-140.3	74.5	0	0	0	111.4
811	E	26.6	Very low	30.3	Very low	145 Å²	145	153.2 Å²	153.2	68%	0.678	79%	0.791	S	S	*	*			trans	-130.6	136.4	-169.8	-178.4	-168.3	153	0	0	110.9
812	R	32.9	Very low	30.4	Very low	238 Å²	238	156 Å²	156	90%	0.898	79%	0.794	S	S	*	*			trans	-158.4	148.7	157.1	-110.1	158.6	-170.4	147.6	4	110.6
813	R	27.3	Very low	30.1	Very low	205 Å²	205	154.6 Å²	154.6	77%	0.774	79%	0.791	S	S	*	*			trans	-94.5	149.9	-164.1	-53.4	169	-177.1	166.4	-1.6	112.4
814	Y	30.8	Very low	30.1	Very low	235 Å²	235	155.8 Å²	155.8	92%	0.922	79%	0.791	S	S	*	*				-159.1	155.8	128.2	-88.7	-62	0	0	0	110.1
815	H	29.7	Very low	30.5	Very low	178 Å²	178	156.2 Å²	156.2	82%	0.824	79%	0.791	S	S	*	*			trans	-81.5	162.2	168	-57	-74.5	0	0	0	108.9
816	T	32.9	Very low	30	Very low	131 Å²	131	155.1 Å²	155.1	80%	0.804	79%	0.786	S	S	*	*			cis	-162.4	165.3	31.6	-30.6	0	0	0	0	109.6
817	A	28.5	Very low	29.8	Very low	77 Å²	77	154.3 Å²	154.3	64%	0.636	78%	0.78	S	S	*	*			trans	30.7	136.9	148.1	0	0	0	0	0	121.1
818	D	29.4	Very low	30	Very low	166 Å²	166	158.3 Å²	158.3	89%	0.888	79%	0.787	S	S	*	*			cis	-159.1	161.9	18.4	-101.2	-34.5	0	0	0	113.2
819	G	28.9	Very low	29.8	Very low	67 Å²	67	150.9 Å²	150.9	69%	0.691	78%	0.775	S	S	*	*			trans	83.7	162.5	152.3	0	0	0	0	0	118.8
820	I	33.2	Very low	29.8	Very low	162 Å²	162	147 Å²	147	83%	0.831	78%	0.776	S	S	*	*			cis	-166.4	153.5	-10.3	-132.8	162.2	0	0	0	108.1
821	E	33.2	Very low	29.6	Very low	124 Å²	124	145.8 Å²	145.8	58%	0.579	77%	0.77	S	S	*	*			cis	-124.1	-115.8	-8.1	-159.8	-164	-82.3	0	0	110.5	L823 K824	E821-L823 WeakPolarHBondContact OE2-CA 3.48Å; E821-L823 PolarHBondContact OE2-N 3.24Å; E821-K824 PolarHBondContact OE2-N 3.44Å
822	V	31.5	Very low	29.6	Very low	131 Å²	131	146.8 Å²	146.8	79%	0.794	78%	0.779	S	S	*	*			cis	-128.9	89.9	-4.1	-175.7	0	0	0	0	110.2
823	L	25.1	Very low	29.4	Very low	148 Å²	148	143.6 Å²	143.6	78%	0.775	78%	0.779	S	S	*	*			trans	-165.4	122.2	166.1	-75.2	-174.3	0	0	0	102.4	E821	E821-L823 WeakPolarHBondContact OE2-CA 3.48Å; E821-L823 PolarHBondContact OE2-N 3.24Å
824	K	29.2	Very low	29.4	Very low	163 Å²	163	143.6 Å²	143.6	71%	0.709	78%	0.784	S	S	*	*				178.4	174.1	53.8	-141.6	176.2	-175.8	174.1	0	106.9	E821	E821-K824 PolarHBondContact OE2-N 3.44Å
825	P	34.1	Very low	29.1	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	78%	0.784	S	S	*	*				-151.6	-174.8	78.5	43.3	-23.3	0	0	0	112.5
826	S	28	Very low	28.9	Very low	92 Å²	92	144 Å²	144	64%	0.643	78%	0.782	S	S	*	*			cis	-143.7	176.4	4.5	65.3	0	0	0	0	111.8
827	S	27.6	Very low	28.6	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	78%	0.778	S	S	*	*			trans	40.1	97.7	162	62.2	0	0	0	0	120.6
828	Q	32.2	Very low	28.7	Very low	189 Å²	189	144.4 Å²	144.4	88%	0.883	77%	0.768	S	S	*	*				-165.2	159.4	111.2	-104.6	-179.9	10.5	0	0	111.9
829	S	29.1	Very low	28.6	Very low	100 Å²	100	143 Å²	143	70%	0.699	76%	0.76	S	S	*	*			trans	-47.8	126.7	-163	50.5	0	0	0	0	119.6
830	T	25.9	Very low	28.5	Very low	143 Å²	143	143.5 Å²	143.5	88%	0.877	75%	0.751	S	S	*	*			trans	-99.8	83.2	154.6	43.5	0	0	0	0	110.5
831	N	25.3	Very low	28.1	Very low	142 Å²	142	140.4 Å²	140.4	76%	0.759	75%	0.749	S	S	*	*			trans	-143.7	30.8	-172.7	-122.6	-23.1	0	0	0	115.7
832	I	26.9	Very low	27.8	Very low	167 Å²	167	138.6 Å²	138.6	86%	0.856	76%	0.755	S	S	*	*			trans	-117.1	76	179.4	-53.9	179.5	0	0	0	110.1
833	L	29.2	Very low	27.5	Very low	171 Å²	171	137.7 Å²	137.7	90%	0.895	76%	0.755	S	S	*	*	S	Bend	trans	-161.3	13.7	169	-114.1	159.5	0	0	0	114.9
834	K	26	Very low	27.5	Very low	204 Å²	204	135 Å²	135	89%	0.887	75%	0.754	S	S	*	*	S	Bend	trans	-123.8	29.7	-178.5	-75.7	-173.8	175.3	177.8	0	114.3
835	R	25.4	Very low	27.5	Very low	242 Å²	242	132.5 Å²	132.5	91%	0.913	76%	0.757	S	S	*	*			trans	-125.9	38.1	-177.7	-107.3	-171.7	174.2	-150.1	-1.4	115.2
836	F	26.2	Very low	27.1	Very low	181 Å²	181	138.2 Å²	138.2	79%	0.794	76%	0.763	S	S	*	*			trans	-126	94.4	162.7	-71.7	-70.1	0	0	0	110.3
837	S	25.9	Very low	27.1	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	77%	0.769	S	S	*	*			trans	-138.2	104.6	170.8	-177.4	0	0	0	0	109.1	N839	S837-N839 PolarHBondContact O-N 3.48Å
838	W	30.4	Very low	27.1	Very low	113 Å²	113	145 Å²	145	43%	0.428	78%	0.778	S	S	.	*			trans	-77.6	70.7	173.9	-76.4	84.2	0	0	0	109.9	M398 M762 T840	M398-W838 HydrophobicContact CE-CH2 4.01Å; M398-W838 HydrophobicContact CE-CZ2 3.54Å; M398-W838 HydrophobicContact SD-CH2 4.44Å; M398-W838 HydrophobicContact SD-CZ2 4.45Å; M762-W838 HydrophobicContact CB-CH2 4.36Å; M762-W838 HydrophobicContact SD-CH2 4.44Å; M762-W838 HydrophobicContact SD-CZ3 4.36Å; W838-T840 VanDerWaalsContact C-N 3.33Å; W838-T840 PolarHBondContact O-N 2.88Å
839	N	26.5	Very low	27	Very low	136 Å²	136	141.3 Å²	141.3	73%	0.727	77%	0.774	S	S	*	*			trans	-83.8	77.3	-177.1	-156	29	0	0	0	110.6	S837 A841	S837-N839 PolarHBondContact O-N 3.48Å; N839-A841 PolarHBondContact O-N 3.33Å
840	T	28.5	Very low	26.9	Very low	79 Å²	79	139.7 Å²	139.7	49%	0.485	77%	0.772	S	S	.	*			trans	-48.2	124.1	165.4	45.3	0	0	0	0	109.5	W838 A842	W838-T840 VanDerWaalsContact C-N 3.33Å; W838-T840 PolarHBondContact O-N 2.88Å; T840-A842 PolarHBondContact O-N 3.46Å
841	A	24.8	Very low	27.2	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	77%	0.77	S	S	*	*			trans	-62.1	93.1	-164.9	0	0	0	0	0	113.9	N839 S843	N839-A841 PolarHBondContact O-N 3.33Å; A841-S843 PolarHBondContact O-N 2.73Å
842	A	25.9	Very low	27.5	Very low	87 Å²	87	141.2 Å²	141.2	72%	0.719	77%	0.774	S	S	*	*			trans	-78.4	96.6	163.6	0	0	0	0	0	108.7	T840 A844	T840-A842 PolarHBondContact O-N 3.46Å; A842-A844 PolarHBondContact O-N 2.87Å
843	S	24.9	Very low	27.7	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	78%	0.775	S	S	*	*			trans	-68.4	73.3	173.5	-62.4	0	0	0	0	111.3	A841 S845	A841-S843 PolarHBondContact O-N 2.73Å; S843-S845 PolarHBondContact O-N 2.75Å
844	A	25.7	Very low	28.1	Very low	93 Å²	93	139.6 Å²	139.6	77%	0.769	77%	0.768	S	S	*	*			trans	-71.6	71.7	172.1	0	0	0	0	0	110.3	A842 R846	A842-A844 PolarHBondContact O-N 2.87Å; A844-R846 VanDerWaalsContact C-N 3.28Å; A844-R846 PolarHBondContact O-N 3.42Å
845	S	28.1	Very low	28.5	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	76%	0.764	S	S	*	*			trans	-64.3	87.8	174.1	57.4	0	0	0	0	109.6	S843 A847	S843-S845 PolarHBondContact O-N 2.75Å; S845-A847 PolarHBondContact O-N 2.86Å
846	R	26.6	Very low	28.8	Very low	242 Å²	242	129.4 Å²	129.4	91%	0.913	76%	0.758	S	S	*	*			trans	-74.6	70.7	-176.4	-164.6	175.4	-172.5	174.8	2.1	110.5	A844 R848	A844-R846 VanDerWaalsContact C-N 3.28Å; A844-R846 PolarHBondContact O-N 3.42Å; R846-R848 PolarHBondContact O-N 3.08Å
847	A	27.4	Very low	29	Very low	94 Å²	94	132.1 Å²	132.1	78%	0.777	76%	0.763	S	S	*	*			trans	-59.1	105.5	-176.8	0	0	0	0	0	111.1	S845 S849	S845-A847 PolarHBondContact O-N 2.86Å; A847-S849 PolarHBondContact O-N 2.96Å
848	R	28.8	Very low	29.3	Very low	244 Å²	244	137 Å²	137	92%	0.921	77%	0.771	S	S	*	*			trans	-74.4	114.8	159.3	-88.6	-178.2	158.7	176.9	-6.8	107.5	R846 G850	R846-R848 PolarHBondContact O-N 3.08Å; R848-G850 PolarHBondContact O-N 3.27Å
849	S	28.6	Very low	29.5	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	79%	0.786	S	S	*	*			trans	-70.6	88.7	176.4	52.7	0	0	0	0	111.1	A847 T851	A847-S849 PolarHBondContact O-N 2.96Å; S849-T851 PolarHBondContact O-N 3.43Å
850	G	28.8	Very low	29.7	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	79%	0.79	S	S	*	*			trans	-77.9	91.6	169.4	0	0	0	0	0	111.1	R848 H852	R848-G850 PolarHBondContact O-N 3.27Å; G850-H852 PolarHBondContact O-N 3.45Å; G850-H852 VanDerWaalsContact O-N 3.09Å
851	T	32	Very low	30	Very low	135 Å²	135	136.9 Å²	136.9	83%	0.828	81%	0.807	S	S	*	*			trans	-76.3	90.1	175.5	48.5	0	0	0	0	110.9	S849	S849-T851 PolarHBondContact O-N 3.43Å
852	H	31.3	Very low	30.5	Very low	183 Å²	183	137.3 Å²	137.3	85%	0.847	80%	0.804	S	S	*	*			trans	-84.1	117.9	169.7	-87.1	-76	0	0	0	111.5	G850	G850-H852 PolarHBondContact O-N 3.45Å; G850-H852 VanDerWaalsContact O-N 3.09Å
853	H	30.2	Very low	30.9	Very low	189 Å²	189	139.1 Å²	139.1	88%	0.875	81%	0.806	S	S	*	*			trans	-106.2	112.1	164.7	-134.7	-65.3	0	0	0	108.3
854	P	37.5	Very low	31.3	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	81%	0.808	S	S	*	*			trans	-96.8	138.1	177.8	34.2	-30.6	0	0	0	111.9
855	S	34.7	Very low	31.6	Very low	116 Å²	116	140.3 Å²	140.3	81%	0.811	80%	0.804	S	S	*	*			trans	-148.7	131.4	163.2	-164.1	0	0	0	0	113.5
856	C	31.6	Very low	31.9	Very low	117 Å²	117	139.2 Å²	139.2	79%	0.791	80%	0.796	S	S	*	*			trans	5.5	111.2	164.5	-64.1	0	0	0	0	122.7
857	R	30.1	Very low	32.1	Very low	238 Å²	238	134.8 Å²	134.8	90%	0.898	79%	0.79	S	S	*	*			trans	7.5	128.1	130.4	-56.1	171.7	175.7	176.3	-3.8	118.8
858	K	32.9	Very low	32.3	Very low	204 Å²	204	135 Å²	135	89%	0.887	79%	0.786	S	S	*	*				174.2	144.7	107.6	-97	179.3	179	-176.4	0	115.3
859	A	34.2	Very low	32.4	Very low	88 Å²	88	128.3 Å²	128.3	73%	0.727	78%	0.775	S	S	*	*			trans	58.4	87.5	143.7	0	0	0	0	0	123.3
860	S	31.5	Very low	32.6	Very low	116 Å²	116	133.7 Å²	133.7	81%	0.811	78%	0.78	S	S	*	*				39.1	120.1	118.9	61.1	0	0	0	0	123.9
861	S	35.4	Very low	32.4	Very low	121 Å²	121	136 Å²	136	85%	0.846	79%	0.786	S	S	*	*				-165.3	167	124.6	59.4	0	0	0	0	113.3
862	S	33.7	Very low	32.4	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	79%	0.79	S	S	*	*			trans	-56.3	166.1	-177.3	52.9	0	0	0	0	117.1
863	T	35.7	Very low	32.2	Very low	124 Å²	124	132 Å²	132	76%	0.761	79%	0.785	S	S	*	*			cis	-154.8	156.1	35.1	49	0	0	0	0	115.9
864	V	33.5	Very low	32.3	Very low	133 Å²	133	127 Å²	127	81%	0.806	78%	0.784	S	S	*	*			trans	5.1	140.4	131.2	174.3	0	0	0	0	117.7
865	S	30.7	Very low	31.8	Very low	97 Å²	97	128.7 Å²	128.7	68%	0.678	79%	0.785	S	S	*	*			cis	-155.6	166	18.6	-147.9	0	0	0	0	116.4
866	S	34.4	Very low	31.5	Very low	86 Å²	86	129.3 Å²	129.3	60%	0.601	79%	0.79	S	S	*	*			trans	66.7	118.8	138	-75.6	0	0	0	0	124.8
867	D	30.3	Very low	31.2	Very low	148 Å²	148	129.1 Å²	129.1	79%	0.791	79%	0.79	S	S	*	*				69.1	136.3	126.2	-59.1	-49.9	0	0	0	121.3
868	S	32.4	Very low	31.1	Very low	98 Å²	98	124.2 Å²	124.2	69%	0.685	79%	0.791	S	S	*	*			cis	-163.2	172.6	1.2	58	0	0	0	0	114.5
869	C	30.5	Very low	30.8	Very low	104 Å²	104	120 Å²	120	70%	0.703	79%	0.788	S	S	*	*			trans	87.2	139.7	140.7	-81.5	0	0	0	0	124.5
870	Y	32.2	Very low	30.6	Very low	225 Å²	225	121.4 Å²	121.4	88%	0.882	79%	0.792	S	S	*	*			trans	74.2	108.3	161.8	-73.3	-68.7	0	0	0	123.4
871	S	26.4	Very low	30.5	Very low	114 Å²	114	124.7 Å²	124.7	80%	0.797	80%	0.795	S	S	*	*			trans	-83	158.5	168.9	-40.7	0	0	0	0	113.4
872	S	32.2	Very low	30.1	Very low	130 Å²	130	126.1 Å²	126.1	91%	0.909	79%	0.792	S	S	*	*			trans	-156.9	117.9	140.4	-171.7	0	0	0	0	111.2
873	S	27.1	Very low	29.8	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	80%	0.801	S	S	*	*			trans	-115.9	105	-179.6	44.6	0	0	0	0	111	I875	S873-I875 PolarHBondContact O-N 2.82Å
874	G	30.4	Very low	29.3	Very low	84 Å²	84	135.8 Å²	135.8	87%	0.866	80%	0.801	S	S	*	*			trans	-82	106	175.9	0	0	0	0	0	112.3
875	I	28.1	Very low	28.9	Very low	149 Å²	149	134.9 Å²	134.9	76%	0.764	80%	0.801	S	S	*	*			trans	-82.5	150.1	177.8	54	166	0	0	0	113.4	S873	S873-I875 PolarHBondContact O-N 2.82Å
876	S	28.3	Very low	28.7	Very low	129 Å²	129	139.1 Å²	139.1	90%	0.902	80%	0.803	S	S	*	*			trans	-164.8	86.7	154.4	-82.4	0	0	0	0	110
877	S	25.5	Very low	28.4	Very low	113 Å²	113	139.5 Å²	139.5	79%	0.79	81%	0.806	S	S	*	*			trans	-96.9	133.2	178.1	-62.3	0	0	0	0	110.6
878	S	28	Very low	28.2	Very low	134 Å²	134	140.1 Å²	140.1	94%	0.937	80%	0.804	S	S	*	*			trans	-160.8	80.7	165.3	-80.8	0	0	0	0	110.7
879	S	27.2	Very low	28	Very low	117 Å²	117	142 Å²	142	82%	0.818	81%	0.807	S	S	*	*			trans	-143.9	93.6	168	176.8	0	0	0	0	108	H881	S879-H881 PolarHBondContact O-N 3.03Å
880	S	29	Very low	28	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	81%	0.807	S	S	*	*			trans	-82.3	104.3	-179.3	35.1	0	0	0	0	111.3
881	H	29.4	Very low	27.9	Very low	186 Å²	186	140.9 Å²	140.9	86%	0.861	80%	0.803	S	S	*	*			trans	-116.3	116	155.7	-102.6	17.1	0	0	0	108.4	S879	S879-H881 PolarHBondContact O-N 3.03Å
882	L	26.9	Very low	28	Very low	150 Å²	150	139.2 Å²	139.2	79%	0.785	80%	0.796	S	S	*	*			trans	-99.3	115.1	167.5	-76.3	170.3	0	0	0	107.8
883	Y	27.1	Very low	27.9	Very low	237 Å²	237	142 Å²	142	93%	0.929	80%	0.795	S	S	*	*			trans	-131.4	129.2	146.9	-116.2	-82.5	0	0	0	107.7
884	Y	25.4	Very low	28	Very low	196 Å²	196	142 Å²	142	77%	0.769	80%	0.795	S	S	*	*			trans	-101.3	122.6	-177	-121.6	-89.1	0	0	0	108.7
885	S	26.2	Very low	28.1	Very low	115 Å²	115	143.1 Å²	143.1	80%	0.804	80%	0.796	S	S	*	*			trans	-157.3	133.2	146.7	62.6	0	0	0	0	112
886	Y	26	Very low	28.3	Very low	186 Å²	186	139.7 Å²	139.7	73%	0.729	80%	0.797	S	S	*	*			trans	-42.5	161.8	158.4	-80.4	-102.1	0	0	0	113.6
887	S	27.9	Very low	28.5	Very low	94 Å²	94	141 Å²	141	66%	0.657	79%	0.793	S	S	*	*			cis	-162.5	135.6	14.2	31.1	0	0	0	0	113.8
888	E	26.4	Very low	28.8	Very low	160 Å²	160	147.1 Å²	147.1	75%	0.748	80%	0.799	S	S	*	*				60.8	161.4	128.9	-60.1	-172.6	128	0	0	125
889	N	28.5	Very low	28.9	Very low	139 Å²	139	144.3 Å²	144.3	74%	0.743	79%	0.791	S	S	*	*			trans	83.5	137.9	163.7	-66.5	-15.5	0	0	0	118.4
890	E	29	Very low	29.2	Very low	153 Å²	153	145.2 Å²	145.2	72%	0.715	79%	0.791	S	S	*	*			cis	-159.4	176.8	9.1	-141.2	-172.7	133.8	0	0	115
891	L	30.6	Very low	29.3	Very low	152 Å²	152	145.9 Å²	145.9	80%	0.796	78%	0.784	S	S	*	*			trans	87.2	136.7	156.7	-66.9	155.1	0	0	0	118.8
892	A	28.7	Very low	29.5	Very low	79 Å²	79	148.3 Å²	148.3	65%	0.653	79%	0.786	S	S	*	*			cis	-160.4	177.1	-3	0	0	0	0	0	114.4
893	E	29.8	Very low	29.5	Very low	189 Å²	189	144.5 Å²	144.5	88%	0.883	78%	0.783	S	S	*	*			trans	87.4	136.3	162.3	-59.9	-160.7	152.2	0	0	119.3
894	S	30.2	Very low	29.6	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	79%	0.786	S	S	*	*			cis	-162.4	173	-11	59.2	0	0	0	0	113.8
895	A	32.6	Very low	29.7	Very low	107 Å²	107	145.1 Å²	145.1	88%	0.884	79%	0.788	S	S	*	*			trans	72.5	141.9	167.2	0	0	0	0	0	119.7
896	G	31.8	Very low	29.7	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	79%	0.785	S	S	*	*			trans	174.2	-7.8	177	0	0	0	0	0	124.7
897	L	32.8	Very low	29.9	Very low	156 Å²	156	142.3 Å²	142.3	82%	0.817	78%	0.783	S	S	*	*			trans	62	119.3	170.2	-72.3	160.2	0	0	0	121.6
898	R	31	Very low	29.9	Very low	242 Å²	242	147.8 Å²	147.8	91%	0.913	80%	0.796	S	S	*	*			trans	62.6	96.2	140.7	-62.2	-177.7	178.4	-139	-0.8	122.3
899	G	30.8	Very low	30	Very low	75 Å²	75	144 Å²	144	77%	0.773	79%	0.792	S	S	*	*			trans	130.4	170	132.6	0	0	0	0	0	118.3
900	V	32.5	Very low	30.7	Very low	135 Å²	135	143.1 Å²	143.1	82%	0.818	79%	0.794	S	S	*	*			cis	-158.6	134.8	-19.1	114.7	0	0	0	0	113
901	I	32.7	Very low	31.4	Very low	130 Å²	130	141.9 Å²	141.9	67%	0.667	80%	0.798	S	S	*	*			trans	31.1	115.7	153.3	-56.5	179.4	0	0	0	122.1
902	R	32	Very low	31.4	Very low	237 Å²	237	138.6 Å²	138.6	89%	0.894	79%	0.794	S	S	*	*			trans	63	141.3	154.3	-63.6	165.1	-171.4	171.6	1.1	118.6
903	G	27.6	Very low	31.5	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	81%	0.807	S	S	*	*			cis	113.9	110.5	-13.3	0	0	0	0	0	116.8
904	R	30	Very low	31.5	Very low	262 Å²	262	139 Å²	139	99%	0.989	80%	0.802	S	S	*	*			trans	-164.2	176.4	160.1	-120.7	173.7	-176.1	175.8	-0.4	114.7
905	K	26.3	Very low	32.1	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	81%	0.805	S	S	*	*			trans	-125.2	150.5	-172.7	-97.2	-176.4	174.4	-177.7	0	112.1
906	L	27.3	Very low	32.1	Very low	144 Å²	144	138.7 Å²	138.7	75%	0.754	80%	0.795	S	S	*	*			trans	57.2	116.1	144.1	-62.7	170.6	0	0	0	121.9
907	S	28.7	Very low	32	Very low	98 Å²	98	141 Å²	141	69%	0.685	79%	0.794	S	S	*	*			trans	52.3	126.2	134.9	63	0	0	0	0	123
908	F	28.3	Very low	31.9	Very low	209 Å²	209	139.9 Å²	139.9	92%	0.917	79%	0.788	S	S	*	*				-168.8	-168.5	111.4	-117.9	-90.9	0	0	0	112.5
909	A	28.3	Very low	31.9	Very low	80 Å²	80	135.9 Å²	135.9	66%	0.661	78%	0.78	S	S	*	*			trans	-81.9	171	-157.3	0	0	0	0	0	119
910	P	43.9	Very low	31.9	Very low	121 Å²	121	138 Å²	138	79%	0.786	77%	0.773	S	S	*	*			trans	-88.5	-161.9	171.6	41.8	-40.5	0	0	0	112.1
911	P	43.4	Very low	31.8	Very low	126 Å²	126	137.9 Å²	137.9	82%	0.818	77%	0.766	S	S	*	*			cis	-138.4	-172.5	-0.5	45.2	-26.6	0	0	0	116.7
912	A	30.9	Very low	31.6	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	77%	0.77	S	S	*	*			trans	-178.3	130.3	153.4	0	0	0	0	0	110.1
913	E	31.3	Very low	31.4	Very low	201 Å²	201	133.3 Å²	133.3	94%	0.939	76%	0.761	S	S	*	*				54.9	136.7	93.7	-59.4	178.9	-175.1	0	0	115
914	G	28.2	Very low	31.6	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	76%	0.761	S	S	*	*			cis	151.4	179.2	10.5	0	0	0	0	0	107.9
915	P	44.6	Very low	31.6	Very low	124 Å²	124	128.2 Å²	128.2	81%	0.805	75%	0.749	S	S	*	*			cis	-134.5	-168.9	-11.4	44	-25.6	0	0	0	114.1
916	A	31.2	Very low	32.4	Very low	82 Å²	82	125.1 Å²	125.1	68%	0.678	75%	0.748	S	S	*	*			trans	29.1	151	135.2	0	0	0	0	0	122.6
917	V	31.1	Very low	32.5	Very low	127 Å²	127	126 Å²	126	77%	0.77	75%	0.752	S	S	*	*			cis	-176.4	-175.5	2.8	-95.7	0	0	0	0	107.5
918	D	30.2	Very low	32.6	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	76%	0.755	S	S	*	*			cis	-161.4	176.8	-4.7	-129.1	-44.5	0	0	0	111.8
919	E	30.7	Very low	32.5	Very low	159 Å²	159	124.9 Å²	124.9	74%	0.743	75%	0.752	S	S	*	*			trans	56.8	159.9	148.8	-74.5	-163.9	144.9	0	0	121.2
920	L	31.1	Very low	32.7	Very low	119 Å²	119	130.2 Å²	130.2	62%	0.623	76%	0.763	S	S	*	*			cis	-158.4	132.5	-7.3	-103.4	160.9	0	0	0	106.9
921	I	30.2	Very low	32.1	Very low	132 Å²	132	129.4 Å²	129.4	68%	0.677	77%	0.767	S	S	*	*				80.9	135	102.2	-106.7	-177.4	0	0	0	119.6
922	D	28.8	Very low	31.4	Very low	137 Å²	137	127.1 Å²	127.1	73%	0.733	77%	0.766	S	S	*	*			trans	54	162.1	162.3	-52.8	-16.3	0	0	0	120.5
923	D	28.1	Very low	31.3	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	78%	0.776	S	S	*	*			cis	-155	176.8	4.8	-154.8	-7.6	0	0	0	113.6
924	V	30.9	Very low	31.3	Very low	121 Å²	121	128.6 Å²	128.6	73%	0.733	77%	0.769	S	S	*	*			trans	80.1	117	163.8	-161.6	0	0	0	0	117.1
925	S	29.3	Very low	31.4	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	77%	0.77	S	S	*	*			cis	104.4	150.5	27.3	-72.6	0	0	0	0	115.6
926	P	43.2	Very low	30.7	Very low	120 Å²	120	129.8 Å²	129.8	78%	0.779	77%	0.768	S	S	*	*			trans	-129.7	-177	-142	45	-32	0	0	0	117.1
927	L	29.8	Very low	30.4	Very low	162 Å²	162	132.4 Å²	132.4	85%	0.848	78%	0.776	S	S	*	*			trans	-169.3	157.8	159.9	-104.9	171	0	0	0	107.6
928	T	30.6	Very low	30.3	Very low	122 Å²	122	134.3 Å²	134.3	75%	0.748	78%	0.776	S	S	*	*			cis	-143.7	-174.9	7.7	-43.7	0	0	0	0	109.6
929	L	27.7	Very low	30.1	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	78%	0.781	S	S	*	*			trans	-116.7	152.3	177.3	-62	116.1	0	0	0	114.5
930	Q	31.6	Very low	30	Very low	192 Å²	192	134 Å²	134	90%	0.897	78%	0.784	S	S	*	*				-176.8	114.6	127.9	-99.2	172.9	-2.9	0	0	108.4
931	A	30.5	Very low	29.9	Very low	104 Å²	104	137.1 Å²	137.1	86%	0.86	79%	0.793	S	S	*	*				86.3	112	66.8	0	0	0	0	0	113.3
932	G	30.1	Very low	29.7	Very low	77 Å²	77	135.3 Å²	135.3	79%	0.794	80%	0.798	S	S	*	*			trans	-172.7	16.5	-171.9	0	0	0	0	0	121.5
933	Q	29.1	Very low	29.7	Very low	196 Å²	196	137.4 Å²	137.4	92%	0.916	81%	0.805	S	S	*	*			trans	61.5	159.5	171.6	-72.1	-172.3	-46.6	0	0	120
934	P	30.7	Very low	29.6	Very low	121 Å²	121	138 Å²	138	79%	0.786	81%	0.808	S	S	*	*			trans	-114.8	155.9	-178.6	40.7	-31	0	0	0	115.6
935	A	29.6	Very low	29.5	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	81%	0.807	S	S	*	*			trans	-134.9	110.4	155.3	0	0	0	0	0	106.9
936	V	29.8	Very low	29.5	Very low	127 Å²	127	139 Å²	139	77%	0.77	81%	0.809	S	S	*	*				65.3	111.6	84.4	177.7	0	0	0	0	111.9
937	V	25.4	Very low	28.8	Very low	137 Å²	137	137.8 Å²	137.8	83%	0.83	80%	0.803	S	S	*	*			trans	-88.1	127.8	170.2	174.2	0	0	0	0	108.1
938	E	28.4	Very low	28.8	Very low	167 Å²	167	140.8 Å²	140.8	78%	0.78	81%	0.809	S	S	*	*			trans	-132.8	140.8	168.5	-165.7	142.7	-133.3	0	0	110
939	V	26.6	Very low	28.7	Very low	132 Å²	132	142.1 Å²	142.1	80%	0.8	81%	0.807	S	S	*	*			trans	-116.1	97.3	-175.9	175.8	0	0	0	0	107.6
940	D	28.8	Very low	28.9	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	81%	0.805	S	S	*	*			trans	-94.2	153.2	-168.5	-145.8	-15.3	0	0	0	114.1
941	K	28.8	Very low	29	Very low	185 Å²	185	135.9 Å²	135.9	80%	0.804	79%	0.788	S	S	*	*			trans	-131	120.1	-175.1	-79.1	-179.7	177	173.8	0	112.1
942	A	26.7	Very low	29	Very low	94 Å²	94	137.8 Å²	137.8	78%	0.777	78%	0.784	S	S	*	*			trans	64.9	172.7	148.6	0	0	0	0	0	118.4
943	M	28.1	Very low	29.1	Very low	181 Å²	181	138.4 Å²	138.4	89%	0.892	78%	0.776	S	S	*	*			trans	60.9	89.4	172.7	-57	-167.2	175.5	0	0	116.2
944	N	26.4	Very low	29.4	Very low	146 Å²	146	134 Å²	134	78%	0.781	77%	0.767	S	S	*	*				46.7	115.6	77.8	-166.8	25	0	0	0	114.6
945	I	27.3	Very low	29.3	Very low	139 Å²	139	135.9 Å²	135.9	71%	0.713	77%	0.77	S	S	*	*				166.7	124.8	129.9	-85.2	153	0	0	0	111.4
946	S	29.6	Very low	29.5	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	77%	0.768	S	S	*	*			trans	174.3	100.1	134.4	35.1	0	0	0	0	108.8
947	S	30.3	Very low	29.2	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	77%	0.771	S	S	*	*				65.6	101.4	59.4	83.7	0	0	0	0	114
948	F	28.5	Very low	29.6	Very low	225 Å²	225	134.7 Å²	134.7	99%	0.987	77%	0.774	S	S	*	*			trans	-109.7	143.2	153.5	-118.1	-88	0	0	0	108.4
949	H	29.9	Very low	29.5	Very low	151 Å²	151	131.7 Å²	131.7	70%	0.699	77%	0.771	S	S	*	*			trans	-118.4	129.2	-159.3	-131.8	-57.3	0	0	0	111.9
950	V	31.9	Very low	29.8	Very low	134 Å²	134	133.3 Å²	133.3	81%	0.812	77%	0.774	S	S	*	*			trans	-156.7	90.2	149.1	-170.4	0	0	0	0	105.5
951	T	32.2	Very low	29.8	Very low	89 Å²	89	129.7 Å²	129.7	55%	0.546	76%	0.76	S	S	.	*				42.5	123.1	92.6	61.3	0	0	0	0	112.6
952	D	30.9	Very low	29.9	Very low	143 Å²	143	129.4 Å²	129.4	77%	0.765	76%	0.762	S	S	*	*			cis	-166.7	167.1	30.7	-110.8	-42.1	0	0	0	108.5
953	S	33.3	Very low	30	Very low	91 Å²	91	130.1 Å²	130.1	64%	0.636	76%	0.761	S	S	*	*			cis	-162.8	164.2	-10.3	-140.5	0	0	0	0	110.2
954	S	34.4	Very low	30.6	Very low	104 Å²	104	127.1 Å²	127.1	73%	0.727	76%	0.755	S	S	*	*			trans	52	144.9	149.1	66.5	0	0	0	0	123.2
955	D	29.3	Very low	30.8	Very low	159 Å²	159	124.7 Å²	124.7	85%	0.85	76%	0.755	S	S	*	*			cis	-170.5	178.4	-29	-140	-40.7	0	0	0	111
956	A	32.8	Very low	30.9	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	75%	0.754	S	S	*	*			trans	66.3	111.6	153.5	0	0	0	0	0	119.5
957	A	24.8	Very low	30.8	Very low	102 Å²	102	123.9 Å²	123.9	84%	0.843	76%	0.76	S	S	*	*			trans	-102.5	140.6	161.2	0	0	0	0	0	111.2
958	V	31.9	Very low	30.7	Very low	145 Å²	145	124.7 Å²	124.7	88%	0.879	77%	0.766	S	S	*	*			trans	-135	138.8	160.2	-177.7	0	0	0	0	108.7
959	S	27.2	Very low	30.8	Very low	103 Å²	103	119.7 Å²	119.7	72%	0.72	76%	0.759	S	S	*	*			trans	-78.4	151.6	179.9	47.6	0	0	0	0	112.7
960	L	32.1	Very low	30.9	Very low	167 Å²	167	120.1 Å²	120.1	87%	0.874	77%	0.766	S	S	*	*				-171.9	161	127.7	-101.8	163	0	0	0	113.1
961	S	28.9	Very low	30.8	Very low	75 Å²	75	118.6 Å²	118.6	52%	0.524	76%	0.762	S	S	.	*			trans	-67.5	141.2	-173.1	49.7	0	0	0	0	116.1
962	H	31.6	Very low	30.7	Very low	180 Å²	180	119 Å²	119	83%	0.833	77%	0.768	S	S	*	*				-178.3	173.7	101.4	-91.4	-47.8	0	0	0	113.6
963	S	28.8	Very low	30.7	Very low	109 Å²	109	118.1 Å²	118.1	76%	0.762	77%	0.768	S	S	*	*			trans	-133	-178.2	-173.3	-45.1	0	0	0	0	109.2
964	P	41.2	Very low	30.5	Very low	118 Å²	118	121.2 Å²	121.2	77%	0.766	78%	0.776	S	S	*	*				-131.1	-159.5	-54.1	37.3	-19.7	0	0	0	111.3
965	A	29.9	Very low	30.3	Very low	95 Å²	95	122 Å²	122	79%	0.785	78%	0.78	S	S	*	*			trans	73.3	154.4	159.3	0	0	0	0	0	117.5
966	S	30.1	Very low	30.4	Very low	98 Å²	98	118.5 Å²	118.5	69%	0.685	77%	0.774	S	S	*	*			cis	-170.6	160.2	-20.6	51.1	0	0	0	0	111.8
967	C	27.5	Very low	30.3	Very low	132 Å²	132	119.8 Å²	119.8	89%	0.892	78%	0.777	S	S	*	*			trans	76.8	154.2	158.9	-63.6	0	0	0	0	119.4
968	S	27.5	Very low	30.8	Very low	111 Å²	111	120.9 Å²	120.9	78%	0.776	77%	0.773	S	S	*	*			trans	-102.9	160.1	-167.9	48.7	0	0	0	0	113.8
969	S	31.7	Very low	30.7	Very low	120 Å²	120	118.8 Å²	118.8	84%	0.839	77%	0.765	S	S	*	*			trans	-168.9	158.9	141.4	-85.1	0	0	0	0	113
970	N	30.6	Very low	31	Very low	159 Å²	159	120.7 Å²	120.7	85%	0.85	77%	0.767	S	S	*	*			trans	-79.3	175.1	179.7	-41.4	-41.8	0	0	0	110.8
971	S	30.7	Very low	30.9	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	76%	0.758	S	S	*	*			cis	-161.4	149.2	9.4	-156.8	0	0	0	0	113.1
972	S	29	Very low	31.1	Very low	97 Å²	97	119.8 Å²	119.8	68%	0.678	76%	0.764	S	S	*	*			trans	22.9	135	144.4	61	0	0	0	0	123.2
973	T	30.6	Very low	31	Very low	126 Å²	126	116.4 Å²	116.4	77%	0.773	76%	0.761	S	S	*	*			trans	-174.3	120.2	139.4	-82.1	0	0	0	0	113.5
974	I	30.6	Very low	30.9	Very low	155 Å²	155	116.2 Å²	116.2	80%	0.795	76%	0.76	S	S	*	*			trans	60.4	147	151	-66.5	173.2	0	0	0	120.2
975	C	29.4	Very low	30.5	Very low	120 Å²	120	117.8 Å²	117.8	81%	0.811	76%	0.76	S	S	*	*			cis	-173.1	148.4	-33.6	-97.3	0	0	0	0	110.4
976	A	31.8	Very low	30.5	Very low	87 Å²	87	121 Å²	121	72%	0.719	76%	0.759	S	S	*	*			trans	-162.9	118.3	148.9	0	0	0	0	0	107.4
977	S	31.3	Very low	30.5	Very low	115 Å²	115	123.3 Å²	123.3	80%	0.804	76%	0.764	S	S	*	*				66.5	123.6	87.9	-54.1	0	0	0	0	112.1
978	V	33.7	Very low	30.7	Very low	125 Å²	125	125.4 Å²	125.4	76%	0.758	76%	0.76	S	S	*	*			cis	-146.6	131.8	16.9	-178	0	0	0	0	107
979	S	30.5	Very low	30.7	Very low	100 Å²	100	125.8 Å²	125.8	70%	0.699	76%	0.758	S	S	*	*				50.4	139	92.7	-21	0	0	0	0	114.7
980	N	33.7	Very low	30.7	Very low	143 Å²	143	126.3 Å²	126.3	77%	0.765	76%	0.756	S	S	*	*			cis	-152.5	163	22.3	-116.9	14	0	0	0	112.9
981	D	30.8	Very low	30.6	Very low	129 Å²	129	126.3 Å²	126.3	69%	0.69	75%	0.751	S	S	*	*			trans	11.9	156.2	140.8	-66.6	-58.5	0	0	0	124.4
982	S	32	Very low	30.7	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	75%	0.749	S	S	*	*			cis	-171.7	156	-21.5	-105	0	0	0	0	112.4
983	S	30.7	Very low	30.8	Very low	109 Å²	109	127.8 Å²	127.8	76%	0.762	75%	0.749	S	S	*	*			trans	41.6	120.4	153.8	63.1	0	0	0	0	123.6
984	S	25.7	Very low	30.8	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	75%	0.749	S	S	*	*			trans	-39.4	152.7	153.7	53.3	0	0	0	0	119.7
985	I	32.6	Very low	31	Very low	151 Å²	151	127.7 Å²	127.7	77%	0.774	75%	0.751	S	S	*	*				-174.4	147.9	125.3	-100.1	161.8	0	0	0	113.7
986	E	31	Very low	31.2	Very low	163 Å²	163	126.4 Å²	126.4	76%	0.762	75%	0.749	S	S	*	*			trans	34.8	118	159.9	-67.9	179.1	134.2	0	0	125.9
987	N	28.7	Very low	31.3	Very low	147 Å²	147	126.8 Å²	126.8	79%	0.786	75%	0.747	S	S	*	*				53.4	144.9	118.5	-73.4	-25.5	0	0	0	126.1
988	Q	31.2	Very low	31.5	Very low	176 Å²	176	130.4 Å²	130.4	82%	0.822	75%	0.75	S	S	*	*			trans	86.6	94.6	150.5	-80.8	-175.7	10.7	0	0	122.7
989	T	28.5	Very low	31.4	Very low	119 Å²	119	132.7 Å²	132.7	73%	0.73	75%	0.75	S	S	*	*				57	136.4	124.3	37.3	0	0	0	0	124.5
990	V	31.5	Very low	31.6	Very low	131 Å²	131	137 Å²	137	79%	0.794	76%	0.76	S	S	*	*			trans	75.1	133.9	146.9	163.1	0	0	0	0	117.2
991	E	28.3	Very low	31.7	Very low	159 Å²	159	135 Å²	135	74%	0.743	75%	0.754	S	S	*	*			cis	-170.5	-180	-13.3	-173.1	-176.9	-116.5	0	0	109.2
992	I	32.6	Very low	32.6	Very low	131 Å²	131	134.2 Å²	134.2	67%	0.672	76%	0.756	S	S	*	*			trans	90.4	101.9	154.9	-49.8	179.7	0	0	0	119.4
993	S	32	Very low	32.6	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	76%	0.761	S	S	*	*			trans	75.9	151.9	141.8	86.6	0	0	0	0	120
994	N	30.6	Very low	32.6	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	76%	0.762	S	S	*	*			cis	-163.3	170.2	-13.6	-120.2	-14.8	0	0	0	112.6
995	T	33.5	Very low	32.8	Very low	136 Å²	136	136 Å²	136	83%	0.834	76%	0.764	S	S	*	*			trans	65.2	155.6	170.1	76.5	0	0	0	0	117.7
996	A	33.8	Very low	32.9	Very low	94 Å²	94	133.1 Å²	133.1	78%	0.777	76%	0.763	S	S	*	*			cis	-167.1	157.5	-34.5	0	0	0	0	0	106
997	S	34.2	Very low	32.8	Very low	95 Å²	95	134.1 Å²	134.1	66%	0.664	77%	0.77	S	S	*	*			cis	-167.4	155.6	20.4	48.4	0	0	0	0	110.8
998	H	35.5	Very low	32.9	Very low	191 Å²	191	138.5 Å²	138.5	88%	0.884	78%	0.775	S	S	*	*				-159.9	157.3	120.7	-123.9	-80	0	0	0	109.2
999	F	32.6	Very low	33.4	Very low	172 Å²	172	135 Å²	135	75%	0.754	77%	0.768	S	S	*	*			trans	-131.3	136.2	-153.9	-122.4	-105.9	0	0	0	114.7
1000	E	33.2	Very low	33.6	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	78%	0.776	S	S	*	*			trans	-128.6	141.1	137.8	-75.5	-162.5	149.5	0	0	106.3
1001	P	37.6	Very low	33.6	Very low	99 Å²	99	135.6 Å²	135.6	64%	0.643	77%	0.772	S	S	*	*				-153	-178.7	100.1	39.7	-20.9	0	0	0	115.2
1002	P	48.5	Very low	33.7	Very low	114 Å²	114	133.3 Å²	133.3	74%	0.74	77%	0.773	S	S	*	*			trans	-116.2	-151.5	-171.3	43.8	-34.3	0	0	0	115.2
1003	T	31.4	Very low	33.7	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	78%	0.78	S	S	*	*			trans	83.3	146.3	168.8	3.2	0	0	0	0	116.7
1004	T	30.6	Very low	33.8	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	79%	0.785	S	S	*	*			cis	-157	173	12	-37.5	0	0	0	0	112.9
1005	A	31.8	Very low	34.4	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	78%	0.784	S	S	*	*			trans	93	144.4	152.5	0	0	0	0	0	119.8
1006	A	33	Very low	34.4	Very low	91 Å²	91	133.6 Å²	133.6	75%	0.752	78%	0.778	S	S	*	*			cis	-167.6	170.7	-18.5	0	0	0	0	0	113.3
1007	M	30.2	Very low	34.5	Very low	183 Å²	183	138.1 Å²	138.1	90%	0.901	78%	0.78	S	S	*	*			trans	85.3	155.9	161.5	-67	-177.3	65.4	0	0	121.9
1008	W	29.9	Very low	34.4	Very low	240 Å²	240	139.1 Å²	139.1	91%	0.909	78%	0.782	S	S	*	*			trans	-115.1	-174	-176.2	-81.7	35.5	0	0	0	108.8
1009	P	42.7	Very low	33.9	Very low	102 Å²	102	134.8 Å²	134.8	66%	0.662	78%	0.779	S	S	*	*			cis	-148.7	-165.6	17.4	46.8	-25.2	0	0	0	118.6
1010	E	32.3	Very low	33.8	Very low	195 Å²	195	133.5 Å²	133.5	91%	0.911	78%	0.78	S	S	*	*			trans	70.1	159.7	160.4	-68.1	-174.3	-163.6	0	0	120.7
1011	G	30.3	Very low	33.7	Very low	67 Å²	67	130 Å²	130	69%	0.691	78%	0.777	S	S	*	*			trans	176.9	-85.4	-177.3	0	0	0	0	0	118.7
1012	S	31	Very low	33.4	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	78%	0.78	S	S	*	*			trans	81	157.2	-178.2	84.4	0	0	0	0	120.1
1013	K	33.6	Very low	32.4	Very low	186 Å²	186	130 Å²	130	81%	0.809	78%	0.777	S	S	*	*			trans	78.7	86	162.6	-63.4	173.9	-177.5	174.2	0	121.6
1014	S	32.6	Very low	32.3	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	78%	0.779	S	S	*	*				32.2	156	102.1	-52.6	0	0	0	0	122.1
1015	P	43.4	Very low	32.3	Very low	114 Å²	114	131.4 Å²	131.4	74%	0.74	78%	0.778	S	S	*	*			cis	-147.2	-168.4	-24.8	40	-19.5	0	0	0	116.6
1016	S	33.5	Very low	32.3	Very low	101 Å²	101	131.2 Å²	131.2	71%	0.706	78%	0.777	S	S	*	*			trans	89.3	143.6	158.4	86.6	0	0	0	0	117.6
1017	K	36.5	Very low	32	Very low	188 Å²	188	134.8 Å²	134.8	82%	0.817	78%	0.775	S	S	*	*			cis	-127.7	109.6	5.5	-76.5	-177.6	-179	178.7	0	110.9
1018	T	31.7	Very low	31.9	Very low	117 Å²	117	132.9 Å²	132.9	72%	0.718	76%	0.764	S	S	*	*				63.4	106.6	100.3	61.3	0	0	0	0	116.8
1019	A	26.2	Very low	31.7	Very low	100 Å²	100	128.7 Å²	128.7	83%	0.826	76%	0.76	S	S	*	*			trans	-108.5	151.7	136.8	0	0	0	0	0	107.2
1020	D	29.4	Very low	31	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	76%	0.76	S	S	*	*			trans	-151	138.3	177.9	-113.2	-45.3	0	0	0	111.9
1021	S	31.3	Very low	30.8	Very low	117 Å²	117	123.4 Å²	123.4	82%	0.818	76%	0.758	S	S	*	*			trans	-161.2	89.4	176.2	62.5	0	0	0	0	111.9
1022	V	31.8	Very low	31	Very low	116 Å²	116	124.7 Å²	124.7	70%	0.703	76%	0.762	S	S	*	*			trans	-142	115.4	177.7	-174.7	0	0	0	0	105.5
1023	S	28	Very low	31	Very low	97 Å²	97	128.5 Å²	128.5	68%	0.678	77%	0.768	S	S	*	*				57.4	140.6	82.7	117.5	0	0	0	0	112.6
1024	L	29.1	Very low	30.9	Very low	154 Å²	154	124 Å²	124	81%	0.806	77%	0.766	S	S	*	*			cis	-145.5	176.7	14.6	-98.2	149.3	0	0	0	107
1025	V	30.1	Very low	31	Very low	127 Å²	127	124.8 Å²	124.8	77%	0.77	77%	0.766	S	S	*	*				-174.1	136	59.6	164.7	0	0	0	0	108.7
1026	A	31.3	Very low	30.5	Very low	90 Å²	90	125.4 Å²	125.4	74%	0.744	77%	0.767	S	S	*	*			trans	39.7	176.3	151.1	0	0	0	0	0	123.7
1027	K	27.1	Very low	30.4	Very low	166 Å²	166	124.3 Å²	124.3	72%	0.722	77%	0.765	S	S	*	*			cis	171	147.9	-47.2	-159.5	-176.5	-178.8	-138.9	0	106.9
1028	E	28.1	Very low	30.2	Very low	143 Å²	143	126.3 Å²	126.3	67%	0.668	77%	0.767	S	S	*	*			trans	63.5	155	166.9	-76.8	147.2	-148.4	0	0	117.4
1029	D	26.5	Very low	30	Very low	152 Å²	152	130.7 Å²	130.7	81%	0.813	77%	0.77	S	S	*	*			cis	-160.8	174.6	-38	-142.7	-38	0	0	0	110.9
1030	A	27.8	Very low	30.3	Very low	82 Å²	82	133.4 Å²	133.4	68%	0.678	77%	0.766	S	S	*	*			trans	63.8	101.8	150.1	0	0	0	0	0	122.8
1031	A	28.4	Very low	30.1	Very low	105 Å²	105	133 Å²	133	87%	0.868	76%	0.763	S	S	*	*				69	121.2	115.7	0	0	0	0	0	124
1032	A	32.8	Very low	29.9	Very low	94 Å²	94	138.3 Å²	138.3	78%	0.777	77%	0.765	S	S	*	*				-178.4	154.8	124.7	0	0	0	0	0	111.3
1033	Q	31.2	Very low	29.7	Very low	191 Å²	191	141.5 Å²	141.5	89%	0.893	77%	0.772	S	S	*	*			cis	-165.5	131.3	-25	-104	-173.5	13.2	0	0	107.8
1034	A	33.1	Very low	29.7	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	78%	0.784	S	S	*	*			trans	-174.9	109.7	155.6	0	0	0	0	0	114.1
1035	T	34.2	Very low	29.6	Very low	130 Å²	130	149.7 Å²	149.7	80%	0.798	79%	0.785	S	S	*	*			trans	18.3	143.3	135.2	56.6	0	0	0	0	122
1036	T	32.6	Very low	29.5	Very low	126 Å²	126	150.2 Å²	150.2	77%	0.773	78%	0.784	S	S	*	*			cis	-173.7	150.2	1.4	-97.2	0	0	0	0	112.8
1037	A	32.2	Very low	29.3	Very low	79 Å²	79	154.6 Å²	154.6	65%	0.653	79%	0.794	S	S	*	*			trans	76	118.9	153	0	0	0	0	0	125.5
1038	R	31.3	Very low	29.4	Very low	229 Å²	229	154.5 Å²	154.5	86%	0.864	79%	0.794	S	S	*	*				79	111.1	122	-69.5	178.2	176.2	-177	-0.4	123.9
1039	R	28.2	Very low	29.5	Very low	209 Å²	209	156.6 Å²	156.6	79%	0.789	80%	0.8	S	S	*	*				68.7	134.9	122.7	-76.7	-171.2	172.6	178.9	-2.4	123.4
1040	H	31.1	Very low	29.8	Very low	158 Å²	158	156.2 Å²	156.2	73%	0.731	80%	0.797	S	S	*	*			trans	77.3	109.9	142.7	-76.1	26.2	0	0	0	118.5
1041	N	26	Very low	29.9	Very low	135 Å²	135	159.2 Å²	159.2	72%	0.722	80%	0.8	S	S	*	*				77.2	125.6	69.8	-166.5	9.7	0	0	0	114.4
1042	R	26.5	Very low	29.8	Very low	229 Å²	229	163.2 Å²	163.2	86%	0.864	80%	0.801	S	S	*	*			trans	103.3	152.6	167.7	-62	-168.3	168.8	-152.2	-5.3	119.3
1043	H	27.2	Very low	29.6	Very low	184 Å²	184	168.5 Å²	168.5	85%	0.852	81%	0.806	S	S	*	*			trans	-64.5	159.6	-177.5	-67.9	-101.9	0	0	0	113.3
1044	R	29.8	Very low	29.5	Very low	243 Å²	243	163.2 Å²	163.2	92%	0.917	80%	0.803	S	S	*	*			trans	-100.8	135.3	154.8	-67.5	179.8	67.9	163.1	2.1	109.2
1045	E	25.3	Very low	29.3	Very low	180 Å²	180	167.9 Å²	167.9	84%	0.841	81%	0.808	S	S	*	*			trans	-87.8	-158.1	160.9	-68.2	165.9	122	0	0	108.6
1046	D	28.7	Very low	29	Very low	137 Å²	137	169.1 Å²	169.1	73%	0.733	81%	0.809	S	S	*	*			trans	66.6	76.8	176	-62.4	-32	0	0	0	117.5
1047	L	28.1	Very low	29	Very low	182 Å²	182	171.5 Å²	171.5	95%	0.953	81%	0.812	S	S	*	*			trans	-111	102.4	139.8	-101	171	0	0	0	109.5
1048	F	28.7	Very low	29	Very low	165 Å²	165	173.3 Å²	173.3	72%	0.724	82%	0.819	S	S	*	*			trans	-86	145.6	177.4	-112.8	-96.6	0	0	0	111.2
1049	K	30.9	Very low	29.2	Very low	186 Å²	186	171.5 Å²	171.5	81%	0.809	84%	0.842	S	S	*	*			trans	70.1	148.1	171.5	-53.4	164.6	-176.5	175.9	0	112.9
1050	I	31.9	Very low	29.2	Very low	144 Å²	144	169.7 Å²	169.7	74%	0.738	85%	0.845	S	S	*	*			cis	-156.6	151.5	6.9	-128.8	160.3	0	0	0	106.3
1051	I	31	Very low	29.1	Very low	145 Å²	145	170.3 Å²	170.3	74%	0.744	85%	0.851	S	S	*	*			cis	-153.8	162.1	-13.8	-135.8	175.9	0	0	0	107.7
1052	H	24.9	Very low	29.3	Very low	190 Å²	190	172.2 Å²	172.2	88%	0.88	86%	0.858	S	S	*	*			trans	-150.5	89.8	163.1	-158.7	-56.2	0	0	0	112.8
1053	K	28.8	Very low	29.4	Very low	204 Å²	204	168.9 Å²	168.9	89%	0.887	86%	0.858	S	S	*	*			trans	-168.1	143.9	163.7	-126.4	-179.2	-177.5	-177.2	0	110.8
1054	G	29.8	Very low	29.6	Very low	80 Å²	80	167.9 Å²	167.9	83%	0.825	86%	0.858	S	S	*	*			trans	131.3	110.9	173.8	0	0	0	0	0	112.3
1055	H	27.7	Very low	29.6	Very low	190 Å²	190	162.9 Å²	162.9	88%	0.88	85%	0.854	S	S	*	*			trans	-141.8	106.5	165.8	-179.3	28.3	0	0	0	107.1
1056	L	27.5	Very low	29.9	Very low	156 Å²	156	161.7 Å²	161.7	82%	0.817	86%	0.855	S	S	*	*			trans	-179.2	153.3	167.2	-102.9	160.4	0	0	0	107.1
1057	E	33.4	Very low	30	Very low	176 Å²	176	163.6 Å²	163.6	82%	0.822	86%	0.864	S	S	*	*			trans	59	103.6	176.2	-64.4	165.3	-155.1	0	0	114.8
1058	S	32.4	Very low	30.1	Very low	117 Å²	117	162.1 Å²	162.1	82%	0.818	86%	0.857	S	S	*	*			cis	82.8	84.7	41.9	86.8	0	0	0	0	115.2
1059	S	34.4	Very low	30.3	Very low	192 Å²	192	161.8 Å²	161.8	100%	1.343	87%	0.869	S	S	*	*			trans	-154.2	0	151.1	-176.3	0	0	0	0	109.4

Retrieved 1,059 of 1,059 residues in 688 ms (Link to these results)

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