A0A077ZG52_TRITR Loading...

RhoGEF domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZG52, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,219 aa.

						>A0A077ZG52_TRITR|A0A077ZG52
MAVASSSHASWPNLCEVTQRPVNLSKSLVSFTLSNACLRTIEQLDQEYSALKVSVAGDEPCEQEVANQLSSCAVRRLKEPQCWNQDMSSELPLVCLNRSQSAALLTKVGQDDVRPPVDDRGRLTLATALRRTSKSDDTLARAGVSAAAVALSTSKLVATGDAVASASALDLFQDRQPVGLERTKRFSLGTFQSKPSVSNGLGAQVHLAQPGPVTDNLQRSPEGTELLKFVDEGISLDRTFSVPSIEDHVEPEPPFTLKHRENAVDASIRERTRQIRASSMVVPAITPRLPLMGLLPKAVGRPVDKADLKSKDKALKLRCSKKHAKTKERKAHFWMAVIEKCLSTCEVCGKPNGDFYQCNDCAIVVHVACKASVEKQPCASYASKTKPPSKHSSLVFPTRPLSIVSRFSSLRSEIGSSVSSSSCSSDAATPRNNLASSDVLSFLPDGAPVYSTPDIEWTRVGLWSDDNEAETWSTGPGKAFRSQLSSKEVKRQDIIYELFVTEKHHCTTLVILKHTYFDGLLELEILSEEDLSVLMPNLDVMLEIHLRFLQNLKKLMDESVIVSEIDKAFLDLFTGELSQKMRMVYTFFCAQKESSVKEYHRLCSTNANFQYFVDNLSKSSHFKTRSLPDCLLLITQRLSKYHSFVESLRKSTTDPAAKEGMIKAEQAVKKLIADVDAGIGLIQLQQLRQKLVAQMDPKESTSFLGKPFTRSDLNSSSRELLYASEVSWQTARRKPIEVSMLLFTDVIVFLHRNSQSYSFCTQDNKEGIISLQKLIVREKAGRMGSQGLYLISTAPCHAEMYEILFHTKKNLAAWTERIQRAVDSYSAPGRRSSKIAAENISDENQEQLKFLFGKAAEANEHIKDCLDEQIETYKSILDLVGEISFGEDDKTKKLLHAVEECLTTNVADSGAAKLAELMSQLFRDQCVQQLLGAASVGSSQPAPINSSEAAINRSQTFHELYRKHVTVSGIPSAIDKSRSMELFEHNYPESRANSKSHLFTLLAKLNDAEFEIKRLKQEKAQLLLEQEKEKNLRNSCIQTAYSAGLEELRKLHAELEKRRADFQQLIENRTAELNAREKEIGIKSASMERDSADFQNKLDRLRGAWEKLQVTTRTIPGSVKQSANTVDNLVQDFSEKTDNSLPNPQSSEGRKPSVPPYLLGSFVHGGRLPEDVVRQQLPSKLVKDDMVNSLSSKIPYGIKDRKKPVKGKEQSLASRKKCK
					

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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	24.3	Very low	29.5	Very low	246 Å²	246	140 Å²	140	100%	1.212	84%	0.837	S	S	*	*				0	-8.5	0	-72.4	-164.4	-163.4	0	0	114.4
2	A	28.4	Very low	29.4	Very low	93 Å²	93	137.3 Å²	137.3	77%	0.769	83%	0.825	S	S	*	*			trans	-108.6	14	-178.1	0	0	0	0	0	115.9
3	V	31.9	Very low	29.3	Very low	138 Å²	138	139.7 Å²	139.7	84%	0.836	83%	0.831	S	S	*	*	S	Bend	trans	-119.2	5.6	179.4	-174.2	0	0	0	0	112.2
4	A	33.3	Very low	29.1	Very low	100 Å²	100	141.7 Å²	141.7	83%	0.826	83%	0.834	S	S	*	*	S	Bend	trans	-94.8	9.4	-175.3	0	0	0	0	0	114.6
5	S	35.8	Very low	29	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	83%	0.834	S	S	*	*	S	Bend	trans	-116.5	16.1	-172.7	52.1	0	0	0	0	116
6	S	30	Very low	28.8	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	83%	0.834	S	S	*	*	S	Bend	trans	-150.9	77.8	174.8	63.8	0	0	0	0	113.6
7	S	31.3	Very low	28.7	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	83%	0.828	S	S	*	*			trans	-165.6	72.7	151.1	42.2	0	0	0	0	109.9	A9	S7-A9 PolarHBondContact O-N 3.48Å
8	H	27	Very low	28.7	Very low	204 Å²	204	139.5 Å²	139.5	94%	0.944	82%	0.818	S	S	*	*			trans	-71	96.6	158	-83.5	-89.7	0	0	0	108.4
9	A	30.6	Very low	28.4	Very low	71 Å²	71	141.9 Å²	141.9	59%	0.587	82%	0.82	S	S	*	*			trans	-139.3	93.8	167.8	0	0	0	0	0	109.4	S7	S7-A9 PolarHBondContact O-N 3.48Å
10	S	27.5	Very low	28.3	Very low	117 Å²	117	145.8 Å²	145.8	82%	0.818	82%	0.821	S	S	*	*			trans	23.1	98	151.8	60.3	0	0	0	0	117.6
11	W	24	Very low	28.2	Very low	244 Å²	244	143.7 Å²	143.7	92%	0.924	81%	0.813	S	S	*	*			trans	-102.8	127.2	152	-86.9	48.7	0	0	0	108.5
12	P	28.3	Very low	28.3	Very low	107 Å²	107	137.9 Å²	137.9	70%	0.695	79%	0.791	S	S	*	*			trans	-79.7	132.4	-172.3	30.2	-31.4	0	0	0	112.1	L14	P12-L14 PolarHBondContact O-N 2.85Å; P12-L14 VanDerWaalsContact O-N 3.12Å
13	N	28.9	Very low	28.2	Very low	169 Å²	169	140 Å²	140	90%	0.904	79%	0.79	S	S	*	*			trans	16.1	79.7	150.6	-61.4	-17.2	0	0	0	116.4
14	L	26.6	Very low	27.9	Very low	168 Å²	168	141 Å²	141	88%	0.88	79%	0.789	S	S	*	*			trans	-97.6	122.7	151.6	-101.2	107.8	0	0	0	108.1	P12 E16	P12-L14 PolarHBondContact O-N 2.85Å; P12-L14 VanDerWaalsContact O-N 3.12Å; L14-E16 PolarHBondContact O-N 2.87Å
15	C	26.8	Very low	27.5	Very low	123 Å²	123	141 Å²	141	83%	0.831	78%	0.783	S	S	*	*			trans	-20.7	110.6	179.1	-77.2	0	0	0	0	114.3	V17	C15-V17 VanDerWaalsContact C-N 3.31Å; C15-V17 PolarHBondContact O-N 3.05Å
16	E	26.3	Very low	27.2	Very low	178 Å²	178	145.5 Å²	145.5	83%	0.832	79%	0.789	S	S	*	*			trans	-61.3	93.2	165.9	-160.4	170.6	-153.8	0	0	107.9	L14 T18	L14-E16 PolarHBondContact O-N 2.87Å; E16-T18 PolarHBondContact O-N 3.04Å
17	V	26.5	Very low	27	Very low	121 Å²	121	145 Å²	145	73%	0.733	79%	0.786	S	S	*	*			trans	-65.3	94.7	162.4	176.9	0	0	0	0	105	C15 Q19	C15-V17 VanDerWaalsContact C-N 3.31Å; C15-V17 PolarHBondContact O-N 3.05Å; V17-Q19 VanDerWaalsContact C-N 3.28Å; V17-Q19 PolarHBondContact O-N 3.1Å
18	T	28.4	Very low	26.7	Very low	105 Å²	105	147.2 Å²	147.2	64%	0.644	79%	0.788	S	S	*	*			trans	-59.2	97.1	170.1	47.8	0	0	0	0	107.7	E16 R20	E16-T18 PolarHBondContact O-N 3.04Å; T18-R20 PolarHBondContact O-N 3.16Å
19	Q	24.4	Very low	26.7	Very low	185 Å²	185	142.3 Å²	142.3	86%	0.864	77%	0.772	S	S	*	*			trans	-62.6	86.5	162	-73.4	-178.3	-14.9	0	0	106.8	V17	V17-Q19 VanDerWaalsContact C-N 3.28Å; V17-Q19 PolarHBondContact O-N 3.1Å
20	R	24.9	Very low	26.4	Very low	220 Å²	220	143.5 Å²	143.5	83%	0.83	78%	0.776	S	S	*	*			trans	-69.7	122.6	162.8	-86.4	-174.5	175.4	178.1	-0.3	106.7	T18 V22	T18-R20 PolarHBondContact O-N 3.16Å; R20-V22 PolarHBondContact O-N 3.48Å
21	P	26.3	Very low	26.4	Very low	102 Å²	102	146.2 Å²	146.2	66%	0.662	77%	0.773	S	S	*	*			trans	-62.7	125.5	177.6	26.9	-31.2	0	0	0	107.4	N23	P21-N23 PolarHBondContact O-N 3.26Å
22	V	26.5	Very low	26.6	Very low	124 Å²	124	140.3 Å²	140.3	75%	0.752	76%	0.764	S	S	*	*			trans	-69.1	82.9	168.5	-173.9	0	0	0	0	106.2	R20 L24	R20-V22 PolarHBondContact O-N 3.48Å; V22-L24 HydrophobicContact CG1-CD2 4.37Å; V22-L24 HydrophobicContact CG1-CG 4.16Å; V22-L24 PolarHBondContact O-N 3.12Å
23	N	26.4	Very low	26.6	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	77%	0.768	S	S	*	*			trans	-65	98.4	156.8	-80.7	-21.8	0	0	0	105.1	P21 S25	P21-N23 PolarHBondContact O-N 3.26Å; N23-S25 PolarHBondContact O-N 3.49Å
24	L	25.5	Very low	26.5	Very low	157 Å²	157	138.8 Å²	138.8	82%	0.822	76%	0.757	S	S	*	*			trans	-60.3	81.9	161.9	-76.2	163.5	0	0	0	106.7	V22 K26	V22-L24 HydrophobicContact CG1-CD2 4.37Å; V22-L24 HydrophobicContact CG1-CG 4.16Å; V22-L24 PolarHBondContact O-N 3.12Å; L24-K26 PolarHBondContact O-N 3.2Å
25	S	26.6	Very low	26.8	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	75%	0.753	S	S	*	*			trans	-60.5	111.2	166.1	54.3	0	0	0	0	106	N23 S27	N23-S25 PolarHBondContact O-N 3.49Å; S25-S27 PolarHBondContact O-N 3.43Å
26	K	28	Very low	27.1	Very low	206 Å²	206	135.8 Å²	135.8	90%	0.896	74%	0.744	S	S	*	*			trans	-53.4	79.9	166.8	-69.2	176.6	175.6	177.8	0	109.1	L24 L28	L24-K26 PolarHBondContact O-N 3.2Å; K26-L28 PolarHBondContact O-N 3.41Å
27	S	25.6	Very low	27.2	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	74%	0.744	S	S	*	*			trans	-87.5	63.4	166.6	168.8	0	0	0	0	107.2	S25 V29	S25-S27 PolarHBondContact O-N 3.43Å; S27-V29 PolarHBondContact O-N 3.39Å
28	L	26.7	Very low	27.2	Very low	161 Å²	161	134.3 Å²	134.3	84%	0.843	75%	0.745	S	S	*	*			trans	-67.1	96.6	156.7	-98.6	154.3	0	0	0	105.4	K26 S30	K26-L28 PolarHBondContact O-N 3.41Å; L28-S30 PolarHBondContact O-N 2.92Å
29	V	26.9	Very low	27.3	Very low	100 Å²	100	139.4 Å²	139.4	61%	0.606	75%	0.753	S	S	*	*			trans	-56.4	105.5	171.4	174.8	0	0	0	0	106.7	S27 F31	S27-V29 PolarHBondContact O-N 3.39Å; V29-F31 HydrophobicContact CG1-CD2 3.93Å; V29-F31 HydrophobicContact CG1-CE2 4.2Å; V29-F31 PolarHBondContact O-N 3.26Å
30	S	24.6	Very low	27.9	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	74%	0.738	S	S	*	*			trans	-55.9	91.5	162.7	167.6	0	0	0	0	108	L28 T32	L28-S30 PolarHBondContact O-N 2.92Å; S30-T32 PolarHBondContact O-N 3.23Å
31	F	26.8	Very low	28.4	Very low	174 Å²	174	131.2 Å²	131.2	76%	0.763	73%	0.733	S	S	*	*			trans	-71.6	90.3	159	-103.7	-92.7	0	0	0	106.2	V29 L33	V29-F31 HydrophobicContact CG1-CD2 3.93Å; V29-F31 HydrophobicContact CG1-CE2 4.2Å; V29-F31 PolarHBondContact O-N 3.26Å; F31-L33 PolarHBondContact O-N 3.2Å
32	T	27	Very low	29.2	Very low	120 Å²	120	133.7 Å²	133.7	74%	0.736	74%	0.736	S	S	*	*			trans	-61.2	91.7	154.5	48.3	0	0	0	0	106.3	S30 S34	S30-T32 PolarHBondContact O-N 3.23Å; T32-S34 PolarHBondContact O-N 2.91Å
33	L	28.2	Very low	29.8	Very low	149 Å²	149	133.1 Å²	133.1	78%	0.78	73%	0.725	S	S	*	*			trans	-53.4	110.3	167.5	-89.5	152.7	0	0	0	106.9	F31 N35	F31-L33 PolarHBondContact O-N 3.2Å; L33-N35 PolarHBondContact O-N 2.76Å; L33-N35 VanDerWaalsContact O-N 3.16Å
34	S	28.5	Very low	30.2	Very low	96 Å²	96	132 Å²	132	67%	0.671	72%	0.718	S	S	*	*			trans	-47.7	118.7	169.3	177.2	0	0	0	0	108.5	T32 A36	T32-S34 PolarHBondContact O-N 2.91Å; S34-A36 PolarHBondContact O-N 3.16Å
35	N	32.1	Very low	30.8	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	27.1	178	-90.2	-23.7	0	0	0	113.9	L33	L33-N35 PolarHBondContact O-N 2.76Å; L33-N35 VanDerWaalsContact O-N 3.16Å
36	A	33	Very low	31.5	Very low	78 Å²	78	132.3 Å²	132.3	65%	0.645	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-1.7	-176.3	0	0	0	0	0	114.9	S34	S34-A36 PolarHBondContact O-N 3.16Å
37	C	28.9	Very low	31.9	Very low	123 Å²	123	128.8 Å²	128.8	83%	0.831	70%	0.695	S	S	*	*			trans	-126.3	28.3	178.5	-90.8	0	0	0	0	114.9	R39	C37-R39 PolarHBondContact O-N 3.14Å
38	L	27.1	Very low	32.3	Very low	145 Å²	145	133.6 Å²	133.6	76%	0.759	70%	0.701	S	S	*	*			trans	-87.5	62.3	162.6	-78.2	168.6	0	0	0	110.1	T40	L38-T40 PolarHBondContact O-N 2.99Å
39	R	30	Very low	33	Very low	213 Å²	213	130 Å²	130	80%	0.804	69%	0.689	S	S	*	*			trans	-71.7	108.1	158.4	-74.7	-170.1	-177.7	174.7	1.4	106.5	C37	C37-R39 PolarHBondContact O-N 3.14Å
40	T	35.7	Very low	33.7	Very low	90 Å²	90	128.5 Å²	128.5	55%	0.552	69%	0.687	S	S	*	*			trans	-57.3	133.7	-176.9	36.2	0	0	0	0	111	L38 E42 Q43	L38-T40 PolarHBondContact O-N 2.99Å; T40-E42 PolarHBondContact O-N 3.1Å; T40-Q43 PolarHBondContact O-N 3.16Å
41	I	36.2	Very low	34.2	Very low	142 Å²	142	130.9 Å²	130.9	73%	0.728	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.1	-23.1	-179.3	-69.1	169	0	0	0	113.2	Q43 L44 D45	I41-Q43 PolarHBondContact O-N 3.29Å; I41-L44 PolarHBondContact O-N 2.68Å; I41-L44 VanDerWaalsContact O-N 3.12Å; I41-D45 PolarHBondContact O-N 3.19Å
42	E	42.9	Very low	34.2	Very low	155 Å²	155	131.7 Å²	131.7	72%	0.724	70%	0.695	S	S	*	*	H	α-helix	trans	-59.4	-27.8	172.6	-74.7	-177.2	155.6	0	0	114.3	T40 Q46	T40-E42 PolarHBondContact O-N 3.1Å; E42-Q46 PolarHBondContact O-N 3.14Å
43	Q	38.6	Very low	34.4	Very low	112 Å²	112	131.5 Å²	131.5	52%	0.523	69%	0.693	S	S	.	*	H	α-helix	trans	-75.9	-30.5	175	-77.4	-170.2	-28.3	0	0	112.8	T40 I41 D45 Q46 E47	T40-Q43 PolarHBondContact O-N 3.16Å; I41-Q43 PolarHBondContact O-N 3.29Å; Q43-D45 VanDerWaalsContact C-N 3.34Å; Q43-Q46 PolarHBondContact O-N 3.48Å; Q43-E47 PolarHBondContact O-N 2.97Å; Q43-E47 VanDerWaalsContact O-N 3.09Å
44	L	35.6	Very low	34.4	Very low	113 Å²	113	129.5 Å²	129.5	59%	0.592	69%	0.692	S	S	*	*	H	α-helix	trans	-70	-32.7	176	-85.9	159.4	0	0	0	111.7	I41 E47 Y48	I41-L44 PolarHBondContact O-N 2.68Å; I41-L44 VanDerWaalsContact O-N 3.12Å; L44-E47 PolarHBondContact O-N 3.26Å; L44-Y48 WeakPolarHBondContact O-CB 3.46Å; L44-Y48 PolarHBondContact O-N 3.11Å
45	D	38.9	Very low	34.6	Very low	114 Å²	114	131.9 Å²	131.9	61%	0.61	70%	0.702	S	S	*	*	H	α-helix	trans	-73.2	-29	176.5	-153.1	38.4	0	0	0	112.4	I41 Q43 S49	I41-D45 PolarHBondContact O-N 3.19Å; Q43-D45 VanDerWaalsContact C-N 3.34Å; D45-S49 WeakPolarHBondContact O-CB 3.38Å; D45-S49 PolarHBondContact O-N 2.73Å; D45-S49 VanDerWaalsContact O-N 3.11Å; D45-S49 PolarHBondContact O-OG 3.09Å
46	Q	41.1	Very low	34.4	Very low	150 Å²	150	129.4 Å²	129.4	70%	0.701	70%	0.702	S	S	*	*	H	α-helix	trans	-72.2	-38.6	171.3	-80	-175.2	-8.3	0	0	112.7	E42 Q43 S49 A50	E42-Q46 PolarHBondContact O-N 3.14Å; Q43-Q46 PolarHBondContact O-N 3.48Å; Q46-S49 PolarHBondContact O-N 3.39Å; Q46-A50 WeakPolarHBondContact O-CB 3.23Å; Q46-A50 PolarHBondContact O-N 3.35Å
47	E	36.3	Very low	34.2	Very low	133 Å²	133	129 Å²	129	62%	0.621	71%	0.705	S	S	*	*	H	α-helix	trans	-69.2	-37.4	173.8	-81.4	-174.7	164.4	0	0	112.1	Q43 L44 S49 A50 L51	Q43-E47 PolarHBondContact O-N 2.97Å; Q43-E47 VanDerWaalsContact O-N 3.09Å; L44-E47 PolarHBondContact O-N 3.26Å; E47-S49 VanDerWaalsContact C-N 3.28Å; E47-S49 PolarHBondContact O-N 3.17Å; E47-A50 PolarHBondContact O-N 2.69Å; E47-A50 VanDerWaalsContact O-N 3.15Å; E47-L51 PolarHBondContact O-N 2.92Å
48	Y	34.3	Very low	34.2	Very low	193 Å²	193	131.1 Å²	131.1	76%	0.757	71%	0.708	S	S	*	*	H	α-helix	trans	-66.3	-32.3	175.7	-134.6	-91.1	0	0	0	112.5	L44	L44-Y48 WeakPolarHBondContact O-CB 3.46Å; L44-Y48 PolarHBondContact O-N 3.11Å
49	S	41	Very low	34.2	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	71%	0.714	S	S	*	*	H	α-helix	trans	-75.2	-26.8	173.7	-64.1	0	0	0	0	113.2	D45 Q46 E47	D45-S49 WeakPolarHBondContact O-CB 3.38Å; D45-S49 PolarHBondContact O-N 2.73Å; D45-S49 VanDerWaalsContact O-N 3.11Å; D45-S49 PolarHBondContact O-OG 3.09Å; Q46-S49 PolarHBondContact O-N 3.39Å; E47-S49 VanDerWaalsContact C-N 3.28Å; E47-S49 PolarHBondContact O-N 3.17Å
50	A	41.4	Very low	34.5	Very low	68 Å²	68	128.7 Å²	128.7	56%	0.562	71%	0.713	S	S	*	*	H	α-helix	trans	-79.7	-19.3	178.3	0	0	0	0	0	113.7	Q46 E47 K52	Q46-A50 WeakPolarHBondContact O-CB 3.23Å; Q46-A50 PolarHBondContact O-N 3.35Å; E47-A50 PolarHBondContact O-N 2.69Å; E47-A50 VanDerWaalsContact O-N 3.15Å; A50-K52 VanDerWaalsContact C-N 3.31Å; A50-K52 PolarHBondContact O-N 3.23Å
51	L	34.1	Very low	34.2	Very low	146 Å²	146	130.3 Å²	130.3	76%	0.764	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	1.4	179.9	-89.3	151.5	0	0	0	114.8	E47 V53	E47-L51 PolarHBondContact O-N 2.92Å; L51-V53 PolarHBondContact O-N 3.41Å; L51-V53 VanDerWaalsContact O-N 3.08Å
52	K	28.4	Very low	33.7	Very low	192 Å²	192	132.1 Å²	132.1	84%	0.835	73%	0.732	S	S	*	*			trans	-81.3	65.9	163.9	-82.4	-177.5	175.9	174	0	110.9	A50	A50-K52 VanDerWaalsContact C-N 3.31Å; A50-K52 PolarHBondContact O-N 3.23Å
53	V	30.5	Very low	33.2	Very low	115 Å²	115	132.1 Å²	132.1	70%	0.697	73%	0.731	S	S	*	*			trans	-95.3	115.5	164.1	177.9	0	0	0	0	108.2	L51 V55	L51-V53 PolarHBondContact O-N 3.41Å; L51-V53 VanDerWaalsContact O-N 3.08Å; V53-V55 PolarHBondContact O-N 3.06Å
54	S	28.8	Very low	32.8	Very low	108 Å²	108	134.8 Å²	134.8	76%	0.755	74%	0.744	S	S	*	*			trans	-50.7	108.5	178.5	49.6	0	0	0	0	112.9	A56	S54-A56 PolarHBondContact O-N 3.48Å
55	V	32	Very low	32.7	Very low	146 Å²	146	134.9 Å²	134.9	89%	0.885	75%	0.749	S	S	*	*			trans	-84.2	93.6	158.7	-179.2	0	0	0	0	107.1	V53	V53-V55 PolarHBondContact O-N 3.06Å
56	A	27	Very low	32.5	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	75%	0.746	S	S	*	*			trans	-73.3	118.4	166.7	0	0	0	0	0	108.6	S54	S54-A56 PolarHBondContact O-N 3.48Å
57	G	30.4	Very low	32.1	Very low	70 Å²	70	132 Å²	132	72%	0.722	75%	0.748	S	S	*	*			trans	-157.2	88.9	175.8	0	0	0	0	0	108.2	E59	G57-E59 PolarHBondContact O-N 3.33Å
58	D	27.3	Very low	32	Very low	167 Å²	167	133.7 Å²	133.7	89%	0.893	76%	0.756	S	S	*	*			trans	-60.7	122	175	-67	-56.9	0	0	0	110.8
59	E	28.7	Very low	31.9	Very low	190 Å²	190	131.4 Å²	131.4	89%	0.888	76%	0.756	S	S	*	*			trans	-162.2	133.3	130.6	-113.9	-166.7	173	0	0	111.4	G57	G57-E59 PolarHBondContact O-N 3.33Å
60	P	36	Very low	31.4	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	76%	0.757	S	S	*	*			trans	-94	122.9	-173.4	35	-28.1	0	0	0	111
61	C	28.2	Very low	30.8	Very low	124 Å²	124	133.4 Å²	133.4	84%	0.838	77%	0.766	S	S	*	*			trans	-134.9	57.7	157.7	-165.4	0	0	0	0	109.3	Q63	C61-Q63 PolarHBondContact O-N 2.87Å
62	E	27.4	Very low	30.4	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	77%	0.768	S	S	*	*			trans	-65	101	154.3	-70.7	-174.1	150.3	0	0	107.4
63	Q	31.5	Very low	30.3	Very low	154 Å²	154	126.8 Å²	126.8	72%	0.72	76%	0.759	S	S	*	*	S	Bend	trans	176.3	39	135.6	-146.8	71	7.5	0	0	113.5	C61	C61-Q63 PolarHBondContact O-N 2.87Å
64	E	30.7	Very low	30.1	Very low	168 Å²	168	126.5 Å²	126.5	79%	0.785	76%	0.757	S	S	*	*	S	Bend	trans	-130	-11	167.7	-110.6	179	175.5	0	0	115.9
65	V	33.2	Very low	30	Very low	115 Å²	115	133.1 Å²	133.1	70%	0.697	77%	0.766	S	S	*	*	S	Bend	trans	-89.8	-15.5	177.8	-172.6	0	0	0	0	112.9	N67 Q68	V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 2.87Å; V65-Q68 PolarHBondContact O-N 3.47Å
66	A	34.9	Very low	29.8	Very low	67 Å²	67	136.7 Å²	136.7	55%	0.554	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-16.6	179.3	0	0	0	0	0	114.3
67	N	33.4	Very low	29.7	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-6.7	178.1	-79.3	-15.6	0	0	0	114.4	V65	V65-N67 VanDerWaalsContact C-N 3.29Å; V65-N67 PolarHBondContact O-N 2.87Å
68	Q	32.6	Very low	29.5	Very low	168 Å²	168	146.2 Å²	146.2	79%	0.785	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-7.4	175.6	-72.4	-169.6	3.5	0	0	114.5	V65	V65-Q68 PolarHBondContact O-N 3.47Å
69	L	31.8	Very low	29.3	Very low	144 Å²	144	146.6 Å²	146.6	75%	0.754	77%	0.771	S	S	*	*	S	Bend	trans	-105.2	4.2	178	-77.5	167.5	0	0	0	115.1
70	S	31.9	Very low	29.1	Very low	89 Å²	89	143.3 Å²	143.3	62%	0.622	77%	0.766	S	S	*	*	S	Bend	trans	-93.2	-6	174.1	71.1	0	0	0	0	115.1
71	S	28.1	Very low	28.6	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	77%	0.766	S	S	*	*	S	Bend	trans	-96	2.7	179.8	89.4	0	0	0	0	115.9
72	C	26.3	Very low	28.3	Very low	121 Å²	121	144.8 Å²	144.8	82%	0.818	76%	0.761	S	S	*	*	S	Bend	trans	-105.5	13.5	177.5	-95	0	0	0	0	114.5	V74	C72-V74 PolarHBondContact O-N 3.09Å
73	A	25.7	Very low	28.1	Very low	78 Å²	78	146 Å²	146	65%	0.645	76%	0.758	S	S	*	*	S	Bend	trans	-84	112.9	171.6	0	0	0	0	0	110.9
74	V	27.3	Very low	27.8	Very low	109 Å²	109	146.3 Å²	146.3	66%	0.661	77%	0.765	S	S	*	*			trans	75.4	60.1	154.2	-158.7	0	0	0	0	116.2	C72 R76	C72-V74 PolarHBondContact O-N 3.09Å; V74-R76 VanDerWaalsContact C-N 3.3Å; V74-R76 HydrophobicContact CG1-CG 3.75Å; V74-R76 PolarHBondContact O-N 3.02Å
75	R	25.5	Very low	27.5	Very low	247 Å²	247	144.2 Å²	144.2	93%	0.932	76%	0.755	S	S	*	*			trans	-84.5	86.8	137.9	-81.2	-173.6	-179	163.2	2.3	107.4	L77	R75-L77 PolarHBondContact O-N 3.14Å
76	R	27.1	Very low	27.1	Very low	220 Å²	220	147 Å²	147	83%	0.83	77%	0.766	S	S	*	*			trans	-45.6	107.2	163.4	-82.2	173.5	-177.3	174.4	0	107.2	V74 K78	V74-R76 VanDerWaalsContact C-N 3.3Å; V74-R76 HydrophobicContact CG1-CG 3.75Å; V74-R76 PolarHBondContact O-N 3.02Å; R76-K78 PolarHBondContact O-N 3.2Å
77	L	25.1	Very low	26.6	Very low	174 Å²	174	150.9 Å²	150.9	91%	0.911	77%	0.774	S	S	*	*			trans	-54.1	97.6	158.8	-80.2	157.2	0	0	0	105.3	R75 E79	R75-L77 PolarHBondContact O-N 3.14Å; L77-E79 PolarHBondContact O-N 3.39Å; L77-E79 VanDerWaalsContact O-N 3.1Å
78	K	26.8	Very low	26.2	Very low	192 Å²	192	149.1 Å²	149.1	84%	0.835	77%	0.773	S	S	*	*			trans	-52	118.9	163.9	-96.1	178.9	171.2	177.9	0	105.1	R76 P80	R76-K78 PolarHBondContact O-N 3.2Å; K78-P80 VanDerWaalsContact O-N 3.16Å
79	E	23.2	Very low	25.9	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	77%	0.771	S	S	*	*			trans	-39.3	123.9	168.9	-71	173	150.8	0	0	108.3	L77 Q81	L77-E79 PolarHBondContact O-N 3.39Å; L77-E79 VanDerWaalsContact O-N 3.1Å; E79-Q81 VanDerWaalsContact C-N 3.35Å; E79-Q81 PolarHBondContact O-N 3.08Å
80	P	24.6	Very low	25.6	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	77%	0.766	S	S	*	*			trans	-63.4	106.7	175.8	25.3	-28.8	0	0	0	105.5	K78 C82	K78-P80 VanDerWaalsContact O-N 3.16Å; P80-C82 VanDerWaalsContact C-N 3.29Å; P80-C82 PolarHBondContact O-N 3.44Å
81	Q	25.3	Very low	25.2	Very low	164 Å²	164	148.7 Å²	148.7	77%	0.766	77%	0.773	S	S	*	*			trans	-51.2	105.3	167.2	-80.7	-174.6	-22.2	0	0	105.9	E79 W83	E79-Q81 VanDerWaalsContact C-N 3.35Å; E79-Q81 PolarHBondContact O-N 3.08Å; Q81-W83 VanDerWaalsContact C-N 3.27Å; Q81-W83 VanDerWaalsContact O-CD1 3.27Å; Q81-W83 PolarHBondContact O-N 3.15Å
82	C	22.6	Very low	25.1	Very low	108 Å²	108	148.6 Å²	148.6	73%	0.73	77%	0.77	S	S	*	*			trans	-49.5	94.9	172	42.5	0	0	0	0	107.8	P80 N84	P80-C82 VanDerWaalsContact C-N 3.29Å; P80-C82 PolarHBondContact O-N 3.44Å; C82-N84 VanDerWaalsContact C-N 3.27Å; C82-N84 PolarHBondContact O-N 3.21Å
83	W	23.9	Very low	25.1	Very low	207 Å²	207	149.3 Å²	149.3	78%	0.784	77%	0.765	S	S	*	*			trans	-65.7	99.4	167.8	-80.7	14.7	0	0	0	105.4	Q81 Q85	Q81-W83 VanDerWaalsContact C-N 3.27Å; Q81-W83 VanDerWaalsContact O-CD1 3.27Å; Q81-W83 PolarHBondContact O-N 3.15Å; W83-Q85 PolarHBondContact O-N 3.06Å
84	N	24.4	Very low	25.2	Very low	159 Å²	159	150.5 Å²	150.5	85%	0.85	76%	0.764	S	S	*	*			trans	-61.1	73.5	159.2	-77	-31.7	0	0	0	107.9	C82	C82-N84 VanDerWaalsContact C-N 3.27Å; C82-N84 PolarHBondContact O-N 3.21Å
85	Q	24.4	Very low	25.1	Very low	125 Å²	125	150.1 Å²	150.1	58%	0.584	77%	0.765	S	S	*	*			trans	-107	115.5	152.1	-83.1	-178.4	-9.4	0	0	104.9	W83 M87	W83-Q85 PolarHBondContact O-N 3.06Å; Q85-M87 PolarHBondContact O-N 3.39Å
86	D	25.4	Very low	25.1	Very low	173 Å²	173	143 Å²	143	93%	0.925	75%	0.745	S	S	*	*			trans	-53.1	85.3	167.5	-79	-45.8	0	0	0	108.2	S88	D86-S88 VanDerWaalsContact C-N 3.31Å; D86-S88 PolarHBondContact O-N 2.97Å
87	M	22.6	Very low	25.3	Very low	148 Å²	148	137.6 Å²	137.6	73%	0.729	73%	0.732	S	S	*	*			trans	-70.3	99.5	163.9	-75.4	-71	157.9	0	0	104.7	Q85 S89	Q85-M87 PolarHBondContact O-N 3.39Å; M87-S89 VanDerWaalsContact C-N 3.27Å; M87-S89 PolarHBondContact O-N 3.11Å
88	S	25.9	Very low	25.6	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	73%	0.731	S	S	*	*			trans	-50.8	96.7	165.9	37.5	0	0	0	0	107.8	D86 E90	D86-S88 VanDerWaalsContact C-N 3.31Å; D86-S88 PolarHBondContact O-N 2.97Å; S88-E90 PolarHBondContact O-N 3.44Å
89	S	27	Very low	26	Very low	107 Å²	107	135 Å²	135	75%	0.748	72%	0.717	S	S	*	*			trans	-75.2	64.4	176.3	33.2	0	0	0	0	108.6	M87	M87-S89 VanDerWaalsContact C-N 3.27Å; M87-S89 PolarHBondContact O-N 3.11Å
90	E	25	Very low	26.4	Very low	136 Å²	136	131.1 Å²	131.1	64%	0.636	70%	0.699	S	S	*	*			trans	-99.5	78.4	169.2	-69.8	-171.3	175.2	0	0	108.1	S88 P92	S88-E90 PolarHBondContact O-N 3.44Å; E90-P92 WeakPolarHBondContact O-CD 3.46Å
91	L	23.6	Very low	26.8	Very low	149 Å²	149	128 Å²	128	78%	0.78	68%	0.68	S	S	*	*			trans	-65.9	120.7	153.5	-86.4	145.5	0	0	0	106.4	L93	L91-L93 PolarHBondContact O-N 3.09Å
92	P	25.4	Very low	27.4	Very low	104 Å²	104	122.9 Å²	122.9	68%	0.675	67%	0.666	S	S	*	*			trans	-70.4	98.4	-177.9	27.2	-31.1	0	0	0	109	E90 V94	E90-P92 WeakPolarHBondContact O-CD 3.46Å; P92-V94 PolarHBondContact O-N 2.99Å
93	L	26.7	Very low	28	Very low	136 Å²	136	120.5 Å²	120.5	71%	0.712	65%	0.654	S	S	*	*			trans	-73	93.2	175.5	-69.6	167.5	0	0	0	109.1	L91 C95	L91-L93 PolarHBondContact O-N 3.09Å; L93-C95 PolarHBondContact O-N 3.12Å
94	V	27.1	Very low	28.3	Very low	103 Å²	103	116 Å²	116	62%	0.624	65%	0.645	S	S	*	*			trans	-78.6	102.8	174.5	-179.7	0	0	0	0	109	P92 L96	P92-V94 PolarHBondContact O-N 2.99Å; V94-L96 HydrophobicContact CG1-CD2 4.18Å; V94-L96 HydrophobicContact CG1-CG 4.46Å; V94-L96 PolarHBondContact O-N 3.32Å
95	C	25.7	Very low	28.8	Very low	102 Å²	102	115.1 Å²	115.1	69%	0.689	64%	0.639	S	S	*	*			trans	-68.5	101.2	165	-65	0	0	0	0	109	L93 N97	L93-C95 PolarHBondContact O-N 3.12Å; C95-N97 PolarHBondContact O-N 2.88Å
96	L	26.2	Very low	29.6	Very low	97 Å²	97	114.1 Å²	114.1	51%	0.508	64%	0.642	S	S	.	*			trans	-66.7	127.3	175.1	-69.2	166.6	0	0	0	109.8	V94 Q100	V94-L96 HydrophobicContact CG1-CD2 4.18Å; V94-L96 HydrophobicContact CG1-CG 4.46Å; V94-L96 PolarHBondContact O-N 3.32Å; L96-Q100 HydrophobicContact CB-CB 4.46Å; L96-Q100 HydrophobicContact CD2-CB 3.94Å
97	N	30	Very low	30.1	Very low	106 Å²	106	114.7 Å²	114.7	57%	0.567	64%	0.636	S	S	*	*			trans	-73.8	153.9	172.9	-164.3	-1.3	0	0	0	109.8	C95 S99 Q100 S101	C95-N97 PolarHBondContact O-N 2.88Å; N97-S99 PolarHBondContact O-N 3.05Å; N97-Q100 WeakPolarHBondContact O-CB 3.34Å; N97-Q100 PolarHBondContact O-N 2.86Å; N97-S101 PolarHBondContact O-N 2.96Å
98	R	31.6	Very low	30.6	Very low	232 Å²	232	113.8 Å²	113.8	88%	0.875	64%	0.639	S	S	*	*	H	α-helix	trans	-50.5	-28.9	-179	-119.8	-178.9	-177.2	-179.4	2.6	113.6
99	S	35.3	Very low	30.8	Very low	79 Å²	79	112.1 Å²	112.1	55%	0.552	64%	0.638	S	S	*	*	H	α-helix	trans	-74.6	-29.7	175.7	54.6	0	0	0	0	114.3	N97 A103	N97-S99 PolarHBondContact O-N 3.05Å; S99-A103 PolarHBondContact O-N 3.43Å
100	Q	31.2	Very low	30.8	Very low	95 Å²	95	115 Å²	115	44%	0.444	64%	0.639	S	S	.	*	H	α-helix	trans	-76.9	-35.6	179.4	-69	174.1	-35	0	0	111.5	L96 N97 A102 A103 L104	L96-Q100 HydrophobicContact CB-CB 4.46Å; L96-Q100 HydrophobicContact CD2-CB 3.94Å; N97-Q100 WeakPolarHBondContact O-CB 3.34Å; N97-Q100 PolarHBondContact O-N 2.86Å; Q100-A102 VanDerWaalsContact C-N 3.3Å; Q100-A102 PolarHBondContact O-N 3.38Å; Q100-A103 PolarHBondContact O-N 3.49Å; Q100-L104 PolarHBondContact O-N 3.29Å
101	S	34.1	Very low	31	Very low	56 Å²	56	115.9 Å²	115.9	39%	0.392	65%	0.648	S	S	.	*	H	α-helix	trans	-63.3	-36.7	172.5	-47.3	0	0	0	0	112	N97 L104 L105	N97-S101 PolarHBondContact O-N 2.96Å; S101-L104 PolarHBondContact O-N 2.59Å; S101-L105 PolarHBondContact O-N 2.93Å
102	A	37.3	Very low	31.4	Very low	57 Å²	57	116.6 Å²	116.6	47%	0.471	65%	0.653	S	S	.	*	H	α-helix	trans	-69.5	-32	176.5	0	0	0	0	0	113.2	Q100 T106	Q100-A102 VanDerWaalsContact C-N 3.3Å; Q100-A102 PolarHBondContact O-N 3.38Å; A102-T106 PolarHBondContact O-N 3.24Å; A102-T106 PolarHBondContact O-OG1 3.31Å
103	A	36.2	Very low	31.4	Very low	58 Å²	58	118.7 Å²	118.7	48%	0.479	66%	0.664	S	S	.	*	H	α-helix	trans	-73.9	-29.9	177.4	0	0	0	0	0	112.9	S99 Q100 T106	S99-A103 PolarHBondContact O-N 3.43Å; Q100-A103 PolarHBondContact O-N 3.49Å; A103-T106 WeakPolarHBondContact CA-OG1 3.19Å; A103-T106 PolarHBondContact O-OG1 3.29Å
104	L	30.3	Very low	31.3	Very low	112 Å²	112	123.5 Å²	123.5	59%	0.586	67%	0.672	S	S	*	*	H	α-helix	trans	-72.5	-38.6	172.9	-86.1	161	0	0	0	111.8	Q100 S101 T106 K107	Q100-L104 PolarHBondContact O-N 3.29Å; S101-L104 PolarHBondContact O-N 2.59Å; L104-T106 PolarHBondContact O-N 3.1Å; L104-K107 PolarHBondContact O-N 2.75Å
105	L	33.5	Very low	31.4	Very low	140 Å²	140	123.5 Å²	123.5	73%	0.733	67%	0.674	S	S	*	*	H	α-helix	trans	-66.7	-24.5	175.7	-77.4	166.5	0	0	0	113.5	S101	S101-L105 PolarHBondContact O-N 2.93Å
106	T	40.6	Very low	31.5	Very low	105 Å²	105	124.9 Å²	124.9	64%	0.644	68%	0.682	S	S	*	*	H	α-helix	trans	-81.7	-15.7	176.1	21.2	0	0	0	0	113.9	A102 A103 L104	A102-T106 PolarHBondContact O-N 3.24Å; A102-T106 PolarHBondContact O-OG1 3.31Å; A103-T106 WeakPolarHBondContact CA-OG1 3.19Å; A103-T106 PolarHBondContact O-OG1 3.29Å; L104-T106 PolarHBondContact O-N 3.1Å
107	K	36.2	Very low	31.6	Very low	185 Å²	185	127.2 Å²	127.2	80%	0.804	70%	0.7	S	S	*	*	H	α-helix	trans	-87.8	-9.2	175.7	-88.3	-167.8	173.1	-172.2	0	114.7	L104	L104-K107 PolarHBondContact O-N 2.75Å
108	V	33.2	Very low	31.3	Very low	129 Å²	129	129 Å²	129	78%	0.782	71%	0.71	S	S	*	*	S	Bend	trans	-96.4	5.7	177.8	-174.1	0	0	0	0	111.9
109	G	29.8	Very low	31	Very low	67 Å²	67	123.4 Å²	123.4	69%	0.691	70%	0.697	S	S	*	*	S	Bend	trans	-107.7	10.6	-175.4	0	0	0	0	0	116.6
110	Q	28.3	Very low	30.5	Very low	167 Å²	167	130.5 Å²	130.5	78%	0.78	71%	0.712	S	S	*	*			trans	-115.5	130.8	174.7	-74.9	-176.9	-22	0	0	108.9
111	D	28.9	Very low	30.3	Very low	154 Å²	154	129.6 Å²	129.6	82%	0.824	73%	0.728	S	S	*	*			trans	98	74.8	176.9	-50.5	-26.1	0	0	0	115
112	D	30.9	Very low	29.6	Very low	165 Å²	165	138.2 Å²	138.2	88%	0.882	75%	0.752	S	S	*	*				-162.1	93.6	127.9	-105.8	-26.9	0	0	0	110.1	R114	D112-R114 PolarHBondContact O-N 2.76Å; D112-R114 VanDerWaalsContact O-N 3.17Å
113	V	27.1	Very low	29	Very low	148 Å²	148	143.8 Å²	143.8	90%	0.897	77%	0.773	S	S	*	*			trans	-76.7	92.5	168.9	177.5	0	0	0	0	107.4
114	R	24.7	Very low	28.3	Very low	236 Å²	236	146.2 Å²	146.2	89%	0.891	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-99	126.3	170.4	-150.3	169.4	-167.7	172.6	3.4	109.7	D112	D112-R114 PolarHBondContact O-N 2.76Å; D112-R114 VanDerWaalsContact O-N 3.17Å
115	P	27.8	Very low	27.9	Very low	103 Å²	103	149 Å²	149	67%	0.669	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.1	159.2	-170.1	32.4	-33.8	0	0	0	112.3
116	P	29.2	Very low	27.4	Very low	131 Å²	131	146 Å²	146	85%	0.851	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.2	128	-164.7	32.8	-31.6	0	0	0	111.2
117	V	26.8	Very low	26.5	Very low	147 Å²	147	147.7 Å²	147.7	89%	0.891	80%	0.803	S	S	*	*			trans	-98.7	112.5	165.5	179.6	0	0	0	0	107.2
118	D	23.7	Very low	25.9	Very low	144 Å²	144	143.9 Å²	143.9	77%	0.77	81%	0.805	S	S	*	*			trans	-85.3	162	178.3	-148.1	-8.5	0	0	0	110.8
119	D	26.2	Very low	25.3	Very low	113 Å²	113	145.5 Å²	145.5	60%	0.604	81%	0.809	S	S	*	*			trans	82.9	105.7	164.5	-89.1	-23.4	0	0	0	121.8
120	R	24.1	Very low	25	Very low	229 Å²	229	154.4 Å²	154.4	86%	0.864	82%	0.822	S	S	*	*				72.4	120.8	123.1	-72.4	170.1	-168.9	-138.8	-1.6	120.8
121	G	26.7	Very low	24.7	Very low	76 Å²	76	157.9 Å²	157.9	78%	0.784	83%	0.828	S	S	*	*			trans	-178.8	59.1	159	0	0	0	0	0	114.8	L123	G121-L123 PolarHBondContact O-N 2.82Å
122	R	20.2	Very low	24.6	Very low	236 Å²	236	157.8 Å²	157.8	89%	0.891	83%	0.832	S	S	*	*			trans	-64.8	114.3	175.7	-165.3	-173	-158.5	-153.4	7.1	110.6
123	L	24.5	Very low	24.3	Very low	175 Å²	175	154.8 Å²	154.8	92%	0.916	82%	0.824	S	S	*	*			trans	-133.2	124.9	161.6	-89.1	162	0	0	0	110.1	G121	G121-L123 PolarHBondContact O-N 2.82Å
124	T	22.3	Very low	24.3	Very low	108 Å²	108	157 Å²	157	66%	0.663	82%	0.822	S	S	*	*			trans	-112.9	161.8	-175.9	-43.2	0	0	0	0	107.9
125	L	21.8	Very low	24.5	Very low	170 Å²	170	150.5 Å²	150.5	89%	0.89	81%	0.813	S	S	*	*			trans	94.8	138.6	174.2	-64.4	152.6	0	0	0	113.7
126	A	22.4	Very low	24.6	Very low	79 Å²	79	152.9 Å²	152.9	65%	0.653	82%	0.82	S	S	*	*			cis	-168.5	154.5	-5.9	0	0	0	0	0	108.3
127	T	21.6	Very low	24.6	Very low	140 Å²	140	154.6 Å²	154.6	86%	0.859	82%	0.822	S	S	*	*			trans	-25	130.2	160.9	-0	0	0	0	0	117.7
128	A	24.3	Very low	24.7	Very low	104 Å²	104	153.7 Å²	153.7	86%	0.86	82%	0.817	S	S	*	*			trans	-148.5	104.6	151.7	0	0	0	0	0	111.3
129	L	21	Very low	25	Very low	163 Å²	163	155 Å²	155	85%	0.853	82%	0.823	S	S	*	*			trans	-68.1	139.4	163.8	-78.1	156.1	0	0	0	110.3
130	R	22.9	Very low	25.3	Very low	255 Å²	255	154.2 Å²	154.2	96%	0.962	83%	0.833	S	S	*	*			trans	-163.8	135.5	139.4	-108.5	172.3	-157.9	-161.2	6.4	112.7
131	R	21.9	Very low	25.7	Very low	240 Å²	240	154.9 Å²	154.9	91%	0.906	84%	0.835	S	S	*	*			trans	-76.7	145	176.6	-62.3	167.7	171.9	171.9	-4.5	110.7
132	T	27.5	Very low	25.9	Very low	151 Å²	151	155.4 Å²	155.4	93%	0.926	83%	0.832	S	S	*	*			trans	-149	132.4	144.6	46.5	0	0	0	0	111.4
133	S	23.9	Very low	26.5	Very low	102 Å²	102	147.3 Å²	147.3	71%	0.713	82%	0.822	S	S	*	*			trans	-101.7	147.5	177.9	52.5	0	0	0	0	111.2
134	K	26.1	Very low	26.9	Very low	194 Å²	194	144.1 Å²	144.1	84%	0.843	81%	0.809	S	S	*	*			trans	135.8	120.5	138.2	-79.8	-175.9	174.1	-177.9	0	114.3
135	S	28.9	Very low	27.5	Very low	100 Å²	100	143.1 Å²	143.1	70%	0.699	81%	0.807	S	S	*	*			trans	35	125.3	141.1	61.5	0	0	0	0	120.8
136	D	31.4	Very low	28.1	Very low	154 Å²	154	138.9 Å²	138.9	82%	0.824	80%	0.796	S	S	*	*			trans	-156.4	100	137.7	-96.8	-24.2	0	0	0	111.3
137	D	27.7	Very low	28.5	Very low	167 Å²	167	138.3 Å²	138.3	89%	0.893	79%	0.792	S	S	*	*			trans	-82.7	96.4	163.7	-88.5	-37	0	0	0	108.5
138	T	30.3	Very low	29	Very low	127 Å²	127	134.6 Å²	134.6	78%	0.779	78%	0.775	S	S	*	*			trans	-159.6	17.5	163.5	16.3	0	0	0	0	116.1
139	L	30	Very low	29.6	Very low	171 Å²	171	134.6 Å²	134.6	90%	0.895	76%	0.764	S	S	*	*			trans	-101	8.3	-174.3	-112.4	149.3	0	0	0	116.2
140	A	32.7	Very low	30.2	Very low	98 Å²	98	130.8 Å²	130.8	81%	0.81	76%	0.756	S	S	*	*	S	Bend	trans	-95.8	9.1	-176.5	0	0	0	0	0	116.1
141	R	30.9	Very low	30.5	Very low	242 Å²	242	126.1 Å²	126.1	91%	0.913	75%	0.75	S	S	*	*	S	Bend	trans	-115.2	-1.2	-175.7	-126	175.3	-168.1	156.1	3.4	117.7
142	A	31.6	Very low	30.9	Very low	88 Å²	88	119.4 Å²	119.4	73%	0.727	74%	0.739	S	S	*	*	S	Bend	trans	-98	-15.6	-179.4	0	0	0	0	0	115.2
143	G	32.7	Very low	30.9	Very low	65 Å²	65	117.9 Å²	117.9	67%	0.67	73%	0.73	S	S	*	*	S	Bend	trans	-80.2	-18.4	-175.9	0	0	0	0	0	116.3
144	V	32.6	Very low	31	Very low	108 Å²	108	118.4 Å²	118.4	66%	0.655	73%	0.733	S	S	*	*	S	Bend	trans	-95.7	-15.2	-169.8	-176.3	0	0	0	0	113.3
145	S	34.9	Very low	31	Very low	88 Å²	88	118.7 Å²	118.7	62%	0.615	74%	0.735	S	S	*	*	H	α-helix	trans	-80.4	-25	-179.4	-164.7	0	0	0	0	114
146	A	34	Very low	30.9	Very low	80 Å²	80	122 Å²	122	66%	0.661	74%	0.744	S	S	*	*	H	α-helix	trans	-75.3	-33.1	-179.3	0	0	0	0	0	112.6	A148	A146-A148 PolarHBondContact O-N 3.5Å
147	A	31.5	Very low	30.7	Very low	68 Å²	68	120.1 Å²	120.1	56%	0.562	74%	0.738	S	S	*	*	H	α-helix	trans	-74.5	-23.8	178.8	0	0	0	0	0	113.5
148	A	32.7	Very low	30.5	Very low	62 Å²	62	117 Å²	117	51%	0.512	74%	0.735	S	S	.	*	H	α-helix	trans	-77.9	-27.3	-180	0	0	0	0	0	113.3	A146	A146-A148 PolarHBondContact O-N 3.5Å
149	V	36.1	Very low	30.5	Very low	104 Å²	104	117 Å²	117	63%	0.63	74%	0.735	S	S	*	*	H	α-helix	trans	-78.5	-28.9	-179	178.6	0	0	0	0	111.8	L151	V149-L151 PolarHBondContact O-N 3.03Å
150	A	34.1	Very low	30.1	Very low	82 Å²	82	111.9 Å²	111.9	68%	0.678	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-15.3	177.7	0	0	0	0	0	114.3
151	L	29.4	Very low	29.7	Very low	158 Å²	158	115.2 Å²	115.2	83%	0.827	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	7.1	-177.1	-85.4	161.8	0	0	0	115.1	V149	V149-L151 PolarHBondContact O-N 3.03Å
152	S	29.7	Very low	29.5	Very low	99 Å²	99	108.4 Å²	108.4	69%	0.692	72%	0.723	S	S	*	*	S	Bend	trans	-115.3	8.7	-176.8	-60.2	0	0	0	0	116.2
153	T	27.2	Very low	29.1	Very low	118 Å²	118	111.1 Å²	111.1	72%	0.724	73%	0.73	S	S	*	*			trans	-121.1	63.7	179.6	55.8	0	0	0	0	113.2
154	S	26	Very low	28.8	Very low	113 Å²	113	112.6 Å²	112.6	79%	0.79	74%	0.736	S	S	*	*			trans	-133.8	65.2	161.8	-58.3	0	0	0	0	109.4	L156	S154-L156 VanDerWaalsContact C-N 3.29Å; S154-L156 PolarHBondContact O-N 2.91Å
155	K	26.9	Very low	28.4	Very low	200 Å²	200	112.8 Å²	112.8	87%	0.87	74%	0.743	S	S	*	*			trans	-68.7	89.8	162.8	-82.7	179.7	176.6	175.1	0	107.8	V157	K155-V157 PolarHBondContact O-N 2.91Å; K155-V157 VanDerWaalsContact O-N 3.14Å
156	L	26	Very low	28	Very low	170 Å²	170	113.1 Å²	113.1	89%	0.89	75%	0.751	S	S	*	*			trans	-70.4	105.7	166.7	-104.4	121.4	0	0	0	108.5	S154 A158	S154-L156 VanDerWaalsContact C-N 3.29Å; S154-L156 PolarHBondContact O-N 2.91Å; L156-A158 PolarHBondContact O-N 3.24Å
157	V	27.4	Very low	27.7	Very low	115 Å²	115	115.4 Å²	115.4	70%	0.697	76%	0.762	S	S	*	*			trans	-64.1	121.8	174.2	172	0	0	0	0	108.8	K155 T159	K155-V157 PolarHBondContact O-N 2.91Å; K155-V157 VanDerWaalsContact O-N 3.14Å; V157-T159 HydrophobicContact CG1-CG2 4.28Å; V157-T159 PolarHBondContact O-N 3.12Å
158	A	23.7	Very low	27.4	Very low	100 Å²	100	117 Å²	117	83%	0.826	78%	0.775	S	S	*	*			trans	-71.2	109.1	170	0	0	0	0	0	109.5	L156	L156-A158 PolarHBondContact O-N 3.24Å
159	T	30.2	Very low	27	Very low	128 Å²	128	121.9 Å²	121.9	79%	0.785	79%	0.792	S	S	*	*			trans	-107	108.7	161.7	51.3	0	0	0	0	108	V157	V157-T159 HydrophobicContact CG1-CG2 4.28Å; V157-T159 PolarHBondContact O-N 3.12Å
160	G	22.7	Very low	26.5	Very low	64 Å²	64	124.1 Å²	124.1	66%	0.66	80%	0.8	S	S	*	*			trans	-71.6	178.7	169.3	0	0	0	0	0	112.7
161	D	23.6	Very low	26.1	Very low	167 Å²	167	128.4 Å²	128.4	89%	0.893	81%	0.811	S	S	*	*			trans	75.5	101.2	166.5	-55.1	-23.8	0	0	0	117.3
162	A	27.5	Very low	25.7	Very low	100 Å²	100	131 Å²	131	83%	0.826	82%	0.816	S	S	*	*				176.4	124.3	90.5	0	0	0	0	0	110.4	A164	A162-A164 PolarHBondContact O-N 3.05Å
163	V	23.2	Very low	25.7	Very low	144 Å²	144	135 Å²	135	87%	0.873	82%	0.824	S	S	*	*			trans	-59.3	120.1	169.8	173.1	0	0	0	0	109.6
164	A	26.5	Very low	25.6	Very low	96 Å²	96	136.5 Å²	136.5	79%	0.793	83%	0.827	S	S	*	*			trans	-132.1	98.6	158.4	0	0	0	0	0	108.3	A162 A166	A162-A164 PolarHBondContact O-N 3.05Å; A164-A166 PolarHBondContact O-N 3.35Å
165	S	23.9	Very low	25.4	Very low	113 Å²	113	143 Å²	143	79%	0.79	83%	0.834	S	S	*	*			trans	-57.1	118.5	168.5	53.5	0	0	0	0	110.8
166	A	26.5	Very low	25.2	Very low	95 Å²	95	140.8 Å²	140.8	79%	0.785	83%	0.827	S	S	*	*			trans	-137.8	98.7	157	0	0	0	0	0	107.9	A164 A168	A164-A166 PolarHBondContact O-N 3.35Å; A166-A168 PolarHBondContact O-N 3.49Å; A166-A168 VanDerWaalsContact O-N 3.16Å
167	S	26.8	Very low	25.1	Very low	127 Å²	127	138.3 Å²	138.3	89%	0.888	82%	0.821	S	S	*	*			trans	-54.5	111.5	171.5	-62.8	0	0	0	0	110.6
168	A	24.9	Very low	25.1	Very low	102 Å²	102	139 Å²	139	84%	0.843	83%	0.826	S	S	*	*			trans	-131.8	58.3	160.2	0	0	0	0	0	108.1	A166	A166-A168 PolarHBondContact O-N 3.49Å; A166-A168 VanDerWaalsContact O-N 3.16Å
169	L	24.2	Very low	25.1	Very low	165 Å²	165	137.6 Å²	137.6	86%	0.864	82%	0.821	S	S	*	*			trans	-98.4	88.5	167.9	-136.9	88.8	0	0	0	106.4
170	D	25.5	Very low	24.9	Very low	150 Å²	150	138 Å²	138	80%	0.802	82%	0.817	S	S	*	*			trans	-172.9	79.2	158.8	-103	-16.9	0	0	0	108.8
171	L	26	Very low	24.9	Very low	173 Å²	173	143.8 Å²	143.8	91%	0.906	83%	0.827	S	S	*	*			trans	-162.3	50.4	161.4	-104.3	158.3	0	0	0	109.7
172	F	22.5	Very low	24.9	Very low	212 Å²	212	146.1 Å²	146.1	93%	0.93	82%	0.823	S	S	*	*			trans	-143.7	90.3	159.1	-95.8	-82.1	0	0	0	107.4
173	Q	27.7	Very low	24.8	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	82%	0.819	S	S	*	*			trans	-123.7	113.8	156.4	-88.1	-169.9	-0.8	0	0	109	R175	Q173-R175 PolarHBondContact O-N 2.7Å
174	D	25.1	Very low	24.8	Very low	149 Å²	149	148.6 Å²	148.6	80%	0.797	81%	0.814	S	S	*	*			trans	-35.8	115.6	166	-90.3	-42.7	0	0	0	112	Q176	D174-Q176 PolarHBondContact O-N 3.44Å
175	R	22.8	Very low	24.6	Very low	249 Å²	249	155.4 Å²	155.4	94%	0.94	82%	0.819	S	S	*	*			trans	-69.4	84.7	155.6	-82.4	-170.3	175.1	-166.8	0.3	108.3	Q173	Q173-R175 PolarHBondContact O-N 2.7Å
176	Q	22.7	Very low	24.7	Very low	153 Å²	153	158.9 Å²	158.9	72%	0.715	82%	0.82	S	S	*	*			trans	-57.1	127.6	158.7	-83.4	-91.9	-22.8	0	0	108.8	D174 V178	D174-Q176 PolarHBondContact O-N 3.44Å; Q176-V178 PolarHBondContact O-N 2.63Å; Q176-V178 VanDerWaalsContact O-N 3.07Å
177	P	23	Very low	24.7	Very low	118 Å²	118	160 Å²	160	77%	0.766	82%	0.822	S	S	*	*			trans	-73.7	104.4	-179.1	29.3	-30.9	0	0	0	108.9	G179	P177-G179 PolarHBondContact O-N 2.94Å
178	V	27.5	Very low	24.6	Very low	131 Å²	131	162 Å²	162	79%	0.794	82%	0.822	S	S	*	*			trans	-69.5	100.2	172.1	-173	0	0	0	0	107.8	Q176 L180	Q176-V178 PolarHBondContact O-N 2.63Å; Q176-V178 VanDerWaalsContact O-N 3.07Å; V178-L180 PolarHBondContact O-N 3.29Å
179	G	24.1	Very low	24.7	Very low	70 Å²	70	160.3 Å²	160.3	72%	0.722	81%	0.814	S	S	*	*			trans	-61.9	114.3	168.1	0	0	0	0	0	110.2	P177	P177-G179 PolarHBondContact O-N 2.94Å
180	L	26.2	Very low	24.8	Very low	135 Å²	135	159.1 Å²	159.1	71%	0.707	81%	0.814	S	S	*	*			trans	-138.8	60	162.6	-139.8	96	0	0	0	109.3	V178 R182	V178-L180 PolarHBondContact O-N 3.29Å; L180-R182 PolarHBondContact O-N 3.22Å
181	E	22.9	Very low	25.1	Very low	186 Å²	186	161.9 Å²	161.9	87%	0.869	82%	0.82	S	S	*	*			trans	-69	81.7	161.6	-77.4	-168.2	155.4	0	0	108.8	T183	E181-T183 PolarHBondContact O-N 3.34Å; E181-T183 PolarHBondContact O-OG1 3.07Å
182	R	24.4	Very low	25.1	Very low	217 Å²	217	162.8 Å²	162.8	82%	0.819	82%	0.819	S	S	*	*			trans	-74.4	86	162	-108.7	178.1	169.7	170	-2.5	107.8	L180 K184	L180-R182 PolarHBondContact O-N 3.22Å; R182-K184 VanDerWaalsContact C-N 3.33Å; R182-K184 PolarHBondContact O-N 3.11Å
183	T	23.8	Very low	25.2	Very low	121 Å²	121	158.1 Å²	158.1	74%	0.742	81%	0.813	S	S	*	*			trans	-65.6	89.3	169.9	-14	0	0	0	0	108.9	E181 R185	E181-T183 PolarHBondContact O-N 3.34Å; E181-T183 PolarHBondContact O-OG1 3.07Å; T183-R185 VanDerWaalsContact C-N 3.34Å; T183-R185 PolarHBondContact O-N 3.29Å
184	K	23.7	Very low	25.2	Very low	174 Å²	174	159.2 Å²	159.2	76%	0.757	82%	0.815	S	S	*	*			trans	-72	94.5	163.8	-78.5	-173.2	177.1	-178.4	0	107.8	R182 F186	R182-K184 VanDerWaalsContact C-N 3.33Å; R182-K184 PolarHBondContact O-N 3.11Å; K184-F186 PolarHBondContact O-N 3.25Å; K184-F186 VanDerWaalsContact O-N 3.14Å
185	R	23.3	Very low	25.5	Very low	240 Å²	240	157.7 Å²	157.7	91%	0.906	81%	0.813	S	S	*	*			trans	-58.6	108.1	166.8	-82.3	178.6	173.3	151.6	-2.2	108.9	T183	T183-R185 VanDerWaalsContact C-N 3.34Å; T183-R185 PolarHBondContact O-N 3.29Å
186	F	24.6	Very low	25.5	Very low	186 Å²	186	151.1 Å²	151.1	82%	0.816	81%	0.805	S	S	*	*			trans	-84.4	108.2	158.6	-75.2	-85.9	0	0	0	107.6	K184 L188	K184-F186 PolarHBondContact O-N 3.25Å; K184-F186 VanDerWaalsContact O-N 3.14Å; F186-L188 PolarHBondContact O-N 2.91Å
187	S	27.4	Very low	25.9	Very low	117 Å²	117	150.8 Å²	150.8	82%	0.818	81%	0.814	S	S	*	*			trans	-75.2	115.4	170	50.7	0	0	0	0	109.1	G189	S187-G189 PolarHBondContact O-N 3.01Å
188	L	25.4	Very low	26.1	Very low	169 Å²	169	149.6 Å²	149.6	89%	0.885	81%	0.808	S	S	*	*			trans	-61.6	126.1	172.7	-86.7	105	0	0	0	110.9	F186	F186-L188 PolarHBondContact O-N 2.91Å
189	G	26	Very low	26	Very low	67 Å²	67	151.3 Å²	151.3	69%	0.691	81%	0.813	S	S	*	*			trans	-66.3	126.4	166.3	0	0	0	0	0	111.3	S187 F191	S187-G189 PolarHBondContact O-N 3.01Å; G189-F191 PolarHBondContact O-N 3.22Å
190	T	27.1	Very low	26.3	Very low	140 Å²	140	151.9 Å²	151.9	86%	0.859	82%	0.818	S	S	*	*			trans	-65.8	110.1	169.2	27.2	0	0	0	0	110.7
191	F	29.9	Very low	26.3	Very low	209 Å²	209	154.3 Å²	154.3	92%	0.917	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-83.4	119.4	164.4	-103.5	-93.3	0	0	0	109.6	G189	G189-F191 PolarHBondContact O-N 3.22Å
192	Q	26.9	Very low	26.4	Very low	191 Å²	191	149.2 Å²	149.2	89%	0.893	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-69	131.1	175.8	-78.4	-179.7	-5.7	0	0	111.5
193	S	25.6	Very low	26.7	Very low	115 Å²	115	143.9 Å²	143.9	80%	0.804	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-71	136.6	166.1	50	0	0	0	0	112
194	K	27.5	Very low	26.8	Very low	207 Å²	207	147.3 Å²	147.3	90%	0.9	84%	0.838	S	S	*	*			trans	-122.8	148.9	155	-94.6	-174.9	176.5	177	0	110.2
195	P	30	Very low	26.9	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	84%	0.839	S	S	*	*			trans	-105.4	158.8	-146.7	24.3	-6.7	0	0	0	114.6
196	S	24.2	Very low	27.1	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	84%	0.836	S	S	*	*			trans	-27.6	132.7	159.9	48.4	0	0	0	0	117.5
197	V	30.7	Very low	27.1	Very low	146 Å²	146	140.4 Å²	140.4	89%	0.885	83%	0.833	S	S	*	*			trans	-139.2	138.7	138.7	-177.8	0	0	0	0	109.4
198	S	26.9	Very low	27.2	Very low	92 Å²	92	139.7 Å²	139.7	64%	0.643	83%	0.834	S	S	*	*			trans	-79.4	153.6	-168.3	49.6	0	0	0	0	116.3
199	N	26.6	Very low	27.3	Very low	168 Å²	168	140 Å²	140	90%	0.898	83%	0.831	S	S	*	*			trans	55.1	110.9	140.2	-63.7	-8.6	0	0	0	119.7
200	G	29.2	Very low	27.7	Very low	81 Å²	81	142.9 Å²	142.9	84%	0.835	84%	0.837	S	S	*	*			trans	-156.7	102.8	156.5	0	0	0	0	0	109.6
201	L	26	Very low	27.7	Very low	187 Å²	187	139.4 Å²	139.4	98%	0.979	83%	0.83	S	S	*	*			trans	-66.1	143.1	174.3	-82	148.9	0	0	0	111.4
202	G	25	Very low	27.9	Very low	78 Å²	78	135.5 Å²	135.5	80%	0.804	83%	0.825	S	S	*	*			trans	104.9	94.8	145.3	0	0	0	0	0	116.3
203	A	30.5	Very low	27.8	Very low	105 Å²	105	132.6 Å²	132.6	87%	0.868	82%	0.82	S	S	*	*			trans	-154.9	136.1	142.3	0	0	0	0	0	109.5
204	Q	26.4	Very low	28	Very low	194 Å²	194	133.4 Å²	133.4	91%	0.907	82%	0.82	S	S	*	*			trans	-76.1	138.1	-158.5	-153.6	166.7	6.2	0	0	111.9	H206	Q204-H206 PolarHBondContact O-N 2.87Å
205	V	25.2	Very low	27.9	Very low	127 Å²	127	129.7 Å²	129.7	77%	0.77	81%	0.811	S	S	*	*			trans	-60.8	114.9	173.9	175.8	0	0	0	0	109.6	L207	V205-L207 HydrophobicContact CG1-CD1 4.12Å
206	H	28.4	Very low	27.9	Very low	185 Å²	185	131.9 Å²	131.9	86%	0.856	82%	0.816	S	S	*	*			trans	-101.9	109.5	160.9	-125.1	-65.7	0	0	0	108.5	Q204 A208	Q204-H206 PolarHBondContact O-N 2.87Å; H206-A208 PolarHBondContact O-N 3.15Å
207	L	24.2	Very low	28	Very low	143 Å²	143	133.6 Å²	133.6	75%	0.749	82%	0.815	S	S	*	*			trans	-57.5	124.5	165.8	-94.4	84.8	0	0	0	109	V205	V205-L207 HydrophobicContact CG1-CD1 4.12Å
208	A	30	Very low	27.9	Very low	101 Å²	101	136 Å²	136	84%	0.835	82%	0.817	S	S	*	*			trans	-118	117.5	157.6	0	0	0	0	0	107.5	H206	H206-A208 PolarHBondContact O-N 3.15Å
209	Q	26.6	Very low	27.7	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.9	159.3	-179.9	-87.5	-156.8	-6.5	0	0	112.6
210	P	34.4	Very low	27.8	Very low	127 Å²	127	140.2 Å²	140.2	83%	0.825	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-88.1	138.1	-161.7	34.2	-31.7	0	0	0	113.3
211	G	27.5	Very low	28.5	Very low	68 Å²	68	141.3 Å²	141.3	70%	0.701	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-90.3	152.3	170.7	0	0	0	0	0	112.5
212	P	33.8	Very low	28.4	Very low	126 Å²	126	142 Å²	142	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-88.6	149.7	-156.7	34.4	-34.4	0	0	0	114.8
213	V	25.6	Very low	28.6	Very low	130 Å²	130	141.7 Å²	141.7	79%	0.788	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-60.6	130.4	172.6	177.9	0	0	0	0	110.6
214	T	29.1	Very low	28.2	Very low	132 Å²	132	143 Å²	143	81%	0.81	81%	0.809	S	S	*	*			trans	-114.2	112.4	163.1	41.3	0	0	0	0	108.4
215	D	25.5	Very low	28.3	Very low	130 Å²	130	142.2 Å²	142.2	70%	0.695	81%	0.805	S	S	*	*			trans	-64.2	128.9	166.8	-91.6	-40.8	0	0	0	109.6
216	N	30.7	Very low	28.1	Very low	162 Å²	162	144 Å²	144	87%	0.866	81%	0.81	S	S	*	*			trans	-140	91.3	152	-97.8	-38	0	0	0	109.2
217	L	24.9	Very low	27.9	Very low	147 Å²	147	141.6 Å²	141.6	77%	0.77	80%	0.803	S	S	*	*			trans	-63.6	121.6	160.2	-90.2	141.6	0	0	0	109.7
218	Q	29.8	Very low	27.9	Very low	196 Å²	196	143.9 Å²	143.9	92%	0.916	81%	0.807	S	S	*	*			trans	-136.7	110.4	152.9	-119.3	164	-16	0	0	110.4
219	R	23.2	Very low	27.9	Very low	235 Å²	235	148.2 Å²	148.2	89%	0.887	81%	0.807	S	S	*	*			trans	-70.7	140.4	170.8	-106.7	174.2	-179.8	175.6	0.3	110
220	S	27.8	Very low	28	Very low	114 Å²	114	146 Å²	146	80%	0.797	81%	0.805	S	S	*	*				-160.5	139.6	127.3	-165.2	0	0	0	0	110.6
221	P	43.1	Very low	27.6	Very low	105 Å²	105	147.5 Å²	147.5	68%	0.682	81%	0.806	S	S	*	*			trans	-97.9	-171.9	-177	40.6	-33.5	0	0	0	112.4
222	E	25.8	Very low	27.6	Very low	200 Å²	200	153.1 Å²	153.1	94%	0.935	81%	0.814	S	S	*	*			trans	99.6	129.6	179	-60.2	175.5	178.3	0	0	112.3
223	G	27.3	Very low	27.2	Very low	73 Å²	73	151 Å²	151	75%	0.753	82%	0.816	S	S	*	*			cis	-166.8	157.5	7.2	0	0	0	0	0	108.2
224	T	23.5	Very low	27.3	Very low	133 Å²	133	151.6 Å²	151.6	82%	0.816	81%	0.813	S	S	*	*			trans	-84.4	115.7	-173.5	-36.9	0	0	0	0	109.9
225	E	27.1	Very low	27	Very low	176 Å²	176	150.2 Å²	150.2	82%	0.822	81%	0.808	S	S	*	*			trans	-132.4	103.8	157.6	-80.9	-162.9	158.5	0	0	110.7
226	L	22.3	Very low	27	Very low	164 Å²	164	151.3 Å²	151.3	86%	0.859	81%	0.814	S	S	*	*			trans	-73.3	108	161.4	-87.3	155.2	0	0	0	108.3
227	L	24.1	Very low	26.5	Very low	136 Å²	136	150.5 Å²	150.5	71%	0.712	81%	0.809	S	S	*	*			trans	-136.3	117.3	161.6	-97.9	156.9	0	0	0	110.7
228	K	24.1	Very low	26.6	Very low	191 Å²	191	153.5 Å²	153.5	83%	0.83	81%	0.81	S	S	*	*			trans	-71.1	131.8	173.5	-69.3	169.4	172.8	173.6	0	110.1
229	F	30.4	Very low	26.2	Very low	191 Å²	191	150.4 Å²	150.4	84%	0.838	81%	0.805	S	S	*	*			trans	-143.7	95.3	152.4	-83	-82	0	0	0	105.3
230	V	27.8	Very low	26.4	Very low	130 Å²	130	148 Å²	148	79%	0.788	80%	0.801	S	S	*	*				50.8	115	90.2	-175.9	0	0	0	0	112.8
231	D	26	Very low	26.2	Very low	158 Å²	158	148.1 Å²	148.1	85%	0.845	80%	0.802	S	S	*	*			trans	-40	124.8	177.9	-67.7	-54.2	0	0	0	115.4
232	E	28.6	Very low	25.4	Very low	187 Å²	187	149.5 Å²	149.5	87%	0.874	81%	0.808	S	S	*	*			trans	-127.7	104.2	143.1	-78.9	-164.5	158.4	0	0	108.8	I234	E232-I234 PolarHBondContact O-N 2.85Å
233	G	24.7	Very low	25.3	Very low	82 Å²	82	145.6 Å²	145.6	85%	0.845	80%	0.8	S	S	*	*			trans	-71.1	114.9	173.1	0	0	0	0	0	110.6
234	I	26.7	Very low	25.1	Very low	142 Å²	142	147.4 Å²	147.4	73%	0.728	80%	0.801	S	S	*	*			trans	-92.7	103.3	166	-62.4	175.4	0	0	0	107.4	E232 L236	E232-I234 PolarHBondContact O-N 2.85Å; I234-L236 HydrophobicContact CG2-CD1 4.49Å; I234-L236 HydrophobicContact CG2-CG 4.27Å; I234-L236 PolarHBondContact O-N 3.33Å
235	S	23.4	Very low	25.3	Very low	103 Å²	103	148.8 Å²	148.8	72%	0.72	80%	0.802	S	S	*	*			trans	-71.7	112.8	170.6	-170.4	0	0	0	0	109.4
236	L	25.5	Very low	25.2	Very low	153 Å²	153	147.6 Å²	147.6	80%	0.801	80%	0.797	S	S	*	*			trans	-106.1	86.9	171.7	-82.5	160.4	0	0	0	109.2	I234 R238	I234-L236 HydrophobicContact CG2-CD1 4.49Å; I234-L236 HydrophobicContact CG2-CG 4.27Å; I234-L236 PolarHBondContact O-N 3.33Å; L236-R238 PolarHBondContact O-N 3Å
237	D	21.3	Very low	25.5	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	80%	0.799	S	S	*	*			trans	-70.7	108.7	162.6	-96.3	-31	0	0	0	109.1
238	R	26	Very low	25.5	Very low	210 Å²	210	148.8 Å²	148.8	79%	0.792	80%	0.799	S	S	*	*			trans	-140.4	94.8	155.2	-75.7	-163	173.4	170.3	-1.6	110.8	L236 F240	L236-R238 PolarHBondContact O-N 3Å; R238-F240 HydrophobicContact CB-CE2 4.25Å
239	T	22.6	Very low	25.9	Very low	132 Å²	132	146.8 Å²	146.8	81%	0.81	80%	0.802	S	S	*	*			trans	-48.2	124.2	159.1	5.1	0	0	0	0	111.1
240	F	26.9	Very low	25.7	Very low	183 Å²	183	145.9 Å²	145.9	80%	0.803	80%	0.801	S	S	*	*			trans	-126.3	108.7	163.2	-84.6	-81.4	0	0	0	109.6	R238	R238-F240 HydrophobicContact CB-CE2 4.25Å
241	S	23.3	Very low	26.5	Very low	117 Å²	117	144.6 Å²	144.6	82%	0.818	80%	0.795	S	S	*	*			trans	-71.8	132.9	168.9	-49.9	0	0	0	0	109.5
242	V	25.6	Very low	26.5	Very low	134 Å²	134	146.2 Å²	146.2	81%	0.812	80%	0.798	S	S	*	*			trans	-125.9	134	168.6	177.7	0	0	0	0	108.5
243	P	24	Very low	26.6	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	79%	0.788	S	S	*	*			trans	-91.3	151	-158.9	0.6	21.1	0	0	0	113.4
244	S	22.8	Very low	26.8	Very low	111 Å²	111	143.6 Å²	143.6	78%	0.776	78%	0.782	S	S	*	*			trans	-53.3	134.3	169.3	-55.3	0	0	0	0	113.5
245	I	29	Very low	26.8	Very low	163 Å²	163	146.8 Å²	146.8	84%	0.836	79%	0.791	S	S	*	*			trans	-129.1	114.9	146.5	-65.5	-179.4	0	0	0	106.6
246	E	24.5	Very low	27.1	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	79%	0.79	S	S	*	*			trans	-67.7	137.3	172.5	-68.3	153.9	147.1	0	0	109.5
247	D	28.3	Very low	27.3	Very low	168 Å²	168	147.4 Å²	147.4	90%	0.898	79%	0.79	S	S	*	*			trans	-144.7	119.5	145.2	-101.6	-32.4	0	0	0	109.9
248	H	25	Very low	27.8	Very low	156 Å²	156	149.2 Å²	149.2	72%	0.722	79%	0.791	S	S	*	*			trans	-71.8	131.8	-179.4	-72.8	-100.4	0	0	0	111.5
249	V	30.9	Very low	28.2	Very low	149 Å²	149	146.6 Å²	146.6	90%	0.903	79%	0.788	S	S	*	*				-150.3	125.6	129.6	179.6	0	0	0	0	108.3
250	E	26.2	Very low	28.8	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	79%	0.789	S	S	*	*			trans	-95.7	-175.5	-170.4	-133.7	-152.8	168.1	0	0	111.7
251	P	44.7	Very low	29.5	Very low	102 Å²	102	149.1 Å²	149.1	66%	0.662	78%	0.783	S	S	*	*				-123.5	162.5	-114.5	38.1	-19.5	0	0	0	115.4
252	E	27.5	Very low	30.6	Very low	193 Å²	193	149.5 Å²	149.5	90%	0.902	78%	0.777	S	S	*	*			trans	-131.1	150.7	155.5	-94.6	-149.3	161.9	0	0	111.3
253	P	29.3	Very low	31.7	Very low	103 Å²	103	145.7 Å²	145.7	67%	0.669	76%	0.759	S	S	*	*			trans	-86.8	159	-136.9	32.7	-35.2	0	0	0	115.2	F255	P253-F255 PolarHBondContact O-N 2.61Å
254	P	29.6	Very low	33	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	75%	0.75	S	S	*	*			trans	-83.5	121.9	-158.9	32.3	-32.7	0	0	0	112.5	T256	P254-T256 VanDerWaalsContact C-N 3.32Å; P254-T256 PolarHBondContact O-N 3.41Å
255	F	26.4	Very low	34.5	Very low	208 Å²	208	142.8 Å²	142.8	91%	0.912	73%	0.732	S	S	*	*			trans	-62.3	95.3	158.3	-86.2	-90.3	0	0	0	109.1	P253 L257	P253-F255 PolarHBondContact O-N 2.61Å; F255-L257 VanDerWaalsContact C-N 3.27Å; F255-L257 PolarHBondContact O-N 3.26Å
256	T	29.2	Very low	36	Very low	115 Å²	115	137.7 Å²	137.7	71%	0.706	71%	0.714	S	S	*	*			trans	-67.6	88.7	167.9	46.5	0	0	0	0	108.7	P254 K258	P254-T256 VanDerWaalsContact C-N 3.32Å; P254-T256 PolarHBondContact O-N 3.41Å; T256-K258 PolarHBondContact O-N 3.23Å
257	L	30.3	Very low	37.9	Very low	154 Å²	154	134 Å²	134	81%	0.806	71%	0.705	S	S	*	*			trans	-69.8	84	172	-141.7	141.3	0	0	0	107.2	F255 H259	F255-L257 VanDerWaalsContact C-N 3.27Å; F255-L257 PolarHBondContact O-N 3.26Å; L257-H259 PolarHBondContact O-N 3.34Å
258	K	31.6	Very low	40	Very low	182 Å²	182	130.4 Å²	130.4	79%	0.791	69%	0.685	S	S	*	*			trans	-48.6	112.8	173.9	-75.6	-178.5	177.4	176.7	0	108.2	T256 R260	T256-K258 PolarHBondContact O-N 3.23Å; K258-R260 PolarHBondContact O-N 3.22Å
259	H	34.9	Very low	41.9	Very low	156 Å²	156	130.7 Å²	130.7	72%	0.722	68%	0.679	S	S	*	*			trans	-44.6	123	179.7	-101.2	-109.5	0	0	0	110.8	L257 E261	L257-H259 PolarHBondContact O-N 3.34Å; H259-E261 PolarHBondContact O-N 3.26Å
260	R	35.6	Very low	43.8	Very low	222 Å²	222	127.8 Å²	127.8	84%	0.838	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	39.9	-176.2	-161.9	177.9	173.1	170.5	-1.2	111.8	K258 A263	K258-R260 PolarHBondContact O-N 3.22Å; R260-A263 HydrophobicContact CG-CB 4.41Å
261	E	40	Very low	45.5	Very low	145 Å²	145	128.1 Å²	128.1	68%	0.678	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-21.8	172.8	-75.5	-177.2	152.2	0	0	111.8	H259 A263 V264 D265	H259-E261 PolarHBondContact O-N 3.26Å; E261-A263 PolarHBondContact O-N 2.88Å; E261-V264 PolarHBondContact O-N 3.26Å; E261-D265 PolarHBondContact O-N 3.21Å
262	N	48.4	Very low	46.7	Very low	126 Å²	126	125.5 Å²	125.5	67%	0.674	63%	0.632	S	S	*	*	H	α-helix	trans	-70.3	-14.8	178.7	-69.5	-19.1	0	0	0	114.4	A266	N262-A266 WeakPolarHBondContact O-CB 3.41Å; N262-A266 PolarHBondContact O-N 2.98Å
263	A	48	Very low	48.4	Very low	54 Å²	54	124.5 Å²	124.5	45%	0.446	62%	0.62	S	S	.	*	H	α-helix	trans	-77.5	-36.4	179.7	0	0	0	0	0	112.3	R260 E261 S267	R260-A263 HydrophobicContact CG-CB 4.41Å; E261-A263 PolarHBondContact O-N 2.88Å; A263-S267 VanDerWaalsContact O-CB 3.26Å; A263-S267 WeakPolarHBondContact O-CB 3.29Å; A263-S267 PolarHBondContact O-N 2.93Å
264	V	51.7	Low	50.1	Low	95 Å²	95	124.8 Å²	124.8	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-72.8	-42.5	176	179.2	0	0	0	0	109.4	E261 S267 I268	E261-V264 PolarHBondContact O-N 3.26Å; V264-S267 CarbonylContact O-C 3.6Å; V264-S267 PolarHBondContact O-N 3.38Å; V264-I268 HydrophobicContact CG1-CD1 3.87Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CB 3.25Å; V264-I268 VanDerWaalsContact O-CG1 3.26Å; V264-I268 WeakPolarHBondContact O-CG1 3.44Å; V264-I268 PolarHBondContact O-N 2.79Å
265	D	54.6	Low	51.4	Low	73 Å²	73	124.8 Å²	124.8	39%	0.39	61%	0.605	S	S	.	*	H	α-helix	trans	-65.9	-38.3	175.2	-105.9	23.1	0	0	0	113.1	E261 I268 R269	E261-D265 PolarHBondContact O-N 3.21Å; D265-I268 PolarHBondContact O-N 3.02Å; D265-R269 VanDerWaalsContact O-CB 3.31Å; D265-R269 WeakPolarHBondContact O-CB 3.33Å; D265-R269 VanDerWaalsContact O-CG 3.25Å; D265-R269 WeakPolarHBondContact O-CG 3.25Å; D265-R269 PolarHBondContact O-N 3.13Å; D265-R269 IonicContact OD2-NH2 3.08Å
266	A	59.9	Low	52.3	Low	56 Å²	56	122.8 Å²	122.8	46%	0.463	59%	0.591	S	S	.	*	H	α-helix	trans	-66.4	-39.6	172	0	0	0	0	0	111.2	N262 R269 E270	N262-A266 WeakPolarHBondContact O-CB 3.41Å; N262-A266 PolarHBondContact O-N 2.98Å; A266-R269 PolarHBondContact O-N 3.42Å; A266-E270 WeakPolarHBondContact O-CB 3.34Å; A266-E270 PolarHBondContact O-N 3.21Å
267	S	64.6	Low	53.1	Low	74 Å²	74	121 Å²	121	52%	0.517	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-39	175.6	-170.2	0	0	0	0	112	A263 V264 E270 R271	A263-S267 VanDerWaalsContact O-CB 3.26Å; A263-S267 WeakPolarHBondContact O-CB 3.29Å; A263-S267 PolarHBondContact O-N 2.93Å; V264-S267 CarbonylContact O-C 3.6Å; V264-S267 PolarHBondContact O-N 3.38Å; S267-E270 PolarHBondContact O-N 3.11Å; S267-R271 WeakPolarHBondContact O-CB 3.35Å; S267-R271 PolarHBondContact O-N 3.04Å
268	I	71	Confident	53.7	Low	92 Å²	92	118.9 Å²	118.9	47%	0.472	59%	0.587	S	S	.	*	H	α-helix	trans	-66.5	-44.5	173.8	-69.2	167.4	0	0	0	110.1	V264 D265 E270 R271 T272	V264-I268 HydrophobicContact CG1-CD1 3.87Å; V264-I268 HydrophobicContact CG1-CG1 4.43Å; V264-I268 WeakPolarHBondContact O-CB 3.25Å; V264-I268 VanDerWaalsContact O-CG1 3.26Å; V264-I268 WeakPolarHBondContact O-CG1 3.44Å; V264-I268 PolarHBondContact O-N 2.79Å; D265-I268 PolarHBondContact O-N 3.02Å; I268-E270 VanDerWaalsContact C-N 3.35Å; I268-R271 PolarHBondContact O-N 3.47Å; I268-T272 VanDerWaalsContact O-CB 3.24Å; I268-T272 WeakPolarHBondContact O-CB 3.48Å; I268-T272 PolarHBondContact O-N 2.94Å; I268-T272 PolarHBondContact O-OG1 2.77Å
269	R	66.1	Low	54	Low	161 Å²	161	114.5 Å²	114.5	61%	0.608	58%	0.579	S	S	*	*	H	α-helix	trans	-64.3	-39.3	175.9	-75.9	179.1	-144.2	-164.4	6.3	111.9	D265 A266 T272 R273	D265-R269 VanDerWaalsContact O-CB 3.31Å; D265-R269 WeakPolarHBondContact O-CB 3.33Å; D265-R269 VanDerWaalsContact O-CG 3.25Å; D265-R269 WeakPolarHBondContact O-CG 3.25Å; D265-R269 PolarHBondContact O-N 3.13Å; D265-R269 IonicContact OD2-NH2 3.08Å; A266-R269 PolarHBondContact O-N 3.42Å; R269-T272 CarbonylContact O-C 3.55Å; R269-T272 PolarHBondContact O-N 3.01Å; R269-R273 WeakPolarHBondContact O-CB 3.44Å; R269-R273 WeakPolarHBondContact O-CG 3.48Å; R269-R273 PolarHBondContact O-N 2.87Å
270	E	70.6	Confident	53.8	Low	89 Å²	89	113.6 Å²	113.6	42%	0.416	58%	0.577	S	S	.	*	H	α-helix	trans	-71.1	-41.5	178.7	-172.2	54.6	-148.4	0	0	110.9	A266 S267 I268 T272 R273 Q274	A266-E270 WeakPolarHBondContact O-CB 3.34Å; A266-E270 PolarHBondContact O-N 3.21Å; S267-E270 PolarHBondContact O-N 3.11Å; I268-E270 VanDerWaalsContact C-N 3.35Å; E270-T272 VanDerWaalsContact C-N 3.3Å; E270-T272 PolarHBondContact O-N 3.44Å; E270-R273 CarbonylContact O-C 3.58Å; E270-R273 WeakPolarHBondContact O-CB 3.33Å; E270-R273 PolarHBondContact O-N 3.37Å; E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 WeakPolarHBondContact O-CG 3.19Å; E270-Q274 PolarHBondContact O-N 2.91Å; E270-Q274 PolarHBondContact OE1-NE2 3.04Å
271	R	61.4	Low	53.9	Low	179 Å²	179	109.3 Å²	109.3	68%	0.675	58%	0.575	S	S	*	*	H	α-helix	trans	-64.9	-36.6	172.8	-155.4	173.4	-152.8	171.5	5.8	111.4	S267 I268 Q274 I275	S267-R271 WeakPolarHBondContact O-CB 3.35Å; S267-R271 PolarHBondContact O-N 3.04Å; I268-R271 PolarHBondContact O-N 3.47Å; R271-Q274 PolarHBondContact O-N 3.43Å; R271-I275 HydrophobicContact CG-CD1 4.4Å; R271-I275 WeakPolarHBondContact O-CB 3.43Å; R271-I275 WeakPolarHBondContact O-CD1 3.4Å; R271-I275 WeakPolarHBondContact O-CG1 3.02Å; R271-I275 PolarHBondContact O-N 2.96Å
272	T	71.2	Confident	53.5	Low	48 Å²	48	107.8 Å²	107.8	29%	0.294	58%	0.575	S	S	.	*	H	α-helix	trans	-69.5	-36.9	173.7	-55.3	0	0	0	0	111.5	I268 R269 E270 R276	I268-T272 VanDerWaalsContact O-CB 3.24Å; I268-T272 WeakPolarHBondContact O-CB 3.48Å; I268-T272 PolarHBondContact O-N 2.94Å; I268-T272 PolarHBondContact O-OG1 2.77Å; R269-T272 CarbonylContact O-C 3.55Å; R269-T272 PolarHBondContact O-N 3.01Å; E270-T272 VanDerWaalsContact C-N 3.3Å; E270-T272 PolarHBondContact O-N 3.44Å; T272-R276 WeakPolarHBondContact O-CB 2.98Å; T272-R276 WeakPolarHBondContact O-CG 3.26Å; T272-R276 PolarHBondContact O-N 3.16Å
273	R	62.4	Low	52.5	Low	172 Å²	172	106.4 Å²	106.4	65%	0.649	57%	0.573	S	S	*	*	H	α-helix	trans	-66	-42.7	172.3	-82.8	-179	-177.1	-171.2	0	111.3	R269 E270 R276 A277	R269-R273 WeakPolarHBondContact O-CB 3.44Å; R269-R273 WeakPolarHBondContact O-CG 3.48Å; R269-R273 PolarHBondContact O-N 2.87Å; E270-R273 CarbonylContact O-C 3.58Å; E270-R273 WeakPolarHBondContact O-CB 3.33Å; E270-R273 PolarHBondContact O-N 3.37Å; R273-R276 PolarHBondContact O-N 3.1Å; R273-A277 VanDerWaalsContact O-CB 3.26Å; R273-A277 WeakPolarHBondContact O-CB 3.29Å; R273-A277 PolarHBondContact O-N 3.23Å
274	Q	65.6	Low	51.6	Low	109 Å²	109	108.7 Å²	108.7	51%	0.509	59%	0.592	S	S	.	*	H	α-helix	trans	-66	-41	176.2	-74.7	175	8.6	0	0	111.3	E270 R271 R276 A277 S278	E270-Q274 WeakPolarHBondContact O-CB 3.44Å; E270-Q274 WeakPolarHBondContact O-CG 3.19Å; E270-Q274 PolarHBondContact O-N 2.91Å; E270-Q274 PolarHBondContact OE1-NE2 3.04Å; R271-Q274 PolarHBondContact O-N 3.43Å; Q274-R276 PolarHBondContact O-N 3.47Å; Q274-A277 PolarHBondContact O-N 2.97Å; Q274-S278 VanDerWaalsContact O-CB 3.27Å; Q274-S278 WeakPolarHBondContact O-CB 3.16Å; Q274-S278 PolarHBondContact O-N 2.85Å; Q274-S278 PolarHBondContact O-OG 3.5Å
275	I	56.6	Low	50.6	Low	110 Å²	110	111.1 Å²	111.1	56%	0.564	60%	0.6	S	S	*	*	H	α-helix	trans	-63	-42.1	173.8	-69.6	164.2	0	0	0	110.7	R271 S278 S279	R271-I275 HydrophobicContact CG-CD1 4.4Å; R271-I275 WeakPolarHBondContact O-CB 3.43Å; R271-I275 WeakPolarHBondContact O-CD1 3.4Å; R271-I275 WeakPolarHBondContact O-CG1 3.02Å; R271-I275 PolarHBondContact O-N 2.96Å; I275-S278 PolarHBondContact O-N 3.05Å; I275-S279 VanDerWaalsContact O-CB 3.23Å; I275-S279 WeakPolarHBondContact O-CB 3.32Å; I275-S279 PolarHBondContact O-N 3.14Å
276	R	44.9	Very low	49.3	Very low	166 Å²	166	113 Å²	113	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-68.4	-43.1	175.8	-76.1	-178.9	-174.5	143.6	2.6	112.5	T272 R273 Q274 S278 S279 M280	T272-R276 WeakPolarHBondContact O-CB 2.98Å; T272-R276 WeakPolarHBondContact O-CG 3.26Å; T272-R276 PolarHBondContact O-N 3.16Å; R273-R276 PolarHBondContact O-N 3.1Å; Q274-R276 PolarHBondContact O-N 3.47Å; R276-S278 VanDerWaalsContact C-N 3.28Å; R276-S278 PolarHBondContact O-N 3.29Å; R276-S279 CarbonylContact O-C 3.58Å; R276-S279 PolarHBondContact O-N 3.43Å; R276-S279 VanDerWaalsContact O-N 3.09Å; R276-M280 VanDerWaalsContact O-CG 3.25Å; R276-M280 WeakPolarHBondContact O-CG 3.22Å; R276-M280 PolarHBondContact O-N 3.45Å
277	A	46.1	Very low	47.9	Very low	79 Å²	79	116 Å²	116	65%	0.653	63%	0.63	S	S	*	*	H	α-helix	trans	-64.3	-34.4	177.3	0	0	0	0	0	111.9	R273 Q274 S279	R273-A277 VanDerWaalsContact O-CB 3.26Å; R273-A277 WeakPolarHBondContact O-CB 3.29Å; R273-A277 PolarHBondContact O-N 3.23Å; Q274-A277 PolarHBondContact O-N 2.97Å; A277-S279 VanDerWaalsContact C-N 3.28Å; A277-S279 PolarHBondContact O-N 3.07Å
278	S	42.4	Very low	46.1	Very low	109 Å²	109	124 Å²	124	76%	0.762	65%	0.648	S	S	*	*	H	α-helix	trans	-75.6	-15.3	175.7	-49.4	0	0	0	0	113.4	Q274 I275 R276	Q274-S278 VanDerWaalsContact O-CB 3.27Å; Q274-S278 WeakPolarHBondContact O-CB 3.16Å; Q274-S278 PolarHBondContact O-N 2.85Å; Q274-S278 PolarHBondContact O-OG 3.5Å; I275-S278 PolarHBondContact O-N 3.05Å; R276-S278 VanDerWaalsContact C-N 3.28Å; R276-S278 PolarHBondContact O-N 3.29Å
279	S	38.9	Very low	44.1	Very low	90 Å²	90	126.8 Å²	126.8	63%	0.629	66%	0.664	S	S	*	*	H	α-helix	trans	-118.8	1	-172.7	-171.5	0	0	0	0	114.4	I275 R276 A277 V281	I275-S279 VanDerWaalsContact O-CB 3.23Å; I275-S279 WeakPolarHBondContact O-CB 3.32Å; I275-S279 PolarHBondContact O-N 3.14Å; R276-S279 CarbonylContact O-C 3.58Å; R276-S279 PolarHBondContact O-N 3.43Å; R276-S279 VanDerWaalsContact O-N 3.09Å; A277-S279 VanDerWaalsContact C-N 3.28Å; A277-S279 PolarHBondContact O-N 3.07Å; S279-V281 VanDerWaalsContact C-N 3.28Å; S279-V281 PolarHBondContact O-N 2.8Å
280	M	29.2	Very low	42.4	Very low	137 Å²	137	125 Å²	125	68%	0.675	67%	0.673	S	S	*	*			trans	-81.2	74.3	177.7	-81	-178.5	73.1	0	0	111.9	R276 V282	R276-M280 VanDerWaalsContact O-CG 3.25Å; R276-M280 WeakPolarHBondContact O-CG 3.22Å; R276-M280 PolarHBondContact O-N 3.45Å; M280-V282 HydrophobicContact CE-CG2 4.39Å; M280-V282 PolarHBondContact O-N 3.31Å
281	V	38.5	Very low	40.2	Very low	131 Å²	131	129.2 Å²	129.2	79%	0.794	70%	0.697	S	S	*	*			trans	-70.2	101.1	142.3	175.9	0	0	0	0	105.5	S279 P283	S279-V281 VanDerWaalsContact C-N 3.28Å; S279-V281 PolarHBondContact O-N 2.8Å; V281-P283 WeakPolarHBondContact O-CD 3.48Å; V281-P283 VanDerWaalsContact O-N 3.12Å
282	V	31.2	Very low	38.5	Very low	113 Å²	113	129.4 Å²	129.4	69%	0.685	71%	0.708	S	S	*	*			trans	-60.8	109	178.5	177.4	0	0	0	0	108.6	M280 A284	M280-V282 HydrophobicContact CE-CG2 4.39Å; M280-V282 PolarHBondContact O-N 3.31Å; V282-A284 PolarHBondContact O-N 3.32Å
283	P	28.8	Very low	36.2	Very low	97 Å²	97	130.4 Å²	130.4	63%	0.63	73%	0.728	S	S	*	*			trans	-75.5	124.8	170.3	-4	24.2	0	0	0	106.4	V281 I285	V281-P283 WeakPolarHBondContact O-CD 3.48Å; V281-P283 VanDerWaalsContact O-N 3.12Å; P283-I285 PolarHBondContact O-N 2.99Å
284	A	27.2	Very low	34.6	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	74%	0.737	S	S	*	*			trans	-62.7	82.4	173.5	0	0	0	0	0	110.2	V282 T286	V282-A284 PolarHBondContact O-N 3.32Å; A284-T286 PolarHBondContact O-N 2.88Å
285	I	30.6	Very low	32.7	Very low	145 Å²	145	132.4 Å²	132.4	74%	0.744	75%	0.753	S	S	*	*			trans	-87.4	100.1	165.6	-60.8	175.1	0	0	0	105.6	P283	P283-I285 PolarHBondContact O-N 2.99Å
286	T	28.5	Very low	31.8	Very low	112 Å²	112	132.2 Å²	132.2	69%	0.687	76%	0.76	S	S	*	*			trans	-44.2	129.8	164.2	41.4	0	0	0	0	110.2	A284 R288	A284-T286 PolarHBondContact O-N 2.88Å; T286-R288 PolarHBondContact O-N 3.5Å
287	P	29.5	Very low	30.8	Very low	121 Å²	121	134.3 Å²	134.3	79%	0.786	77%	0.773	S	S	*	*			trans	-67.3	106.5	-171.1	27.4	-32.8	0	0	0	109.8	L289	P287-L289 PolarHBondContact O-N 3.24Å
288	R	28.3	Very low	30.1	Very low	240 Å²	240	135.4 Å²	135.4	91%	0.906	78%	0.782	S	S	*	*			trans	-77.8	109.6	161.5	-77.8	-164	169.5	-177.5	-2.3	107.4	T286	T286-R288 PolarHBondContact O-N 3.5Å
289	L	29.2	Very low	29.3	Very low	151 Å²	151	137.5 Å²	137.5	79%	0.791	79%	0.79	S	S	*	*			trans	-54.4	146.1	176.2	-78.6	125.5	0	0	0	111.7	P287 L291	P287-L289 PolarHBondContact O-N 3.24Å; L289-L291 PolarHBondContact O-N 3Å
290	P	28.6	Very low	28.7	Very low	125 Å²	125	136.2 Å²	136.2	81%	0.812	79%	0.791	S	S	*	*			trans	-77.8	114.7	-175.3	0.6	17.7	0	0	0	110.2	M292	P290-M292 PolarHBondContact O-N 2.95Å
291	L	25.2	Very low	28.8	Very low	176 Å²	176	141.6 Å²	141.6	92%	0.921	80%	0.804	S	S	*	*			trans	-87.8	90.4	169.2	-85.3	155.1	0	0	0	108.8	L289	L289-L291 PolarHBondContact O-N 3Å
292	M	24.8	Very low	28.7	Very low	183 Å²	183	141.3 Å²	141.3	90%	0.901	81%	0.805	S	S	*	*			trans	-119.5	114.1	160.1	-87.7	-71	178.1	0	0	108.9	P290	P290-M292 PolarHBondContact O-N 2.95Å
293	G	24.9	Very low	28.9	Very low	69 Å²	69	142.5 Å²	142.5	71%	0.711	81%	0.812	S	S	*	*			trans	2.1	123.4	172.3	0	0	0	0	0	121.5
294	L	27.5	Very low	29.1	Very low	162 Å²	162	145 Å²	145	85%	0.848	82%	0.82	S	S	*	*			trans	-144.5	112.9	140.1	-75.8	179.3	0	0	0	109.9
295	L	26.3	Very low	29.4	Very low	161 Å²	161	150.5 Å²	150.5	84%	0.843	83%	0.825	S	S	*	*			trans	48.5	155.2	133.5	-73.4	164.9	0	0	0	121.8
296	P	37.2	Very low	29.7	Very low	107 Å²	107	147.6 Å²	147.6	70%	0.695	82%	0.822	S	S	*	*			trans	-92.3	149.8	-141.4	35	-35.3	0	0	0	115.7	A298	P296-A298 PolarHBondContact O-N 3.27Å
297	K	24.8	Very low	30.2	Very low	210 Å²	210	148.3 Å²	148.3	91%	0.913	82%	0.822	S	S	*	*			trans	2.6	102.1	150	-63.8	177.6	178.2	177	0	115.6
298	A	30.8	Very low	30.8	Very low	102 Å²	102	149.9 Å²	149.9	84%	0.843	82%	0.823	S	S	*	*			trans	-119.8	115.8	154.5	0	0	0	0	0	108.9	P296	P296-A298 PolarHBondContact O-N 3.27Å
299	V	26.5	Very low	31.3	Very low	152 Å²	152	147.9 Å²	147.9	92%	0.921	82%	0.821	S	S	*	*			trans	-67.4	138.7	176.6	171.5	0	0	0	0	109.6
300	G	25.6	Very low	32.1	Very low	64 Å²	64	144.3 Å²	144.3	66%	0.66	81%	0.809	S	S	*	*			trans	152	96.6	155.5	0	0	0	0	0	119
301	R	30	Very low	32.6	Very low	250 Å²	250	146 Å²	146	94%	0.943	80%	0.803	S	S	*	*			trans	82.2	138	143.8	-62.6	-173.2	-158.7	-138.4	2.5	121.3
302	P	37.2	Very low	33.4	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	79%	0.791	S	S	*	*			trans	-92.1	145.6	-174.1	38	-31.9	0	0	0	111.9
303	V	35.3	Very low	34.2	Very low	137 Å²	137	143.1 Å²	143.1	83%	0.83	78%	0.784	S	S	*	*			trans	-131.3	145.2	167.3	179.3	0	0	0	0	108.5
304	D	34.2	Very low	34.9	Very low	150 Å²	150	143.1 Å²	143.1	80%	0.802	78%	0.778	S	S	*	*			trans	-58.8	130.8	-151	-63.9	-65.7	0	0	0	117.5	A306	D304-A306 PolarHBondContact O-N 3.33Å; D304-A306 VanDerWaalsContact O-N 3.1Å
305	K	31.9	Very low	35.4	Very low	218 Å²	218	142.3 Å²	142.3	95%	0.948	77%	0.773	S	S	*	*			trans	-78.3	79.5	169.7	-70	179.3	177.3	174	0	110
306	A	37.3	Very low	35.9	Very low	84 Å²	84	143.7 Å²	143.7	69%	0.694	77%	0.773	S	S	*	*			trans	-126.3	-9.9	170.6	0	0	0	0	0	115.7	D304	D304-A306 PolarHBondContact O-N 3.33Å; D304-A306 VanDerWaalsContact O-N 3.1Å
307	D	40.1	Very low	35.8	Very low	128 Å²	128	145.8 Å²	145.8	68%	0.684	78%	0.777	S	S	*	*	S	Bend	trans	-121.1	15	-173.2	-102	-31.4	0	0	0	117	S310	D307-S310 PolarHBondContact O-OG 3.17Å
308	L	40.5	Very low	36.2	Very low	154 Å²	154	146.9 Å²	146.9	81%	0.806	78%	0.775	S	S	*	*	S	Bend	trans	-97.9	5.6	178.8	-129.4	76.6	0	0	0	115.6
309	K	40.2	Very low	36.1	Very low	197 Å²	197	148.1 Å²	148.1	86%	0.857	78%	0.776	S	S	*	*	S	Bend	trans	-98.5	-12.7	173.5	-86.4	-176.4	176.5	176	0	114.4
310	S	44.4	Very low	36.4	Very low	77 Å²	77	146.5 Å²	146.5	54%	0.538	77%	0.772	S	S	.	*	S	Bend	trans	-90.8	-23.7	-178.8	34.5	0	0	0	0	113.2	D307	D307-S310 PolarHBondContact O-OG 3.17Å
311	K	40.1	Very low	36.7	Very low	160 Å²	160	153 Å²	153	70%	0.696	78%	0.782	S	S	*	*	S	Bend	trans	-83.3	-23.4	178.5	-89	177.1	173	171.5	0	115.6	K313 A314	K311-K313 PolarHBondContact O-N 3.37Å; K311-A314 PolarHBondContact O-N 2.72Å
312	D	41.5	Very low	36.6	Very low	125 Å²	125	150.3 Å²	150.3	67%	0.668	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-19.7	179.5	-104.4	-7.1	0	0	0	114.1
313	K	41.7	Very low	36.3	Very low	173 Å²	173	153.1 Å²	153.1	75%	0.752	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-22.5	172.6	-77.9	-176.1	176.6	179.6	0	113.3	K311	K311-K313 PolarHBondContact O-N 3.37Å
314	A	40.2	Very low	36.1	Very low	70 Å²	70	151.5 Å²	151.5	58%	0.579	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-28.5	177.9	0	0	0	0	0	113	K311	K311-A314 PolarHBondContact O-N 2.72Å
315	L	37.2	Very low	35.9	Very low	144 Å²	144	153.7 Å²	153.7	75%	0.754	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-12.2	179.6	-107.5	136.7	0	0	0	114.4
316	K	37.4	Very low	36.1	Very low	191 Å²	191	149.9 Å²	149.9	83%	0.83	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-8.2	173.7	-100.4	178.1	177.1	174.5	0	115.3
317	L	34.3	Very low	36	Very low	150 Å²	150	155.5 Å²	155.5	79%	0.785	79%	0.786	S	S	*	*	S	Bend	trans	-109.5	3.5	-177.5	-85	158.1	0	0	0	115.6
318	R	33.1	Very low	36	Very low	233 Å²	233	158.2 Å²	158.2	88%	0.879	80%	0.795	S	S	*	*	S	Bend	trans	-106.9	8.7	179.1	-142	175.6	-169.1	178	3.4	116.8
319	C	30	Very low	36.3	Very low	128 Å²	128	161.4 Å²	161.4	87%	0.865	80%	0.797	S	S	*	*	S	Bend	trans	-109.4	12.4	174	-80.9	0	0	0	0	115.5
320	S	32.2	Very low	37.2	Very low	118 Å²	118	160.1 Å²	160.1	83%	0.825	79%	0.791	S	S	*	*	S	Bend	trans	-106.2	17.2	179.8	-98.2	0	0	0	0	116.3
321	K	31.7	Very low	38.7	Very low	200 Å²	200	160.2 Å²	160.2	87%	0.87	80%	0.796	S	S	*	*	S	Bend	trans	-137.9	82.4	174.2	-100.1	177.4	177.5	170.5	0	112.1
322	K	29.1	Very low	40.7	Very low	195 Å²	195	153.4 Å²	153.4	85%	0.848	77%	0.767	S	S	*	*	S	Bend	trans	174.4	134.7	136.4	-95.4	166	-177.1	-175.5	0	109.1
323	H	30.9	Very low	42.8	Very low	183 Å²	183	153.3 Å²	153.3	85%	0.847	76%	0.761	S	S	*	*			trans	90.8	51.6	-170.9	-50.8	-60.9	0	0	0	116.8	K325	H323-K325 PolarHBondContact O-N 3.23Å
324	A	31.1	Very low	44.8	Very low	104 Å²	104	146.7 Å²	146.7	86%	0.86	73%	0.731	S	S	*	*			trans	-63.5	84.3	141.9	0	0	0	0	0	107.8	T326	A324-T326 PolarHBondContact O-N 2.9Å; A324-T326 VanDerWaalsContact O-N 3.09Å
325	K	29.6	Very low	46.8	Very low	196 Å²	196	147.9 Å²	147.9	85%	0.852	73%	0.726	S	S	*	*			trans	-65.7	104.9	171.7	-161.9	172.1	-174.5	176.3	0	105.9	H323 K327	H323-K325 PolarHBondContact O-N 3.23Å; K325-K327 PolarHBondContact O-N 2.7Å
326	T	35.9	Very low	49	Very low	138 Å²	138	144 Å²	144	85%	0.847	72%	0.715	S	S	*	*			trans	-50.2	105.2	177	-10.1	0	0	0	0	107.8	A324 E328	A324-T326 PolarHBondContact O-N 2.9Å; A324-T326 VanDerWaalsContact O-N 3.09Å; T326-E328 PolarHBondContact O-N 3.09Å
327	K	35.4	Very low	50.9	Low	201 Å²	201	136.9 Å²	136.9	87%	0.874	69%	0.687	S	S	*	*			trans	-67.8	101.1	-178.3	-160.2	178	-174.9	-178.9	0	106.3	K325 R329	K325-K327 PolarHBondContact O-N 2.7Å; K327-R329 PolarHBondContact O-N 3.21Å
328	E	40.6	Very low	52.3	Low	186 Å²	186	137.7 Å²	137.7	87%	0.869	69%	0.691	S	S	*	*			trans	-49.3	122.8	175.8	-106.4	175.3	160.6	0	0	109.3	T326 K330	T326-E328 PolarHBondContact O-N 3.09Å; E328-K330 PolarHBondContact O-N 3.2Å; E328-K330 VanDerWaalsContact O-N 3.09Å
329	R	46.8	Very low	53.5	Low	221 Å²	221	133.6 Å²	133.6	83%	0.834	68%	0.681	S	S	*	*			trans	-70.8	102	-179.7	-64.8	177.4	178.2	-176.6	-1	107.6	K327 A331	K327-R329 PolarHBondContact O-N 3.21Å; R329-A331 PolarHBondContact O-N 3.08Å
330	K	58.5	Low	54.6	Low	170 Å²	170	137.7 Å²	137.7	74%	0.739	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.7	119.2	170.4	-87	-171.8	173.5	-171.6	0	109.5	E328 C378	E328-K330 PolarHBondContact O-N 3.2Å; E328-K330 VanDerWaalsContact O-N 3.09Å; K330-C378 PolarHBondContact O-N 3.09Å
331	A	75.4	Confident	55.5	Low	79 Å²	79	134.5 Å²	134.5	65%	0.653	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-70.9	160.7	173.5	0	0	0	0	0	111.1	R329	R329-A331 PolarHBondContact O-N 3.08Å
332	H	82.6	Confident	56.8	Low	17 Å²	17	133.7 Å²	133.7	8%	0.079	67%	0.666	C	S	.	*	P	Polyproline II helix	trans	-76.8	138.6	176.3	-69.3	-94.1	0	0	0	111.2	W334 C358 C361 Q376 C378	H332-W334 HydrophobicContact CB-CD2 4.31Å; H332-W334 HydrophobicContact CB-CZ2 3.71Å; H332-W334 AromaticContact CG-CZ2 3.87Å; H332-C358 HydrophobicContact CB-CB 4.37Å; H332-C358 PolarHBondContact ND1-SG 3.32Å; H332-C358 VanDerWaalsContact ND1-SG 3.35Å; H332-C361 VanDerWaalsContact CE1-SG 3.54Å; H332-C361 PolarHBondContact ND1-SG 3.46Å; H332-C361 VanDerWaalsContact ND1-SG 3.37Å; H332-Q376 PolarHBondContact CD2-O 2.89Å; H332-Q376 PolarHBondContact NE2-O 3.2Å; H332-C378 VanDerWaalsContact CE1-CA 3.45Å; H332-C378 WeakPolarHBondContact CE1-CA 3.5Å
333	F	84.8	Confident	58.4	Low	123 Å²	123	126.1 Å²	126.1	54%	0.539	64%	0.637	S	S	.	*			trans	-100.8	100.5	173.7	-172.8	-98.7	0	0	0	110.7	M335 C358 N359	F333-M335 HydrophobicContact CD1-CG 4.33Å; F333-M335 HydrophobicContact CE1-CG 4.07Å; F333-M335 HydrophobicContact CE1-SD 4.38Å; F333-C358 PolarHBondContact N-SG 2.9Å; F333-C358 CarbonylContact O-C 3.45Å; F333-C358 VanDerWaalsContact O-CA 3.31Å; F333-C358 WeakPolarHBondContact O-CA 3.17Å; F333-N359 HydrophobicContact CD1-CB 3.88Å; F333-N359 PolarHBondContact O-N 3.04Å
334	W	84.7	Confident	60.8	Low	33 Å²	33	121 Å²	121	13%	0.125	62%	0.619	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	129.7	-171.5	-60.8	102.2	0	0	0	113.2	H332 Y356 C358 I363 V365 K370 V373	H332-W334 HydrophobicContact CB-CD2 4.31Å; H332-W334 HydrophobicContact CB-CZ2 3.71Å; H332-W334 AromaticContact CG-CZ2 3.87Å; W334-Y356 HydrophobicContact CB-CD1 4.34Å; W334-Y356 HydrophobicContact CB-CG 4.41Å; W334-C358 HydrophobicContact CE3-CB 3.97Å; W334-C358 HydrophobicContact CH2-CB 4.29Å; W334-C358 HydrophobicContact CZ3-CB 3.83Å; W334-I363 HydrophobicContact CH2-CG2 3.63Å; W334-I363 HydrophobicContact CZ3-CG2 3.79Å; W334-V365 HydrophobicContact CE3-CG2 4.2Å; W334-V365 HydrophobicContact CH2-CG1 4.34Å; W334-V365 HydrophobicContact CH2-CG2 3.61Å; W334-V365 HydrophobicContact CZ2-CG2 4.45Å; W334-V365 HydrophobicContact CZ3-CG2 3.46Å; W334-V365 VanDerWaalsContact CZ3-CG2 3.46Å; W334-K370 HydrophobicContact CD2-CG 4.38Å; W334-K370 HydrophobicContact CG-CD 4.31Å; W334-K370 HydrophobicContact CZ2-CG 4.32Å; W334-V373 HydrophobicContact CH2-CB 4.23Å; W334-V373 HydrophobicContact CH2-CG1 3.92Å; W334-V373 HydrophobicContact CZ2-CB 4.24Å; W334-V373 HydrophobicContact CZ2-CG1 4.02Å
335	M	82.1	Confident	63.3	Low	95 Å²	95	116 Å²	116	47%	0.468	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	138.1	170.3	-61	-151.9	-57.5	0	0	110.9	F333 Y356 Q357	F333-M335 HydrophobicContact CD1-CG 4.33Å; F333-M335 HydrophobicContact CE1-CG 4.07Å; F333-M335 HydrophobicContact CE1-SD 4.38Å; M335-Y356 WeakPolarHBondContact O-CA 3.46Å; M335-Q357 PolarHBondContact N-O 3.07Å; M335-Q357 PolarHBondContact O-N 2.96Å
336	A	82.3	Confident	65.7	Low	64 Å²	64	111.8 Å²	111.8	53%	0.529	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.5	129.3	175.9	0	0	0	0	0	110	I338 Y356	A336-I338 PolarHBondContact O-N 3.17Å; A336-Y356 HydrophobicContact CB-CD1 4.18Å; A336-Y356 HydrophobicContact CB-CE1 3.81Å
337	V	77.3	Confident	68	Low	40 Å²	40	108.2 Å²	108.2	24%	0.242	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	107.7	175.8	-172.3	0	0	0	0	107.7	E339 C341 F355 Q357	V337-E339 WeakPolarHBondContact CG1-O 3.39Å; V337-C341 HydrophobicContact CG1-CB 4.25Å; V337-F355 HydrophobicContact CB-CB 4.13Å; V337-F355 HydrophobicContact CG2-CB 4.21Å; V337-F355 PolarHBondContact N-O 3.47Å; V337-Q357 HydrophobicContact CG2-CB 3.75Å
338	I	64.7	Low	70.3	Confident	168 Å²	168	101.3 Å²	101.3	86%	0.862	52%	0.516	S	S	*	.			trans	-81	-25.6	-173.7	-58.4	172.2	0	0	0	111.6	A336	A336-I338 PolarHBondContact O-N 3.17Å
339	E	57.4	Low	72.2	Confident	146 Å²	146	94.8 Å²	94.8	68%	0.682	50%	0.498	S	S	*	.	S	Bend	trans	-91.7	140.6	178	-71.8	-176.6	158.5	0	0	111.4	V337 C341	V337-E339 WeakPolarHBondContact CG1-O 3.39Å; E339-C341 PolarHBondContact O-N 3.27Å
340	K	54.3	Low	73.7	Confident	215 Å²	215	91 Å²	91	94%	0.935	49%	0.487	S	S	*	.			trans	-56.8	96	175.9	-74.1	-178.1	178.1	178.8	0	109.7
341	C	49.6	Very low	74.5	Confident	51 Å²	51	86.1 Å²	86.1	35%	0.345	47%	0.473	S	S	.	.			trans	-74.8	132.5	179.8	-148.7	0	0	0	0	108.9	V337 E339 S343	V337-C341 HydrophobicContact CG1-CB 4.25Å; E339-C341 PolarHBondContact O-N 3.27Å; C341-S343 WeakPolarHBondContact CB-OG 3.04Å; C341-S343 PolarHBondContact O-N 2.95Å; C341-S343 VanDerWaalsContact O-N 3.11Å; C341-S343 PolarHBondContact SG-OG 3.25Å
342	L	59.2	Low	74.3	Confident	183 Å²	183	89 Å²	89	96%	0.958	48%	0.478	S	S	*	.	S	Bend	trans	-71.3	8.2	169.2	-74	162.9	0	0	0	112.4
343	S	63.8	Low	74	Confident	35 Å²	35	90.6 Å²	90.6	25%	0.245	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-87.8	139.3	-179.4	60.5	0	0	0	0	111.3	C341 F355	C341-S343 WeakPolarHBondContact CB-OG 3.04Å; C341-S343 PolarHBondContact O-N 2.95Å; C341-S343 VanDerWaalsContact O-N 3.11Å; C341-S343 PolarHBondContact SG-OG 3.25Å; S343-F355 WeakPolarHBondContact O-CZ 3.07Å
344	T	80.6	Confident	73.7	Confident	75 Å²	75	91 Å²	91	46%	0.46	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-84.6	141.9	171.8	50.1	0	0	0	0	110	E346 G349 P351	T344-E346 PolarHBondContact O-N 3.21Å; T344-G349 WeakPolarHBondContact CB-O 3.28Å; T344-G349 WeakPolarHBondContact CG2-O 3.36Å; T344-P351 HydrophobicContact CG2-CB 4.02Å
345	C	83.1	Confident	73.8	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-59.8	125.1	173.9	170.2	0	0	0	0	110.8	V347 C348 G349 K350 F355 H366	C345-V347 PolarHBondContact O-N 2.9Å; C345-V347 VanDerWaalsContact O-N 3.11Å; C345-V347 PolarHBondContact SG-N 2.91Å; C345-C348 PolarHBondContact O-N 3.3Å; C345-G349 VanDerWaalsContact O-CA 3.23Å; C345-G349 WeakPolarHBondContact O-CA 3.43Å; C345-G349 PolarHBondContact O-N 2.84Å; C345-K350 PolarHBondContact N-O 3.42Å; C345-F355 HydrophobicContact CB-CE1 4.07Å; C345-H366 WeakPolarHBondContact CB-CE1 3.43Å; C345-H366 WeakPolarHBondContact CB-ND1 3.39Å; C345-H366 PolarHBondContact SG-N 3.25Å
346	E	80.9	Confident	74	Confident	107 Å²	107	88.9 Å²	88.9	50%	0.5	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.1	-178.1	-81.1	-172.6	-160.9	0	0	114.2	T344 I363 V364	T344-E346 PolarHBondContact O-N 3.21Å; E346-I363 HydrophobicContact CB-CD1 4.35Å; E346-I363 HydrophobicContact CB-CG1 4.27Å; E346-I363 HydrophobicContact CG-CG1 4.33Å; E346-I363 WeakPolarHBondContact OE2-CD1 3.43Å; E346-I363 VanDerWaalsContact OE2-CG1 3.29Å; E346-I363 WeakPolarHBondContact OE2-CG1 3.39Å; E346-V364 PolarHBondContact N-O 3.47Å
347	V	83.2	Confident	74.2	Confident	63 Å²	63	88.9 Å²	88.9	38%	0.382	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-41.2	-178.6	-177.9	0	0	0	0	112.1	C345 V365 C369 V373	C345-V347 PolarHBondContact O-N 2.9Å; C345-V347 VanDerWaalsContact O-N 3.11Å; C345-V347 PolarHBondContact SG-N 2.91Å; V347-V365 HydrophobicContact CG2-CG1 3.86Å; V347-C369 HydrophobicContact CB-CB 3.83Å; V347-C369 HydrophobicContact CG1-CB 4.13Å; V347-C369 HydrophobicContact CG2-CB 4.04Å; V347-V373 HydrophobicContact CG2-CG2 3.4Å
348	C	83.6	Confident	74.7	Confident	57 Å²	57	87 Å²	87	39%	0.385	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-5.1	-173.9	71.9	0	0	0	0	114.5	C345 K350 H366	C345-C348 PolarHBondContact O-N 3.3Å; C348-K350 PolarHBondContact O-N 2.91Å; C348-K350 VanDerWaalsContact O-N 3.12Å; C348-H366 PolarHBondContact SG-CE1 3.46Å; C348-H366 PolarHBondContact SG-ND1 2.98Å
349	G	82.1	Confident	75.5	Confident	48 Å²	48	83.8 Å²	83.8	50%	0.495	46%	0.457	S	S	.	.			trans	68.2	1.6	-179.6	0	0	0	0	0	115.3	T344 C345	T344-G349 WeakPolarHBondContact CB-O 3.28Å; T344-G349 WeakPolarHBondContact CG2-O 3.36Å; C345-G349 VanDerWaalsContact O-CA 3.23Å; C345-G349 WeakPolarHBondContact O-CA 3.43Å; C345-G349 PolarHBondContact O-N 2.84Å
350	K	78.2	Confident	76.6	Confident	141 Å²	141	81.6 Å²	81.6	61%	0.613	45%	0.45	S	S	*	.			trans	-88.1	142.6	-176.6	-61.8	-178.9	-177	-177.9	0	111	C345 C348 H366	C345-K350 PolarHBondContact N-O 3.42Å; C348-K350 PolarHBondContact O-N 2.91Å; C348-K350 VanDerWaalsContact O-N 3.12Å; K350-H366 PolarHBondContact O-CE1 3.04Å; K350-H366 PolarHBondContact O-NE2 2.86Å
351	P	74.7	Confident	77.9	Confident	68 Å²	68	71.8 Å²	71.8	44%	0.442	41%	0.408	S	S	.	.			trans	-91.1	-5.8	178.7	33.9	-35.1	0	0	0	114.6	T344 F355	T344-P351 HydrophobicContact CG2-CB 4.02Å; P351-F355 WeakPolarHBondContact O-CE2 3.45Å; P351-F355 VanDerWaalsContact O-CZ 3.25Å; P351-F355 WeakPolarHBondContact O-CZ 3.18Å
352	N	72	Confident	79.4	Confident	141 Å²	141	70.7 Å²	70.7	75%	0.754	40%	0.402	S	S	*	.			trans	-105.7	117.9	-171.3	-68.2	-12.9	0	0	0	111.8	H366	N352-H366 PolarHBondContact O-NE2 3.34Å
353	G	74.6	Confident	80.6	Confident	50 Å²	50	62 Å²	62	52%	0.515	36%	0.357	S	S	.	.	S	Bend	trans	151.4	-178.6	172.9	0	0	0	0	0	112.7	F355	G353-F355 WeakPolarHBondContact O-CD2 3.16Å; G353-F355 WeakPolarHBondContact O-CE2 3.42Å
354	D	79.9	Confident	81.7	Confident	131 Å²	131	61.1 Å²	61.1	70%	0.701	35%	0.35	S	S	*	.			trans	-78.6	134.3	169.9	-65.3	-37.6	0	0	0	109.8	H366 V367	D354-H366 CarbonylContact O-C 3.57Å; D354-H366 VanDerWaalsContact O-CA 3.28Å; D354-H366 WeakPolarHBondContact O-CA 3.48Å; D354-V367 HydrophobicContact CB-CG2 3.55Å; D354-V367 WeakPolarHBondContact O-CG2 3.5Å; D354-V367 PolarHBondContact O-N 3.28Å
355	F	85.4	Confident	82.2	Confident	14 Å²	14	57.6 Å²	57.6	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	143.1	-174.4	-66.5	-83.3	0	0	0	112.7	V337 S343 C345 P351 G353 V364 V365 H366	V337-F355 HydrophobicContact CB-CB 4.13Å; V337-F355 HydrophobicContact CG2-CB 4.21Å; V337-F355 PolarHBondContact N-O 3.47Å; S343-F355 WeakPolarHBondContact O-CZ 3.07Å; C345-F355 HydrophobicContact CB-CE1 4.07Å; P351-F355 WeakPolarHBondContact O-CE2 3.45Å; P351-F355 VanDerWaalsContact O-CZ 3.25Å; P351-F355 WeakPolarHBondContact O-CZ 3.18Å; G353-F355 WeakPolarHBondContact O-CD2 3.16Å; G353-F355 WeakPolarHBondContact O-CE2 3.42Å; F355-V364 HydrophobicContact CB-CG1 4Å; F355-V364 HydrophobicContact CD1-CG1 3.66Å; F355-V364 HydrophobicContact CE1-CG1 4.44Å; F355-V364 HydrophobicContact CG-CG1 4.1Å; F355-V365 CarbonylContact C-O 3.58Å; F355-V365 WeakPolarHBondContact CA-O 3.28Å; F355-H366 AromaticContact CD1-CD2 3.69Å; F355-H366 AromaticContact CE1-CD2 3.35Å; F355-H366 WeakPolarHBondContact CE1-CD2 3.48Å; F355-H366 AromaticContact CE1-NE2 3.25Å; F355-H366 VanDerWaalsContact CE1-NE2 3.25Å; F355-H366 WeakPolarHBondContact CE1-NE2 3.4Å; F355-H366 AromaticContact CZ-CD2 3.71Å; F355-H366 AromaticContact CZ-NE2 3.33Å; F355-H366 VanDerWaalsContact CZ-NE2 3.33Å; F355-H366 WeakPolarHBondContact CZ-NE2 3.29Å
356	Y	88.2	Confident	82.5	Confident	69 Å²	69	58.4 Å²	58.4	27%	0.271	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137	162.9	-75.9	-58.2	0	0	0	109.8	W334 M335 A336 V364 V365 V367 K370	W334-Y356 HydrophobicContact CB-CD1 4.34Å; W334-Y356 HydrophobicContact CB-CG 4.41Å; M335-Y356 WeakPolarHBondContact O-CA 3.46Å; A336-Y356 HydrophobicContact CB-CD1 4.18Å; A336-Y356 HydrophobicContact CB-CE1 3.81Å; Y356-V364 WeakPolarHBondContact O-CA 3.43Å; Y356-V365 PolarHBondContact N-O 3.4Å; Y356-V365 PolarHBondContact O-N 2.9Å; Y356-V367 HydrophobicContact CD2-CB 4.27Å; Y356-V367 HydrophobicContact CD2-CG2 3.85Å; Y356-V367 HydrophobicContact CE2-CB 4.01Å; Y356-V367 HydrophobicContact CE2-CG1 3.95Å; Y356-V367 HydrophobicContact CE2-CG2 3.53Å; Y356-K370 HydrophobicContact CD2-CD 4.15Å; Y356-K370 HydrophobicContact CE2-CD 4.4Å
357	Q	86.5	Confident	82.6	Confident	64 Å²	64	56.6 Å²	56.6	30%	0.299	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	131.9	170.7	-173.5	172.6	23.3	0	0	110	M335 V337 A362 I363 V364	M335-Q357 PolarHBondContact N-O 3.07Å; M335-Q357 PolarHBondContact O-N 2.96Å; V337-Q357 HydrophobicContact CG2-CB 3.75Å; Q357-A362 PolarHBondContact NE2-O 3.31Å; Q357-A362 VanDerWaalsContact NE2-O 3.13Å; Q357-I363 CarbonylContact C-O 3.55Å; Q357-I363 VanDerWaalsContact CA-O 3.28Å; Q357-I363 WeakPolarHBondContact CA-O 3.3Å; Q357-V364 HydrophobicContact CB-CG2 4.17Å; Q357-V364 HydrophobicContact CG-CG2 3.87Å
358	C	86.6	Confident	82.6	Confident	0 Å²	0	58 Å²	58	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	126.1	171.4	-176.7	0	0	0	0	109.6	H332 F333 W334 D360 C361 A362 I363	H332-C358 HydrophobicContact CB-CB 4.37Å; H332-C358 PolarHBondContact ND1-SG 3.32Å; H332-C358 VanDerWaalsContact ND1-SG 3.35Å; F333-C358 PolarHBondContact N-SG 2.9Å; F333-C358 CarbonylContact O-C 3.45Å; F333-C358 VanDerWaalsContact O-CA 3.31Å; F333-C358 WeakPolarHBondContact O-CA 3.17Å; W334-C358 HydrophobicContact CE3-CB 3.97Å; W334-C358 HydrophobicContact CH2-CB 4.29Å; W334-C358 HydrophobicContact CZ3-CB 3.83Å; C358-D360 VanDerWaalsContact C-N 3.26Å; C358-D360 PolarHBondContact O-N 3.17Å; C358-C361 VanDerWaalsContact SG-SG 3.63Å; C358-A362 WeakPolarHBondContact O-CA 3.4Å; C358-A362 PolarHBondContact O-N 2.71Å; C358-I363 HydrophobicContact CB-CG2 3.71Å; C358-I363 PolarHBondContact N-O 3.43Å
359	N	82	Confident	82.8	Confident	102 Å²	102	56.2 Å²	56.2	55%	0.545	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-26.8	-178	-163.7	54.9	0	0	0	113.1	F333	F333-N359 HydrophobicContact CD1-CB 3.88Å; F333-N359 PolarHBondContact O-N 3.04Å
360	D	79.3	Confident	83	Confident	100 Å²	100	56.8 Å²	56.8	54%	0.535	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-37.4	-173.3	-71	-32	0	0	0	113.4	C358 C378	C358-D360 VanDerWaalsContact C-N 3.26Å; C358-D360 PolarHBondContact O-N 3.17Å; D360-C378 WeakPolarHBondContact CB-SG 3.14Å
361	C	81.8	Confident	83.1	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.054	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	4.6	178.5	64.8	0	0	0	0	114.3	H332 C358 I363 C378	H332-C361 VanDerWaalsContact CE1-SG 3.54Å; H332-C361 PolarHBondContact ND1-SG 3.46Å; H332-C361 VanDerWaalsContact ND1-SG 3.37Å; C358-C361 VanDerWaalsContact SG-SG 3.63Å; C361-I363 PolarHBondContact O-N 2.91Å; C361-I363 VanDerWaalsContact SG-CG2 3.51Å; C361-C378 WeakPolarHBondContact CB-O 3.37Å; C361-C378 VanDerWaalsContact CB-SG 3.58Å
362	A	82.1	Confident	83.3	Confident	28 Å²	28	53.2 Å²	53.2	23%	0.231	32%	0.321	C	S	.	.			trans	59.6	5.1	178.3	0	0	0	0	0	116.5	Q357 C358 V364 P387	Q357-A362 PolarHBondContact NE2-O 3.31Å; Q357-A362 VanDerWaalsContact NE2-O 3.13Å; C358-A362 WeakPolarHBondContact O-CA 3.4Å; C358-A362 PolarHBondContact O-N 2.71Å; A362-V364 PolarHBondContact O-N 2.86Å; A362-P387 HydrophobicContact CB-CG 4.29Å
363	I	84.7	Confident	83.8	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	29%	0.286	C	S	.	.			trans	-60.9	133.8	179	-167.3	175.9	0	0	0	111.5	W334 E346 Q357 C358 C361 V365 V373 Y381	W334-I363 HydrophobicContact CH2-CG2 3.63Å; W334-I363 HydrophobicContact CZ3-CG2 3.79Å; E346-I363 HydrophobicContact CB-CD1 4.35Å; E346-I363 HydrophobicContact CB-CG1 4.27Å; E346-I363 HydrophobicContact CG-CG1 4.33Å; E346-I363 WeakPolarHBondContact OE2-CD1 3.43Å; E346-I363 VanDerWaalsContact OE2-CG1 3.29Å; E346-I363 WeakPolarHBondContact OE2-CG1 3.39Å; Q357-I363 CarbonylContact C-O 3.55Å; Q357-I363 VanDerWaalsContact CA-O 3.28Å; Q357-I363 WeakPolarHBondContact CA-O 3.3Å; C358-I363 HydrophobicContact CB-CG2 3.71Å; C358-I363 PolarHBondContact N-O 3.43Å; C361-I363 PolarHBondContact O-N 2.91Å; C361-I363 VanDerWaalsContact SG-CG2 3.51Å; I363-V365 HydrophobicContact CD1-CG1 4.14Å; I363-V365 HydrophobicContact CG1-CG1 4.11Å; I363-V373 HydrophobicContact CD1-CG1 3.94Å; I363-V373 HydrophobicContact CD1-CG2 4.09Å; I363-V373 HydrophobicContact CG2-CG1 4.42Å; I363-Y381 HydrophobicContact CD1-CD1 3.54Å; I363-Y381 HydrophobicContact CD1-CD2 4.34Å; I363-Y381 HydrophobicContact CD1-CE1 3.39Å; I363-Y381 HydrophobicContact CD1-CE2 4.24Å; I363-Y381 HydrophobicContact CD1-CG 4.02Å; I363-Y381 HydrophobicContact CG1-CD1 4.32Å
364	V	86.9	Confident	84	Confident	16 Å²	16	49.2 Å²	49.2	10%	0.097	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.2	178.5	-175.2	0	0	0	0	110.4	E346 F355 Y356 Q357 A362	E346-V364 PolarHBondContact N-O 3.47Å; F355-V364 HydrophobicContact CB-CG1 4Å; F355-V364 HydrophobicContact CD1-CG1 3.66Å; F355-V364 HydrophobicContact CE1-CG1 4.44Å; F355-V364 HydrophobicContact CG-CG1 4.1Å; Y356-V364 WeakPolarHBondContact O-CA 3.43Å; Q357-V364 HydrophobicContact CB-CG2 4.17Å; Q357-V364 HydrophobicContact CG-CG2 3.87Å; A362-V364 PolarHBondContact O-N 2.86Å
365	V	89.6	Confident	83.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.5	-178.5	-59.7	0	0	0	0	111.7	W334 V347 F355 Y356 I363 C369 K370 V373	W334-V365 HydrophobicContact CE3-CG2 4.2Å; W334-V365 HydrophobicContact CH2-CG1 4.34Å; W334-V365 HydrophobicContact CH2-CG2 3.61Å; W334-V365 HydrophobicContact CZ2-CG2 4.45Å; W334-V365 HydrophobicContact CZ3-CG2 3.46Å; W334-V365 VanDerWaalsContact CZ3-CG2 3.46Å; V347-V365 HydrophobicContact CG2-CG1 3.86Å; F355-V365 CarbonylContact C-O 3.58Å; F355-V365 WeakPolarHBondContact CA-O 3.28Å; Y356-V365 PolarHBondContact N-O 3.4Å; Y356-V365 PolarHBondContact O-N 2.9Å; I363-V365 HydrophobicContact CD1-CG1 4.14Å; I363-V365 HydrophobicContact CG1-CG1 4.11Å; V365-C369 HydrophobicContact CB-CB 4.29Å; V365-K370 HydrophobicContact CG2-CB 4.32Å; V365-V373 HydrophobicContact CG1-CG2 3.77Å
366	H	90.1	Very high	83.1	Confident	17 Å²	17	55.4 Å²	55.4	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	153.3	168.9	-65.7	125.5	0	0	0	111.4	C345 C348 K350 N352 D354 F355 A368 C369 K370	C345-H366 WeakPolarHBondContact CB-CE1 3.43Å; C345-H366 WeakPolarHBondContact CB-ND1 3.39Å; C345-H366 PolarHBondContact SG-N 3.25Å; C348-H366 PolarHBondContact SG-CE1 3.46Å; C348-H366 PolarHBondContact SG-ND1 2.98Å; K350-H366 PolarHBondContact O-CE1 3.04Å; K350-H366 PolarHBondContact O-NE2 2.86Å; N352-H366 PolarHBondContact O-NE2 3.34Å; D354-H366 CarbonylContact O-C 3.57Å; D354-H366 VanDerWaalsContact O-CA 3.28Å; D354-H366 WeakPolarHBondContact O-CA 3.48Å; F355-H366 AromaticContact CD1-CD2 3.69Å; F355-H366 AromaticContact CE1-CD2 3.35Å; F355-H366 WeakPolarHBondContact CE1-CD2 3.48Å; F355-H366 AromaticContact CE1-NE2 3.25Å; F355-H366 VanDerWaalsContact CE1-NE2 3.25Å; F355-H366 WeakPolarHBondContact CE1-NE2 3.4Å; F355-H366 AromaticContact CZ-CD2 3.71Å; F355-H366 AromaticContact CZ-NE2 3.33Å; F355-H366 VanDerWaalsContact CZ-NE2 3.33Å; F355-H366 WeakPolarHBondContact CZ-NE2 3.29Å; H366-A368 PolarHBondContact O-N 3.48Å; H366-A368 VanDerWaalsContact O-N 3.16Å; H366-C369 HydrophobicContact CB-CB 4.14Å; H366-C369 WeakPolarHBondContact O-CA 3.13Å; H366-C369 PolarHBondContact O-N 3.35Å; H366-K370 PolarHBondContact O-N 2.89Å
367	V	84	Confident	82.5	Confident	69 Å²	69	55.3 Å²	55.3	42%	0.418	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-44.2	170.2	174.5	0	0	0	0	111.6	D354 Y356 K370	D354-V367 HydrophobicContact CB-CG2 3.55Å; D354-V367 WeakPolarHBondContact O-CG2 3.5Å; D354-V367 PolarHBondContact O-N 3.28Å; Y356-V367 HydrophobicContact CD2-CB 4.27Å; Y356-V367 HydrophobicContact CD2-CG2 3.85Å; Y356-V367 HydrophobicContact CE2-CB 4.01Å; Y356-V367 HydrophobicContact CE2-CG1 3.95Å; Y356-V367 HydrophobicContact CE2-CG2 3.53Å; V367-K370 WeakPolarHBondContact O-CB 3.39Å
368	A	83.1	Confident	81.9	Confident	93 Å²	93	52.6 Å²	52.6	77%	0.769	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-26.6	178.4	0	0	0	0	0	114.1	H366	H366-A368 PolarHBondContact O-N 3.48Å; H366-A368 VanDerWaalsContact O-N 3.16Å
369	C	87.3	Confident	80.8	Confident	19 Å²	19	56.7 Å²	56.7	13%	0.128	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-15	-178.5	-67.3	0	0	0	0	113.3	V347 V365 H366 A371 S372	V347-C369 HydrophobicContact CB-CB 3.83Å; V347-C369 HydrophobicContact CG1-CB 4.13Å; V347-C369 HydrophobicContact CG2-CB 4.04Å; V365-C369 HydrophobicContact CB-CB 4.29Å; H366-C369 HydrophobicContact CB-CB 4.14Å; H366-C369 WeakPolarHBondContact O-CA 3.13Å; H366-C369 PolarHBondContact O-N 3.35Å; C369-A371 VanDerWaalsContact C-N 3.28Å; C369-A371 PolarHBondContact O-N 3.33Å; C369-S372 WeakPolarHBondContact O-CB 3.49Å; C369-S372 PolarHBondContact O-N 3.23Å
370	K	85.1	Confident	80	Confident	60 Å²	60	54.7 Å²	54.7	26%	0.261	33%	0.331	S	S	.	.	H	α-helix	trans	-47.7	-46.4	-179.6	178.6	-175.3	163.7	179.6	0	113.3	W334 Y356 V365 H366 V367 S372 V373 E374	W334-K370 HydrophobicContact CD2-CG 4.38Å; W334-K370 HydrophobicContact CG-CD 4.31Å; W334-K370 HydrophobicContact CZ2-CG 4.32Å; Y356-K370 HydrophobicContact CD2-CD 4.15Å; Y356-K370 HydrophobicContact CE2-CD 4.4Å; V365-K370 HydrophobicContact CG2-CB 4.32Å; H366-K370 PolarHBondContact O-N 2.89Å; V367-K370 WeakPolarHBondContact O-CB 3.39Å; K370-S372 PolarHBondContact O-N 3.17Å; K370-S372 VanDerWaalsContact O-N 3.14Å; K370-V373 PolarHBondContact O-N 3.25Å; K370-V373 VanDerWaalsContact O-N 3.09Å; K370-E374 VanDerWaalsContact CE-OE1 3.26Å; K370-E374 WeakPolarHBondContact CE-OE1 3.39Å; K370-E374 IonicContact NZ-OE1 3.81Å; K370-E374 PolarHBondContact O-N 2.89Å; K370-E374 VanDerWaalsContact O-N 3.1Å
371	A	80.4	Confident	79	Confident	64 Å²	64	52.6 Å²	52.6	53%	0.529	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-23.4	-176.8	0	0	0	0	0	113.8	C369	C369-A371 VanDerWaalsContact C-N 3.28Å; C369-A371 PolarHBondContact O-N 3.33Å
372	S	80.3	Confident	77.5	Confident	70 Å²	70	55.7 Å²	55.7	49%	0.49	34%	0.342	S	S	.	.	H	α-helix	trans	-76	-35.2	176.8	-63.7	0	0	0	0	112.1	C369 K370	C369-S372 WeakPolarHBondContact O-CB 3.49Å; C369-S372 PolarHBondContact O-N 3.23Å; K370-S372 PolarHBondContact O-N 3.17Å; K370-S372 VanDerWaalsContact O-N 3.14Å
373	V	81.1	Confident	75.5	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-82.6	-30	-179.6	178.3	0	0	0	0	112.4	W334 V347 I363 V365 K370 K375 Q376 Y381	W334-V373 HydrophobicContact CH2-CB 4.23Å; W334-V373 HydrophobicContact CH2-CG1 3.92Å; W334-V373 HydrophobicContact CZ2-CB 4.24Å; W334-V373 HydrophobicContact CZ2-CG1 4.02Å; V347-V373 HydrophobicContact CG2-CG2 3.4Å; I363-V373 HydrophobicContact CD1-CG1 3.94Å; I363-V373 HydrophobicContact CD1-CG2 4.09Å; I363-V373 HydrophobicContact CG2-CG1 4.42Å; V365-V373 HydrophobicContact CG1-CG2 3.77Å; K370-V373 PolarHBondContact O-N 3.25Å; K370-V373 VanDerWaalsContact O-N 3.09Å; V373-K375 PolarHBondContact O-N 3.38Å; V373-Q376 PolarHBondContact O-N 2.94Å; V373-Y381 HydrophobicContact CG1-CE2 4.14Å
374	E	79.1	Confident	73.2	Confident	105 Å²	105	67 Å²	67	49%	0.491	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.7	-179.5	-148.6	158.2	-138.9	0	0	113.1	K370 Q376	K370-E374 VanDerWaalsContact CE-OE1 3.26Å; K370-E374 WeakPolarHBondContact CE-OE1 3.39Å; K370-E374 IonicContact NZ-OE1 3.81Å; K370-E374 PolarHBondContact O-N 2.89Å; K370-E374 VanDerWaalsContact O-N 3.1Å; E374-Q376 VanDerWaalsContact C-N 3.28Å; E374-Q376 PolarHBondContact O-N 2.85Å
375	K	75.2	Confident	70.6	Confident	181 Å²	181	71.7 Å²	71.7	79%	0.787	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-17.4	172.4	-64.2	-177.9	-177.8	179.1	0	113.6	V373	V373-K375 PolarHBondContact O-N 3.38Å
376	Q	71.8	Confident	67.7	Low	93 Å²	93	81.3 Å²	81.3	44%	0.435	47%	0.469	S	S	.	.	S	Bend	trans	-110.5	140.2	-178	-66.7	-172.3	-12.6	0	0	111.7	H332 V373 E374 Y381	H332-Q376 PolarHBondContact CD2-O 2.89Å; H332-Q376 PolarHBondContact NE2-O 3.2Å; V373-Q376 PolarHBondContact O-N 2.94Å; E374-Q376 VanDerWaalsContact C-N 3.28Å; E374-Q376 PolarHBondContact O-N 2.85Å; Q376-Y381 HydrophobicContact CB-CE2 4.28Å; Q376-Y381 PolarHBondContact OE1-OH 3.44Å
377	P	75.8	Confident	64.8	Low	67 Å²	67	84.1 Å²	84.1	44%	0.435	49%	0.489	S	S	.	.			trans	-68.3	142.5	-176.9	27.8	-33.6	0	0	0	112	A379 S380	P377-A379 PolarHBondContact O-N 2.97Å; P377-S380 PolarHBondContact O-N 3.27Å; P377-S380 PolarHBondContact O-OG 2.86Å
378	C	74.1	Confident	62.4	Low	8 Å²	8	86.9 Å²	86.9	5%	0.054	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-54.5	-30.6	-176.8	-172.2	0	0	0	0	114.3	K330 H332 D360 C361 S380 Y381	K330-C378 PolarHBondContact O-N 3.09Å; H332-C378 VanDerWaalsContact CE1-CA 3.45Å; H332-C378 WeakPolarHBondContact CE1-CA 3.5Å; D360-C378 WeakPolarHBondContact CB-SG 3.14Å; C361-C378 WeakPolarHBondContact CB-O 3.37Å; C361-C378 VanDerWaalsContact CB-SG 3.58Å; C378-S380 PolarHBondContact O-N 3.18Å; C378-Y381 PolarHBondContact O-N 2.88Å
379	A	62.8	Low	60	Low	85 Å²	85	87.5 Å²	87.5	70%	0.702	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-64	-20.8	179.9	0	0	0	0	0	114.4	P377 Y381	P377-A379 PolarHBondContact O-N 2.97Å; A379-Y381 VanDerWaalsContact C-N 3.27Å; A379-Y381 PolarHBondContact O-N 3.09Å
380	S	65.3	Low	57.1	Low	60 Å²	60	95.3 Å²	95.3	42%	0.42	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-70.6	-22.4	-177.9	59.4	0	0	0	0	113.6	P377 C378	P377-S380 PolarHBondContact O-N 3.27Å; P377-S380 PolarHBondContact O-OG 2.86Å; C378-S380 PolarHBondContact O-N 3.18Å
381	Y	59.5	Low	54.4	Low	57 Å²	57	99.9 Å²	99.9	22%	0.224	56%	0.561	C	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	-18.4	-174.6	-70.6	-86	0	0	0	113.9	I363 V373 Q376 C378 A379 S383 K384	I363-Y381 HydrophobicContact CD1-CD1 3.54Å; I363-Y381 HydrophobicContact CD1-CD2 4.34Å; I363-Y381 HydrophobicContact CD1-CE1 3.39Å; I363-Y381 HydrophobicContact CD1-CE2 4.24Å; I363-Y381 HydrophobicContact CD1-CG 4.02Å; I363-Y381 HydrophobicContact CG1-CD1 4.32Å; V373-Y381 HydrophobicContact CG1-CE2 4.14Å; Q376-Y381 HydrophobicContact CB-CE2 4.28Å; Q376-Y381 PolarHBondContact OE1-OH 3.44Å; C378-Y381 PolarHBondContact O-N 2.88Å; A379-Y381 VanDerWaalsContact C-N 3.27Å; A379-Y381 PolarHBondContact O-N 3.09Å; Y381-S383 PolarHBondContact O-N 3.26Å; Y381-K384 PolarHBondContact O-N 3.41Å
382	A	49	Very low	51.8	Low	72 Å²	72	102 Å²	102	60%	0.595	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-11.3	-173.3	0	0	0	0	0	115.6
383	S	41	Very low	49.2	Very low	104 Å²	104	103.4 Å²	103.4	73%	0.727	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-3.2	-178.6	51.4	0	0	0	0	114.5	Y381	Y381-S383 PolarHBondContact O-N 3.26Å
384	K	35.8	Very low	46.6	Very low	165 Å²	165	109.9 Å²	109.9	72%	0.717	62%	0.615	S	S	*	*	S	Bend	trans	-127.8	108.2	178.9	-67.2	-176.2	179.3	-178.1	0	109.8	Y381	Y381-K384 PolarHBondContact O-N 3.41Å
385	T	32.6	Very low	43.9	Very low	113 Å²	113	111.3 Å²	111.3	69%	0.693	63%	0.631	S	S	*	*			trans	80	101.6	169.7	74.8	0	0	0	0	116.9
386	K	27.9	Very low	41.5	Very low	203 Å²	203	110.2 Å²	110.2	88%	0.883	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-86.4	118.9	159.4	-81.8	-179.1	175.6	178.4	0	108.5
387	P	30.2	Very low	39.2	Very low	76 Å²	76	111.5 Å²	111.5	49%	0.494	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-83.4	157.3	167.6	33.3	-29.9	0	0	0	110.7	A362 S389	A362-P387 HydrophobicContact CB-CG 4.29Å; P387-S389 PolarHBondContact O-N 2.92Å
388	P	32.5	Very low	36.7	Very low	126 Å²	126	114.4 Å²	114.4	82%	0.818	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-77	122.7	-171.6	26	-21.3	0	0	0	110.5	K390	P388-K390 PolarHBondContact O-N 3.48Å
389	S	33.7	Very low	34.4	Very low	106 Å²	106	124 Å²	124	74%	0.741	69%	0.694	S	S	*	*			trans	-66.3	111.5	179	44.6	0	0	0	0	111.1	P387 H391	P387-S389 PolarHBondContact O-N 2.92Å; S389-H391 PolarHBondContact O-N 3.17Å
390	K	26.3	Very low	32.9	Very low	183 Å²	183	124.5 Å²	124.5	80%	0.796	69%	0.69	S	S	*	*			trans	-64.9	126.9	166.4	-70.8	-179.6	178.2	179.1	0	109.5	P388 S392	P388-K390 PolarHBondContact O-N 3.48Å; K390-S392 PolarHBondContact O-N 3.07Å
391	H	28	Very low	31.2	Very low	157 Å²	157	128.4 Å²	128.4	73%	0.727	71%	0.705	S	S	*	*			trans	-60.6	112.5	-176.8	-64.9	-92.1	0	0	0	112.1	S389 H600	S389-H391 PolarHBondContact O-N 3.17Å; H391-H600 AromaticContact CE1-CE1 3.84Å; H391-H600 AromaticContact ND1-CE1 3.92Å
392	S	25.4	Very low	29.9	Very low	107 Å²	107	128.6 Å²	128.6	75%	0.748	72%	0.715	S	S	*	*			trans	-105.2	117.4	164	174.6	0	0	0	0	109.1	K390 L394	K390-S392 PolarHBondContact O-N 3.07Å; S392-L394 PolarHBondContact O-N 3.4Å
393	S	25.2	Very low	29.3	Very low	100 Å²	100	128.1 Å²	128.1	70%	0.699	70%	0.702	S	S	*	*			trans	-33.1	113.1	175.5	53.5	0	0	0	0	115.6
394	L	26.5	Very low	29	Very low	139 Å²	139	128.9 Å²	128.9	73%	0.728	70%	0.702	S	S	*	*			trans	-109.8	100.6	155.4	-68.5	179	0	0	0	108	S392 F396	S392-L394 PolarHBondContact O-N 3.4Å; L394-F396 HydrophobicContact CB-CE2 4.09Å; L394-F396 HydrophobicContact CB-CZ 4.23Å; L394-F396 WeakPolarHBondContact O-CD2 3.45Å; L394-F396 PolarHBondContact O-N 3.47Å
395	V	24.1	Very low	28.7	Very low	135 Å²	135	125.1 Å²	125.1	82%	0.818	70%	0.697	S	S	*	*			trans	-73.9	105.1	172.7	178.8	0	0	0	0	107.6
396	F	23.5	Very low	28.5	Very low	159 Å²	159	129.1 Å²	129.1	70%	0.697	70%	0.699	S	S	*	*			trans	-81.9	124.7	173.3	-68.1	-78.4	0	0	0	110.1	L394 T398	L394-F396 HydrophobicContact CB-CE2 4.09Å; L394-F396 HydrophobicContact CB-CZ 4.23Å; L394-F396 WeakPolarHBondContact O-CD2 3.45Å; L394-F396 PolarHBondContact O-N 3.47Å; F396-T398 PolarHBondContact O-N 3.42Å
397	P	24.2	Very low	28.8	Very low	120 Å²	120	124.5 Å²	124.5	78%	0.779	68%	0.679	S	S	*	*			trans	-71	128.5	177.8	26.2	-29.9	0	0	0	110.9	R399	P397-R399 PolarHBondContact O-N 2.91Å
398	T	23.5	Very low	28.8	Very low	127 Å²	127	126.6 Å²	126.6	78%	0.779	70%	0.696	S	S	*	*			trans	-67.3	114.2	-180	46.9	0	0	0	0	111.6	F396	F396-T398 PolarHBondContact O-N 3.42Å
399	R	25.1	Very low	28.6	Very low	211 Å²	211	126.1 Å²	126.1	80%	0.796	70%	0.695	S	S	*	*			trans	-134.6	130.9	156	-105.7	-177	176.1	168.8	0.5	108.8	P397 L401	P397-R399 PolarHBondContact O-N 2.91Å; R399-L401 PolarHBondContact O-N 3.14Å
400	P	32.5	Very low	28.3	Very low	95 Å²	95	126.2 Å²	126.2	62%	0.617	69%	0.687	S	S	*	*			trans	-80.3	109.8	-178.5	31	-29.1	0	0	0	108.6
401	L	28.5	Very low	28.3	Very low	141 Å²	141	128.6 Å²	128.6	74%	0.738	69%	0.691	S	S	*	*			trans	-145.1	138.3	175.1	-69.7	177.9	0	0	0	111.1	R399	R399-L401 PolarHBondContact O-N 3.14Å
402	S	32.1	Very low	28.5	Very low	61 Å²	61	126.1 Å²	126.1	43%	0.427	69%	0.692	S	S	.	*			trans	-55.6	152.4	-166.3	63.6	0	0	0	0	116.3	V404 S405 D676	S402-V404 PolarHBondContact O-N 3.43Å; S402-V404 VanDerWaalsContact O-N 3.09Å; S402-S405 PolarHBondContact O-N 2.8Å; S402-S405 PolarHBondContact O-OG 3.23Å; S402-D676 WeakPolarHBondContact CB-OD2 3.46Å
403	I	37.6	Very low	28.7	Very low	62 Å²	62	128.6 Å²	128.6	32%	0.318	69%	0.691	S	S	.	*	G	3₁₀ helix	trans	-53.4	-32.7	-174.4	-79.7	168.8	0	0	0	112.6	S405 F407 D676 I679	I403-S405 PolarHBondContact O-N 2.99Å; I403-S405 VanDerWaalsContact O-N 3.16Å; I403-F407 HydrophobicContact CG2-CD2 4.4Å; I403-F407 HydrophobicContact CG2-CE2 4.11Å; I403-F407 VanDerWaalsContact O-CD2 3.26Å; I403-F407 WeakPolarHBondContact O-CD2 3.14Å; I403-D676 WeakPolarHBondContact CB-OD1 3.4Å; I403-D676 PolarHBondContact N-OD1 3.28Å; I403-D676 VanDerWaalsContact N-OD1 3.08Å; I403-I679 HydrophobicContact CD1-CD1 3.76Å
404	V	34	Very low	28.9	Very low	120 Å²	120	130.3 Å²	130.3	73%	0.727	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-63.7	-26.3	-173.4	-174.6	0	0	0	0	113.3	S402	S402-V404 PolarHBondContact O-N 3.43Å; S402-V404 VanDerWaalsContact O-N 3.09Å
405	S	30.2	Very low	29	Very low	87 Å²	87	127.2 Å²	127.2	61%	0.608	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-85.1	-14	-170	69.8	0	0	0	0	116	S402 I403	S402-S405 PolarHBondContact O-N 2.8Å; S402-S405 PolarHBondContact O-OG 3.23Å; I403-S405 PolarHBondContact O-N 2.99Å; I403-S405 VanDerWaalsContact O-N 3.16Å
406	R	28.6	Very low	29.1	Very low	196 Å²	196	125.8 Å²	125.8	74%	0.74	69%	0.689	S	S	*	*	S	Bend	trans	-98.4	-9	-174.4	-77.7	-168.8	-177.8	165.1	2.7	116.4
407	F	33.7	Very low	29.2	Very low	106 Å²	106	123.5 Å²	123.5	47%	0.465	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-98.9	3.5	-164.7	-72.9	-73.5	0	0	0	117.3	I403 S409	I403-F407 HydrophobicContact CG2-CD2 4.4Å; I403-F407 HydrophobicContact CG2-CE2 4.11Å; I403-F407 VanDerWaalsContact O-CD2 3.26Å; I403-F407 WeakPolarHBondContact O-CD2 3.14Å; F407-S409 VanDerWaalsContact C-N 3.35Å; F407-S409 PolarHBondContact O-N 2.69Å
408	S	29.1	Very low	29.2	Very low	121 Å²	121	123.6 Å²	123.6	85%	0.846	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-77.8	-11.3	-177.8	-156.8	0	0	0	0	115.3
409	S	29.1	Very low	29.4	Very low	115 Å²	115	123 Å²	123	80%	0.804	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-103.2	-0.4	-172.9	-68.1	0	0	0	0	116.5	F407	F407-S409 VanDerWaalsContact C-N 3.35Å; F407-S409 PolarHBondContact O-N 2.69Å
410	L	26.5	Very low	29.4	Very low	108 Å²	108	118.3 Å²	118.3	57%	0.565	69%	0.691	S	S	*	*			trans	-110.4	19.3	-172.1	-86	155.8	0	0	0	115.2	S412	L410-S412 PolarHBondContact O-N 3.39Å; L410-S412 VanDerWaalsContact O-N 3.09Å
411	R	27.3	Very low	29.2	Very low	233 Å²	233	118.7 Å²	118.7	88%	0.879	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	0.8	179.8	-149.5	178.6	-157.8	-104.5	-1.1	114.8
412	S	32.4	Very low	29	Very low	106 Å²	106	117.4 Å²	117.4	74%	0.741	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113	-6.8	-169.1	-56.1	0	0	0	0	116.9	L410	L410-S412 PolarHBondContact O-N 3.39Å; L410-S412 VanDerWaalsContact O-N 3.09Å
413	E	29	Very low	28.6	Very low	158 Å²	158	120.3 Å²	120.3	74%	0.738	72%	0.718	S	S	*	*	S	Bend	trans	-105.9	-6.6	-172.9	-78.5	-175.1	166.5	0	0	116.5
414	I	28.7	Very low	28	Very low	137 Å²	137	122.5 Å²	122.5	70%	0.703	74%	0.738	S	S	*	*	S	Bend	trans	-101.3	-0.5	-176.6	-59.1	175.9	0	0	0	113.3
415	G	29	Very low	27.7	Very low	74 Å²	74	121.5 Å²	121.5	76%	0.763	74%	0.737	S	S	*	*	S	Bend	trans	-93.1	-1.1	-174.2	0	0	0	0	0	117.6
416	S	26.4	Very low	27.6	Very low	104 Å²	104	125 Å²	125	73%	0.727	75%	0.749	S	S	*	*			trans	-159.9	83.2	-171.2	35.5	0	0	0	0	114.3
417	S	25.6	Very low	27.6	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	75%	0.751	S	S	*	*			trans	-162.5	60.4	152	51.5	0	0	0	0	112.1
418	V	24.9	Very low	27.2	Very low	123 Å²	123	119.8 Å²	119.8	75%	0.745	77%	0.767	S	S	*	*			trans	-124	95.8	147.6	-87.4	0	0	0	0	105.3
419	S	26.5	Very low	27.2	Very low	114 Å²	114	120.6 Å²	120.6	80%	0.797	77%	0.767	S	S	*	*			trans	-113.2	106.7	172.1	-63.2	0	0	0	0	106.5	S421	S419-S421 PolarHBondContact O-N 3.08Å; S419-S421 VanDerWaalsContact O-N 3.14Å
420	S	26.3	Very low	27.4	Very low	112 Å²	112	120.9 Å²	120.9	78%	0.783	77%	0.766	S	S	*	*			trans	-53.7	106.2	172.6	40.5	0	0	0	0	110.7	S422	S420-S422 PolarHBondContact O-N 2.98Å
421	S	27.8	Very low	27.4	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	78%	0.784	S	S	*	*			trans	-84.8	87.4	164.8	57.5	0	0	0	0	108.7	S419 C423	S419-S421 PolarHBondContact O-N 3.08Å; S419-S421 VanDerWaalsContact O-N 3.14Å; S421-C423 PolarHBondContact O-N 2.83Å; S421-C423 VanDerWaalsContact O-N 3.16Å
422	S	24.3	Very low	27.4	Very low	113 Å²	113	123.3 Å²	123.3	79%	0.79	78%	0.778	S	S	*	*			trans	-59	109.7	165.9	55.2	0	0	0	0	109.7	S420	S420-S422 PolarHBondContact O-N 2.98Å
423	C	24.3	Very low	27.1	Very low	122 Å²	122	125.1 Å²	125.1	82%	0.824	78%	0.78	S	S	*	*			trans	-113.8	111.5	165.6	29.7	0	0	0	0	107.8	S421	S421-C423 PolarHBondContact O-N 2.83Å; S421-C423 VanDerWaalsContact O-N 3.16Å
424	S	25.4	Very low	27	Very low	108 Å²	108	125.3 Å²	125.3	76%	0.755	79%	0.785	S	S	*	*			trans	-75.3	138.2	-178.9	-53.1	0	0	0	0	111.6
425	S	27.3	Very low	27	Very low	99 Å²	99	123.6 Å²	123.6	69%	0.692	79%	0.791	S	S	*	*			trans	53.1	118.6	141.9	-47	0	0	0	0	119.3
426	D	27.8	Very low	26.9	Very low	161 Å²	161	125 Å²	125	86%	0.861	79%	0.789	S	S	*	*				-173.8	137.7	102.9	-87.4	-23.2	0	0	0	114.1
427	A	28.8	Very low	27	Very low	94 Å²	94	124.5 Å²	124.5	78%	0.777	79%	0.786	S	S	*	*			trans	63.1	92	149.1	0	0	0	0	0	121.6
428	A	24.5	Very low	27.2	Very low	98 Å²	98	125.2 Å²	125.2	81%	0.81	78%	0.781	S	S	*	*			trans	12.3	120.6	134.2	0	0	0	0	0	120.5
429	T	30.5	Very low	27.4	Very low	138 Å²	138	123.8 Å²	123.8	85%	0.847	77%	0.773	S	S	*	*			trans	-154.1	127.6	131.9	0	0	0	0	0	109.1	R431	T429-R431 PolarHBondContact O-N 3.27Å
430	P	32.8	Very low	28.1	Very low	122 Å²	122	121.5 Å²	121.5	79%	0.792	75%	0.751	S	S	*	*			trans	-85.4	118.2	-171.6	31.9	-29.4	0	0	0	110.2
431	R	26.7	Very low	28.6	Very low	250 Å²	250	119.7 Å²	119.7	94%	0.943	74%	0.739	S	S	*	*			trans	-115.1	105.8	161.9	-90.9	-176	166.9	179.5	-3.7	109	T429	T429-R431 PolarHBondContact O-N 3.27Å
432	N	25.9	Very low	29	Very low	141 Å²	141	120.5 Å²	120.5	75%	0.754	73%	0.729	S	S	*	*			trans	-65.5	142	167.2	-85.3	-13	0	0	0	111
433	N	26.6	Very low	29.7	Very low	144 Å²	144	116.2 Å²	116.2	77%	0.77	70%	0.697	S	S	*	*			trans	66.2	107.4	148.6	-56.3	-18.4	0	0	0	117.9
434	L	26.3	Very low	30.3	Very low	163 Å²	163	116.3 Å²	116.3	85%	0.853	70%	0.696	S	S	*	*				178.2	139.5	87.8	-170.3	60.6	0	0	0	107	S436	L434-S436 PolarHBondContact O-N 3.01Å
435	A	29.6	Very low	31.1	Very low	100 Å²	100	117.2 Å²	117.2	83%	0.826	69%	0.693	S	S	*	*			trans	-57.4	97.6	-178.2	0	0	0	0	0	110.9	S437	A435-S437 PolarHBondContact O-N 3.45Å
436	S	26.9	Very low	31.4	Very low	103 Å²	103	114.5 Å²	114.5	72%	0.72	68%	0.68	S	S	*	*			trans	-67.9	102.9	170.7	-63.2	0	0	0	0	107.5	L434 D438	L434-S436 PolarHBondContact O-N 3.01Å; S436-D438 PolarHBondContact O-N 3.14Å
437	S	29.2	Very low	31.7	Very low	95 Å²	95	108.2 Å²	108.2	66%	0.664	65%	0.651	S	S	*	*			trans	-54.2	108.9	159.2	180	0	0	0	0	107	A435 V439	A435-S437 PolarHBondContact O-N 3.45Å; S437-V439 VanDerWaalsContact C-N 3.31Å; S437-V439 PolarHBondContact O-N 3.33Å
438	D	30	Very low	32	Very low	126 Å²	126	108 Å²	108	67%	0.674	64%	0.641	S	S	*	*			trans	-66.8	90.8	179.1	-84.5	-31.8	0	0	0	108.8	S436 L440 S451	S436-D438 PolarHBondContact O-N 3.14Å; D438-L440 PolarHBondContact O-N 3.41Å; D438-L440 VanDerWaalsContact O-N 3.09Å; D438-S451 PolarHBondContact O-OG 3.24Å
439	V	28.6	Very low	32.9	Very low	93 Å²	93	104 Å²	104	56%	0.564	61%	0.607	S	S	*	*			trans	-71.5	100	172	179.7	0	0	0	0	107.7	S437 F442	S437-V439 VanDerWaalsContact C-N 3.31Å; S437-V439 PolarHBondContact O-N 3.33Å; V439-F442 HydrophobicContact CG1-CZ 4.12Å
440	L	41.1	Very low	33.6	Very low	65 Å²	65	100.3 Å²	100.3	34%	0.34	58%	0.578	S	S	.	*			trans	-75.4	125.1	174.1	-65.7	171	0	0	0	108.7	D438	D438-L440 PolarHBondContact O-N 3.41Å; D438-L440 VanDerWaalsContact O-N 3.09Å
441	S	35.3	Very low	34.4	Very low	75 Å²	75	97 Å²	97	52%	0.524	56%	0.557	S	S	.	*			trans	-23.7	139.4	-175	50.6	0	0	0	0	118.4	V449	S441-V449 WeakPolarHBondContact O-CG2 2.92Å
442	F	37.1	Very low	35.7	Very low	120 Å²	120	86.6 Å²	86.6	53%	0.526	52%	0.522	S	S	.	.			trans	-66.3	144.3	177.5	-55.2	-78	0	0	0	114.5	V439 G446 A447	V439-F442 HydrophobicContact CG1-CZ 4.12Å; F442-G446 WeakPolarHBondContact CD1-O 3.45Å; F442-A447 WeakPolarHBondContact CA-O 3.47Å
443	L	38.2	Very low	37	Very low	23 Å²	23	81 Å²	81	12%	0.12	49%	0.493	C	S	.	.			trans	-62.9	165.1	161.1	-72.4	161.5	0	0	0	110.5	D445 G446 A447 V449 L523 Y611	L443-D445 WeakPolarHBondContact CB-OD1 3.36Å; L443-D445 PolarHBondContact O-N 3.06Å; L443-G446 PolarHBondContact O-N 3.36Å; L443-A447 HydrophobicContact CD1-CB 4.13Å; L443-A447 PolarHBondContact N-O 3.41Å; L443-A447 VanDerWaalsContact N-O 3.15Å; L443-V449 HydrophobicContact CG-CG2 4.22Å; L443-L523 HydrophobicContact CD1-CD1 3.79Å; L443-L523 HydrophobicContact CD1-CD2 3.31Å; L443-L523 HydrophobicContact CD1-CG 4.11Å; L443-Y611 HydrophobicContact CD2-CD1 3.42Å; L443-Y611 VanDerWaalsContact CD2-CD1 3.42Å; L443-Y611 HydrophobicContact CD2-CE1 3.29Å; L443-Y611 HydrophobicContact CG-CE1 4.4Å
444	P	38.7	Very low	38.4	Very low	124 Å²	124	78.6 Å²	78.6	81%	0.805	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-20.6	-179	-25.7	34.4	0	0	0	115.2
445	D	40.9	Very low	39.7	Very low	128 Å²	128	78.5 Å²	78.5	68%	0.684	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	1.8	176.6	60.2	1.2	0	0	0	114	L443 A447	L443-D445 WeakPolarHBondContact CB-OD1 3.36Å; L443-D445 PolarHBondContact O-N 3.06Å; D445-A447 PolarHBondContact OD1-N 2.85Å
446	G	33.9	Very low	41.2	Very low	42 Å²	42	80.6 Å²	80.6	43%	0.433	47%	0.471	S	S	.	.			trans	85.6	6.8	177.6	0	0	0	0	0	114.7	F442 L443	F442-G446 WeakPolarHBondContact CD1-O 3.45Å; L443-G446 PolarHBondContact O-N 3.36Å
447	A	33.7	Very low	43.2	Very low	28 Å²	28	76.7 Å²	76.7	23%	0.231	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-71.3	131	175.4	0	0	0	0	0	110.8	F442 L443 D445 L523	F442-A447 WeakPolarHBondContact CA-O 3.47Å; L443-A447 HydrophobicContact CD1-CB 4.13Å; L443-A447 PolarHBondContact N-O 3.41Å; L443-A447 VanDerWaalsContact N-O 3.15Å; D445-A447 PolarHBondContact OD1-N 2.85Å; A447-L523 HydrophobicContact CB-CD2 4.26Å
448	P	36.4	Very low	44.8	Very low	90 Å²	90	75.9 Å²	75.9	58%	0.584	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-65.2	133.8	177.5	26.2	-32	0	0	0	110.2
449	V	42.1	Very low	46.3	Very low	13 Å²	13	80.2 Å²	80.2	8%	0.079	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-78.2	124.2	173.4	172.5	0	0	0	0	107.9	S441 L443 S451	S441-V449 WeakPolarHBondContact O-CG2 2.92Å; L443-V449 HydrophobicContact CG-CG2 4.22Å; V449-S451 PolarHBondContact O-N 3.44Å
450	Y	45.6	Very low	47.9	Very low	62 Å²	62	77.7 Å²	77.7	24%	0.243	42%	0.424	C	S	.	.			trans	-41.2	108.7	-174.8	-148.5	-88.8	0	0	0	112.3	P453 H514 E522	Y450-P453 HydrophobicContact CE1-CB 4.27Å; Y450-P453 HydrophobicContact CE1-CG 4.37Å; Y450-H514 HydrophobicContact CE1-CB 3.88Å; Y450-E522 WeakPolarHBondContact CD2-OE2 3.42Å; Y450-E522 VanDerWaalsContact CE2-OE2 3.29Å; Y450-E522 WeakPolarHBondContact CE2-OE2 3.44Å
451	S	49.2	Very low	49.1	Very low	51 Å²	51	75.9 Å²	75.9	36%	0.357	42%	0.42	S	S	.	.			trans	-65.9	145.3	167.1	-63.7	0	0	0	0	108.2	D438 V449 P453	D438-S451 PolarHBondContact O-OG 3.24Å; V449-S451 PolarHBondContact O-N 3.44Å; S451-P453 VanDerWaalsContact O-N 3.13Å
452	T	53.6	Low	50.7	Low	33 Å²	33	72.4 Å²	72.4	20%	0.202	40%	0.396	C	S	.	.			trans	-38	123.4	168.2	-22.4	0	0	0	0	109.1	D454 W463	T452-D454 VanDerWaalsContact C-N 3.32Å; T452-D454 PolarHBondContact O-N 2.88Å; T452-W463 HydrophobicContact CG2-CE3 4.46Å; T452-W463 HydrophobicContact CG2-CH2 3.18Å; T452-W463 HydrophobicContact CG2-CZ2 3.24Å; T452-W463 HydrophobicContact CG2-CZ3 3.82Å
453	P	55.2	Low	52.2	Low	24 Å²	24	69.8 Å²	69.8	16%	0.156	38%	0.383	C	S	.	.			trans	-64.2	96.8	-176.5	24	-33.6	0	0	0	108.3	Y450 S451 W457 V510 H514	Y450-P453 HydrophobicContact CE1-CB 4.27Å; Y450-P453 HydrophobicContact CE1-CG 4.37Å; S451-P453 VanDerWaalsContact O-N 3.13Å; P453-W457 VanDerWaalsContact CG-CD1 3.44Å; P453-V510 HydrophobicContact CG-CG1 4.17Å; P453-H514 HydrophobicContact CB-CB 4.48Å; P453-H514 HydrophobicContact CG-CB 3.62Å
454	D	54.6	Low	53.3	Low	92 Å²	92	72.1 Å²	72.1	49%	0.492	40%	0.401	S	S	.	.	H	α-helix	trans	-89.9	-36.8	-159.4	-125.4	-2.6	0	0	0	111.8	T452 T458	T452-D454 VanDerWaalsContact C-N 3.32Å; T452-D454 PolarHBondContact O-N 2.88Å; D454-T458 WeakPolarHBondContact O-CB 3.49Å; D454-T458 PolarHBondContact O-N 3.41Å; D454-T458 VanDerWaalsContact O-N 3.1Å; D454-T458 PolarHBondContact O-OG1 3.35Å
455	I	54.5	Low	54	Low	162 Å²	162	72.3 Å²	72.3	83%	0.831	40%	0.395	S	S	*	.	H	α-helix	trans	-72.5	-43.9	-167.7	-56.8	175.5	0	0	0	111.9
456	E	60.8	Low	54.4	Low	143 Å²	143	74.4 Å²	74.4	67%	0.668	41%	0.406	S	S	*	.	H	α-helix	trans	-77.5	-43.7	-175.7	-167.8	166.5	-167	0	0	112.2	R459	E456-R459 WeakPolarHBondContact O-CB 3.4Å; E456-R459 PolarHBondContact O-N 2.88Å
457	W	69.6	Low	55.2	Low	21 Å²	21	79.5 Å²	79.5	8%	0.08	42%	0.424	C	S	.	.	H	α-helix	trans	-79.3	-24.4	-175.3	-59.2	106.8	0	0	0	113.5	P453 R459 V460 G461 L462 V510 H514 L542 L546	P453-W457 VanDerWaalsContact CG-CD1 3.44Å; W457-R459 VanDerWaalsContact C-N 3.29Å; W457-R459 PolarHBondContact O-N 3.37Å; W457-V460 HydrophobicContact CE3-CG2 4.25Å; W457-V460 PolarHBondContact O-N 3.23Å; W457-G461 PolarHBondContact O-N 3.33Å; W457-L462 HydrophobicContact CB-CD1 4.02Å; W457-L462 HydrophobicContact CD2-CD1 4.01Å; W457-L462 HydrophobicContact CE3-CD1 3.23Å; W457-L462 HydrophobicContact CG-CD1 4.36Å; W457-L462 HydrophobicContact CZ3-CD1 3.98Å; W457-L462 PolarHBondContact O-N 2.88Å; W457-V510 HydrophobicContact CD2-CB 4.48Å; W457-V510 HydrophobicContact CD2-CG1 3.91Å; W457-V510 HydrophobicContact CD2-CG2 3.67Å; W457-V510 HydrophobicContact CE3-CG2 3.74Å; W457-V510 HydrophobicContact CG-CG1 3.82Å; W457-V510 HydrophobicContact CG-CG2 4.37Å; W457-V510 HydrophobicContact CH2-CG2 3.89Å; W457-V510 HydrophobicContact CZ2-CG2 3.86Å; W457-V510 HydrophobicContact CZ3-CG2 3.83Å; W457-H514 AromaticContact CE2-CD2 3.75Å; W457-H514 AromaticContact CE2-NE2 3.45Å; W457-H514 AromaticContact CZ2-CD2 3.82Å; W457-H514 AromaticContact CZ2-NE2 3.2Å; W457-H514 WeakPolarHBondContact CZ2-NE2 3.12Å; W457-H514 AromaticContact NE1-CD2 3.27Å; W457-H514 PolarHBondContact NE1-CD2 3.45Å; W457-H514 VanDerWaalsContact NE1-CD2 3.27Å; W457-H514 AromaticContact NE1-NE2 3.17Å; W457-H514 PolarHBondContact NE1-NE2 3.34Å; W457-H514 VanDerWaalsContact NE1-NE2 3.17Å; W457-L542 HydrophobicContact CH2-CD1 4.45Å; W457-L542 HydrophobicContact CH2-CD2 3.6Å; W457-L542 HydrophobicContact CH2-CG 4.23Å; W457-L542 HydrophobicContact CZ2-CD2 3.96Å; W457-L546 HydrophobicContact CH2-CD1 3.75Å; W457-L546 HydrophobicContact CZ3-CD1 3.5Å; W457-L546 VanDerWaalsContact CZ3-CD1 3.5Å; W457-L546 HydrophobicContact CZ3-CD2 4.05Å; W457-L546 HydrophobicContact CZ3-CG 4.4Å
458	T	62.1	Low	56.6	Low	78 Å²	78	81.5 Å²	81.5	48%	0.479	43%	0.428	S	S	.	.	H	α-helix	trans	-63.2	-36.9	169	-62.7	0	0	0	0	111.2	D454 V460 G461	D454-T458 WeakPolarHBondContact O-CB 3.49Å; D454-T458 PolarHBondContact O-N 3.41Å; D454-T458 VanDerWaalsContact O-N 3.1Å; D454-T458 PolarHBondContact O-OG1 3.35Å; T458-V460 VanDerWaalsContact C-N 3.29Å; T458-V460 PolarHBondContact O-N 2.96Å; T458-G461 WeakPolarHBondContact O-CA 3.38Å; T458-G461 PolarHBondContact O-N 2.95Å
459	R	60.4	Low	57.9	Low	218 Å²	218	78.6 Å²	78.6	82%	0.823	41%	0.412	S	S	*	.	H	α-helix	trans	-64.3	-34.6	177	-170.2	-179.9	-179.8	-173.5	0.1	112.6	E456 W457 G461	E456-R459 WeakPolarHBondContact O-CB 3.4Å; E456-R459 PolarHBondContact O-N 2.88Å; W457-R459 VanDerWaalsContact C-N 3.29Å; W457-R459 PolarHBondContact O-N 3.37Å; R459-G461 PolarHBondContact O-N 2.92Å
460	V	62.5	Low	59.5	Low	40 Å²	40	85.4 Å²	85.4	24%	0.242	44%	0.443	C	S	.	.	H	α-helix	trans	-72.8	-17.2	174.2	-171.4	0	0	0	0	111.2	W457 T458 L462 L546	W457-V460 HydrophobicContact CE3-CG2 4.25Å; W457-V460 PolarHBondContact O-N 3.23Å; T458-V460 VanDerWaalsContact C-N 3.29Å; T458-V460 PolarHBondContact O-N 2.96Å; V460-L462 HydrophobicContact CB-CD1 3.85Å; V460-L462 HydrophobicContact CB-CG 4.27Å; V460-L462 HydrophobicContact CG1-CD1 3.91Å; V460-L462 HydrophobicContact CG1-CG 4.13Å; V460-L546 HydrophobicContact CG1-CD2 4.3Å
461	G	67.1	Low	61.2	Low	26 Å²	26	84.6 Å²	84.6	27%	0.268	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	34.2	-179.6	0	0	0	0	0	112.5	W457 T458 R459 K503	W457-G461 PolarHBondContact O-N 3.33Å; T458-G461 WeakPolarHBondContact O-CA 3.38Å; T458-G461 PolarHBondContact O-N 2.95Å; R459-G461 PolarHBondContact O-N 2.92Å; G461-K503 WeakPolarHBondContact O-CE 3.49Å; G461-K503 PolarHBondContact O-NZ 2.82Å
462	L	68.9	Low	63	Low	2 Å²	2	82.7 Å²	82.7	1%	0.01	43%	0.43	C	S	.	.			trans	-78.6	-28.8	-179.9	-78.8	150	0	0	0	113.5	W457 V460 K503 C506 T507 V510 L546 L549	W457-L462 HydrophobicContact CB-CD1 4.02Å; W457-L462 HydrophobicContact CD2-CD1 4.01Å; W457-L462 HydrophobicContact CE3-CD1 3.23Å; W457-L462 HydrophobicContact CG-CD1 4.36Å; W457-L462 HydrophobicContact CZ3-CD1 3.98Å; W457-L462 PolarHBondContact O-N 2.88Å; V460-L462 HydrophobicContact CB-CD1 3.85Å; V460-L462 HydrophobicContact CB-CG 4.27Å; V460-L462 HydrophobicContact CG1-CD1 3.91Å; V460-L462 HydrophobicContact CG1-CG 4.13Å; L462-K503 WeakPolarHBondContact O-CE 3.2Å; L462-C506 HydrophobicContact CD2-CB 3.32Å; L462-T507 PolarHBondContact O-OG1 3.37Å; L462-V510 HydrophobicContact CD1-CG2 4.27Å; L462-L546 HydrophobicContact CD1-CD2 4.23Å; L462-L549 HydrophobicContact CD2-CD2 3.98Å
463	W	68.8	Low	64.1	Low	65 Å²	65	81.7 Å²	81.7	25%	0.246	42%	0.424	C	S	.	.	S	Bend	trans	-82	124.3	172.2	-50.4	115.9	0	0	0	107.4	T452 K503 T507 V510 I511	T452-W463 HydrophobicContact CG2-CE3 4.46Å; T452-W463 HydrophobicContact CG2-CH2 3.18Å; T452-W463 HydrophobicContact CG2-CZ2 3.24Å; T452-W463 HydrophobicContact CG2-CZ3 3.82Å; W463-K503 PolarHBondContact O-NZ 3.23Å; W463-T507 HydrophobicContact CE3-CG2 3.95Å; W463-T507 HydrophobicContact CH2-CG2 3.75Å; W463-T507 HydrophobicContact CZ3-CG2 3.35Å; W463-V510 HydrophobicContact CZ2-CG1 4.26Å; W463-I511 HydrophobicContact CH2-CD1 4.5Å; W463-I511 HydrophobicContact CH2-CG1 4.26Å
464	S	60.3	Low	65.3	Low	72 Å²	72	84.3 Å²	84.3	50%	0.503	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-70.6	129.6	178.2	-63	0	0	0	0	109.2	E468	S464-E468 VanDerWaalsContact CB-OE2 3.29Å; S464-E468 WeakPolarHBondContact CB-OE2 3.08Å; S464-E468 PolarHBondContact OG-OE2 2.77Å
465	D	53.1	Low	66.6	Low	128 Å²	128	81.1 Å²	81.1	68%	0.684	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-66.6	140.7	152	-64.9	-38.5	0	0	0	106.6	N467 E468	D465-N467 PolarHBondContact O-N 2.74Å; D465-E468 PolarHBondContact O-N 3.03Å
466	D	49.6	Very low	67.6	Low	172 Å²	172	77 Å²	77	92%	0.92	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	3.9	177.4	-75.5	-40	0	0	0	114.9
467	N	51.8	Low	68.4	Low	149 Å²	149	70.2 Å²	70.2	80%	0.797	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	0.5	-176.9	-67.1	-36.7	0	0	0	114.9	D465 A469	D465-N467 PolarHBondContact O-N 2.74Å; N467-A469 PolarHBondContact O-N 2.98Å
468	E	62	Low	69	Low	70 Å²	70	76.7 Å²	76.7	33%	0.327	41%	0.409	S	S	.	.			trans	-68.2	114.6	177.9	-72	-172.4	146.3	0	0	111.2	S464 D465 K503	S464-E468 VanDerWaalsContact CB-OE2 3.29Å; S464-E468 WeakPolarHBondContact CB-OE2 3.08Å; S464-E468 PolarHBondContact OG-OE2 2.77Å; D465-E468 PolarHBondContact O-N 3.03Å; E468-K503 IonicContact OE1-NZ 2.7Å; E468-K503 PolarHBondContact OE1-NZ 3.12Å; E468-K503 IonicContact OE2-NZ 3.44Å; E468-K503 PolarHBondContact OE2-NZ 3.05Å
469	A	63.7	Low	69.9	Low	29 Å²	29	76.2 Å²	76.2	24%	0.24	41%	0.414	C	S	.	.			trans	-64.7	144.1	179.5	0	0	0	0	0	111.5	N467 T471 G475 Y496	N467-A469 PolarHBondContact O-N 2.98Å; A469-T471 VanDerWaalsContact C-N 3.26Å; A469-T471 PolarHBondContact O-N 2.61Å; A469-G475 VanDerWaalsContact CB-CA 3.45Å; A469-Y496 WeakPolarHBondContact O-CE1 3.47Å; A469-Y496 PolarHBondContact O-OH 2.89Å
470	E	76.4	Confident	70.9	Confident	156 Å²	156	69.2 Å²	69.2	73%	0.729	39%	0.389	S	S	*	.	S	Bend	trans	-63.1	-29.4	-179	-69	-179.8	178.5	0	0	113.3
471	T	80.9	Confident	71.7	Confident	46 Å²	46	74 Å²	74	28%	0.282	40%	0.403	S	S	.	.	S	Bend	trans	-138.8	153.8	-179.8	69.6	0	0	0	0	111.9	A469 S473 T474 G475	A469-T471 VanDerWaalsContact C-N 3.26Å; A469-T471 PolarHBondContact O-N 2.61Å; T471-S473 PolarHBondContact O-N 3.01Å; T471-S473 PolarHBondContact OG1-OG 2.99Å; T471-T474 PolarHBondContact N-OG1 3.34Å; T471-T474 PolarHBondContact O-N 3.25Å; T471-T474 VanDerWaalsContact O-N 3.11Å; T471-T474 PolarHBondContact O-OG1 2.81Å; T471-T474 WeakPolarHBondContact OG1-CG2 3.47Å; T471-T474 PolarHBondContact OG1-N 2.76Å; T471-T474 PolarHBondContact OG1-OG1 3.06Å; T471-G475 PolarHBondContact O-N 2.98Å
472	W	87.2	Confident	72.3	Confident	11 Å²	11	78 Å²	78	4%	0.042	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-43.6	173.2	-177.7	87.7	0	0	0	111.3	T474 G475 G477 F480 L484 Q492 D493 Y496 V560 I561	W472-T474 PolarHBondContact O-N 2.91Å; W472-G475 CarbonylContact O-C 3.54Å; W472-G475 PolarHBondContact O-N 3.3Å; W472-G477 VanDerWaalsContact CE2-CA 3.47Å; W472-G477 VanDerWaalsContact CZ2-CA 3.45Å; W472-G477 VanDerWaalsContact O-CA 3.26Å; W472-G477 WeakPolarHBondContact O-CA 3.49Å; W472-G477 PolarHBondContact O-N 3.31Å; W472-F480 HydrophobicContact CH2-CB 4.02Å; W472-L484 HydrophobicContact CH2-CD1 3.59Å; W472-L484 HydrophobicContact CZ3-CD1 4.15Å; W472-Q492 HydrophobicContact CD2-CB 3.49Å; W472-Q492 VanDerWaalsContact CD2-CB 3.49Å; W472-Q492 HydrophobicContact CD2-CG 4.36Å; W472-Q492 HydrophobicContact CE3-CB 3.59Å; W472-Q492 HydrophobicContact CE3-CG 4.41Å; W472-Q492 HydrophobicContact CG-CB 3.95Å; W472-Q492 HydrophobicContact CH2-CB 4.27Å; W472-Q492 HydrophobicContact CH2-CG 4.22Å; W472-Q492 HydrophobicContact CZ2-CB 4.16Å; W472-Q492 HydrophobicContact CZ2-CG 4.12Å; W472-Q492 HydrophobicContact CZ3-CB 4Å; W472-Q492 HydrophobicContact CZ3-CG 4.35Å; W472-D493 WeakPolarHBondContact CB-OD1 3.24Å; W472-D493 PolarHBondContact N-OD1 3.07Å; W472-Y496 HydrophobicContact CB-CD1 4.42Å; W472-Y496 HydrophobicContact CB-CG 3.96Å; W472-V560 HydrophobicContact CZ2-CG1 4.08Å; W472-V560 WeakPolarHBondContact CZ2-O 3.5Å; W472-V560 PolarHBondContact NE1-O 3.26Å; W472-V560 VanDerWaalsContact NE1-O 3.08Å; W472-I561 HydrophobicContact CZ2-CG1 4.33Å
473	S	76.9	Confident	73.1	Confident	12 Å²	12	84.9 Å²	84.9	8%	0.084	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.9	-179.7	51.3	0	0	0	0	115.6	T471 D493	T471-S473 PolarHBondContact O-N 3.01Å; T471-S473 PolarHBondContact OG1-OG 2.99Å; S473-D493 WeakPolarHBondContact CB-OD1 3.31Å; S473-D493 PolarHBondContact N-OD1 3.32Å; S473-D493 PolarHBondContact OG-OD1 3.02Å; S473-D493 PolarHBondContact OG-OD2 3.46Å
474	T	80.7	Confident	73.9	Confident	78 Å²	78	83.8 Å²	83.8	48%	0.479	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-25.4	175.8	52.9	0	0	0	0	113.2	T471 W472	T471-T474 PolarHBondContact N-OG1 3.34Å; T471-T474 PolarHBondContact O-N 3.25Å; T471-T474 VanDerWaalsContact O-N 3.11Å; T471-T474 PolarHBondContact O-OG1 2.81Å; T471-T474 WeakPolarHBondContact OG1-CG2 3.47Å; T471-T474 PolarHBondContact OG1-N 2.76Å; T471-T474 PolarHBondContact OG1-OG1 3.06Å; W472-T474 PolarHBondContact O-N 2.91Å
475	G	81.5	Confident	75.2	Confident	26 Å²	26	83.8 Å²	83.8	27%	0.268	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-111.5	175.2	0	0	0	0	0	113.1	A469 T471 W472 G477 K478	A469-G475 VanDerWaalsContact CB-CA 3.45Å; T471-G475 PolarHBondContact O-N 2.98Å; W472-G475 CarbonylContact O-C 3.54Å; W472-G475 PolarHBondContact O-N 3.3Å; G475-G477 PolarHBondContact O-N 2.85Å; G475-G477 VanDerWaalsContact O-N 3.14Å; G475-K478 WeakPolarHBondContact O-CB 3.36Å; G475-K478 PolarHBondContact O-N 3.21Å; G475-K478 VanDerWaalsContact O-N 3.1Å
476	P	76.3	Confident	76.8	Confident	75 Å²	75	82.9 Å²	82.9	49%	0.487	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.5	-170.4	-23.4	31.8	0	0	0	114.3	K478 Y496	P476-K478 PolarHBondContact O-N 3.4Å; P476-Y496 HydrophobicContact CG-CE2 4.25Å
477	G	77.6	Confident	78.6	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.2	-176.9	0	0	0	0	0	115.2	W472 G475 A479 F480 R481	W472-G477 VanDerWaalsContact CE2-CA 3.47Å; W472-G477 VanDerWaalsContact CZ2-CA 3.45Å; W472-G477 VanDerWaalsContact O-CA 3.26Å; W472-G477 WeakPolarHBondContact O-CA 3.49Å; W472-G477 PolarHBondContact O-N 3.31Å; G475-G477 PolarHBondContact O-N 2.85Å; G475-G477 VanDerWaalsContact O-N 3.14Å; G477-A479 PolarHBondContact O-N 2.82Å; G477-A479 VanDerWaalsContact O-N 3.16Å; G477-F480 PolarHBondContact O-N 2.97Å; G477-R481 PolarHBondContact O-N 3.37Å
478	K	81.6	Confident	80.4	Confident	157 Å²	157	73 Å²	73	68%	0.683	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.9	-174.6	-173.1	178.7	179.2	-178.5	0	112.7	G475 P476	G475-K478 WeakPolarHBondContact O-CB 3.36Å; G475-K478 PolarHBondContact O-N 3.21Å; G475-K478 VanDerWaalsContact O-N 3.1Å; P476-K478 PolarHBondContact O-N 3.4Å
479	A	80.4	Confident	81.7	Confident	69 Å²	69	70.5 Å²	70.5	57%	0.57	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-31.5	178.6	0	0	0	0	0	113.7	G477	G477-A479 PolarHBondContact O-N 2.82Å; G477-A479 VanDerWaalsContact O-N 3.16Å
480	F	80.8	Confident	83	Confident	71 Å²	71	75.5 Å²	75.5	31%	0.311	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-15.9	-176.1	-65.2	-81.2	0	0	0	113.1	W472 G477 S482 Q483 L484 V560 I561	W472-F480 HydrophobicContact CH2-CB 4.02Å; G477-F480 PolarHBondContact O-N 2.97Å; F480-S482 PolarHBondContact O-N 3.13Å; F480-S482 VanDerWaalsContact O-N 3.12Å; F480-Q483 PolarHBondContact O-N 3.14Å; F480-L484 HydrophobicContact CB-CD1 4.31Å; F480-L484 PolarHBondContact O-N 3.06Å; F480-V560 HydrophobicContact CD2-CB 4.32Å; F480-V560 HydrophobicContact CD2-CG1 3.66Å; F480-V560 HydrophobicContact CE2-CB 4.03Å; F480-V560 HydrophobicContact CE2-CG1 3.76Å; F480-V560 HydrophobicContact CE2-CG2 4.12Å; F480-I561 HydrophobicContact CD1-CD1 4.36Å
481	R	79.9	Confident	83.8	Confident	140 Å²	140	68.9 Å²	68.9	53%	0.528	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-37.5	-177.8	-177.4	-177.2	173.7	176.1	-1.8	113.6	G477 Q483 V489	G477-R481 PolarHBondContact O-N 3.37Å; R481-Q483 VanDerWaalsContact C-N 3.33Å; R481-V489 HydrophobicContact CG-CG1 4.34Å; R481-V489 HydrophobicContact CG-CG2 4.3Å
482	S	80.7	Confident	84.4	Confident	110 Å²	110	66.8 Å²	66.8	77%	0.769	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-17.6	179.6	55.5	0	0	0	0	113.8	F480	F480-S482 PolarHBondContact O-N 3.13Å; F480-S482 VanDerWaalsContact O-N 3.12Å
483	Q	84.4	Confident	84.6	Confident	146 Å²	146	68.2 Å²	68.2	68%	0.682	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-18.8	-177.2	-57	179.8	24.2	0	0	112.3	F480 R481	F480-Q483 PolarHBondContact O-N 3.14Å; R481-Q483 VanDerWaalsContact C-N 3.33Å
484	L	85.6	Confident	85.4	Confident	43 Å²	43	68.4 Å²	68.4	23%	0.225	37%	0.373	C	S	.	.	S	Bend	trans	-99	152.8	-175.7	-62.8	176.3	0	0	0	112.7	W472 F480 E488 V489 I561	W472-L484 HydrophobicContact CH2-CD1 3.59Å; W472-L484 HydrophobicContact CZ3-CD1 4.15Å; F480-L484 HydrophobicContact CB-CD1 4.31Å; F480-L484 PolarHBondContact O-N 3.06Å; L484-E488 HydrophobicContact CB-CB 4.36Å; L484-E488 HydrophobicContact CB-CG 4.41Å; L484-E488 HydrophobicContact CD1-CG 4.22Å; L484-E488 HydrophobicContact CD2-CG 4.23Å; L484-V489 HydrophobicContact CB-CG2 3.93Å; L484-I561 HydrophobicContact CD1-CD1 3.97Å; L484-I561 HydrophobicContact CD1-CG1 4.07Å; L484-I561 HydrophobicContact CD2-CD1 3.84Å; L484-I561 HydrophobicContact CG-CD1 4.35Å
485	S	87.8	Confident	86	Confident	72 Å²	72	64.9 Å²	64.9	50%	0.503	35%	0.351	S	S	.	.			trans	-64.2	149.7	171.9	77.8	0	0	0	0	110.9	K487 E488 V489	S485-K487 PolarHBondContact O-N 2.86Å; S485-K487 VanDerWaalsContact O-N 3.08Å; S485-E488 PolarHBondContact O-N 2.96Å; S485-E488 WeakPolarHBondContact OG-CB 3.39Å; S485-E488 PolarHBondContact OG-N 3.33Å; S485-V489 PolarHBondContact O-N 2.83Å
486	S	86.8	Confident	86.5	Confident	108 Å²	108	64.5 Å²	64.5	76%	0.755	34%	0.342	S	S	*	.	H	α-helix	trans	-55.7	-30.4	176.9	172	0	0	0	0	113.2	K490	S486-K490 PolarHBondContact O-N 3.46Å
487	K	88.2	Confident	87.4	Confident	87 Å²	87	65.9 Å²	65.9	38%	0.378	34%	0.341	S	S	.	.	H	α-helix	trans	-71.8	-36.7	177.5	-163.8	-175.8	172.6	-148.8	0	111.6	S485 R491 K650 S651 T652 T653	S485-K487 PolarHBondContact O-N 2.86Å; S485-K487 VanDerWaalsContact O-N 3.08Å; K487-R491 PolarHBondContact O-N 2.87Å; K487-K650 WeakPolarHBondContact CE-O 3.31Å; K487-S651 WeakPolarHBondContact CE-O 3.45Å; K487-S651 WeakPolarHBondContact CG-O 3.31Å; K487-T652 PolarHBondContact NZ-O 2.95Å; K487-T653 PolarHBondContact NZ-OG1 2.68Å
488	E	89.5	Confident	88.2	Confident	27 Å²	27	65.9 Å²	65.9	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-74.3	-40.7	176.7	-174.2	57.2	-157.5	0	0	112.2	L484 S485 K490 R491 Q492	L484-E488 HydrophobicContact CB-CB 4.36Å; L484-E488 HydrophobicContact CB-CG 4.41Å; L484-E488 HydrophobicContact CD1-CG 4.22Å; L484-E488 HydrophobicContact CD2-CG 4.23Å; S485-E488 PolarHBondContact O-N 2.96Å; S485-E488 WeakPolarHBondContact OG-CB 3.39Å; S485-E488 PolarHBondContact OG-N 3.33Å; E488-K490 PolarHBondContact O-N 2.81Å; E488-R491 VanDerWaalsContact CD-NE 3.35Å; E488-R491 WeakPolarHBondContact O-CA 3.41Å; E488-R491 WeakPolarHBondContact O-CB 3.32Å; E488-R491 PolarHBondContact O-N 3.03Å; E488-R491 IonicContact OE1-CZ 3.64Å; E488-R491 IonicContact OE1-NE 2.89Å; E488-R491 PolarHBondContact OE1-NE 3.46Å; E488-R491 IonicContact OE1-NH2 3.94Å; E488-R491 PolarHBondContact OE1-NH2 3.19Å; E488-R491 IonicContact OE2-CZ 3.01Å; E488-R491 IonicContact OE2-NE 2.76Å; E488-R491 PolarHBondContact OE2-NE 3.39Å; E488-R491 IonicContact OE2-NH2 2.77Å; E488-Q492 WeakPolarHBondContact O-CG 3.43Å; E488-Q492 PolarHBondContact O-N 3.11Å; E488-Q492 PolarHBondContact OE1-NE2 3.29Å
489	V	88.9	Confident	88.8	Confident	17 Å²	17	59.5 Å²	59.5	10%	0.103	31%	0.314	C	S	.	.	H	α-helix	trans	-55.3	-44.3	172.2	176.1	0	0	0	0	110.4	R481 L484 S485 R491 Q492 D493	R481-V489 HydrophobicContact CG-CG1 4.34Å; R481-V489 HydrophobicContact CG-CG2 4.3Å; L484-V489 HydrophobicContact CB-CG2 3.93Å; S485-V489 PolarHBondContact O-N 2.83Å; V489-R491 PolarHBondContact O-N 3.48Å; V489-Q492 PolarHBondContact O-N 2.97Å; V489-D493 PolarHBondContact O-N 2.98Å
490	K	90.3	Very high	89.3	Confident	135 Å²	135	58.4 Å²	58.4	59%	0.587	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-37.9	175	-174.3	174.7	-178.2	175.9	0	112.7	S486 E488 I494	S486-K490 PolarHBondContact O-N 3.46Å; E488-K490 PolarHBondContact O-N 2.81Å; K490-I494 HydrophobicContact CG-CD1 4.14Å; K490-I494 WeakPolarHBondContact O-CD1 3.44Å; K490-I494 VanDerWaalsContact O-CG1 3.23Å; K490-I494 WeakPolarHBondContact O-CG1 3.26Å; K490-I494 PolarHBondContact O-N 3.46Å; K490-I494 VanDerWaalsContact O-N 3.12Å
491	R	93	Very high	89.9	Confident	17 Å²	17	57 Å²	57	6%	0.064	30%	0.298	C	S	.	.	H	α-helix	trans	-60.4	-48.7	175.3	-168.7	171	78.1	109.5	12.6	110.2	K487 E488 V489 I494 I495 V562 S563 L648	K487-R491 PolarHBondContact O-N 2.87Å; E488-R491 VanDerWaalsContact CD-NE 3.35Å; E488-R491 WeakPolarHBondContact O-CA 3.41Å; E488-R491 WeakPolarHBondContact O-CB 3.32Å; E488-R491 PolarHBondContact O-N 3.03Å; E488-R491 IonicContact OE1-CZ 3.64Å; E488-R491 IonicContact OE1-NE 2.89Å; E488-R491 PolarHBondContact OE1-NE 3.46Å; E488-R491 IonicContact OE1-NH2 3.94Å; E488-R491 PolarHBondContact OE1-NH2 3.19Å; E488-R491 IonicContact OE2-CZ 3.01Å; E488-R491 IonicContact OE2-NE 2.76Å; E488-R491 PolarHBondContact OE2-NE 3.39Å; E488-R491 IonicContact OE2-NH2 2.77Å; V489-R491 PolarHBondContact O-N 3.48Å; R491-I494 PolarHBondContact O-N 2.89Å; R491-I495 HydrophobicContact CG-CD1 4.27Å; R491-I495 WeakPolarHBondContact O-CG1 3.45Å; R491-I495 PolarHBondContact O-N 2.87Å; R491-V562 PolarHBondContact NH2-O 3.22Å; R491-S563 PolarHBondContact NH1-O 3.16Å; R491-S563 VanDerWaalsContact NH1-O 3.09Å; R491-L648 HydrophobicContact CG-CD2 4.07Å
492	Q	93.5	Very high	90.6	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-38.5	179.2	-62	-56.5	-38.5	0	0	112.8	W472 E488 V489 I494 I495 Y496 V562	W472-Q492 HydrophobicContact CD2-CB 3.49Å; W472-Q492 VanDerWaalsContact CD2-CB 3.49Å; W472-Q492 HydrophobicContact CD2-CG 4.36Å; W472-Q492 HydrophobicContact CE3-CB 3.59Å; W472-Q492 HydrophobicContact CE3-CG 4.41Å; W472-Q492 HydrophobicContact CG-CB 3.95Å; W472-Q492 HydrophobicContact CH2-CB 4.27Å; W472-Q492 HydrophobicContact CH2-CG 4.22Å; W472-Q492 HydrophobicContact CZ2-CB 4.16Å; W472-Q492 HydrophobicContact CZ2-CG 4.12Å; W472-Q492 HydrophobicContact CZ3-CB 4Å; W472-Q492 HydrophobicContact CZ3-CG 4.35Å; E488-Q492 WeakPolarHBondContact O-CG 3.43Å; E488-Q492 PolarHBondContact O-N 3.11Å; E488-Q492 PolarHBondContact OE1-NE2 3.29Å; V489-Q492 PolarHBondContact O-N 2.97Å; Q492-I494 VanDerWaalsContact C-N 3.3Å; Q492-I494 PolarHBondContact O-N 3.18Å; Q492-I495 PolarHBondContact O-N 3.34Å; Q492-Y496 WeakPolarHBondContact O-CB 3.41Å; Q492-Y496 PolarHBondContact O-N 3.44Å; Q492-V562 PolarHBondContact NE2-O 3.04Å; Q492-V562 VanDerWaalsContact OE1-N 3.1Å
493	D	93.2	Very high	91.1	Very high	41 Å²	41	45.7 Å²	45.7	22%	0.219	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-40.4	173	-75.9	-32.7	0	0	0	111.5	W472 S473 V489 Y496 E497	W472-D493 WeakPolarHBondContact CB-OD1 3.24Å; W472-D493 PolarHBondContact N-OD1 3.07Å; S473-D493 WeakPolarHBondContact CB-OD1 3.31Å; S473-D493 PolarHBondContact N-OD1 3.32Å; S473-D493 PolarHBondContact OG-OD1 3.02Å; S473-D493 PolarHBondContact OG-OD2 3.46Å; V489-D493 PolarHBondContact O-N 2.98Å; D493-Y496 PolarHBondContact O-N 2.99Å; D493-E497 WeakPolarHBondContact O-CB 3.37Å; D493-E497 PolarHBondContact O-N 3.2Å
494	I	93.6	Very high	91.3	Very high	16 Å²	16	43.2 Å²	43.2	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-67.7	-38.8	176.6	-63.9	160.1	0	0	0	111.4	K490 R491 Q492 E497 L498 F644 L648	K490-I494 HydrophobicContact CG-CD1 4.14Å; K490-I494 WeakPolarHBondContact O-CD1 3.44Å; K490-I494 VanDerWaalsContact O-CG1 3.23Å; K490-I494 WeakPolarHBondContact O-CG1 3.26Å; K490-I494 PolarHBondContact O-N 3.46Å; K490-I494 VanDerWaalsContact O-N 3.12Å; R491-I494 PolarHBondContact O-N 2.89Å; Q492-I494 VanDerWaalsContact C-N 3.3Å; Q492-I494 PolarHBondContact O-N 3.18Å; I494-E497 PolarHBondContact O-N 3.08Å; I494-L498 WeakPolarHBondContact O-CB 3.39Å; I494-L498 PolarHBondContact O-N 2.79Å; I494-F644 HydrophobicContact CG2-CD1 4.08Å; I494-L648 HydrophobicContact CB-CD2 4Å; I494-L648 HydrophobicContact CG2-CD2 3.7Å; I494-L648 HydrophobicContact CG2-CG 3.79Å
495	I	93.3	Very high	91.7	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-43.6	177.5	-66.1	171.5	0	0	0	110.4	R491 Q492 L498 F499 V562 I565 L648	R491-I495 HydrophobicContact CG-CD1 4.27Å; R491-I495 WeakPolarHBondContact O-CG1 3.45Å; R491-I495 PolarHBondContact O-N 2.87Å; Q492-I495 PolarHBondContact O-N 3.34Å; I495-L498 WeakPolarHBondContact O-CB 3.3Å; I495-L498 PolarHBondContact O-N 3.13Å; I495-F499 PolarHBondContact O-N 3.03Å; I495-V562 HydrophobicContact CD1-CB 4.02Å; I495-V562 HydrophobicContact CD1-CG1 4.26Å; I495-V562 HydrophobicContact CG2-CB 4.24Å; I495-V562 HydrophobicContact CG2-CG1 4.4Å; I495-V562 HydrophobicContact CG2-CG2 4.26Å; I495-I565 HydrophobicContact CD1-CB 4.08Å; I495-I565 HydrophobicContact CD1-CG1 4.37Å; I495-I565 HydrophobicContact CD1-CG2 4.08Å; I495-I565 HydrophobicContact CG1-CB 4.42Å; I495-I565 HydrophobicContact CG1-CG1 4.15Å; I495-I565 HydrophobicContact CG2-CD1 4.28Å; I495-L648 HydrophobicContact CD1-CD2 4.37Å; I495-L648 HydrophobicContact CG1-CD2 3.65Å
496	Y	92.2	Very high	91.9	Very high	19 Å²	19	38.2 Å²	38.2	8%	0.075	19%	0.194	C	C	.	.	H	α-helix	trans	-68.4	-38.9	177.3	-176.4	-95.2	0	0	0	112.2	A469 W472 P476 Q492 D493 L498 F499 V500 M556	A469-Y496 WeakPolarHBondContact O-CE1 3.47Å; A469-Y496 PolarHBondContact O-OH 2.89Å; W472-Y496 HydrophobicContact CB-CD1 4.42Å; W472-Y496 HydrophobicContact CB-CG 3.96Å; P476-Y496 HydrophobicContact CG-CE2 4.25Å; Q492-Y496 WeakPolarHBondContact O-CB 3.41Å; Q492-Y496 PolarHBondContact O-N 3.44Å; D493-Y496 PolarHBondContact O-N 2.99Å; Y496-L498 VanDerWaalsContact C-N 3.3Å; Y496-L498 PolarHBondContact O-N 3.41Å; Y496-F499 PolarHBondContact O-N 2.86Å; Y496-V500 HydrophobicContact CD1-CG2 3.98Å; Y496-V500 HydrophobicContact CE1-CG2 3.57Å; Y496-V500 HydrophobicContact CE2-CG2 4.34Å; Y496-V500 WeakPolarHBondContact O-CG2 3.37Å; Y496-V500 PolarHBondContact O-N 3.17Å; Y496-M556 HydrophobicContact CD2-SD 4.46Å
497	E	94.2	Very high	92	Very high	103 Å²	103	33.5 Å²	33.5	48%	0.481	16%	0.16	S	C	.	.	H	α-helix	trans	-58.9	-42	170.5	-174.3	-170.3	158.9	0	0	111.4	D493 I494 F499 V500 T501 F644	D493-E497 WeakPolarHBondContact O-CB 3.37Å; D493-E497 PolarHBondContact O-N 3.2Å; I494-E497 PolarHBondContact O-N 3.08Å; E497-F499 PolarHBondContact O-N 3.39Å; E497-V500 PolarHBondContact O-N 2.9Å; E497-T501 HydrophobicContact CG-CG2 4.19Å; E497-T501 VanDerWaalsContact O-CB 3.31Å; E497-T501 WeakPolarHBondContact O-CB 2.85Å; E497-T501 WeakPolarHBondContact O-CG2 3.46Å; E497-T501 PolarHBondContact O-N 3.5Å; E497-T501 PolarHBondContact O-OG1 2.91Å; E497-F644 HydrophobicContact CB-CE1 4.47Å; E497-F644 HydrophobicContact CG-CE1 4.13Å
498	L	94.8	Very high	92.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-46.6	175	174.2	68.3	0	0	0	111.1	I494 I495 Y496 T501 E502 F548 L552 I565 F569 Y641 F644	I494-L498 WeakPolarHBondContact O-CB 3.39Å; I494-L498 PolarHBondContact O-N 2.79Å; I495-L498 WeakPolarHBondContact O-CB 3.3Å; I495-L498 PolarHBondContact O-N 3.13Å; Y496-L498 VanDerWaalsContact C-N 3.3Å; Y496-L498 PolarHBondContact O-N 3.41Å; L498-T501 PolarHBondContact O-OG1 3.44Å; L498-E502 VanDerWaalsContact O-CB 3.22Å; L498-E502 WeakPolarHBondContact O-CB 3.26Å; L498-E502 PolarHBondContact O-N 3.48Å; L498-F548 HydrophobicContact CD1-CE1 4.31Å; L498-F548 HydrophobicContact CD2-CZ 4.21Å; L498-L552 HydrophobicContact CD2-CD1 4.31Å; L498-L552 HydrophobicContact CD2-CD2 4.1Å; L498-L552 HydrophobicContact CG-CD1 4.05Å; L498-I565 HydrophobicContact CD2-CD1 4.2Å; L498-F569 HydrophobicContact CD1-CZ 4.25Å; L498-F569 HydrophobicContact CD2-CE2 3.62Å; L498-F569 HydrophobicContact CD2-CZ 3.52Å; L498-Y641 HydrophobicContact CD1-CD1 4.35Å; L498-Y641 HydrophobicContact CD1-CE1 4.28Å; L498-F644 HydrophobicContact CB-CD1 4.08Å; L498-F644 HydrophobicContact CB-CE1 4.15Å; L498-F644 HydrophobicContact CD1-CB 4.37Å; L498-F644 HydrophobicContact CD1-CD1 4.24Å; L498-F644 HydrophobicContact CD1-CD2 3.84Å; L498-F644 HydrophobicContact CD1-CE2 4.13Å; L498-F644 HydrophobicContact CD1-CG 3.9Å; L498-F644 HydrophobicContact CD1-CZ 4.47Å
499	F	93	Very high	92.2	Very high	23 Å²	23	28.2 Å²	28.2	10%	0.101	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-53	176.8	170.2	-100.9	0	0	0	112.5	I495 Y496 E497 T501 E502 K503 L549 L552 K553 M556	I495-F499 PolarHBondContact O-N 3.03Å; Y496-F499 PolarHBondContact O-N 2.86Å; E497-F499 PolarHBondContact O-N 3.39Å; F499-T501 VanDerWaalsContact C-N 3.32Å; F499-T501 PolarHBondContact O-N 3.48Å; F499-E502 PolarHBondContact O-N 2.93Å; F499-E502 VanDerWaalsContact O-N 3.17Å; F499-K503 PolarHBondContact O-N 3.06Å; F499-L549 HydrophobicContact CD2-CD1 3.72Å; F499-L549 HydrophobicContact CE2-CD1 3.57Å; F499-L549 HydrophobicContact CZ-CD1 4.44Å; F499-L552 HydrophobicContact CD2-CB 4.1Å; F499-K553 HydrophobicContact CE2-CB 4.06Å; F499-M556 HydrophobicContact CB-CE 3.97Å; F499-M556 HydrophobicContact CB-SD 4.06Å; F499-M556 HydrophobicContact CD1-CE 3.52Å; F499-M556 HydrophobicContact CD1-SD 4.23Å; F499-M556 HydrophobicContact CD2-CE 3.19Å; F499-M556 HydrophobicContact CD2-SD 4.36Å; F499-M556 HydrophobicContact CE1-CE 3.7Å; F499-M556 HydrophobicContact CE2-CE 3.38Å; F499-M556 HydrophobicContact CG-CE 3.25Å; F499-M556 HydrophobicContact CG-SD 3.95Å; F499-M556 HydrophobicContact CZ-CE 3.63Å
500	V	91.4	Very high	92.2	Very high	46 Å²	46	27.4 Å²	27.4	28%	0.279	13%	0.132	S	C	.	.	H	α-helix	trans	-61.4	-43	-178.4	173.3	0	0	0	0	110.8	Y496 E497 K503 H504	Y496-V500 HydrophobicContact CD1-CG2 3.98Å; Y496-V500 HydrophobicContact CE1-CG2 3.57Å; Y496-V500 HydrophobicContact CE2-CG2 4.34Å; Y496-V500 WeakPolarHBondContact O-CG2 3.37Å; Y496-V500 PolarHBondContact O-N 3.17Å; E497-V500 PolarHBondContact O-N 2.9Å; V500-K503 PolarHBondContact O-N 3.39Å; V500-H504 PolarHBondContact O-N 3.23Å
501	T	93	Very high	92	Very high	43 Å²	43	21.2 Å²	21.2	26%	0.264	11%	0.106	S	C	.	.	H	α-helix	trans	-72.3	-28.6	178.6	62.8	0	0	0	0	112.9	E497 L498 F499 H505 R637	E497-T501 HydrophobicContact CG-CG2 4.19Å; E497-T501 VanDerWaalsContact O-CB 3.31Å; E497-T501 WeakPolarHBondContact O-CB 2.85Å; E497-T501 WeakPolarHBondContact O-CG2 3.46Å; E497-T501 PolarHBondContact O-N 3.5Å; E497-T501 PolarHBondContact O-OG1 2.91Å; L498-T501 PolarHBondContact O-OG1 3.44Å; F499-T501 VanDerWaalsContact C-N 3.32Å; F499-T501 PolarHBondContact O-N 3.48Å; T501-H505 WeakPolarHBondContact O-CB 3.31Å; T501-H505 PolarHBondContact O-N 2.96Å; T501-R637 PolarHBondContact OG1-NH1 2.92Å; T501-R637 VanDerWaalsContact OG1-NH1 3.08Å
502	E	94.7	Very high	91.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.8	-43.5	171.5	-170.1	66.5	-140.8	0	0	111	L498 F499 H504 H505 C506 H545 F548 L549 L552 R637 Y641	L498-E502 VanDerWaalsContact O-CB 3.22Å; L498-E502 WeakPolarHBondContact O-CB 3.26Å; L498-E502 PolarHBondContact O-N 3.48Å; F499-E502 PolarHBondContact O-N 2.93Å; F499-E502 VanDerWaalsContact O-N 3.17Å; E502-H504 VanDerWaalsContact C-N 3.33Å; E502-H504 PolarHBondContact O-N 2.95Å; E502-H505 WeakPolarHBondContact O-CB 3.43Å; E502-H505 PolarHBondContact O-N 3.08Å; E502-H505 VanDerWaalsContact O-N 3.13Å; E502-H505 IonicContact OE1-CD2 3.81Å; E502-C506 PolarHBondContact O-N 3Å; E502-C506 PolarHBondContact O-SG 2.95Å; E502-H545 WeakPolarHBondContact OE1-CB 3.29Å; E502-H545 IonicContact OE1-CE1 3.93Å; E502-H545 IonicContact OE1-CG 2.85Å; E502-H545 IonicContact OE1-ND1 3.06Å; E502-H545 PolarHBondContact OE1-ND1 3.47Å; E502-F548 HydrophobicContact CG-CD1 3.82Å; E502-F548 HydrophobicContact CG-CE1 4.33Å; E502-F548 WeakPolarHBondContact OE2-CD1 3.26Å; E502-L549 HydrophobicContact CB-CD1 4.26Å; E502-L549 HydrophobicContact CG-CB 4.12Å; E502-L549 HydrophobicContact CG-CD1 4.25Å; E502-L552 HydrophobicContact CB-CD1 4.24Å; E502-L552 HydrophobicContact CG-CD1 4.4Å; E502-R637 IonicContact OE2-CZ 2.7Å; E502-R637 VanDerWaalsContact OE2-CZ 3.27Å; E502-R637 IonicContact OE2-NE 3.16Å; E502-R637 PolarHBondContact OE2-NE 3.3Å; E502-R637 IonicContact OE2-NH2 2.8Å; E502-R637 PolarHBondContact OE2-NH2 3.16Å; E502-Y641 PolarHBondContact OE1-OH 3.21Å; E502-Y641 WeakPolarHBondContact OE2-CE1 3.46Å; E502-Y641 PolarHBondContact OE2-OH 2.94Å
503	K	91.1	Very high	91.7	Very high	12 Å²	12	21.4 Å²	21.4	5%	0.052	11%	0.107	C	C	.	.	H	α-helix	trans	-54.7	-51	172.7	175	175.5	164.8	164.7	0	110.4	G461 L462 W463 E468 F499 V500 H505 C506 T507 L549	G461-K503 WeakPolarHBondContact O-CE 3.49Å; G461-K503 PolarHBondContact O-NZ 2.82Å; L462-K503 WeakPolarHBondContact O-CE 3.2Å; W463-K503 PolarHBondContact O-NZ 3.23Å; E468-K503 IonicContact OE1-NZ 2.7Å; E468-K503 PolarHBondContact OE1-NZ 3.12Å; E468-K503 IonicContact OE2-NZ 3.44Å; E468-K503 PolarHBondContact OE2-NZ 3.05Å; F499-K503 PolarHBondContact O-N 3.06Å; V500-K503 PolarHBondContact O-N 3.39Å; K503-H505 VanDerWaalsContact C-N 3.3Å; K503-H505 PolarHBondContact O-N 3.04Å; K503-C506 WeakPolarHBondContact O-CB 3.47Å; K503-C506 PolarHBondContact O-N 3.21Å; K503-T507 PolarHBondContact O-N 2.82Å; K503-T507 PolarHBondContact O-OG1 3.08Å; K503-L549 HydrophobicContact CB-CD1 4Å; K503-L549 HydrophobicContact CB-CD2 4.39Å
504	H	89.4	Confident	91.3	Very high	94 Å²	94	20.9 Å²	20.9	44%	0.435	10%	0.103	S	C	.	.	H	α-helix	trans	-61	-36.3	177.2	-175.3	92	0	0	0	113.6	V500 E502 T507 T508 R625	V500-H504 PolarHBondContact O-N 3.23Å; E502-H504 VanDerWaalsContact C-N 3.33Å; E502-H504 PolarHBondContact O-N 2.95Å; H504-T507 WeakPolarHBondContact O-CB 3.42Å; H504-T507 PolarHBondContact O-N 3.45Å; H504-T508 PolarHBondContact O-N 3.27Å; H504-T508 PolarHBondContact O-OG1 3.3Å; H504-R625 PolarHBondContact CE1-NH2 3.13Å; H504-R625 PolarHBondContact ND1-NH2 3.15Å; H504-R625 PolarHBondContact NE2-NH1 3.36Å
505	H	93	Very high	90.8	Very high	9 Å²	9	20.2 Å²	20.2	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-66.2	-44.6	175	177.9	68.2	0	0	0	111.3	T501 E502 K503 T507 T508 L509 H545	T501-H505 WeakPolarHBondContact O-CB 3.31Å; T501-H505 PolarHBondContact O-N 2.96Å; E502-H505 WeakPolarHBondContact O-CB 3.43Å; E502-H505 PolarHBondContact O-N 3.08Å; E502-H505 VanDerWaalsContact O-N 3.13Å; E502-H505 IonicContact OE1-CD2 3.81Å; K503-H505 VanDerWaalsContact C-N 3.3Å; K503-H505 PolarHBondContact O-N 3.04Å; H505-T507 PolarHBondContact O-N 2.8Å; H505-T508 WeakPolarHBondContact O-CA 3.36Å; H505-T508 VanDerWaalsContact O-CB 3.3Å; H505-T508 WeakPolarHBondContact O-CB 3.24Å; H505-T508 PolarHBondContact O-N 3.34Å; H505-T508 VanDerWaalsContact O-N 3.07Å; H505-L509 WeakPolarHBondContact NE2-CD1 3.34Å; H505-L509 PolarHBondContact O-N 2.98Å; H505-H545 AromaticContact CD2-CD2 3.87Å; H505-H545 AromaticContact CD2-CE1 3.59Å; H505-H545 AromaticContact CD2-CG 3.53Å; H505-H545 AromaticContact CD2-ND1 3.34Å; H505-H545 PolarHBondContact CD2-ND1 2.85Å; H505-H545 VanDerWaalsContact CD2-ND1 3.34Å; H505-H545 AromaticContact CD2-NE2 3.88Å; H505-H545 AromaticContact NE2-CD2 3.32Å; H505-H545 PolarHBondContact NE2-CD2 3.27Å; H505-H545 VanDerWaalsContact NE2-CD2 3.32Å; H505-H545 AromaticContact NE2-CE1 3.25Å; H505-H545 PolarHBondContact NE2-CE1 2.98Å; H505-H545 AromaticContact NE2-CG 3.49Å; H505-H545 AromaticContact NE2-ND1 3.44Å; H505-H545 PolarHBondContact NE2-ND1 3.29Å; H505-H545 AromaticContact NE2-NE2 3.14Å; H505-H545 PolarHBondContact NE2-NE2 3.43Å; H505-H545 VanDerWaalsContact NE2-NE2 3.14Å
506	C	93.1	Very high	90.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-42.8	173.1	-65.5	0	0	0	0	111.6	L462 E502 K503 T508 L509 V510 L546 L549	L462-C506 HydrophobicContact CD2-CB 3.32Å; E502-C506 PolarHBondContact O-N 3Å; E502-C506 PolarHBondContact O-SG 2.95Å; K503-C506 WeakPolarHBondContact O-CB 3.47Å; K503-C506 PolarHBondContact O-N 3.21Å; C506-T508 PolarHBondContact O-N 2.9Å; C506-L509 PolarHBondContact O-N 3.44Å; C506-L509 VanDerWaalsContact O-N 3.11Å; C506-V510 WeakPolarHBondContact O-CG2 3.44Å; C506-V510 PolarHBondContact O-N 3.18Å; C506-L546 HydrophobicContact CB-CD2 4.14Å; C506-L549 HydrophobicContact CB-CD2 4.18Å
507	T	88.4	Confident	90.5	Very high	9 Å²	9	20.4 Å²	20.4	6%	0.055	10%	0.101	C	C	.	.	H	α-helix	trans	-57	-39.9	173	-48	0	0	0	0	111.6	L462 W463 K503 H504 H505 V510 I511	L462-T507 PolarHBondContact O-OG1 3.37Å; W463-T507 HydrophobicContact CE3-CG2 3.95Å; W463-T507 HydrophobicContact CH2-CG2 3.75Å; W463-T507 HydrophobicContact CZ3-CG2 3.35Å; K503-T507 PolarHBondContact O-N 2.82Å; K503-T507 PolarHBondContact O-OG1 3.08Å; H504-T507 WeakPolarHBondContact O-CB 3.42Å; H504-T507 PolarHBondContact O-N 3.45Å; H505-T507 PolarHBondContact O-N 2.8Å; T507-V510 PolarHBondContact O-N 2.91Å; T507-I511 HydrophobicContact CG2-CD1 4.19Å; T507-I511 WeakPolarHBondContact O-CB 3.35Å; T507-I511 VanDerWaalsContact O-CG1 3.31Å; T507-I511 WeakPolarHBondContact O-CG1 3.34Å; T507-I511 PolarHBondContact O-N 3.3Å
508	T	90.1	Very high	90.2	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-65.6	-41.1	177	-50.8	0	0	0	0	111.6	H504 H505 C506 I511 L512 R625 C630 L633	H504-T508 PolarHBondContact O-N 3.27Å; H504-T508 PolarHBondContact O-OG1 3.3Å; H505-T508 WeakPolarHBondContact O-CA 3.36Å; H505-T508 VanDerWaalsContact O-CB 3.3Å; H505-T508 WeakPolarHBondContact O-CB 3.24Å; H505-T508 PolarHBondContact O-N 3.34Å; H505-T508 VanDerWaalsContact O-N 3.07Å; C506-T508 PolarHBondContact O-N 2.9Å; T508-I511 PolarHBondContact O-N 3.46Å; T508-L512 WeakPolarHBondContact O-CB 3.48Å; T508-L512 PolarHBondContact O-N 2.9Å; T508-R625 PolarHBondContact OG1-NH1 3.1Å; T508-C630 HydrophobicContact CG2-CB 4.12Å; T508-L633 HydrophobicContact CG2-CB 4.46Å; T508-L633 HydrophobicContact CG2-CD1 4.18Å
509	L	92.5	Very high	89.8	Confident	2 Å²	2	16.7 Å²	16.7	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-66.3	-41.8	176	-74.1	167.2	0	0	0	112.1	H505 C506 L512 K513 M541 L542 H545 I634	H505-L509 WeakPolarHBondContact NE2-CD1 3.34Å; H505-L509 PolarHBondContact O-N 2.98Å; C506-L509 PolarHBondContact O-N 3.44Å; C506-L509 VanDerWaalsContact O-N 3.11Å; L509-L512 PolarHBondContact O-N 3.34Å; L509-K513 WeakPolarHBondContact O-CB 3.38Å; L509-K513 PolarHBondContact O-N 3.5Å; L509-M541 HydrophobicContact CD1-CG 4.09Å; L509-M541 HydrophobicContact CD2-CB 4.31Å; L509-M541 HydrophobicContact CD2-CG 3.57Å; L509-L542 HydrophobicContact CB-CD1 3.78Å; L509-H545 HydrophobicContact CD1-CB 3.91Å; L509-I634 HydrophobicContact CD2-CD1 3.53Å; L509-I634 HydrophobicContact CD2-CG1 3.82Å; L509-I634 HydrophobicContact CD2-CG2 4.32Å; L509-I634 HydrophobicContact CG-CD1 4.38Å; L509-I634 HydrophobicContact CG-CG1 4.36Å
510	V	89.1	Confident	89.6	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-60.8	-44.9	175	166.5	0	0	0	0	110.9	P453 W457 L462 W463 C506 T507 L512 K513 H514 L542	P453-V510 HydrophobicContact CG-CG1 4.17Å; W457-V510 HydrophobicContact CD2-CB 4.48Å; W457-V510 HydrophobicContact CD2-CG1 3.91Å; W457-V510 HydrophobicContact CD2-CG2 3.67Å; W457-V510 HydrophobicContact CE3-CG2 3.74Å; W457-V510 HydrophobicContact CG-CG1 3.82Å; W457-V510 HydrophobicContact CG-CG2 4.37Å; W457-V510 HydrophobicContact CH2-CG2 3.89Å; W457-V510 HydrophobicContact CZ2-CG2 3.86Å; W457-V510 HydrophobicContact CZ3-CG2 3.83Å; L462-V510 HydrophobicContact CD1-CG2 4.27Å; W463-V510 HydrophobicContact CZ2-CG1 4.26Å; C506-V510 WeakPolarHBondContact O-CG2 3.44Å; C506-V510 PolarHBondContact O-N 3.18Å; T507-V510 PolarHBondContact O-N 2.91Å; V510-L512 VanDerWaalsContact C-N 3.34Å; V510-K513 PolarHBondContact O-N 3.38Å; V510-H514 WeakPolarHBondContact O-CB 3.46Å; V510-H514 PolarHBondContact O-N 2.59Å; V510-L542 HydrophobicContact CG2-CD1 3.88Å; V510-L542 HydrophobicContact CG2-CD2 4.3Å
511	I	85.6	Confident	89.6	Confident	6 Å²	6	16.2 Å²	16.2	3%	0.031	8%	0.081	C	C	.	.	I	π-helix	trans	-60	-46.1	173.5	-74.9	168	0	0	0	110.7	W463 T507 T508 K513 T515 Y516 F622	W463-I511 HydrophobicContact CH2-CD1 4.5Å; W463-I511 HydrophobicContact CH2-CG1 4.26Å; T507-I511 HydrophobicContact CG2-CD1 4.19Å; T507-I511 WeakPolarHBondContact O-CB 3.35Å; T507-I511 VanDerWaalsContact O-CG1 3.31Å; T507-I511 WeakPolarHBondContact O-CG1 3.34Å; T507-I511 PolarHBondContact O-N 3.3Å; T508-I511 PolarHBondContact O-N 3.46Å; I511-K513 VanDerWaalsContact C-N 3.35Å; I511-K513 PolarHBondContact O-N 3.01Å; I511-T515 WeakPolarHBondContact O-CA 3.33Å; I511-T515 WeakPolarHBondContact O-CB 3.45Å; I511-T515 PolarHBondContact O-N 3.26Å; I511-T515 PolarHBondContact O-OG1 3.46Å; I511-Y516 HydrophobicContact CG2-CD2 4.26Å; I511-Y516 HydrophobicContact CG2-CE2 4.07Å; I511-Y516 PolarHBondContact O-N 2.81Å; I511-F622 HydrophobicContact CB-CE1 4.4Å; I511-F622 HydrophobicContact CD1-CE1 4.37Å; I511-F622 HydrophobicContact CG1-CE1 4.06Å; I511-F622 HydrophobicContact CG2-CD1 3.95Å; I511-F622 HydrophobicContact CG2-CE1 3.63Å
512	L	90.1	Very high	89.3	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-63.3	-41	180	-175.1	61	0	0	0	112.1	T508 L509 V510 Y516 F517 M535 L538 F588 L627 C630 L631 I634	T508-L512 WeakPolarHBondContact O-CB 3.48Å; T508-L512 PolarHBondContact O-N 2.9Å; L509-L512 PolarHBondContact O-N 3.34Å; V510-L512 VanDerWaalsContact C-N 3.34Å; L512-Y516 HydrophobicContact CD1-CD2 4.27Å; L512-Y516 HydrophobicContact CD1-CG 4.43Å; L512-Y516 WeakPolarHBondContact O-CB 3.48Å; L512-F517 PolarHBondContact O-N 3.36Å; L512-M535 HydrophobicContact CD1-CE 4.08Å; L512-M535 HydrophobicContact CD1-SD 3.84Å; L512-M535 HydrophobicContact CG-SD 4.09Å; L512-L538 HydrophobicContact CD2-CD1 4.33Å; L512-L538 HydrophobicContact CD2-CD2 3.63Å; L512-L538 HydrophobicContact CG-CD1 3.94Å; L512-L538 HydrophobicContact CG-CD2 4.14Å; L512-F588 HydrophobicContact CD2-CE2 4.46Å; L512-F588 HydrophobicContact CD2-CZ 4.27Å; L512-L627 HydrophobicContact CD1-CD1 3.2Å; L512-C630 HydrophobicContact CD1-CB 4.38Å; L512-L631 HydrophobicContact CD2-CD2 4.28Å; L512-I634 HydrophobicContact CD2-CD1 3.24Å; L512-I634 HydrophobicContact CG-CD1 4.5Å
513	K	89.5	Confident	88.9	Confident	22 Å²	22	22.2 Å²	22.2	10%	0.096	11%	0.108	C	C	.	.	I	π-helix	trans	-71.8	-62.2	177.6	179.2	62.1	172.5	73.4	0	111.3	L509 V510 I511 F517 D518 L538 D539	L509-K513 WeakPolarHBondContact O-CB 3.38Å; L509-K513 PolarHBondContact O-N 3.5Å; V510-K513 PolarHBondContact O-N 3.38Å; I511-K513 VanDerWaalsContact C-N 3.35Å; I511-K513 PolarHBondContact O-N 3.01Å; K513-F517 HydrophobicContact CD-CB 4.27Å; K513-F517 HydrophobicContact CD-CG 4.45Å; K513-F517 CarbonylContact O-C 3.51Å; K513-F517 WeakPolarHBondContact O-CA 3.41Å; K513-F517 WeakPolarHBondContact O-CB 3.45Å; K513-F517 PolarHBondContact O-N 3.41Å; K513-D518 IonicContact NZ-OD1 3.8Å; K513-D518 PolarHBondContact NZ-OD1 3.35Å; K513-D518 IonicContact NZ-OD2 3.94Å; K513-D518 PolarHBondContact NZ-OD2 3Å; K513-D518 PolarHBondContact O-N 3.13Å; K513-L538 HydrophobicContact CB-CD1 4.42Å; K513-L538 HydrophobicContact CD-CB 4.11Å; K513-L538 HydrophobicContact CD-CD1 4.33Å; K513-D539 WeakPolarHBondContact CE-OD1 3.41Å; K513-D539 IonicContact NZ-OD1 2.8Å
514	H	85.4	Confident	88.8	Confident	30 Å²	30	30.2 Å²	30.2	14%	0.139	15%	0.145	C	C	.	.	I	π-helix	trans	-81.5	-38.8	-169	-69.6	-67.6	0	0	0	113.9	Y450 P453 W457 V510 D518 G519	Y450-H514 HydrophobicContact CE1-CB 3.88Å; P453-H514 HydrophobicContact CB-CB 4.48Å; P453-H514 HydrophobicContact CG-CB 3.62Å; W457-H514 AromaticContact CE2-CD2 3.75Å; W457-H514 AromaticContact CE2-NE2 3.45Å; W457-H514 AromaticContact CZ2-CD2 3.82Å; W457-H514 AromaticContact CZ2-NE2 3.2Å; W457-H514 WeakPolarHBondContact CZ2-NE2 3.12Å; W457-H514 AromaticContact NE1-CD2 3.27Å; W457-H514 PolarHBondContact NE1-CD2 3.45Å; W457-H514 VanDerWaalsContact NE1-CD2 3.27Å; W457-H514 AromaticContact NE1-NE2 3.17Å; W457-H514 PolarHBondContact NE1-NE2 3.34Å; W457-H514 VanDerWaalsContact NE1-NE2 3.17Å; V510-H514 WeakPolarHBondContact O-CB 3.46Å; V510-H514 PolarHBondContact O-N 2.59Å; H514-D518 IonicContact CE1-OD2 3.03Å; H514-D518 IonicContact CG-OD2 3Å; H514-D518 IonicContact ND1-OD2 3.32Å; H514-D518 PolarHBondContact ND1-OD2 2.84Å; H514-G519 PolarHBondContact O-N 3.48Å; H514-G519 VanDerWaalsContact O-N 3.14Å
515	T	83.6	Confident	88.8	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.129	C	C	.	.	I	π-helix	trans	-77.4	-48.4	179.2	-47.7	0	0	0	0	110.7	I511 F612 L616 F622	I511-T515 WeakPolarHBondContact O-CA 3.33Å; I511-T515 WeakPolarHBondContact O-CB 3.45Å; I511-T515 PolarHBondContact O-N 3.26Å; I511-T515 PolarHBondContact O-OG1 3.46Å; T515-F612 WeakPolarHBondContact O-CZ 3.38Å; T515-L616 HydrophobicContact CG2-CD1 4.09Å; T515-L616 HydrophobicContact CG2-CD2 3.51Å; T515-L616 HydrophobicContact CG2-CG 4.47Å; T515-F622 HydrophobicContact CG2-CD1 4.29Å; T515-F622 HydrophobicContact CG2-CE1 3.56Å; T515-F622 HydrophobicContact CG2-CZ 3.81Å; T515-F622 WeakPolarHBondContact OG1-CE1 3.48Å
516	Y	88.1	Confident	88.6	Confident	5 Å²	5	27 Å²	27	2%	0.02	13%	0.131	C	C	.	.	I	π-helix	trans	-86.3	-59.7	-177.9	-69.1	-88.5	0	0	0	112.8	I511 L512 L520 F612 L616 R625 S626 L627	I511-Y516 HydrophobicContact CG2-CD2 4.26Å; I511-Y516 HydrophobicContact CG2-CE2 4.07Å; I511-Y516 PolarHBondContact O-N 2.81Å; L512-Y516 HydrophobicContact CD1-CD2 4.27Å; L512-Y516 HydrophobicContact CD1-CG 4.43Å; L512-Y516 WeakPolarHBondContact O-CB 3.48Å; Y516-L520 WeakPolarHBondContact O-CB 3.31Å; Y516-L520 WeakPolarHBondContact O-CD1 3.3Å; Y516-L520 WeakPolarHBondContact O-CG 3.44Å; Y516-L520 PolarHBondContact O-N 3.13Å; Y516-F612 HydrophobicContact CD1-CE1 4.16Å; Y516-L616 HydrophobicContact CD1-CD1 4.21Å; Y516-L616 HydrophobicContact CE1-CD1 3.72Å; Y516-R625 PolarHBondContact OH-O 2.87Å; Y516-S626 WeakPolarHBondContact OH-CA 3.48Å; Y516-L627 HydrophobicContact CD1-CB 4.09Å; Y516-L627 HydrophobicContact CD1-CD1 4.35Å; Y516-L627 HydrophobicContact CE1-CB 3.71Å; Y516-L627 HydrophobicContact CG-CD1 4.33Å; Y516-L627 PolarHBondContact OH-N 3.48Å
517	F	90	Very high	88.5	Confident	22 Å²	22	29 Å²	29	10%	0.096	15%	0.145	C	C	.	.	I	π-helix	trans	-63.3	-59.7	-175.7	-169	-78.1	0	0	0	111.8	L512 K513 L520 L521 E528 L531 M535 L538	L512-F517 PolarHBondContact O-N 3.36Å; K513-F517 HydrophobicContact CD-CB 4.27Å; K513-F517 HydrophobicContact CD-CG 4.45Å; K513-F517 CarbonylContact O-C 3.51Å; K513-F517 WeakPolarHBondContact O-CA 3.41Å; K513-F517 WeakPolarHBondContact O-CB 3.45Å; K513-F517 PolarHBondContact O-N 3.41Å; F517-L520 PolarHBondContact O-N 2.95Å; F517-L521 HydrophobicContact CE1-CD2 4.3Å; F517-L521 WeakPolarHBondContact O-CB 3.39Å; F517-L521 PolarHBondContact O-N 3.34Å; F517-E528 HydrophobicContact CZ-CG 4.41Å; F517-L531 HydrophobicContact CD1-CD1 4.4Å; F517-L531 HydrophobicContact CD2-CB 3.72Å; F517-L531 HydrophobicContact CD2-CD1 4.49Å; F517-L531 HydrophobicContact CD2-CG 4.49Å; F517-L531 HydrophobicContact CE2-CB 3.5Å; F517-L531 HydrophobicContact CG-CB 4.41Å; F517-L531 HydrophobicContact CG-CD1 4.39Å; F517-L531 HydrophobicContact CZ-CB 4.01Å; F517-L531 WeakPolarHBondContact O-CD1 3.35Å; F517-M535 HydrophobicContact CB-SD 3.77Å; F517-M535 HydrophobicContact CD2-CG 3.7Å; F517-M535 HydrophobicContact CD2-SD 3.97Å; F517-M535 HydrophobicContact CE2-CG 4.47Å; F517-M535 HydrophobicContact CG-SD 4.39Å; F517-L538 HydrophobicContact CB-CD1 4.24Å; F517-L538 HydrophobicContact CD2-CD1 4.32Å
518	D	88	Confident	88.6	Confident	23 Å²	23	34 Å²	34	12%	0.123	17%	0.168	C	C	.	.	I	π-helix	trans	-68.3	-44.4	-175.4	-58.8	-24.6	0	0	0	110.8	K513 H514 L520 L521 E522	K513-D518 IonicContact NZ-OD1 3.8Å; K513-D518 PolarHBondContact NZ-OD1 3.35Å; K513-D518 IonicContact NZ-OD2 3.94Å; K513-D518 PolarHBondContact NZ-OD2 3Å; K513-D518 PolarHBondContact O-N 3.13Å; H514-D518 IonicContact CE1-OD2 3.03Å; H514-D518 IonicContact CG-OD2 3Å; H514-D518 IonicContact ND1-OD2 3.32Å; H514-D518 PolarHBondContact ND1-OD2 2.84Å; D518-L520 VanDerWaalsContact C-N 3.33Å; D518-L520 PolarHBondContact O-N 2.93Å; D518-L521 PolarHBondContact O-N 3.37Å; D518-L521 VanDerWaalsContact O-N 3.13Å; D518-E522 WeakPolarHBondContact O-CB 3.2Å; D518-E522 WeakPolarHBondContact O-CG 3.31Å; D518-E522 PolarHBondContact O-N 3.15Å
519	G	86.5	Confident	88.5	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-38.6	175.7	0	0	0	0	0	114.1	H514 L523	H514-G519 PolarHBondContact O-N 3.48Å; H514-G519 VanDerWaalsContact O-N 3.14Å; G519-L523 VanDerWaalsContact O-CB 3.31Å; G519-L523 WeakPolarHBondContact O-CB 3.37Å; G519-L523 WeakPolarHBondContact O-CD1 3.31Å; G519-L523 WeakPolarHBondContact O-CG 3.23Å; G519-L523 PolarHBondContact O-N 3.13Å
520	L	90.1	Very high	88.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-74.5	-30.5	176.6	-71.7	167.9	0	0	0	112.8	Y516 F517 D518 I525 L526 L531 F609 F612	Y516-L520 WeakPolarHBondContact O-CB 3.31Å; Y516-L520 WeakPolarHBondContact O-CD1 3.3Å; Y516-L520 WeakPolarHBondContact O-CG 3.44Å; Y516-L520 PolarHBondContact O-N 3.13Å; F517-L520 PolarHBondContact O-N 2.95Å; D518-L520 VanDerWaalsContact C-N 3.33Å; D518-L520 PolarHBondContact O-N 2.93Å; L520-I525 HydrophobicContact CD2-CB 3.99Å; L520-I525 HydrophobicContact CD2-CD1 4.01Å; L520-I525 HydrophobicContact CD2-CG2 3.92Å; L520-I525 PolarHBondContact O-N 3.08Å; L520-L526 HydrophobicContact CD1-CD1 4.1Å; L520-L526 PolarHBondContact O-N 3.21Å; L520-L531 HydrophobicContact CB-CD1 4.33Å; L520-L531 HydrophobicContact CB-CD2 3.95Å; L520-L531 HydrophobicContact CD1-CD2 3.88Å; L520-F609 HydrophobicContact CD1-CD2 4.4Å; L520-F609 HydrophobicContact CD1-CE2 3.73Å; L520-F609 HydrophobicContact CD2-CD2 3.75Å; L520-F609 HydrophobicContact CD2-CE2 3.87Å; L520-F612 HydrophobicContact CD1-CE1 4.42Å; L520-F612 HydrophobicContact CD2-CD1 3.56Å; L520-F612 HydrophobicContact CD2-CD2 4.39Å; L520-F612 HydrophobicContact CD2-CE1 3.67Å; L520-F612 HydrophobicContact CD2-CE2 4.48Å; L520-F612 HydrophobicContact CD2-CG 3.94Å; L520-F612 HydrophobicContact CD2-CZ 4.14Å; L520-F612 HydrophobicContact CG-CD1 4.25Å; L520-F612 HydrophobicContact CG-CE1 3.83Å; L520-F612 HydrophobicContact CG-CZ 4.1Å
521	L	89.6	Confident	88.5	Confident	60 Å²	60	44.6 Å²	44.6	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-73.9	-48.5	178	-176.6	60.9	0	0	0	111.5	F517 D518 L523 E524 E528 L531	F517-L521 HydrophobicContact CE1-CD2 4.3Å; F517-L521 WeakPolarHBondContact O-CB 3.39Å; F517-L521 PolarHBondContact O-N 3.34Å; D518-L521 PolarHBondContact O-N 3.37Å; D518-L521 VanDerWaalsContact O-N 3.13Å; L521-L523 VanDerWaalsContact C-N 3.29Å; L521-L523 PolarHBondContact O-N 3.33Å; L521-E524 WeakPolarHBondContact O-CA 3.22Å; L521-E524 PolarHBondContact O-N 2.98Å; L521-E528 HydrophobicContact CD1-CB 4.16Å; L521-L531 HydrophobicContact CB-CD1 3.72Å; L521-L531 HydrophobicContact CD1-CD1 4.33Å
522	E	87.2	Confident	88.6	Confident	125 Å²	125	46.8 Å²	46.8	58%	0.584	24%	0.236	S	C	*	.	H	α-helix	trans	-63.6	-35.3	179.9	-74.1	179.9	-174.4	0	0	112.4	Y450 D518 E524	Y450-E522 WeakPolarHBondContact CD2-OE2 3.42Å; Y450-E522 VanDerWaalsContact CE2-OE2 3.29Å; Y450-E522 WeakPolarHBondContact CE2-OE2 3.44Å; D518-E522 WeakPolarHBondContact O-CB 3.2Å; D518-E522 WeakPolarHBondContact O-CG 3.31Å; D518-E522 PolarHBondContact O-N 3.15Å; E522-E524 PolarHBondContact O-N 2.93Å
523	L	87.2	Confident	88.4	Confident	44 Å²	44	51 Å²	51	23%	0.23	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	3.7	174.9	-63.7	177.1	0	0	0	113.1	L443 A447 G519 L521 I525 F612	L443-L523 HydrophobicContact CD1-CD1 3.79Å; L443-L523 HydrophobicContact CD1-CD2 3.31Å; L443-L523 HydrophobicContact CD1-CG 4.11Å; A447-L523 HydrophobicContact CB-CD2 4.26Å; G519-L523 VanDerWaalsContact O-CB 3.31Å; G519-L523 WeakPolarHBondContact O-CB 3.37Å; G519-L523 WeakPolarHBondContact O-CD1 3.31Å; G519-L523 WeakPolarHBondContact O-CG 3.23Å; G519-L523 PolarHBondContact O-N 3.13Å; L521-L523 VanDerWaalsContact C-N 3.29Å; L521-L523 PolarHBondContact O-N 3.33Å; L523-I525 HydrophobicContact CB-CD1 3.82Å; L523-I525 HydrophobicContact CB-CG1 3.78Å; L523-I525 HydrophobicContact CD1-CD1 4Å; L523-I525 PolarHBondContact O-N 3.47Å; L523-F612 HydrophobicContact CD1-CD2 3.68Å; L523-F612 HydrophobicContact CD1-CE2 3.85Å
524	E	88.3	Confident	88.3	Confident	179 Å²	179	50 Å²	50	84%	0.836	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	30.2	-178.4	-59	-178.3	175.8	0	0	112.9	L521 E522	L521-E524 WeakPolarHBondContact O-CA 3.22Å; L521-E524 PolarHBondContact O-N 2.98Å; E522-E524 PolarHBondContact O-N 2.93Å
525	I	88.6	Confident	88.5	Confident	19 Å²	19	48.7 Å²	48.7	10%	0.097	25%	0.251	C	S	.	.	S	Bend	trans	-77.4	-36.2	-179.6	-63	175.8	0	0	0	110.2	L520 L523 N606 N608 F609 F612	L520-I525 HydrophobicContact CD2-CB 3.99Å; L520-I525 HydrophobicContact CD2-CD1 4.01Å; L520-I525 HydrophobicContact CD2-CG2 3.92Å; L520-I525 PolarHBondContact O-N 3.08Å; L523-I525 HydrophobicContact CB-CD1 3.82Å; L523-I525 HydrophobicContact CB-CG1 3.78Å; L523-I525 HydrophobicContact CD1-CD1 4Å; L523-I525 PolarHBondContact O-N 3.47Å; I525-N606 PolarHBondContact O-ND2 3.49Å; I525-N608 HydrophobicContact CG1-CB 4.27Å; I525-N608 HydrophobicContact CG2-CB 4.38Å; I525-F609 HydrophobicContact CG2-CB 3.91Å; I525-F609 HydrophobicContact CG2-CD2 4.08Å; I525-F612 HydrophobicContact CD1-CB 3.84Å; I525-F612 HydrophobicContact CD1-CD2 4.08Å; I525-F612 HydrophobicContact CD1-CG 4.11Å
526	L	90.3	Very high	88.7	Confident	16 Å²	16	49.5 Å²	49.5	8%	0.084	26%	0.257	C	S	.	.	S	Bend	trans	-136	150	176.4	-64.4	178.6	0	0	0	110	L520 D530 L531 L534 L602 F609	L520-L526 HydrophobicContact CD1-CD1 4.1Å; L520-L526 PolarHBondContact O-N 3.21Å; L526-D530 HydrophobicContact CB-CB 4.35Å; L526-L531 HydrophobicContact CB-CD1 4.42Å; L526-L531 HydrophobicContact CB-CD2 4.14Å; L526-L531 HydrophobicContact CB-CG 3.9Å; L526-L531 HydrophobicContact CD1-CD2 3.82Å; L526-L531 HydrophobicContact CD1-CG 4.42Å; L526-L534 HydrophobicContact CD1-CD2 4.21Å; L526-L602 HydrophobicContact CD1-CD1 3.87Å; L526-L602 HydrophobicContact CD2-CD1 3.97Å; L526-L602 HydrophobicContact CD2-CD2 3.86Å; L526-F609 HydrophobicContact CD1-CD2 4.19Å; L526-F609 HydrophobicContact CD1-CE2 4.03Å
527	S	90.8	Very high	88.7	Confident	42 Å²	42	52.7 Å²	52.7	29%	0.294	27%	0.274	S	S	.	.			trans	-74.5	160.8	172.9	65.7	0	0	0	0	111.7	E529 D530 L531	S527-E529 WeakPolarHBondContact CB-OE2 3.39Å; S527-E529 PolarHBondContact O-N 3.31Å; S527-E529 PolarHBondContact OG-OE2 2.95Å; S527-D530 PolarHBondContact O-N 2.89Å; S527-D530 WeakPolarHBondContact OG-CB 3.43Å; S527-D530 PolarHBondContact OG-N 3.31Å; S527-D530 VanDerWaalsContact OG-N 3.15Å; S527-D530 PolarHBondContact OG-OD2 3.46Å; S527-L531 WeakPolarHBondContact O-CB 3.35Å; S527-L531 WeakPolarHBondContact O-CG 3.03Å; S527-L531 PolarHBondContact O-N 3.01Å
528	E	90.2	Very high	88.8	Confident	116 Å²	116	51.9 Å²	51.9	54%	0.542	27%	0.27	S	S	.	.	H	α-helix	trans	-59.8	-35.4	174.5	-173.1	176.4	179	0	0	111.5	F517 L521 L531 S532	F517-E528 HydrophobicContact CZ-CG 4.41Å; L521-E528 HydrophobicContact CD1-CB 4.16Å; E528-L531 PolarHBondContact O-N 3Å; E528-S532 VanDerWaalsContact O-CB 3.27Å; E528-S532 WeakPolarHBondContact O-CB 3.2Å; E528-S532 PolarHBondContact O-N 3.41Å; E528-S532 PolarHBondContact O-OG 3.48Å
529	E	89	Confident	88.9	Confident	137 Å²	137	55.4 Å²	55.4	64%	0.64	29%	0.29	S	S	*	.	H	α-helix	trans	-66.5	-44.3	175.6	-61.9	85.8	173.1	0	0	112	S527 L531 S532 V533	S527-E529 WeakPolarHBondContact CB-OE2 3.39Å; S527-E529 PolarHBondContact O-N 3.31Å; S527-E529 PolarHBondContact OG-OE2 2.95Å; E529-L531 VanDerWaalsContact C-N 3.32Å; E529-L531 PolarHBondContact O-N 3.35Å; E529-S532 PolarHBondContact O-N 3.27Å; E529-V533 WeakPolarHBondContact O-CG2 3.11Å; E529-V533 PolarHBondContact O-N 2.8Å
530	D	89.7	Confident	89.3	Confident	87 Å²	87	57.1 Å²	57.1	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-64	-40.3	177.7	-66.5	-41.6	0	0	0	111	L526 S527 V533 L534	L526-D530 HydrophobicContact CB-CB 4.35Å; S527-D530 PolarHBondContact O-N 2.89Å; S527-D530 WeakPolarHBondContact OG-CB 3.43Å; S527-D530 PolarHBondContact OG-N 3.31Å; S527-D530 VanDerWaalsContact OG-N 3.15Å; S527-D530 PolarHBondContact OG-OD2 3.46Å; D530-V533 PolarHBondContact O-N 3.24Å; D530-L534 WeakPolarHBondContact O-CB 3.46Å; D530-L534 PolarHBondContact O-N 2.96Å
531	L	90.3	Very high	89.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.9	-40	177	-73.5	170.2	0	0	0	112.3	F517 L520 L521 L526 S527 E528 E529 V533 L534 M535	F517-L531 HydrophobicContact CD1-CD1 4.4Å; F517-L531 HydrophobicContact CD2-CB 3.72Å; F517-L531 HydrophobicContact CD2-CD1 4.49Å; F517-L531 HydrophobicContact CD2-CG 4.49Å; F517-L531 HydrophobicContact CE2-CB 3.5Å; F517-L531 HydrophobicContact CG-CB 4.41Å; F517-L531 HydrophobicContact CG-CD1 4.39Å; F517-L531 HydrophobicContact CZ-CB 4.01Å; F517-L531 WeakPolarHBondContact O-CD1 3.35Å; L520-L531 HydrophobicContact CB-CD1 4.33Å; L520-L531 HydrophobicContact CB-CD2 3.95Å; L520-L531 HydrophobicContact CD1-CD2 3.88Å; L521-L531 HydrophobicContact CB-CD1 3.72Å; L521-L531 HydrophobicContact CD1-CD1 4.33Å; L526-L531 HydrophobicContact CB-CD1 4.42Å; L526-L531 HydrophobicContact CB-CD2 4.14Å; L526-L531 HydrophobicContact CB-CG 3.9Å; L526-L531 HydrophobicContact CD1-CD2 3.82Å; L526-L531 HydrophobicContact CD1-CG 4.42Å; S527-L531 WeakPolarHBondContact O-CB 3.35Å; S527-L531 WeakPolarHBondContact O-CG 3.03Å; S527-L531 PolarHBondContact O-N 3.01Å; E528-L531 PolarHBondContact O-N 3Å; E529-L531 VanDerWaalsContact C-N 3.32Å; E529-L531 PolarHBondContact O-N 3.35Å; L531-V533 PolarHBondContact O-N 2.95Å; L531-L534 PolarHBondContact O-N 2.86Å; L531-L534 VanDerWaalsContact O-N 3.07Å; L531-M535 WeakPolarHBondContact O-CG 3.41Å; L531-M535 PolarHBondContact O-N 3.49Å
532	S	88	Confident	89.6	Confident	53 Å²	53	54.8 Å²	54.8	37%	0.371	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-31.7	175.2	-64.5	0	0	0	0	112.2	E528 E529 P536	E528-S532 VanDerWaalsContact O-CB 3.27Å; E528-S532 WeakPolarHBondContact O-CB 3.2Å; E528-S532 PolarHBondContact O-N 3.41Å; E528-S532 PolarHBondContact O-OG 3.48Å; E529-S532 PolarHBondContact O-N 3.27Å; S532-P536 VanDerWaalsContact O-CA 3.3Å; S532-P536 WeakPolarHBondContact O-CA 3.36Å; S532-P536 WeakPolarHBondContact O-CB 3.4Å
533	V	86.4	Confident	90	Very high	87 Å²	87	51.8 Å²	51.8	53%	0.527	27%	0.273	S	S	.	.	H	α-helix	trans	-75.1	-35.5	171.8	173.3	0	0	0	0	111.7	E529 D530 L531 Q591	E529-V533 WeakPolarHBondContact O-CG2 3.11Å; E529-V533 PolarHBondContact O-N 2.8Å; D530-V533 PolarHBondContact O-N 3.24Å; L531-V533 PolarHBondContact O-N 2.95Å; V533-Q591 WeakPolarHBondContact O-CG 3.4Å; V533-Q591 PolarHBondContact O-NE2 3.43Å
534	L	86.6	Confident	90.4	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-73.9	-40.4	-178.6	-170.1	63.5	0	0	0	112.1	L526 D530 L531 S595 E598 L627	L526-L534 HydrophobicContact CD1-CD2 4.21Å; D530-L534 WeakPolarHBondContact O-CB 3.46Å; D530-L534 PolarHBondContact O-N 2.96Å; L531-L534 PolarHBondContact O-N 2.86Å; L531-L534 VanDerWaalsContact O-N 3.07Å; L534-S595 WeakPolarHBondContact CD1-O 3.41Å; L534-S595 WeakPolarHBondContact O-CB 3.48Å; L534-S595 PolarHBondContact O-OG 2.7Å; L534-E598 HydrophobicContact CD1-CB 4.04Å; L534-E598 HydrophobicContact CD1-CG 4.14Å; L534-L627 HydrophobicContact CD2-CD2 3.95Å; L534-L627 HydrophobicContact CG-CD2 4.37Å
535	M	90.4	Very high	90.7	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.222	C	C	.	.	S	Bend	trans	-146.2	80.9	-176.6	56.9	-171.1	81.9	0	0	111	L512 F517 L531 L538 L627	L512-M535 HydrophobicContact CD1-CE 4.08Å; L512-M535 HydrophobicContact CD1-SD 3.84Å; L512-M535 HydrophobicContact CG-SD 4.09Å; F517-M535 HydrophobicContact CB-SD 3.77Å; F517-M535 HydrophobicContact CD2-CG 3.7Å; F517-M535 HydrophobicContact CD2-SD 3.97Å; F517-M535 HydrophobicContact CE2-CG 4.47Å; F517-M535 HydrophobicContact CG-SD 4.39Å; L531-M535 WeakPolarHBondContact O-CG 3.41Å; L531-M535 PolarHBondContact O-N 3.49Å; M535-L538 HydrophobicContact CB-CD1 3.94Å; M535-L538 HydrophobicContact CB-CD2 4.36Å; M535-L538 HydrophobicContact CB-CG 4.18Å; M535-L538 HydrophobicContact CG-CD1 3.62Å; M535-L538 HydrophobicContact CG-CG 4.27Å; M535-L538 HydrophobicContact SD-CD1 3.54Å; M535-L538 VanDerWaalsContact SD-CD1 3.54Å; M535-L627 HydrophobicContact CE-CD1 3.82Å; M535-L627 HydrophobicContact CE-CD2 4.19Å
536	P	87.8	Confident	90.9	Very high	19 Å²	19	41.3 Å²	41.3	12%	0.123	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	146.6	-173	27.4	-34.5	0	0	0	113.1	S532 L538 F588 Q591	S532-P536 VanDerWaalsContact O-CA 3.3Å; S532-P536 WeakPolarHBondContact O-CA 3.36Å; S532-P536 WeakPolarHBondContact O-CB 3.4Å; P536-L538 VanDerWaalsContact C-N 3.32Å; P536-L538 PolarHBondContact O-N 2.8Å; P536-F588 HydrophobicContact CG-CD2 4.4Å; P536-Q591 HydrophobicContact CG-CB 4.39Å; P536-Q591 HydrophobicContact CG-CG 4.49Å
537	N	88.4	Confident	91.1	Very high	71 Å²	71	45.9 Å²	45.9	38%	0.38	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	55	37.7	167.5	-58	-41.8	0	0	0	115	D539 V540 M541 V584	N537-D539 VanDerWaalsContact C-N 3.32Å; N537-D539 PolarHBondContact O-N 3.14Å; N537-V540 PolarHBondContact O-N 3.46Å; N537-M541 PolarHBondContact O-N 2.98Å; N537-M541 VanDerWaalsContact O-N 3.1Å; N537-V584 HydrophobicContact CB-CG1 4.1Å; N537-V584 HydrophobicContact CB-CG2 4.2Å
538	L	91.5	Very high	91.3	Very high	5 Å²	5	44 Å²	44	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-36	-179.3	-71.6	-177.7	0	0	0	113.3	L512 K513 F517 M535 P536 M541 L542 F588	L512-L538 HydrophobicContact CD2-CD1 4.33Å; L512-L538 HydrophobicContact CD2-CD2 3.63Å; L512-L538 HydrophobicContact CG-CD1 3.94Å; L512-L538 HydrophobicContact CG-CD2 4.14Å; K513-L538 HydrophobicContact CB-CD1 4.42Å; K513-L538 HydrophobicContact CD-CB 4.11Å; K513-L538 HydrophobicContact CD-CD1 4.33Å; F517-L538 HydrophobicContact CB-CD1 4.24Å; F517-L538 HydrophobicContact CD2-CD1 4.32Å; M535-L538 HydrophobicContact CB-CD1 3.94Å; M535-L538 HydrophobicContact CB-CD2 4.36Å; M535-L538 HydrophobicContact CB-CG 4.18Å; M535-L538 HydrophobicContact CG-CD1 3.62Å; M535-L538 HydrophobicContact CG-CG 4.27Å; M535-L538 HydrophobicContact SD-CD1 3.54Å; M535-L538 VanDerWaalsContact SD-CD1 3.54Å; P536-L538 VanDerWaalsContact C-N 3.32Å; P536-L538 PolarHBondContact O-N 2.8Å; L538-M541 WeakPolarHBondContact O-CB 3.42Å; L538-M541 PolarHBondContact O-N 3.2Å; L538-L542 VanDerWaalsContact O-CB 3.29Å; L538-L542 WeakPolarHBondContact O-CB 3.27Å; L538-L542 PolarHBondContact O-N 3.39Å; L538-F588 HydrophobicContact CD2-CE2 3.94Å
539	D	90.9	Very high	91.5	Very high	98 Å²	98	38.9 Å²	38.9	52%	0.524	20%	0.202	S	C	.	.	H	α-helix	trans	-61.9	-47.7	179.9	-60.2	-69.9	0	0	0	111.7	K513 N537 M541 L542 E543	K513-D539 WeakPolarHBondContact CE-OD1 3.41Å; K513-D539 IonicContact NZ-OD1 2.8Å; N537-D539 VanDerWaalsContact C-N 3.32Å; N537-D539 PolarHBondContact O-N 3.14Å; D539-M541 VanDerWaalsContact C-N 3.33Å; D539-M541 PolarHBondContact O-N 3.43Å; D539-L542 PolarHBondContact O-N 3.46Å; D539-E543 WeakPolarHBondContact O-CB 3.48Å; D539-E543 PolarHBondContact O-N 3.49Å
540	V	93.4	Very high	91.6	Very high	37 Å²	37	37.6 Å²	37.6	22%	0.224	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-38.5	177.3	-171.1	0	0	0	0	110.7	N537 E543 I544 K580 V584	N537-V540 PolarHBondContact O-N 3.46Å; V540-E543 PolarHBondContact O-N 3.12Å; V540-I544 HydrophobicContact CG1-CD1 4.13Å; V540-I544 VanDerWaalsContact O-CD1 3.32Å; V540-I544 WeakPolarHBondContact O-CD1 3.47Å; V540-I544 VanDerWaalsContact O-CG1 3.23Å; V540-I544 WeakPolarHBondContact O-CG1 3.43Å; V540-I544 PolarHBondContact O-N 3.49Å; V540-I544 VanDerWaalsContact O-N 3.14Å; V540-K580 HydrophobicContact CG1-CB 4.23Å; V540-K580 HydrophobicContact CG1-CD 4.47Å; V540-V584 HydrophobicContact CB-CG2 3.74Å; V540-V584 HydrophobicContact CG1-CG2 3.55Å
541	M	94.4	Very high	91.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.1	-49	174.5	-169.9	68.1	91.7	0	0	111	L509 N537 L538 D539 I544 H545 V584 Y585 F588 I634	L509-M541 HydrophobicContact CD1-CG 4.09Å; L509-M541 HydrophobicContact CD2-CB 4.31Å; L509-M541 HydrophobicContact CD2-CG 3.57Å; N537-M541 PolarHBondContact O-N 2.98Å; N537-M541 VanDerWaalsContact O-N 3.1Å; L538-M541 WeakPolarHBondContact O-CB 3.42Å; L538-M541 PolarHBondContact O-N 3.2Å; D539-M541 VanDerWaalsContact C-N 3.33Å; D539-M541 PolarHBondContact O-N 3.43Å; M541-I544 PolarHBondContact O-N 3.27Å; M541-H545 PolarHBondContact O-CD2 3.09Å; M541-H545 PolarHBondContact O-N 3.27Å; M541-V584 HydrophobicContact CB-CG1 3.8Å; M541-V584 HydrophobicContact CE-CG1 3.51Å; M541-V584 HydrophobicContact CG-CG1 4.35Å; M541-V584 HydrophobicContact SD-CG1 3.81Å; M541-Y585 HydrophobicContact CE-CD1 4.02Å; M541-Y585 HydrophobicContact CE-CD2 3.98Å; M541-Y585 HydrophobicContact CE-CE1 3.94Å; M541-Y585 HydrophobicContact CE-CE2 3.92Å; M541-Y585 HydrophobicContact CE-CG 4.05Å; M541-Y585 HydrophobicContact SD-CD2 3.91Å; M541-Y585 HydrophobicContact SD-CE1 4.38Å; M541-Y585 HydrophobicContact SD-CE2 3.45Å; M541-Y585 WeakPolarHBondContact SD-CE2 3.36Å; M541-F588 HydrophobicContact CE-CB 4.22Å; M541-F588 HydrophobicContact CE-CD1 4.48Å; M541-F588 HydrophobicContact CE-CG 4.19Å; M541-I634 HydrophobicContact CE-CG2 3.89Å
542	L	93.4	Very high	91.9	Very high	11 Å²	11	35.4 Å²	35.4	6%	0.058	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-42.4	-179.3	-177.8	58	0	0	0	111.3	W457 L509 V510 L538 D539 I544 H545 L546	W457-L542 HydrophobicContact CH2-CD1 4.45Å; W457-L542 HydrophobicContact CH2-CD2 3.6Å; W457-L542 HydrophobicContact CH2-CG 4.23Å; W457-L542 HydrophobicContact CZ2-CD2 3.96Å; L509-L542 HydrophobicContact CB-CD1 3.78Å; V510-L542 HydrophobicContact CG2-CD1 3.88Å; V510-L542 HydrophobicContact CG2-CD2 4.3Å; L538-L542 VanDerWaalsContact O-CB 3.29Å; L538-L542 WeakPolarHBondContact O-CB 3.27Å; L538-L542 PolarHBondContact O-N 3.39Å; D539-L542 PolarHBondContact O-N 3.46Å; L542-I544 PolarHBondContact O-N 3.46Å; L542-H545 PolarHBondContact O-N 3.28Å; L542-L546 HydrophobicContact CD1-CD1 3.72Å; L542-L546 HydrophobicContact CD1-CD2 4.36Å; L542-L546 HydrophobicContact CD1-CG 3.78Å; L542-L546 HydrophobicContact CD2-CD1 4.41Å; L542-L546 HydrophobicContact CG-CD1 3.63Å; L542-L546 HydrophobicContact CG-CG 4.17Å; L542-L546 VanDerWaalsContact O-CB 3.31Å; L542-L546 WeakPolarHBondContact O-CB 3.36Å; L542-L546 VanDerWaalsContact O-CG 3.24Å; L542-L546 WeakPolarHBondContact O-CG 3.28Å; L542-L546 PolarHBondContact O-N 2.84Å
543	E	94.2	Very high	92	Very high	63 Å²	63	36.8 Å²	36.8	29%	0.294	18%	0.184	S	C	.	.	H	α-helix	trans	-55	-49.9	175.8	-175.1	-168.8	174.7	0	0	112.1	D539 V540 H545 L546 R547	D539-E543 WeakPolarHBondContact O-CB 3.48Å; D539-E543 PolarHBondContact O-N 3.49Å; V540-E543 PolarHBondContact O-N 3.12Å; E543-H545 PolarHBondContact O-N 3.36Å; E543-L546 PolarHBondContact O-N 3.5Å; E543-R547 WeakPolarHBondContact O-CB 3.38Å; E543-R547 VanDerWaalsContact O-CG 3.32Å; E543-R547 WeakPolarHBondContact O-CG 3.47Å; E543-R547 PolarHBondContact O-N 3.32Å; E543-R547 IonicContact OE1-CZ 3.5Å; E543-R547 IonicContact OE1-NE 2.81Å; E543-R547 PolarHBondContact OE1-NE 3.32Å; E543-R547 IonicContact OE1-NH2 3.67Å; E543-R547 PolarHBondContact OE1-NH2 3.36Å
544	I	95.3	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-49.2	-178.7	-65.8	159.4	0	0	0	110.7	V540 M541 L542 R547 F548 L572 K580 M581	V540-I544 HydrophobicContact CG1-CD1 4.13Å; V540-I544 VanDerWaalsContact O-CD1 3.32Å; V540-I544 WeakPolarHBondContact O-CD1 3.47Å; V540-I544 VanDerWaalsContact O-CG1 3.23Å; V540-I544 WeakPolarHBondContact O-CG1 3.43Å; V540-I544 PolarHBondContact O-N 3.49Å; V540-I544 VanDerWaalsContact O-N 3.14Å; M541-I544 PolarHBondContact O-N 3.27Å; L542-I544 PolarHBondContact O-N 3.46Å; I544-R547 PolarHBondContact O-N 3.18Å; I544-F548 PolarHBondContact O-N 3.29Å; I544-F548 VanDerWaalsContact O-N 3.12Å; I544-L572 HydrophobicContact CG2-CD1 3.62Å; I544-K580 HydrophobicContact CD1-CB 3.92Å; I544-K580 HydrophobicContact CG1-CB 4.37Å; I544-M581 HydrophobicContact CD1-CB 4.1Å; I544-M581 HydrophobicContact CG2-CB 4.41Å; I544-M581 HydrophobicContact CG2-CG 4.4Å; I544-M581 HydrophobicContact CG2-SD 4.41Å
545	H	95.9	Very high	92.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-71.8	-36.2	-175.9	-76.5	-70.7	0	0	0	112.8	E502 H505 L509 M541 L542 E543 F548 L549 Y585 Y641	E502-H545 WeakPolarHBondContact OE1-CB 3.29Å; E502-H545 IonicContact OE1-CE1 3.93Å; E502-H545 IonicContact OE1-CG 2.85Å; E502-H545 IonicContact OE1-ND1 3.06Å; E502-H545 PolarHBondContact OE1-ND1 3.47Å; H505-H545 AromaticContact CD2-CD2 3.87Å; H505-H545 AromaticContact CD2-CE1 3.59Å; H505-H545 AromaticContact CD2-CG 3.53Å; H505-H545 AromaticContact CD2-ND1 3.34Å; H505-H545 PolarHBondContact CD2-ND1 2.85Å; H505-H545 VanDerWaalsContact CD2-ND1 3.34Å; H505-H545 AromaticContact CD2-NE2 3.88Å; H505-H545 AromaticContact NE2-CD2 3.32Å; H505-H545 PolarHBondContact NE2-CD2 3.27Å; H505-H545 VanDerWaalsContact NE2-CD2 3.32Å; H505-H545 AromaticContact NE2-CE1 3.25Å; H505-H545 PolarHBondContact NE2-CE1 2.98Å; H505-H545 AromaticContact NE2-CG 3.49Å; H505-H545 AromaticContact NE2-ND1 3.44Å; H505-H545 PolarHBondContact NE2-ND1 3.29Å; H505-H545 AromaticContact NE2-NE2 3.14Å; H505-H545 PolarHBondContact NE2-NE2 3.43Å; H505-H545 VanDerWaalsContact NE2-NE2 3.14Å; L509-H545 HydrophobicContact CD1-CB 3.91Å; M541-H545 PolarHBondContact O-CD2 3.09Å; M541-H545 PolarHBondContact O-N 3.27Å; L542-H545 PolarHBondContact O-N 3.28Å; E543-H545 PolarHBondContact O-N 3.36Å; H545-F548 PolarHBondContact O-N 3.46Å; H545-L549 WeakPolarHBondContact O-CB 3.34Å; H545-L549 PolarHBondContact O-N 2.76Å; H545-Y585 PolarHBondContact CE1-OH 3.18Å; H545-Y585 AromaticContact NE2-CE2 3.7Å; H545-Y585 AromaticContact NE2-CZ 3.7Å; H545-Y585 PolarHBondContact NE2-OH 2.94Å; H545-Y641 PolarHBondContact CE1-OH 3.35Å; H545-Y641 PolarHBondContact ND1-OH 3.27Å; H545-Y641 VanDerWaalsContact ND1-OH 3.16Å
546	L	93.2	Very high	92.2	Very high	22 Å²	22	41.5 Å²	41.5	12%	0.115	20%	0.199	C	C	.	.	H	α-helix	trans	-66.3	-42.8	174.1	-74.1	173	0	0	0	112.1	W457 V460 L462 C506 L542 E543 F548 L549 Q550	W457-L546 HydrophobicContact CH2-CD1 3.75Å; W457-L546 HydrophobicContact CZ3-CD1 3.5Å; W457-L546 VanDerWaalsContact CZ3-CD1 3.5Å; W457-L546 HydrophobicContact CZ3-CD2 4.05Å; W457-L546 HydrophobicContact CZ3-CG 4.4Å; V460-L546 HydrophobicContact CG1-CD2 4.3Å; L462-L546 HydrophobicContact CD1-CD2 4.23Å; C506-L546 HydrophobicContact CB-CD2 4.14Å; L542-L546 HydrophobicContact CD1-CD1 3.72Å; L542-L546 HydrophobicContact CD1-CD2 4.36Å; L542-L546 HydrophobicContact CD1-CG 3.78Å; L542-L546 HydrophobicContact CD2-CD1 4.41Å; L542-L546 HydrophobicContact CG-CD1 3.63Å; L542-L546 HydrophobicContact CG-CG 4.17Å; L542-L546 VanDerWaalsContact O-CB 3.31Å; L542-L546 WeakPolarHBondContact O-CB 3.36Å; L542-L546 VanDerWaalsContact O-CG 3.24Å; L542-L546 WeakPolarHBondContact O-CG 3.28Å; L542-L546 PolarHBondContact O-N 2.84Å; E543-L546 PolarHBondContact O-N 3.5Å; L546-F548 VanDerWaalsContact C-N 3.28Å; L546-F548 PolarHBondContact O-N 2.88Å; L546-L549 PolarHBondContact O-N 3.16Å; L546-Q550 WeakPolarHBondContact O-CB 3.4Å; L546-Q550 VanDerWaalsContact O-CG 3.26Å; L546-Q550 WeakPolarHBondContact O-CG 3.39Å; L546-Q550 PolarHBondContact O-N 3.44Å
547	R	93.5	Very high	92.2	Very high	112 Å²	112	46.4 Å²	46.4	42%	0.423	22%	0.224	S	C	.	.	H	α-helix	trans	-59	-42.7	174.5	-75.6	-179.5	-176.6	-145.4	5.2	111.1	E543 I544 Q550 N551	E543-R547 WeakPolarHBondContact O-CB 3.38Å; E543-R547 VanDerWaalsContact O-CG 3.32Å; E543-R547 WeakPolarHBondContact O-CG 3.47Å; E543-R547 PolarHBondContact O-N 3.32Å; E543-R547 IonicContact OE1-CZ 3.5Å; E543-R547 IonicContact OE1-NE 2.81Å; E543-R547 PolarHBondContact OE1-NE 3.32Å; E543-R547 IonicContact OE1-NH2 3.67Å; E543-R547 PolarHBondContact OE1-NH2 3.36Å; I544-R547 PolarHBondContact O-N 3.18Å; R547-Q550 PolarHBondContact O-N 3.34Å; R547-N551 WeakPolarHBondContact O-CB 3.32Å; R547-N551 PolarHBondContact O-N 2.71Å
548	F	95.5	Very high	92.2	Very high	3 Å²	3	49.1 Å²	49.1	1%	0.013	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-43.3	176.1	-175.9	-123.1	0	0	0	112.4	L498 E502 I544 H545 L546 Q550 N551 L552 A568 F569 L572 Y641	L498-F548 HydrophobicContact CD1-CE1 4.31Å; L498-F548 HydrophobicContact CD2-CZ 4.21Å; E502-F548 HydrophobicContact CG-CD1 3.82Å; E502-F548 HydrophobicContact CG-CE1 4.33Å; E502-F548 WeakPolarHBondContact OE2-CD1 3.26Å; I544-F548 PolarHBondContact O-N 3.29Å; I544-F548 VanDerWaalsContact O-N 3.12Å; H545-F548 PolarHBondContact O-N 3.46Å; L546-F548 VanDerWaalsContact C-N 3.28Å; L546-F548 PolarHBondContact O-N 2.88Å; F548-Q550 VanDerWaalsContact C-N 3.33Å; F548-Q550 PolarHBondContact O-N 3.25Å; F548-N551 PolarHBondContact O-N 2.83Å; F548-L552 HydrophobicContact CD1-CD1 4.03Å; F548-L552 HydrophobicContact CD2-CG 4.48Å; F548-L552 HydrophobicContact CE1-CD1 3.61Å; F548-L552 HydrophobicContact CE1-CG 4.21Å; F548-L552 HydrophobicContact CE2-CD1 4.45Å; F548-L552 HydrophobicContact CE2-CD2 4.17Å; F548-L552 HydrophobicContact CE2-CG 4.17Å; F548-L552 HydrophobicContact CZ-CD1 3.86Å; F548-L552 HydrophobicContact CZ-CD2 4Å; F548-L552 HydrophobicContact CZ-CG 4.03Å; F548-L552 WeakPolarHBondContact O-CG 3.27Å; F548-L552 PolarHBondContact O-N 2.84Å; F548-A568 HydrophobicContact CE2-CB 4.25Å; F548-F569 HydrophobicContact CZ-CE1 4.49Å; F548-L572 HydrophobicContact CB-CD1 4.33Å; F548-L572 HydrophobicContact CB-CD2 4.13Å; F548-L572 HydrophobicContact CD1-CD2 3.83Å; F548-L572 HydrophobicContact CD2-CB 3.99Å; F548-L572 HydrophobicContact CD2-CD2 3.66Å; F548-L572 HydrophobicContact CD2-CG 4.33Å; F548-L572 HydrophobicContact CE1-CD2 4.11Å; F548-L572 HydrophobicContact CE2-CB 4.33Å; F548-L572 HydrophobicContact CE2-CD2 3.94Å; F548-L572 HydrophobicContact CG-CD2 3.6Å; F548-L572 HydrophobicContact CG-CG 4.5Å; F548-L572 HydrophobicContact CZ-CD2 4.15Å; F548-Y641 HydrophobicContact CD1-CE1 4.37Å; F548-Y641 AromaticContact CE1-CE1 3.79Å; F548-Y641 HydrophobicContact CE1-CE1 3.79Å
549	L	93.4	Very high	91.9	Very high	8 Å²	8	51.4 Å²	51.4	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-43	175.2	-179.7	62.9	0	0	0	112	L462 F499 E502 K503 C506 H545 L546 L552 K553	L462-L549 HydrophobicContact CD2-CD2 3.98Å; F499-L549 HydrophobicContact CD2-CD1 3.72Å; F499-L549 HydrophobicContact CE2-CD1 3.57Å; F499-L549 HydrophobicContact CZ-CD1 4.44Å; E502-L549 HydrophobicContact CB-CD1 4.26Å; E502-L549 HydrophobicContact CG-CB 4.12Å; E502-L549 HydrophobicContact CG-CD1 4.25Å; K503-L549 HydrophobicContact CB-CD1 4Å; K503-L549 HydrophobicContact CB-CD2 4.39Å; C506-L549 HydrophobicContact CB-CD2 4.18Å; H545-L549 WeakPolarHBondContact O-CB 3.34Å; H545-L549 PolarHBondContact O-N 2.76Å; L546-L549 PolarHBondContact O-N 3.16Å; L549-L552 PolarHBondContact O-N 3.23Å; L549-K553 WeakPolarHBondContact O-CB 3.45Å; L549-K553 PolarHBondContact O-N 2.81Å
550	Q	92.2	Very high	91.6	Very high	109 Å²	109	49.6 Å²	49.6	51%	0.509	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-41.2	176.2	-73.1	171.2	-5.7	0	0	111.7	L546 R547 F548 K553 K554	L546-Q550 WeakPolarHBondContact O-CB 3.4Å; L546-Q550 VanDerWaalsContact O-CG 3.26Å; L546-Q550 WeakPolarHBondContact O-CG 3.39Å; L546-Q550 PolarHBondContact O-N 3.44Å; R547-Q550 PolarHBondContact O-N 3.34Å; F548-Q550 VanDerWaalsContact C-N 3.33Å; F548-Q550 PolarHBondContact O-N 3.25Å; Q550-K553 PolarHBondContact O-N 3.37Å; Q550-K554 WeakPolarHBondContact O-CB 3.39Å; Q550-K554 PolarHBondContact O-N 2.6Å
551	N	93	Very high	91.2	Very high	37 Å²	37	50.1 Å²	50.1	20%	0.198	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-45.2	175.5	-166.4	3.4	0	0	0	111.3	R547 F548 K553 K554 L555 D571	R547-N551 WeakPolarHBondContact O-CB 3.32Å; R547-N551 PolarHBondContact O-N 2.71Å; F548-N551 PolarHBondContact O-N 2.83Å; N551-K553 VanDerWaalsContact C-N 3.35Å; N551-K553 PolarHBondContact O-N 3.04Å; N551-K554 PolarHBondContact O-N 3.14Å; N551-L555 WeakPolarHBondContact O-CG 3.32Å; N551-L555 PolarHBondContact O-N 3.19Å; N551-D571 PolarHBondContact ND2-OD2 2.96Å
552	L	92.9	Very high	90.9	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-42.6	174.5	-69.1	178.2	0	0	0	112.3	L498 F499 E502 F548 L549 L555 M556 I565	L498-L552 HydrophobicContact CD2-CD1 4.31Å; L498-L552 HydrophobicContact CD2-CD2 4.1Å; L498-L552 HydrophobicContact CG-CD1 4.05Å; F499-L552 HydrophobicContact CD2-CB 4.1Å; E502-L552 HydrophobicContact CB-CD1 4.24Å; E502-L552 HydrophobicContact CG-CD1 4.4Å; F548-L552 HydrophobicContact CD1-CD1 4.03Å; F548-L552 HydrophobicContact CD2-CG 4.48Å; F548-L552 HydrophobicContact CE1-CD1 3.61Å; F548-L552 HydrophobicContact CE1-CG 4.21Å; F548-L552 HydrophobicContact CE2-CD1 4.45Å; F548-L552 HydrophobicContact CE2-CD2 4.17Å; F548-L552 HydrophobicContact CE2-CG 4.17Å; F548-L552 HydrophobicContact CZ-CD1 3.86Å; F548-L552 HydrophobicContact CZ-CD2 4Å; F548-L552 HydrophobicContact CZ-CG 4.03Å; F548-L552 WeakPolarHBondContact O-CG 3.27Å; F548-L552 PolarHBondContact O-N 2.84Å; L549-L552 PolarHBondContact O-N 3.23Å; L552-L555 PolarHBondContact O-N 3.09Å; L552-M556 WeakPolarHBondContact O-CG 3.38Å; L552-M556 PolarHBondContact O-N 3.27Å; L552-I565 HydrophobicContact CD2-CD1 3.57Å
553	K	89.7	Confident	90.5	Very high	83 Å²	83	53.2 Å²	53.2	36%	0.361	27%	0.267	S	S	.	.	H	α-helix	trans	-62.1	-47.5	177.1	-172.4	172.3	-179.2	171.9	0	111.2	F499 L549 Q550 N551 L555 M556 D557	F499-K553 HydrophobicContact CE2-CB 4.06Å; L549-K553 WeakPolarHBondContact O-CB 3.45Å; L549-K553 PolarHBondContact O-N 2.81Å; Q550-K553 PolarHBondContact O-N 3.37Å; N551-K553 VanDerWaalsContact C-N 3.35Å; N551-K553 PolarHBondContact O-N 3.04Å; K553-L555 VanDerWaalsContact C-N 3.32Å; K553-L555 PolarHBondContact O-N 3.08Å; K553-M556 PolarHBondContact O-N 3.12Å; K553-M556 VanDerWaalsContact O-N 3.09Å; K553-D557 PolarHBondContact O-N 3.25Å
554	K	90.6	Very high	90.2	Very high	123 Å²	123	54.3 Å²	54.3	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-54.8	-47.2	176.3	-179.9	179.5	172.5	-178.2	0	111.7	Q550 N551 M556 D557 E558	Q550-K554 WeakPolarHBondContact O-CB 3.39Å; Q550-K554 PolarHBondContact O-N 2.6Å; N551-K554 PolarHBondContact O-N 3.14Å; K554-M556 VanDerWaalsContact C-N 3.29Å; K554-M556 PolarHBondContact O-N 3.25Å; K554-D557 PolarHBondContact O-N 2.63Å; K554-E558 WeakPolarHBondContact CE-OE1 3.45Å; K554-E558 HydrophobicContact CG-CG 4.42Å; K554-E558 WeakPolarHBondContact CG-OE1 3.29Å; K554-E558 IonicContact NZ-OE1 2.69Å; K554-E558 WeakPolarHBondContact O-CB 3.41Å; K554-E558 VanDerWaalsContact O-CG 3.3Å; K554-E558 WeakPolarHBondContact O-CG 2.94Å; K554-E558 PolarHBondContact O-N 3.44Å
555	L	90.3	Very high	90.1	Very high	23 Å²	23	54.3 Å²	54.3	12%	0.12	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-34.3	178.3	-73	175.9	0	0	0	113.5	N551 L552 K553 S559 V562 A568	N551-L555 WeakPolarHBondContact O-CG 3.32Å; N551-L555 PolarHBondContact O-N 3.19Å; L552-L555 PolarHBondContact O-N 3.09Å; K553-L555 VanDerWaalsContact C-N 3.32Å; K553-L555 PolarHBondContact O-N 3.08Å; L555-S559 PolarHBondContact O-N 2.99Å; L555-V562 HydrophobicContact CB-CG1 4.09Å; L555-V562 HydrophobicContact CD1-CG1 4.33Å; L555-A568 HydrophobicContact CD1-CB 3.79Å
556	M	87	Confident	90	Very high	43 Å²	43	55.2 Å²	55.2	21%	0.212	28%	0.277	C	S	.	.	H	α-helix	trans	-79.6	-31.8	177.5	-68.2	-172.1	-53.4	0	0	113.2	Y496 F499 L552 K553 K554 S559 V562	Y496-M556 HydrophobicContact CD2-SD 4.46Å; F499-M556 HydrophobicContact CB-CE 3.97Å; F499-M556 HydrophobicContact CB-SD 4.06Å; F499-M556 HydrophobicContact CD1-CE 3.52Å; F499-M556 HydrophobicContact CD1-SD 4.23Å; F499-M556 HydrophobicContact CD2-CE 3.19Å; F499-M556 HydrophobicContact CD2-SD 4.36Å; F499-M556 HydrophobicContact CE1-CE 3.7Å; F499-M556 HydrophobicContact CE2-CE 3.38Å; F499-M556 HydrophobicContact CG-CE 3.25Å; F499-M556 HydrophobicContact CG-SD 3.95Å; F499-M556 HydrophobicContact CZ-CE 3.63Å; L552-M556 WeakPolarHBondContact O-CG 3.38Å; L552-M556 PolarHBondContact O-N 3.27Å; K553-M556 PolarHBondContact O-N 3.12Å; K553-M556 VanDerWaalsContact O-N 3.09Å; K554-M556 VanDerWaalsContact C-N 3.29Å; K554-M556 PolarHBondContact O-N 3.25Å; M556-S559 CarbonylContact O-C 3.58Å; M556-S559 VanDerWaalsContact O-O 3.11Å; M556-V562 HydrophobicContact CG-CG2 3.91Å
557	D	86.6	Confident	89.9	Confident	122 Å²	122	59.5 Å²	59.5	65%	0.652	29%	0.294	S	S	*	.	H	α-helix	trans	-73.7	-34.7	177	-69.6	-16.9	0	0	0	111	K553 K554	K553-D557 PolarHBondContact O-N 3.25Å; K554-D557 PolarHBondContact O-N 2.63Å
558	E	89.6	Confident	90	Very high	128 Å²	128	54.2 Å²	54.2	60%	0.598	28%	0.275	S	S	*	.	H	α-helix	trans	-69.5	-35.7	175	-75	174.1	176.1	0	0	112.7	K554	K554-E558 WeakPolarHBondContact CE-OE1 3.45Å; K554-E558 HydrophobicContact CG-CG 4.42Å; K554-E558 WeakPolarHBondContact CG-OE1 3.29Å; K554-E558 IonicContact NZ-OE1 2.69Å; K554-E558 WeakPolarHBondContact O-CB 3.41Å; K554-E558 VanDerWaalsContact O-CG 3.3Å; K554-E558 WeakPolarHBondContact O-CG 2.94Å; K554-E558 PolarHBondContact O-N 3.44Å
559	S	85.4	Confident	90	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	28%	0.275	S	S	.	.			trans	-152.6	133	179.9	178	0	0	0	0	112.2	L555 M556 I561	L555-S559 PolarHBondContact O-N 2.99Å; M556-S559 CarbonylContact O-C 3.58Å; M556-S559 VanDerWaalsContact O-O 3.11Å; S559-I561 WeakPolarHBondContact CB-O 3.43Å; S559-I561 PolarHBondContact O-N 3.18Å; S559-I561 PolarHBondContact OG-N 3.42Å; S559-I561 PolarHBondContact OG-O 3.34Å
560	V	83.7	Confident	90	Very high	61 Å²	61	55.8 Å²	55.8	37%	0.37	28%	0.283	S	S	.	.	S	Bend	trans	-60.5	-28.4	172.7	-174.7	0	0	0	0	111.8	W472 F480	W472-V560 HydrophobicContact CZ2-CG1 4.08Å; W472-V560 WeakPolarHBondContact CZ2-O 3.5Å; W472-V560 PolarHBondContact NE1-O 3.26Å; W472-V560 VanDerWaalsContact NE1-O 3.08Å; F480-V560 HydrophobicContact CD2-CB 4.32Å; F480-V560 HydrophobicContact CD2-CG1 3.66Å; F480-V560 HydrophobicContact CE2-CB 4.03Å; F480-V560 HydrophobicContact CE2-CG1 3.76Å; F480-V560 HydrophobicContact CE2-CG2 4.12Å
561	I	86.6	Confident	90.1	Very high	48 Å²	48	54.9 Å²	54.9	25%	0.246	28%	0.282	C	S	.	.	S	Bend	trans	-109	106.8	175	-59.2	164.4	0	0	0	108.1	W472 F480 L484 S559 S563	W472-I561 HydrophobicContact CZ2-CG1 4.33Å; F480-I561 HydrophobicContact CD1-CD1 4.36Å; L484-I561 HydrophobicContact CD1-CD1 3.97Å; L484-I561 HydrophobicContact CD1-CG1 4.07Å; L484-I561 HydrophobicContact CD2-CD1 3.84Å; L484-I561 HydrophobicContact CG-CD1 4.35Å; S559-I561 WeakPolarHBondContact CB-O 3.43Å; S559-I561 PolarHBondContact O-N 3.18Å; S559-I561 PolarHBondContact OG-N 3.42Å; S559-I561 PolarHBondContact OG-O 3.34Å; I561-S563 PolarHBondContact O-N 2.98Å
562	V	87.1	Confident	90.1	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.03	27%	0.273	C	S	.	.			trans	-79.5	113.1	-178.6	-179.6	0	0	0	0	109.6	R491 Q492 I495 L555 M556 I565	R491-V562 PolarHBondContact NH2-O 3.22Å; Q492-V562 PolarHBondContact NE2-O 3.04Å; Q492-V562 VanDerWaalsContact OE1-N 3.1Å; I495-V562 HydrophobicContact CD1-CB 4.02Å; I495-V562 HydrophobicContact CD1-CG1 4.26Å; I495-V562 HydrophobicContact CG2-CB 4.24Å; I495-V562 HydrophobicContact CG2-CG1 4.4Å; I495-V562 HydrophobicContact CG2-CG2 4.26Å; L555-V562 HydrophobicContact CB-CG1 4.09Å; L555-V562 HydrophobicContact CD1-CG1 4.33Å; M556-V562 HydrophobicContact CG-CG2 3.91Å; V562-I565 HydrophobicContact CG1-CB 4.23Å
563	S	84.7	Confident	90.3	Very high	71 Å²	71	53.4 Å²	53.4	50%	0.497	27%	0.274	S	S	.	.			trans	-86.1	-50	176.4	44.1	0	0	0	0	112.1	R491 I561 I565	R491-S563 PolarHBondContact NH1-O 3.16Å; R491-S563 VanDerWaalsContact NH1-O 3.09Å; I561-S563 PolarHBondContact O-N 2.98Å; S563-I565 PolarHBondContact O-N 3.26Å
564	E	88.5	Confident	90.4	Very high	85 Å²	85	52.6 Å²	52.6	40%	0.397	28%	0.276	S	S	.	.			trans	-93.7	40	-165.3	-50.3	-165.1	148.3	0	0	114.9	D566 K567	E564-D566 VanDerWaalsContact C-OD1 3.27Å; E564-D566 WeakPolarHBondContact CA-OD1 3.49Å; E564-D566 PolarHBondContact O-N 2.97Å; E564-K567 HydrophobicContact CB-CD 4.19Å; E564-K567 HydrophobicContact CB-CG 4.38Å; E564-K567 PolarHBondContact O-N 2.92Å; E564-K567 IonicContact OE1-NZ 2.61Å; E564-K567 PolarHBondContact OE1-NZ 2.85Å; E564-K567 WeakPolarHBondContact OE2-CD 3.41Å; E564-K567 WeakPolarHBondContact OE2-CE 3.18Å; E564-K567 IonicContact OE2-NZ 3.68Å; E564-K567 PolarHBondContact OE2-NZ 3.18Å
565	I	93	Very high	90.4	Very high	1 Å²	1	49 Å²	49	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-27	179.4	-172.5	60.5	0	0	0	112.9	I495 L498 L552 V562 S563 K567 A568 F569 L648 M661	I495-I565 HydrophobicContact CD1-CB 4.08Å; I495-I565 HydrophobicContact CD1-CG1 4.37Å; I495-I565 HydrophobicContact CD1-CG2 4.08Å; I495-I565 HydrophobicContact CG1-CB 4.42Å; I495-I565 HydrophobicContact CG1-CG1 4.15Å; I495-I565 HydrophobicContact CG2-CD1 4.28Å; L498-I565 HydrophobicContact CD2-CD1 4.2Å; L552-I565 HydrophobicContact CD2-CD1 3.57Å; V562-I565 HydrophobicContact CG1-CB 4.23Å; S563-I565 PolarHBondContact O-N 3.26Å; I565-K567 VanDerWaalsContact C-N 3.32Å; I565-K567 PolarHBondContact O-N 3.07Å; I565-A568 HydrophobicContact CD1-CB 4.45Å; I565-A568 PolarHBondContact O-N 2.82Å; I565-F569 HydrophobicContact CD1-CE2 4.33Å; I565-F569 HydrophobicContact CG1-CD2 4.11Å; I565-F569 HydrophobicContact CG1-CE2 3.98Å; I565-F569 WeakPolarHBondContact O-CD2 3.44Å; I565-F569 PolarHBondContact O-N 3.44Å; I565-L648 HydrophobicContact CG1-CD1 4.09Å; I565-M661 HydrophobicContact CG2-SD 4Å
566	D	93	Very high	90.4	Very high	19 Å²	19	53.5 Å²	53.5	10%	0.102	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-40	176.7	58.7	-44.4	0	0	0	112.2	E564 A568 F569 L570 M661	E564-D566 VanDerWaalsContact C-OD1 3.27Å; E564-D566 WeakPolarHBondContact CA-OD1 3.49Å; E564-D566 PolarHBondContact O-N 2.97Å; D566-A568 PolarHBondContact O-N 3.19Å; D566-F569 PolarHBondContact O-N 3.1Å; D566-L570 WeakPolarHBondContact O-CG 3.4Å; D566-L570 PolarHBondContact O-N 3.09Å; D566-M661 HydrophobicContact CB-CG 4.14Å; D566-M661 HydrophobicContact CB-SD 3.71Å
567	K	92.5	Very high	90.6	Very high	111 Å²	111	52.3 Å²	52.3	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.3	-63.2	-173.8	-169.7	168	0	112.1	E564 I565 F569 L570 D571	E564-K567 HydrophobicContact CB-CD 4.19Å; E564-K567 HydrophobicContact CB-CG 4.38Å; E564-K567 PolarHBondContact O-N 2.92Å; E564-K567 IonicContact OE1-NZ 2.61Å; E564-K567 PolarHBondContact OE1-NZ 2.85Å; E564-K567 WeakPolarHBondContact OE2-CD 3.41Å; E564-K567 WeakPolarHBondContact OE2-CE 3.18Å; E564-K567 IonicContact OE2-NZ 3.68Å; E564-K567 PolarHBondContact OE2-NZ 3.18Å; I565-K567 VanDerWaalsContact C-N 3.32Å; I565-K567 PolarHBondContact O-N 3.07Å; K567-F569 VanDerWaalsContact C-N 3.32Å; K567-F569 PolarHBondContact O-N 3.33Å; K567-L570 PolarHBondContact O-N 2.73Å; K567-D571 WeakPolarHBondContact O-CB 3.48Å; K567-D571 PolarHBondContact O-N 3.44Å
568	A	94.1	Very high	91	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-37.2	176.5	0	0	0	0	0	112.5	F548 L555 I565 D566 L572	F548-A568 HydrophobicContact CE2-CB 4.25Å; L555-A568 HydrophobicContact CD1-CB 3.79Å; I565-A568 HydrophobicContact CD1-CB 4.45Å; I565-A568 PolarHBondContact O-N 2.82Å; D566-A568 PolarHBondContact O-N 3.19Å; A568-L572 PolarHBondContact O-N 2.99Å
569	F	95.6	Very high	91.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-42.7	172.2	-85.2	-79.5	0	0	0	112.1	L498 F548 I565 D566 K567 D571 L572 F573 Y641 F644 V645 L648 M661 A664	L498-F569 HydrophobicContact CD1-CZ 4.25Å; L498-F569 HydrophobicContact CD2-CE2 3.62Å; L498-F569 HydrophobicContact CD2-CZ 3.52Å; F548-F569 HydrophobicContact CZ-CE1 4.49Å; I565-F569 HydrophobicContact CD1-CE2 4.33Å; I565-F569 HydrophobicContact CG1-CD2 4.11Å; I565-F569 HydrophobicContact CG1-CE2 3.98Å; I565-F569 WeakPolarHBondContact O-CD2 3.44Å; I565-F569 PolarHBondContact O-N 3.44Å; D566-F569 PolarHBondContact O-N 3.1Å; K567-F569 VanDerWaalsContact C-N 3.32Å; K567-F569 PolarHBondContact O-N 3.33Å; F569-D571 VanDerWaalsContact C-N 3.34Å; F569-D571 PolarHBondContact O-N 3.42Å; F569-L572 PolarHBondContact O-N 3.37Å; F569-F573 HydrophobicContact CB-CD2 4.45Å; F569-F573 AromaticContact CD1-CD2 3.79Å; F569-F573 HydrophobicContact CD1-CD2 3.79Å; F569-F573 AromaticContact CD1-CE2 3.55Å; F569-F573 HydrophobicContact CD1-CE2 3.55Å; F569-F573 HydrophobicContact CE1-CE2 4Å; F569-F573 WeakPolarHBondContact O-CB 3.37Å; F569-F573 VanDerWaalsContact O-CD2 3.24Å; F569-F573 WeakPolarHBondContact O-CD2 3.36Å; F569-F573 PolarHBondContact O-N 2.92Å; F569-Y641 HydrophobicContact CE1-CD1 4.05Å; F569-F644 HydrophobicContact CZ-CB 4.27Å; F569-V645 HydrophobicContact CD1-CG2 3.42Å; F569-V645 VanDerWaalsContact CD1-CG2 3.42Å; F569-V645 HydrophobicContact CD2-CG2 4.27Å; F569-V645 HydrophobicContact CE1-CG2 3.34Å; F569-V645 HydrophobicContact CE2-CG2 4.19Å; F569-V645 HydrophobicContact CG-CG2 3.93Å; F569-V645 HydrophobicContact CZ-CG2 3.74Å; F569-L648 HydrophobicContact CD2-CD1 4.49Å; F569-L648 HydrophobicContact CE2-CD1 3.61Å; F569-L648 HydrophobicContact CZ-CD1 4.24Å; F569-M661 HydrophobicContact CD2-CE 4.31Å; F569-A664 HydrophobicContact CB-CB 3.68Å; F569-A664 HydrophobicContact CG-CB 4.44Å
570	L	94.1	Very high	91.6	Very high	43 Å²	43	46.6 Å²	46.6	23%	0.225	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-42.4	178.2	-70.6	171	0	0	0	111.3	D566 K567 L572 F573 T574 K663 A664	D566-L570 WeakPolarHBondContact O-CG 3.4Å; D566-L570 PolarHBondContact O-N 3.09Å; K567-L570 PolarHBondContact O-N 2.73Å; L570-L572 VanDerWaalsContact C-N 3.33Å; L570-L572 PolarHBondContact O-N 3.28Å; L570-F573 PolarHBondContact O-N 3.28Å; L570-T574 HydrophobicContact CD2-CG2 4.17Å; L570-T574 WeakPolarHBondContact O-CA 3.33Å; L570-T574 VanDerWaalsContact O-CB 3.24Å; L570-T574 WeakPolarHBondContact O-CB 3.32Å; L570-T574 WeakPolarHBondContact O-CG2 3.49Å; L570-T574 PolarHBondContact O-N 3.19Å; L570-T574 PolarHBondContact O-OG1 3.14Å; L570-K663 HydrophobicContact CD2-CB 3.88Å; L570-A664 HydrophobicContact CD2-CB 4.38Å
571	D	93.7	Very high	92.2	Very high	91 Å²	91	43.7 Å²	43.7	49%	0.487	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-40.5	176.1	-173.4	45.9	0	0	0	112.6	N551 K567 F569	N551-D571 PolarHBondContact ND2-OD2 2.96Å; K567-D571 WeakPolarHBondContact O-CB 3.48Å; K567-D571 PolarHBondContact O-N 3.44Å; F569-D571 VanDerWaalsContact C-N 3.34Å; F569-D571 PolarHBondContact O-N 3.42Å
572	L	94.7	Very high	92.6	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-73.3	-42.5	176.9	178.7	60.6	0	0	0	113.2	I544 F548 A568 F569 L570 S578 M581	I544-L572 HydrophobicContact CG2-CD1 3.62Å; F548-L572 HydrophobicContact CB-CD1 4.33Å; F548-L572 HydrophobicContact CB-CD2 4.13Å; F548-L572 HydrophobicContact CD1-CD2 3.83Å; F548-L572 HydrophobicContact CD2-CB 3.99Å; F548-L572 HydrophobicContact CD2-CD2 3.66Å; F548-L572 HydrophobicContact CD2-CG 4.33Å; F548-L572 HydrophobicContact CE1-CD2 4.11Å; F548-L572 HydrophobicContact CE2-CB 4.33Å; F548-L572 HydrophobicContact CE2-CD2 3.94Å; F548-L572 HydrophobicContact CG-CD2 3.6Å; F548-L572 HydrophobicContact CG-CG 4.5Å; F548-L572 HydrophobicContact CZ-CD2 4.15Å; A568-L572 PolarHBondContact O-N 2.99Å; F569-L572 PolarHBondContact O-N 3.37Å; L570-L572 VanDerWaalsContact C-N 3.33Å; L570-L572 PolarHBondContact O-N 3.28Å; L572-S578 WeakPolarHBondContact O-CB 3.48Å; L572-S578 PolarHBondContact O-N 3Å; L572-M581 HydrophobicContact CD1-SD 4.24Å; L572-M581 HydrophobicContact CG-SD 4.43Å
573	F	96.2	Very high	93	Very high	7 Å²	7	49.6 Å²	49.6	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-98.6	1.8	-170.5	-67.9	-75	0	0	0	114.1	F569 L570 S578 M581 L638 Y641 A667 V668 L671	F569-F573 HydrophobicContact CB-CD2 4.45Å; F569-F573 AromaticContact CD1-CD2 3.79Å; F569-F573 HydrophobicContact CD1-CD2 3.79Å; F569-F573 AromaticContact CD1-CE2 3.55Å; F569-F573 HydrophobicContact CD1-CE2 3.55Å; F569-F573 HydrophobicContact CE1-CE2 4Å; F569-F573 WeakPolarHBondContact O-CB 3.37Å; F569-F573 VanDerWaalsContact O-CD2 3.24Å; F569-F573 WeakPolarHBondContact O-CD2 3.36Å; F569-F573 PolarHBondContact O-N 2.92Å; L570-F573 PolarHBondContact O-N 3.28Å; F573-S578 VanDerWaalsContact O-CB 3.26Å; F573-S578 WeakPolarHBondContact O-CB 3.33Å; F573-S578 PolarHBondContact O-OG 3.2Å; F573-M581 HydrophobicContact CD1-SD 4.49Å; F573-M581 HydrophobicContact CE1-CE 4.43Å; F573-M581 HydrophobicContact CE1-SD 3.9Å; F573-M581 HydrophobicContact CZ-SD 4.47Å; F573-L638 HydrophobicContact CE1-CD1 4.4Å; F573-Y641 HydrophobicContact CE1-CD2 4.27Å; F573-Y641 HydrophobicContact CE2-CD1 4.35Å; F573-Y641 HydrophobicContact CE2-CG 4.13Å; F573-Y641 HydrophobicContact CZ-CD1 4.11Å; F573-Y641 AromaticContact CZ-CD2 3.54Å; F573-Y641 HydrophobicContact CZ-CD2 3.54Å; F573-Y641 HydrophobicContact CZ-CE2 4.12Å; F573-Y641 AromaticContact CZ-CG 3.52Å; F573-Y641 HydrophobicContact CZ-CG 3.52Å; F573-A667 HydrophobicContact CB-CB 3.81Å; F573-V668 HydrophobicContact CB-CG2 4.35Å; F573-V668 HydrophobicContact CD1-CB 4.4Å; F573-V668 HydrophobicContact CD1-CG2 3.72Å; F573-V668 HydrophobicContact CD2-CG2 3.48Å; F573-V668 VanDerWaalsContact CD2-CG2 3.48Å; F573-V668 HydrophobicContact CE1-CG2 3.87Å; F573-V668 HydrophobicContact CE2-CG2 3.64Å; F573-V668 HydrophobicContact CG-CG2 3.55Å; F573-V668 HydrophobicContact CZ-CG2 3.85Å; F573-L671 HydrophobicContact CD1-CB 4.43Å; F573-L671 HydrophobicContact CD1-CD2 3.51Å; F573-L671 HydrophobicContact CE1-CD2 3.7Å
574	T	91.4	Very high	93.5	Very high	66 Å²	66	46.2 Å²	46.2	41%	0.405	24%	0.235	S	C	.	.	S	Bend	trans	-127.6	157.7	172.8	74.9	0	0	0	0	110.8	L570 A667	L570-T574 HydrophobicContact CD2-CG2 4.17Å; L570-T574 WeakPolarHBondContact O-CA 3.33Å; L570-T574 VanDerWaalsContact O-CB 3.24Å; L570-T574 WeakPolarHBondContact O-CB 3.32Å; L570-T574 WeakPolarHBondContact O-CG2 3.49Å; L570-T574 PolarHBondContact O-N 3.19Å; L570-T574 PolarHBondContact O-OG1 3.14Å; T574-A667 HydrophobicContact CG2-CB 4.07Å
575	G	91.2	Very high	93.8	Very high	47 Å²	47	42.1 Å²	42.1	49%	0.485	22%	0.216	S	C	.	.	H	α-helix	trans	76	-147.6	178.8	0	0	0	0	0	115.3	S578 Q579	G575-S578 PolarHBondContact O-OG 3.08Å; G575-Q579 WeakPolarHBondContact O-CG 3.32Å; G575-Q579 PolarHBondContact O-N 3.37Å
576	E	90.4	Very high	93.9	Very high	117 Å²	117	42.7 Å²	42.7	55%	0.547	22%	0.22	S	C	.	.	H	α-helix	trans	-70.5	-42.3	-171.2	-169.1	-163.7	146.3	0	0	112.8	S578 Q579 K580	E576-S578 VanDerWaalsContact C-N 3.27Å; E576-S578 PolarHBondContact O-N 3.5Å; E576-Q579 PolarHBondContact O-N 2.9Å; E576-Q579 VanDerWaalsContact O-N 3.15Å; E576-K580 PolarHBondContact O-N 2.95Å; E576-K580 WeakPolarHBondContact OE1-CE 3.35Å; E576-K580 IonicContact OE1-NZ 3.36Å; E576-K580 PolarHBondContact OE1-NZ 3.32Å
577	L	91.3	Very high	93.9	Very high	19 Å²	19	45.7 Å²	45.7	10%	0.099	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-38.5	-179.9	-71.4	178.2	0	0	0	111.4	K580 M581	L577-K580 PolarHBondContact O-N 3.5Å; L577-M581 VanDerWaalsContact O-CB 3.26Å; L577-M581 WeakPolarHBondContact O-CB 3.03Å; L577-M581 PolarHBondContact O-N 3.48Å
578	S	94.1	Very high	93.9	Very high	17 Å²	17	40.6 Å²	40.6	12%	0.119	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-33.7	178	80.4	0	0	0	0	112.6	L572 F573 G575 E576 M581 R582 L671	L572-S578 WeakPolarHBondContact O-CB 3.48Å; L572-S578 PolarHBondContact O-N 3Å; F573-S578 VanDerWaalsContact O-CB 3.26Å; F573-S578 WeakPolarHBondContact O-CB 3.33Å; F573-S578 PolarHBondContact O-OG 3.2Å; G575-S578 PolarHBondContact O-OG 3.08Å; E576-S578 VanDerWaalsContact C-N 3.27Å; E576-S578 PolarHBondContact O-N 3.5Å; S578-M581 PolarHBondContact O-N 3.2Å; S578-R582 WeakPolarHBondContact O-CB 3.36Å; S578-R582 PolarHBondContact O-N 3.39Å; S578-L671 WeakPolarHBondContact O-CD1 3.48Å
579	Q	94.6	Very high	93.9	Very high	112 Å²	112	41.7 Å²	41.7	52%	0.523	22%	0.217	S	C	.	.	H	α-helix	trans	-67.6	-44.5	173.5	-68.1	178.1	4.7	0	0	111.7	G575 E576 M581 R582 M583	G575-Q579 WeakPolarHBondContact O-CG 3.32Å; G575-Q579 PolarHBondContact O-N 3.37Å; E576-Q579 PolarHBondContact O-N 2.9Å; E576-Q579 VanDerWaalsContact O-N 3.15Å; Q579-M581 VanDerWaalsContact C-N 3.34Å; Q579-R582 WeakPolarHBondContact O-CB 3.37Å; Q579-R582 PolarHBondContact O-N 3.39Å; Q579-M583 PolarHBondContact O-N 2.96Å
580	K	94.2	Very high	93.7	Very high	53 Å²	53	42.3 Å²	42.3	23%	0.23	22%	0.222	C	C	.	.	H	α-helix	trans	-59.7	-45.7	172.4	-73.5	176.7	167.6	168.5	0	110.7	V540 I544 E576 L577 R582 M583 V584	V540-K580 HydrophobicContact CG1-CB 4.23Å; V540-K580 HydrophobicContact CG1-CD 4.47Å; I544-K580 HydrophobicContact CD1-CB 3.92Å; I544-K580 HydrophobicContact CG1-CB 4.37Å; E576-K580 PolarHBondContact O-N 2.95Å; E576-K580 WeakPolarHBondContact OE1-CE 3.35Å; E576-K580 IonicContact OE1-NZ 3.36Å; E576-K580 PolarHBondContact OE1-NZ 3.32Å; L577-K580 PolarHBondContact O-N 3.5Å; K580-R582 PolarHBondContact O-N 3.24Å; K580-M583 PolarHBondContact O-N 3.1Å; K580-V584 VanDerWaalsContact O-CG2 3.28Å; K580-V584 WeakPolarHBondContact O-CG2 3.48Å; K580-V584 PolarHBondContact O-N 2.99Å
581	M	95.4	Very high	93.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-43.8	177.4	-163.6	176.6	-155.9	0	0	111.7	I544 L572 F573 L577 S578 Q579 M583 Y585 L638 Y641 L671	I544-M581 HydrophobicContact CD1-CB 4.1Å; I544-M581 HydrophobicContact CG2-CB 4.41Å; I544-M581 HydrophobicContact CG2-CG 4.4Å; I544-M581 HydrophobicContact CG2-SD 4.41Å; L572-M581 HydrophobicContact CD1-SD 4.24Å; L572-M581 HydrophobicContact CG-SD 4.43Å; F573-M581 HydrophobicContact CD1-SD 4.49Å; F573-M581 HydrophobicContact CE1-CE 4.43Å; F573-M581 HydrophobicContact CE1-SD 3.9Å; F573-M581 HydrophobicContact CZ-SD 4.47Å; L577-M581 VanDerWaalsContact O-CB 3.26Å; L577-M581 WeakPolarHBondContact O-CB 3.03Å; L577-M581 PolarHBondContact O-N 3.48Å; S578-M581 PolarHBondContact O-N 3.2Å; Q579-M581 VanDerWaalsContact C-N 3.34Å; M581-M583 PolarHBondContact O-N 3.39Å; M581-Y585 HydrophobicContact CE-CD2 4.23Å; M581-Y585 HydrophobicContact CE-CE2 3.5Å; M581-Y585 VanDerWaalsContact CE-CE2 3.5Å; M581-Y585 HydrophobicContact CG-CD2 3.53Å; M581-Y585 HydrophobicContact CG-CE2 3.73Å; M581-Y585 WeakPolarHBondContact O-CB 3.45Å; M581-Y585 WeakPolarHBondContact O-CD2 3.32Å; M581-Y585 PolarHBondContact O-N 3.11Å; M581-Y585 HydrophobicContact SD-CE2 4.45Å; M581-L638 HydrophobicContact CE-CD1 3.9Å; M581-L638 HydrophobicContact SD-CD1 4.14Å; M581-Y641 HydrophobicContact CE-CD2 4.42Å; M581-Y641 HydrophobicContact CE-CE2 3.76Å; M581-L671 HydrophobicContact CB-CD2 4.23Å; M581-L671 HydrophobicContact CG-CD2 4.02Å; M581-L671 HydrophobicContact SD-CD2 3.65Å
582	R	95.5	Very high	93.4	Very high	91 Å²	91	40.1 Å²	40.1	34%	0.343	21%	0.207	S	C	.	.	H	α-helix	trans	-55.7	-52.4	174.7	-176.5	179	59.8	-165.3	2.5	110.8	S578 Q579 K580 T586 L671 D674 V675	S578-R582 WeakPolarHBondContact O-CB 3.36Å; S578-R582 PolarHBondContact O-N 3.39Å; Q579-R582 WeakPolarHBondContact O-CB 3.37Å; Q579-R582 PolarHBondContact O-N 3.39Å; K580-R582 PolarHBondContact O-N 3.24Å; R582-T586 WeakPolarHBondContact O-CB 3.43Å; R582-T586 PolarHBondContact O-N 3.23Å; R582-T586 PolarHBondContact O-OG1 3.46Å; R582-L671 HydrophobicContact CB-CD1 3.53Å; R582-L671 HydrophobicContact CG-CD1 4.2Å; R582-D674 HydrophobicContact CG-CB 4.13Å; R582-D674 IonicContact NH1-OD2 2.63Å; R582-V675 HydrophobicContact CG-CG2 4.23Å
583	M	94.7	Very high	93.1	Very high	86 Å²	86	45.1 Å²	45.1	42%	0.424	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-55.7	-178.2	-176.9	-173.5	70.7	0	0	111.1	Q579 K580 M581 Y585 T586 F587	Q579-M583 PolarHBondContact O-N 2.96Å; K580-M583 PolarHBondContact O-N 3.1Å; M581-M583 PolarHBondContact O-N 3.39Å; M583-Y585 PolarHBondContact O-N 2.9Å; M583-T586 WeakPolarHBondContact O-CB 3.5Å; M583-T586 PolarHBondContact O-N 3.07Å; M583-F587 HydrophobicContact CG-CD2 3.95Å; M583-F587 HydrophobicContact CG-CE2 3.76Å; M583-F587 WeakPolarHBondContact O-CD2 3.03Å; M583-F587 PolarHBondContact O-N 3.38Å; M583-F587 VanDerWaalsContact O-N 3.15Å
584	V	94.8	Very high	92.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-47.2	-174	177.5	0	0	0	0	111.4	N537 V540 M541 K580 T586 F587 F588	N537-V584 HydrophobicContact CB-CG1 4.1Å; N537-V584 HydrophobicContact CB-CG2 4.2Å; V540-V584 HydrophobicContact CB-CG2 3.74Å; V540-V584 HydrophobicContact CG1-CG2 3.55Å; M541-V584 HydrophobicContact CB-CG1 3.8Å; M541-V584 HydrophobicContact CE-CG1 3.51Å; M541-V584 HydrophobicContact CG-CG1 4.35Å; M541-V584 HydrophobicContact SD-CG1 3.81Å; K580-V584 VanDerWaalsContact O-CG2 3.28Å; K580-V584 WeakPolarHBondContact O-CG2 3.48Å; K580-V584 PolarHBondContact O-N 2.99Å; V584-T586 VanDerWaalsContact C-N 3.3Å; V584-T586 PolarHBondContact O-N 2.73Å; V584-F587 PolarHBondContact O-N 3.19Å; V584-F588 WeakPolarHBondContact O-CB 3.39Å; V584-F588 PolarHBondContact O-N 3.19Å
585	Y	96.2	Very high	92.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-33	178	-89	-81.2	0	0	0	113	M541 H545 M581 M583 C589 I634 L638	M541-Y585 HydrophobicContact CE-CD1 4.02Å; M541-Y585 HydrophobicContact CE-CD2 3.98Å; M541-Y585 HydrophobicContact CE-CE1 3.94Å; M541-Y585 HydrophobicContact CE-CE2 3.92Å; M541-Y585 HydrophobicContact CE-CG 4.05Å; M541-Y585 HydrophobicContact SD-CD2 3.91Å; M541-Y585 HydrophobicContact SD-CE1 4.38Å; M541-Y585 HydrophobicContact SD-CE2 3.45Å; M541-Y585 WeakPolarHBondContact SD-CE2 3.36Å; H545-Y585 PolarHBondContact CE1-OH 3.18Å; H545-Y585 AromaticContact NE2-CE2 3.7Å; H545-Y585 AromaticContact NE2-CZ 3.7Å; H545-Y585 PolarHBondContact NE2-OH 2.94Å; M581-Y585 HydrophobicContact CE-CD2 4.23Å; M581-Y585 HydrophobicContact CE-CE2 3.5Å; M581-Y585 VanDerWaalsContact CE-CE2 3.5Å; M581-Y585 HydrophobicContact CG-CD2 3.53Å; M581-Y585 HydrophobicContact CG-CE2 3.73Å; M581-Y585 WeakPolarHBondContact O-CB 3.45Å; M581-Y585 WeakPolarHBondContact O-CD2 3.32Å; M581-Y585 PolarHBondContact O-N 3.11Å; M581-Y585 HydrophobicContact SD-CE2 4.45Å; M583-Y585 PolarHBondContact O-N 2.9Å; Y585-C589 WeakPolarHBondContact O-CB 3.07Å; Y585-C589 PolarHBondContact O-N 2.79Å; Y585-C589 PolarHBondContact O-SG 3.34Å; Y585-I634 WeakPolarHBondContact CE1-O 3.4Å; Y585-L638 HydrophobicContact CD1-CB 3.95Å; Y585-L638 HydrophobicContact CD1-CD2 4.08Å; Y585-L638 HydrophobicContact CD2-CD1 4.44Å; Y585-L638 HydrophobicContact CD2-CD2 4.45Å; Y585-L638 HydrophobicContact CE1-CB 3.73Å; Y585-L638 HydrophobicContact CE2-CB 4.47Å; Y585-L638 HydrophobicContact CE2-CD1 4.46Å; Y585-L638 HydrophobicContact CG-CB 4.41Å; Y585-L638 HydrophobicContact CG-CD2 3.94Å
586	T	95	Very high	93	Very high	13 Å²	13	43.3 Å²	43.3	8%	0.08	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-53.3	176.3	-65.1	0	0	0	0	110.8	R582 M583 V584 A590 G678 I679 I682	R582-T586 WeakPolarHBondContact O-CB 3.43Å; R582-T586 PolarHBondContact O-N 3.23Å; R582-T586 PolarHBondContact O-OG1 3.46Å; M583-T586 WeakPolarHBondContact O-CB 3.5Å; M583-T586 PolarHBondContact O-N 3.07Å; V584-T586 VanDerWaalsContact C-N 3.3Å; V584-T586 PolarHBondContact O-N 2.73Å; T586-A590 WeakPolarHBondContact O-CB 3.49Å; T586-A590 PolarHBondContact O-N 3.33Å; T586-G678 VanDerWaalsContact CG2-C 3.42Å; T586-I679 HydrophobicContact CG2-CG1 4.4Å; T586-I682 HydrophobicContact CG2-CD1 3.7Å
587	F	92.4	Very high	93.1	Very high	82 Å²	82	43 Å²	43	36%	0.36	21%	0.209	S	C	.	.	H	α-helix	trans	-65.2	-46.7	178.7	-73.4	-71	0	0	0	112.2	M583 V584 C589 A590 Q591 I682	M583-F587 HydrophobicContact CG-CD2 3.95Å; M583-F587 HydrophobicContact CG-CE2 3.76Å; M583-F587 WeakPolarHBondContact O-CD2 3.03Å; M583-F587 PolarHBondContact O-N 3.38Å; M583-F587 VanDerWaalsContact O-N 3.15Å; V584-F587 PolarHBondContact O-N 3.19Å; F587-C589 PolarHBondContact O-N 2.93Å; F587-A590 PolarHBondContact O-N 3.34Å; F587-Q591 VanDerWaalsContact O-CB 3.3Å; F587-Q591 WeakPolarHBondContact O-CB 3.44Å; F587-Q591 PolarHBondContact O-N 2.93Å; F587-I682 HydrophobicContact CD1-CD1 3.79Å; F587-I682 HydrophobicContact CE1-CD1 3.85Å; F587-I682 HydrophobicContact CG-CD1 4.48Å
588	F	93.2	Very high	93.1	Very high	3 Å²	3	45 Å²	45	1%	0.013	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-44.5	-177.8	-167.8	-89.1	0	0	0	111.8	L512 P536 L538 M541 V584 Q591 K592 L631 I634 T635	L512-F588 HydrophobicContact CD2-CE2 4.46Å; L512-F588 HydrophobicContact CD2-CZ 4.27Å; P536-F588 HydrophobicContact CG-CD2 4.4Å; L538-F588 HydrophobicContact CD2-CE2 3.94Å; M541-F588 HydrophobicContact CE-CB 4.22Å; M541-F588 HydrophobicContact CE-CD1 4.48Å; M541-F588 HydrophobicContact CE-CG 4.19Å; V584-F588 WeakPolarHBondContact O-CB 3.39Å; V584-F588 PolarHBondContact O-N 3.19Å; F588-Q591 PolarHBondContact O-N 3.48Å; F588-K592 PolarHBondContact O-N 2.83Å; F588-L631 HydrophobicContact CE1-CD2 4.2Å; F588-L631 HydrophobicContact CE2-CD2 4.08Å; F588-L631 HydrophobicContact CZ-CD2 3.46Å; F588-L631 VanDerWaalsContact CZ-CD2 3.46Å; F588-I634 HydrophobicContact CD1-CG2 4.04Å; F588-I634 HydrophobicContact CE1-CB 3.86Å; F588-I634 HydrophobicContact CE1-CG2 3.53Å; F588-I634 HydrophobicContact CZ-CB 4.14Å; F588-I634 HydrophobicContact CZ-CD1 3.99Å; F588-I634 HydrophobicContact CZ-CG2 3.87Å; F588-T635 HydrophobicContact CD1-CG2 3.78Å; F588-T635 HydrophobicContact CE1-CG2 3.79Å
589	C	93.7	Very high	93	Very high	26 Å²	26	44.9 Å²	44.9	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-70.9	-36.6	177.7	-64.7	0	0	0	0	112.8	Y585 F587 Q591 I679	Y585-C589 WeakPolarHBondContact O-CB 3.07Å; Y585-C589 PolarHBondContact O-N 2.79Å; Y585-C589 PolarHBondContact O-SG 3.34Å; F587-C589 PolarHBondContact O-N 2.93Å; C589-Q591 VanDerWaalsContact C-N 3.29Å; C589-Q591 PolarHBondContact O-N 2.77Å; C589-I679 HydrophobicContact CB-CD1 3.41Å; C589-I679 VanDerWaalsContact CB-CD1 3.41Å; C589-I679 HydrophobicContact CB-CG1 4.05Å
590	A	91.3	Very high	93	Very high	12 Å²	12	43 Å²	43	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-65	-34.4	176.3	0	0	0	0	0	112.1	T586 F587 I679 I682	T586-A590 WeakPolarHBondContact O-CB 3.49Å; T586-A590 PolarHBondContact O-N 3.33Å; F587-A590 PolarHBondContact O-N 3.34Å; A590-I679 HydrophobicContact CB-CG1 4.45Å; A590-I679 HydrophobicContact CB-CG2 4.34Å; A590-I682 HydrophobicContact CB-CB 4.21Å; A590-I682 HydrophobicContact CB-CD1 4.04Å; A590-I682 HydrophobicContact CB-CG2 3.89Å
591	Q	89.8	Confident	93	Very high	40 Å²	40	46 Å²	46	19%	0.187	22%	0.216	C	C	.	.	H	α-helix	trans	-87	-24.5	-177.3	-173.5	56.5	20.3	0	0	113.9	V533 P536 F587 F588 C589 E593 S594 S595	V533-Q591 WeakPolarHBondContact O-CG 3.4Å; V533-Q591 PolarHBondContact O-NE2 3.43Å; P536-Q591 HydrophobicContact CG-CB 4.39Å; P536-Q591 HydrophobicContact CG-CG 4.49Å; F587-Q591 VanDerWaalsContact O-CB 3.3Å; F587-Q591 WeakPolarHBondContact O-CB 3.44Å; F587-Q591 PolarHBondContact O-N 2.93Å; F588-Q591 PolarHBondContact O-N 3.48Å; C589-Q591 VanDerWaalsContact C-N 3.29Å; C589-Q591 PolarHBondContact O-N 2.77Å; Q591-E593 VanDerWaalsContact C-N 3.33Å; Q591-E593 PolarHBondContact O-N 2.96Å; Q591-E593 VanDerWaalsContact O-N 3.07Å; Q591-S594 WeakPolarHBondContact O-CA 3.44Å; Q591-S594 VanDerWaalsContact O-CB 3.3Å; Q591-S594 WeakPolarHBondContact O-CB 3.49Å; Q591-S594 PolarHBondContact O-N 2.82Å; Q591-S595 PolarHBondContact O-N 3.05Å; Q591-S595 PolarHBondContact O-OG 2.65Å
592	K	91.4	Very high	92.8	Very high	49 Å²	49	46.3 Å²	46.3	21%	0.213	22%	0.218	C	C	.	.	H	α-helix	trans	-41.5	-49.9	-174.9	-174.6	-158.4	-176.4	168.6	0	115.5	F588 S594 S595 V596 L631 T635	F588-K592 PolarHBondContact O-N 2.83Å; K592-S594 VanDerWaalsContact C-N 3.32Å; K592-S594 PolarHBondContact O-N 3.26Å; K592-S595 WeakPolarHBondContact O-CB 3.21Å; K592-S595 PolarHBondContact O-N 3.04Å; K592-V596 WeakPolarHBondContact O-CG2 2.99Å; K592-V596 PolarHBondContact O-N 2.89Å; K592-L631 HydrophobicContact CG-CB 4.47Å; K592-T635 HydrophobicContact CB-CG2 4.3Å; K592-T635 HydrophobicContact CD-CG2 3.62Å; K592-T635 WeakPolarHBondContact CE-OG1 3.29Å; K592-T635 HydrophobicContact CG-CG2 4.04Å; K592-T635 PolarHBondContact NZ-OG1 3.12Å
593	E	89.4	Confident	92.6	Very high	107 Å²	107	43.2 Å²	43.2	50%	0.5	21%	0.209	S	C	.	.	H	α-helix	trans	-65.2	-37.8	-177.5	178.6	65.8	-167.6	0	0	111.8	Q591 K597	Q591-E593 VanDerWaalsContact C-N 3.33Å; Q591-E593 PolarHBondContact O-N 2.96Å; Q591-E593 VanDerWaalsContact O-N 3.07Å; E593-K597 WeakPolarHBondContact O-CG 3.32Å; E593-K597 PolarHBondContact O-N 3.21Å; E593-K597 WeakPolarHBondContact OE1-CE 3.47Å; E593-K597 IonicContact OE1-NZ 3.02Å; E593-K597 PolarHBondContact OE1-NZ 2.74Å
594	S	89.9	Confident	92.4	Very high	49 Å²	49	44 Å²	44	34%	0.343	22%	0.224	S	C	.	.	H	α-helix	trans	-67.4	-42.4	173.5	-58.6	0	0	0	0	110.5	Q591 K592 V596 K597 E598	Q591-S594 WeakPolarHBondContact O-CA 3.44Å; Q591-S594 VanDerWaalsContact O-CB 3.3Å; Q591-S594 WeakPolarHBondContact O-CB 3.49Å; Q591-S594 PolarHBondContact O-N 2.82Å; K592-S594 VanDerWaalsContact C-N 3.32Å; K592-S594 PolarHBondContact O-N 3.26Å; S594-V596 PolarHBondContact O-N 3.45Å; S594-K597 PolarHBondContact O-N 2.9Å; S594-E598 WeakPolarHBondContact O-CB 3.47Å; S594-E598 PolarHBondContact O-N 3.26Å
595	S	92.7	Very high	92.2	Very high	3 Å²	3	48.5 Å²	48.5	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-42.1	177.2	-54.4	0	0	0	0	113	L534 Q591 K592 E598 Y599	L534-S595 WeakPolarHBondContact CD1-O 3.41Å; L534-S595 WeakPolarHBondContact O-CB 3.48Å; L534-S595 PolarHBondContact O-OG 2.7Å; Q591-S595 PolarHBondContact O-N 3.05Å; Q591-S595 PolarHBondContact O-OG 2.65Å; K592-S595 WeakPolarHBondContact O-CB 3.21Å; K592-S595 PolarHBondContact O-N 3.04Å; S595-E598 PolarHBondContact O-N 3.36Å; S595-Y599 WeakPolarHBondContact O-CB 3.33Å; S595-Y599 PolarHBondContact O-N 2.7Å
596	V	93.3	Very high	91.9	Very high	30 Å²	30	50.3 Å²	50.3	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-40	177.4	173.1	0	0	0	0	111.4	K592 S594 E598 Y599 H600 P628 L631	K592-V596 WeakPolarHBondContact O-CG2 2.99Å; K592-V596 PolarHBondContact O-N 2.89Å; S594-V596 PolarHBondContact O-N 3.45Å; V596-E598 VanDerWaalsContact C-N 3.33Å; V596-Y599 PolarHBondContact O-N 3.5Å; V596-H600 PolarHBondContact O-CD2 2.89Å; V596-H600 PolarHBondContact O-N 2.86Å; V596-H600 VanDerWaalsContact O-N 3.16Å; V596-P628 HydrophobicContact CG2-CB 4.44Å; V596-L631 HydrophobicContact CG2-CD1 4.09Å
597	K	91.9	Very high	91.7	Very high	112 Å²	112	53 Å²	53	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-63.7	-42.3	174.4	-74.8	171.4	-176.1	159.3	0	111.6	E593 S594 H600 R601	E593-K597 WeakPolarHBondContact O-CG 3.32Å; E593-K597 PolarHBondContact O-N 3.21Å; E593-K597 WeakPolarHBondContact OE1-CE 3.47Å; E593-K597 IonicContact OE1-NZ 3.02Å; E593-K597 PolarHBondContact OE1-NZ 2.74Å; S594-K597 PolarHBondContact O-N 2.9Å; K597-H600 PolarHBondContact O-N 3.2Å; K597-R601 WeakPolarHBondContact O-CB 3.06Å; K597-R601 PolarHBondContact O-N 3.43Å
598	E	92.3	Very high	91.6	Very high	59 Å²	59	54.3 Å²	54.3	28%	0.276	30%	0.295	S	S	.	.	H	α-helix	trans	-66.1	-41.7	179.6	-173.1	57.2	-163.2	0	0	111.7	L534 S594 S595 V596 H600 R601 L602	L534-E598 HydrophobicContact CD1-CB 4.04Å; L534-E598 HydrophobicContact CD1-CG 4.14Å; S594-E598 WeakPolarHBondContact O-CB 3.47Å; S594-E598 PolarHBondContact O-N 3.26Å; S595-E598 PolarHBondContact O-N 3.36Å; V596-E598 VanDerWaalsContact C-N 3.33Å; E598-H600 PolarHBondContact O-N 2.92Å; E598-R601 VanDerWaalsContact CD-NE 3.29Å; E598-R601 WeakPolarHBondContact O-CB 3.38Å; E598-R601 PolarHBondContact O-N 3.27Å; E598-R601 IonicContact OE1-CZ 3.94Å; E598-R601 IonicContact OE1-NE 2.67Å; E598-R601 PolarHBondContact OE1-NE 3.41Å; E598-R601 IonicContact OE1-NH2 3.48Å; E598-R601 PolarHBondContact OE1-NH2 3.3Å; E598-R601 IonicContact OE2-CZ 2.96Å; E598-R601 IonicContact OE2-NE 3.81Å; E598-R601 PolarHBondContact OE2-NE 3.34Å; E598-R601 IonicContact OE2-NH2 2.76Å; E598-L602 HydrophobicContact CG-CD1 4.18Å; E598-L602 HydrophobicContact CG-CG 4.5Å; E598-L602 WeakPolarHBondContact O-CB 3.23Å; E598-L602 WeakPolarHBondContact O-CG 3.41Å; E598-L602 PolarHBondContact O-N 3.41Å
599	Y	92.4	Very high	91.5	Very high	16 Å²	16	54.1 Å²	54.1	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-53	-50.9	170	169.9	-99	0	0	0	112.2	S595 V596 R601 L602 C603 F609 V613 L627 P628	S595-Y599 WeakPolarHBondContact O-CB 3.33Å; S595-Y599 PolarHBondContact O-N 2.7Å; V596-Y599 PolarHBondContact O-N 3.5Å; Y599-R601 VanDerWaalsContact C-N 3.33Å; Y599-R601 PolarHBondContact O-N 3.37Å; Y599-L602 PolarHBondContact O-N 2.94Å; Y599-C603 PolarHBondContact O-N 3.18Å; Y599-C603 PolarHBondContact O-SG 3.42Å; Y599-C603 VanDerWaalsContact O-SG 3.33Å; Y599-F609 AromaticContact CD2-CE1 3.67Å; Y599-F609 HydrophobicContact CD2-CE1 3.67Å; Y599-F609 AromaticContact CD2-CZ 3.71Å; Y599-F609 HydrophobicContact CD2-CZ 3.71Å; Y599-F609 AromaticContact CE2-CE1 3.84Å; Y599-F609 HydrophobicContact CE2-CE1 3.84Å; Y599-F609 HydrophobicContact CE2-CZ 4.07Å; Y599-V613 HydrophobicContact CE2-CG2 3.97Å; Y599-V613 WeakPolarHBondContact OH-CG1 3.49Å; Y599-L627 HydrophobicContact CD2-CB 4.03Å; Y599-L627 HydrophobicContact CD2-CD2 3.7Å; Y599-L627 HydrophobicContact CD2-CG 4.3Å; Y599-L627 HydrophobicContact CE2-CB 3.98Å; Y599-L627 HydrophobicContact CE2-CD2 4.4Å; Y599-L627 HydrophobicContact CG-CD2 4.39Å; Y599-P628 HydrophobicContact CD1-CG 3.49Å; Y599-P628 VanDerWaalsContact CD1-CG 3.49Å; Y599-P628 HydrophobicContact CE1-CG 3.52Å; Y599-P628 HydrophobicContact CG-CG 4.1Å
600	H	93.1	Very high	91.3	Very high	71 Å²	71	57.3 Å²	57.3	33%	0.329	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-36.3	179.2	-71	-51	0	0	0	113	H391 V596 K597 E598 S604	H391-H600 AromaticContact CE1-CE1 3.84Å; H391-H600 AromaticContact ND1-CE1 3.92Å; V596-H600 PolarHBondContact O-CD2 2.89Å; V596-H600 PolarHBondContact O-N 2.86Å; V596-H600 VanDerWaalsContact O-N 3.16Å; K597-H600 PolarHBondContact O-N 3.2Å; E598-H600 PolarHBondContact O-N 2.92Å; H600-S604 PolarHBondContact O-N 3.1Å; H600-S604 PolarHBondContact O-OG 3.48Å
601	R	94	Very high	91.1	Very high	117 Å²	117	60.9 Å²	60.9	44%	0.442	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-47.6	173.6	-168.7	-165	71	72.9	-6.2	110.4	K597 E598 Y599 S604 T605	K597-R601 WeakPolarHBondContact O-CB 3.06Å; K597-R601 PolarHBondContact O-N 3.43Å; E598-R601 VanDerWaalsContact CD-NE 3.29Å; E598-R601 WeakPolarHBondContact O-CB 3.38Å; E598-R601 PolarHBondContact O-N 3.27Å; E598-R601 IonicContact OE1-CZ 3.94Å; E598-R601 IonicContact OE1-NE 2.67Å; E598-R601 PolarHBondContact OE1-NE 3.41Å; E598-R601 IonicContact OE1-NH2 3.48Å; E598-R601 PolarHBondContact OE1-NH2 3.3Å; E598-R601 IonicContact OE2-CZ 2.96Å; E598-R601 IonicContact OE2-NE 3.81Å; E598-R601 PolarHBondContact OE2-NE 3.34Å; E598-R601 IonicContact OE2-NH2 2.76Å; Y599-R601 VanDerWaalsContact C-N 3.33Å; Y599-R601 PolarHBondContact O-N 3.37Å; R601-S604 PolarHBondContact O-N 3.41Å; R601-S604 VanDerWaalsContact O-N 3.12Å; R601-T605 HydrophobicContact CG-CG2 4.32Å; R601-T605 PolarHBondContact NH1-OG1 3.28Å; R601-T605 VanDerWaalsContact NH1-OG1 3.12Å; R601-T605 WeakPolarHBondContact O-CB 3.24Å; R601-T605 WeakPolarHBondContact O-CG2 3.3Å; R601-T605 PolarHBondContact O-N 2.89Å; R601-T605 PolarHBondContact O-OG1 3.42Å
602	L	92.1	Very high	91	Very high	7 Å²	7	59.3 Å²	59.3	4%	0.037	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-44.2	179.1	-72.6	171	0	0	0	111.9	L526 E598 Y599 S604 T605 N606 F609	L526-L602 HydrophobicContact CD1-CD1 3.87Å; L526-L602 HydrophobicContact CD2-CD1 3.97Å; L526-L602 HydrophobicContact CD2-CD2 3.86Å; E598-L602 HydrophobicContact CG-CD1 4.18Å; E598-L602 HydrophobicContact CG-CG 4.5Å; E598-L602 WeakPolarHBondContact O-CB 3.23Å; E598-L602 WeakPolarHBondContact O-CG 3.41Å; E598-L602 PolarHBondContact O-N 3.41Å; Y599-L602 PolarHBondContact O-N 2.94Å; L602-S604 PolarHBondContact O-N 3.34Å; L602-S604 VanDerWaalsContact O-N 3.1Å; L602-T605 PolarHBondContact O-N 3.09Å; L602-N606 HydrophobicContact CD2-CB 4.28Å; L602-N606 WeakPolarHBondContact O-CA 3.37Å; L602-N606 PolarHBondContact O-N 3.36Å; L602-F609 HydrophobicContact CB-CB 4.45Å; L602-F609 HydrophobicContact CB-CD1 3.61Å; L602-F609 HydrophobicContact CB-CD2 4.35Å; L602-F609 HydrophobicContact CB-CE1 3.86Å; L602-F609 HydrophobicContact CB-CG 3.88Å; L602-F609 HydrophobicContact CB-CZ 4.35Å; L602-F609 HydrophobicContact CD1-CD2 4.33Å; L602-F609 HydrophobicContact CD1-CE2 4.16Å; L602-F609 HydrophobicContact CD1-CZ 4.34Å
603	C	90.4	Very high	90.8	Very high	25 Å²	25	57.8 Å²	57.8	17%	0.169	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-27.3	173.7	-69	0	0	0	0	113.5	Y599	Y599-C603 PolarHBondContact O-N 3.18Å; Y599-C603 PolarHBondContact O-SG 3.42Å; Y599-C603 VanDerWaalsContact O-SG 3.33Å
604	S	91.3	Very high	90.6	Very high	104 Å²	104	56.2 Å²	56.2	73%	0.727	30%	0.301	S	S	*	.	H	α-helix	trans	-94.5	-22.9	-178.7	-51.2	0	0	0	0	113.5	H600 R601 L602	H600-S604 PolarHBondContact O-N 3.1Å; H600-S604 PolarHBondContact O-OG 3.48Å; R601-S604 PolarHBondContact O-N 3.41Å; R601-S604 VanDerWaalsContact O-N 3.12Å; L602-S604 PolarHBondContact O-N 3.34Å; L602-S604 VanDerWaalsContact O-N 3.1Å
605	T	91.1	Very high	90.2	Very high	93 Å²	93	54.5 Å²	54.5	57%	0.571	29%	0.288	S	S	*	.	H	α-helix	trans	-112.7	-30.5	-171	54.7	0	0	0	0	113.6	R601 L602	R601-T605 HydrophobicContact CG-CG2 4.32Å; R601-T605 PolarHBondContact NH1-OG1 3.28Å; R601-T605 VanDerWaalsContact NH1-OG1 3.12Å; R601-T605 WeakPolarHBondContact O-CB 3.24Å; R601-T605 WeakPolarHBondContact O-CG2 3.3Å; R601-T605 PolarHBondContact O-N 2.89Å; R601-T605 PolarHBondContact O-OG1 3.42Å; L602-T605 PolarHBondContact O-N 3.09Å
606	N	90.2	Very high	89.7	Confident	38 Å²	38	54.8 Å²	54.8	20%	0.203	29%	0.289	C	S	.	.			trans	-111.6	105.5	-177.8	-175.9	-22.1	0	0	0	109.5	I525 L602 N608 F609 Q610	I525-N606 PolarHBondContact O-ND2 3.49Å; L602-N606 HydrophobicContact CD2-CB 4.28Å; L602-N606 WeakPolarHBondContact O-CA 3.37Å; L602-N606 PolarHBondContact O-N 3.36Å; N606-N608 VanDerWaalsContact C-N 3.3Å; N606-N608 PolarHBondContact O-N 3.14Å; N606-N608 WeakPolarHBondContact OD1-CB 3.29Å; N606-N608 PolarHBondContact OD1-N 2.92Å; N606-F609 HydrophobicContact CB-CB 3.83Å; N606-F609 WeakPolarHBondContact O-CB 3.32Å; N606-F609 PolarHBondContact O-N 2.91Å; N606-F609 PolarHBondContact OD1-N 3.47Å; N606-F609 VanDerWaalsContact OD1-N 3.08Å; N606-Q610 PolarHBondContact O-N 3.35Å
607	A	90.2	Very high	88.9	Confident	71 Å²	71	56 Å²	56	59%	0.587	30%	0.299	S	S	*	.	H	α-helix	trans	-64.2	-33.4	-179.3	0	0	0	0	0	112.9	Q610 Y611	A607-Q610 PolarHBondContact O-N 3.22Å; A607-Y611 WeakPolarHBondContact O-CB 3.38Å; A607-Y611 PolarHBondContact O-N 2.96Å
608	N	89.6	Confident	88	Confident	108 Å²	108	57.7 Å²	57.7	58%	0.578	31%	0.306	S	S	*	.	H	α-helix	trans	-67.2	-42	176.9	-65.5	-15.9	0	0	0	110.5	I525 N606 Y611 F612	I525-N608 HydrophobicContact CG1-CB 4.27Å; I525-N608 HydrophobicContact CG2-CB 4.38Å; N606-N608 VanDerWaalsContact C-N 3.3Å; N606-N608 PolarHBondContact O-N 3.14Å; N606-N608 WeakPolarHBondContact OD1-CB 3.29Å; N606-N608 PolarHBondContact OD1-N 2.92Å; N608-Y611 PolarHBondContact O-N 2.93Å; N608-F612 WeakPolarHBondContact O-CB 3.16Å; N608-F612 PolarHBondContact O-N 2.8Å
609	F	91.3	Very high	86.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.1	-44.4	174.2	-171.6	-91.7	0	0	0	111.8	L520 I525 L526 Y599 L602 N606 Y611 F612 V613	L520-F609 HydrophobicContact CD1-CD2 4.4Å; L520-F609 HydrophobicContact CD1-CE2 3.73Å; L520-F609 HydrophobicContact CD2-CD2 3.75Å; L520-F609 HydrophobicContact CD2-CE2 3.87Å; I525-F609 HydrophobicContact CG2-CB 3.91Å; I525-F609 HydrophobicContact CG2-CD2 4.08Å; L526-F609 HydrophobicContact CD1-CD2 4.19Å; L526-F609 HydrophobicContact CD1-CE2 4.03Å; Y599-F609 AromaticContact CD2-CE1 3.67Å; Y599-F609 HydrophobicContact CD2-CE1 3.67Å; Y599-F609 AromaticContact CD2-CZ 3.71Å; Y599-F609 HydrophobicContact CD2-CZ 3.71Å; Y599-F609 AromaticContact CE2-CE1 3.84Å; Y599-F609 HydrophobicContact CE2-CE1 3.84Å; Y599-F609 HydrophobicContact CE2-CZ 4.07Å; L602-F609 HydrophobicContact CB-CB 4.45Å; L602-F609 HydrophobicContact CB-CD1 3.61Å; L602-F609 HydrophobicContact CB-CD2 4.35Å; L602-F609 HydrophobicContact CB-CE1 3.86Å; L602-F609 HydrophobicContact CB-CG 3.88Å; L602-F609 HydrophobicContact CB-CZ 4.35Å; L602-F609 HydrophobicContact CD1-CD2 4.33Å; L602-F609 HydrophobicContact CD1-CE2 4.16Å; L602-F609 HydrophobicContact CD1-CZ 4.34Å; N606-F609 HydrophobicContact CB-CB 3.83Å; N606-F609 WeakPolarHBondContact O-CB 3.32Å; N606-F609 PolarHBondContact O-N 2.91Å; N606-F609 PolarHBondContact OD1-N 3.47Å; N606-F609 VanDerWaalsContact OD1-N 3.08Å; F609-Y611 PolarHBondContact O-N 2.78Å; F609-F612 WeakPolarHBondContact O-CB 3.43Å; F609-F612 PolarHBondContact O-N 2.86Å; F609-V613 HydrophobicContact CD1-CG2 4.03Å; F609-V613 HydrophobicContact CE1-CG2 3.67Å; F609-V613 HydrophobicContact CZ-CG2 4.08Å; F609-V613 WeakPolarHBondContact O-CG2 3.47Å; F609-V613 PolarHBondContact O-N 3.47Å
610	Q	89.4	Confident	85.4	Confident	93 Å²	93	59.9 Å²	59.9	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-45.9	175.8	-173	-178.2	14.1	0	0	111.6	N606 A607 F612 V613 D614	N606-Q610 PolarHBondContact O-N 3.35Å; A607-Q610 PolarHBondContact O-N 3.22Å; Q610-F612 VanDerWaalsContact C-N 3.32Å; Q610-F612 PolarHBondContact O-N 3.37Å; Q610-V613 PolarHBondContact O-N 3.27Å; Q610-D614 WeakPolarHBondContact O-CB 3.27Å; Q610-D614 PolarHBondContact O-N 2.94Å
611	Y	87.6	Confident	84	Confident	86 Å²	86	62.4 Å²	62.4	34%	0.337	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-41.5	177.9	-176	-102.3	0	0	0	112.1	L443 A607 N608 F609 D614 N615	L443-Y611 HydrophobicContact CD2-CD1 3.42Å; L443-Y611 VanDerWaalsContact CD2-CD1 3.42Å; L443-Y611 HydrophobicContact CD2-CE1 3.29Å; L443-Y611 HydrophobicContact CG-CE1 4.4Å; A607-Y611 WeakPolarHBondContact O-CB 3.38Å; A607-Y611 PolarHBondContact O-N 2.96Å; N608-Y611 PolarHBondContact O-N 2.93Å; F609-Y611 PolarHBondContact O-N 2.78Å; Y611-D614 PolarHBondContact O-N 3.41Å; Y611-N615 WeakPolarHBondContact CD1-ND2 3.45Å; Y611-N615 WeakPolarHBondContact CE1-ND2 3.33Å; Y611-N615 WeakPolarHBondContact O-CB 3.43Å; Y611-N615 VanDerWaalsContact O-CG 3.27Å; Y611-N615 PolarHBondContact O-N 3.18Å
612	F	87.7	Confident	82.7	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-59.1	-50.8	174.3	176.6	-93.8	0	0	0	111.9	T515 Y516 L520 L523 I525 N608 F609 Q610 D614 N615 L616	T515-F612 WeakPolarHBondContact O-CZ 3.38Å; Y516-F612 HydrophobicContact CD1-CE1 4.16Å; L520-F612 HydrophobicContact CD1-CE1 4.42Å; L520-F612 HydrophobicContact CD2-CD1 3.56Å; L520-F612 HydrophobicContact CD2-CD2 4.39Å; L520-F612 HydrophobicContact CD2-CE1 3.67Å; L520-F612 HydrophobicContact CD2-CE2 4.48Å; L520-F612 HydrophobicContact CD2-CG 3.94Å; L520-F612 HydrophobicContact CD2-CZ 4.14Å; L520-F612 HydrophobicContact CG-CD1 4.25Å; L520-F612 HydrophobicContact CG-CE1 3.83Å; L520-F612 HydrophobicContact CG-CZ 4.1Å; L523-F612 HydrophobicContact CD1-CD2 3.68Å; L523-F612 HydrophobicContact CD1-CE2 3.85Å; I525-F612 HydrophobicContact CD1-CB 3.84Å; I525-F612 HydrophobicContact CD1-CD2 4.08Å; I525-F612 HydrophobicContact CD1-CG 4.11Å; N608-F612 WeakPolarHBondContact O-CB 3.16Å; N608-F612 PolarHBondContact O-N 2.8Å; F609-F612 WeakPolarHBondContact O-CB 3.43Å; F609-F612 PolarHBondContact O-N 2.86Å; Q610-F612 VanDerWaalsContact C-N 3.32Å; Q610-F612 PolarHBondContact O-N 3.37Å; F612-D614 PolarHBondContact O-N 3.36Å; F612-N615 PolarHBondContact O-N 3.07Å; F612-L616 HydrophobicContact CD1-CD1 3.93Å; F612-L616 HydrophobicContact CE1-CD1 3.31Å; F612-L616 HydrophobicContact CE1-CG 4.17Å; F612-L616 HydrophobicContact CZ-CD1 3.65Å; F612-L616 HydrophobicContact CZ-CG 4.26Å; F612-L616 WeakPolarHBondContact O-CG 3.43Å; F612-L616 PolarHBondContact O-N 2.82Å
613	V	88	Confident	81.2	Confident	18 Å²	18	64.6 Å²	64.6	11%	0.109	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-43.2	177.6	171.3	0	0	0	0	111.7	Y599 F609 Q610 N615 L616 S617	Y599-V613 HydrophobicContact CE2-CG2 3.97Å; Y599-V613 WeakPolarHBondContact OH-CG1 3.49Å; F609-V613 HydrophobicContact CD1-CG2 4.03Å; F609-V613 HydrophobicContact CE1-CG2 3.67Å; F609-V613 HydrophobicContact CZ-CG2 4.08Å; F609-V613 WeakPolarHBondContact O-CG2 3.47Å; F609-V613 PolarHBondContact O-N 3.47Å; Q610-V613 PolarHBondContact O-N 3.27Å; V613-N615 VanDerWaalsContact C-N 3.32Å; V613-N615 PolarHBondContact O-N 2.98Å; V613-L616 PolarHBondContact O-N 3.36Å; V613-S617 WeakPolarHBondContact O-CB 3.36Å; V613-S617 PolarHBondContact O-N 3.18Å
614	D	85.1	Confident	80	Confident	73 Å²	73	68.6 Å²	68.6	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-39.5	178.4	-77.4	-15.3	0	0	0	111.1	Q610 Y611 F612 S617 K618	Q610-D614 WeakPolarHBondContact O-CB 3.27Å; Q610-D614 PolarHBondContact O-N 2.94Å; Y611-D614 PolarHBondContact O-N 3.41Å; F612-D614 PolarHBondContact O-N 3.36Å; D614-S617 PolarHBondContact O-N 2.92Å; D614-S617 PolarHBondContact O-OG 3.2Å; D614-K618 WeakPolarHBondContact O-CG 3.44Å; D614-K618 PolarHBondContact O-N 3.15Å
615	N	81.5	Confident	79.3	Confident	14 Å²	14	65.2 Å²	65.2	8%	0.075	35%	0.35	C	S	.	.	H	α-helix	trans	-66	-43.4	175.2	-77.1	-10.5	0	0	0	112.4	Y611 F612 V613 S617 K618	Y611-N615 WeakPolarHBondContact CD1-ND2 3.45Å; Y611-N615 WeakPolarHBondContact CE1-ND2 3.33Å; Y611-N615 WeakPolarHBondContact O-CB 3.43Å; Y611-N615 VanDerWaalsContact O-CG 3.27Å; Y611-N615 PolarHBondContact O-N 3.18Å; F612-N615 PolarHBondContact O-N 3.07Å; V613-N615 VanDerWaalsContact C-N 3.32Å; V613-N615 PolarHBondContact O-N 2.98Å; N615-S617 VanDerWaalsContact C-N 3.29Å; N615-S617 PolarHBondContact O-N 3.24Å; N615-K618 PolarHBondContact O-N 3.29Å; N615-K618 PolarHBondContact OD1-NZ 3.42Å
616	L	81.2	Confident	79.1	Confident	8 Å²	8	62.4 Å²	62.4	4%	0.042	33%	0.334	C	S	.	.	H	α-helix	trans	-58.7	-43.1	172.1	-70.8	-179.6	0	0	0	111	T515 Y516 F612 V613 K618 S619 F622	T515-L616 HydrophobicContact CG2-CD1 4.09Å; T515-L616 HydrophobicContact CG2-CD2 3.51Å; T515-L616 HydrophobicContact CG2-CG 4.47Å; Y516-L616 HydrophobicContact CD1-CD1 4.21Å; Y516-L616 HydrophobicContact CE1-CD1 3.72Å; F612-L616 HydrophobicContact CD1-CD1 3.93Å; F612-L616 HydrophobicContact CE1-CD1 3.31Å; F612-L616 HydrophobicContact CE1-CG 4.17Å; F612-L616 HydrophobicContact CZ-CD1 3.65Å; F612-L616 HydrophobicContact CZ-CG 4.26Å; F612-L616 WeakPolarHBondContact O-CG 3.43Å; F612-L616 PolarHBondContact O-N 2.82Å; V613-L616 PolarHBondContact O-N 3.36Å; L616-K618 PolarHBondContact O-N 2.86Å; L616-S619 PolarHBondContact O-N 3.4Å; L616-S619 VanDerWaalsContact O-N 3.07Å; L616-S619 PolarHBondContact O-OG 2.89Å; L616-F622 WeakPolarHBondContact O-CB 3.36Å
617	S	77.3	Confident	79	Confident	56 Å²	56	60.6 Å²	60.6	39%	0.392	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-23.5	-178.7	80.7	0	0	0	0	114.8	V613 D614 N615 S619	V613-S617 WeakPolarHBondContact O-CB 3.36Å; V613-S617 PolarHBondContact O-N 3.18Å; D614-S617 PolarHBondContact O-N 2.92Å; D614-S617 PolarHBondContact O-OG 3.2Å; N615-S617 VanDerWaalsContact C-N 3.29Å; N615-S617 PolarHBondContact O-N 3.24Å; S617-S619 VanDerWaalsContact C-N 3.33Å
618	K	73.4	Confident	79.1	Confident	147 Å²	147	58.4 Å²	58.4	64%	0.639	30%	0.304	S	S	*	.	H	α-helix	trans	-73.1	-27.5	176.2	-69.2	166.9	-165.7	162.7	0	112.2	D614 N615 L616	D614-K618 WeakPolarHBondContact O-CG 3.44Å; D614-K618 PolarHBondContact O-N 3.15Å; N615-K618 PolarHBondContact O-N 3.29Å; N615-K618 PolarHBondContact OD1-NZ 3.42Å; L616-K618 PolarHBondContact O-N 2.86Å
619	S	67.6	Low	79.1	Confident	17 Å²	17	56.5 Å²	56.5	12%	0.119	29%	0.294	C	S	.	.	S	Bend	trans	-77.9	134.1	179.6	66.7	0	0	0	0	111.3	L616 S617 H621 F622 K623	L616-S619 PolarHBondContact O-N 3.4Å; L616-S619 VanDerWaalsContact O-N 3.07Å; L616-S619 PolarHBondContact O-OG 2.89Å; S617-S619 VanDerWaalsContact C-N 3.33Å; S619-H621 VanDerWaalsContact C-N 3.25Å; S619-H621 PolarHBondContact O-N 3.15Å; S619-F622 PolarHBondContact O-N 2.88Å; S619-F622 WeakPolarHBondContact OG-CD2 3.4Å; S619-K623 PolarHBondContact O-N 3.22Å
620	S	62.1	Low	79.2	Confident	104 Å²	104	56.5 Å²	56.5	73%	0.727	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-41.9	-176.4	174.2	0	0	0	0	112.7	F622	S620-F622 VanDerWaalsContact C-N 3.31Å; S620-F622 PolarHBondContact O-N 2.69Å
621	H	63.3	Low	79.3	Confident	125 Å²	125	52.1 Å²	52.1	58%	0.579	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.7	-174.8	-61.4	-80.2	0	0	0	114	S619	S619-H621 VanDerWaalsContact C-N 3.25Å; S619-H621 PolarHBondContact O-N 3.15Å
622	F	66.2	Low	79.6	Confident	9 Å²	9	51.4 Å²	51.4	4%	0.039	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-9.2	-171.3	-60.8	-92.3	0	0	0	113.5	I511 T515 L616 S619 S620 T624 R625	I511-F622 HydrophobicContact CB-CE1 4.4Å; I511-F622 HydrophobicContact CD1-CE1 4.37Å; I511-F622 HydrophobicContact CG1-CE1 4.06Å; I511-F622 HydrophobicContact CG2-CD1 3.95Å; I511-F622 HydrophobicContact CG2-CE1 3.63Å; T515-F622 HydrophobicContact CG2-CD1 4.29Å; T515-F622 HydrophobicContact CG2-CE1 3.56Å; T515-F622 HydrophobicContact CG2-CZ 3.81Å; T515-F622 WeakPolarHBondContact OG1-CE1 3.48Å; L616-F622 WeakPolarHBondContact O-CB 3.36Å; S619-F622 PolarHBondContact O-N 2.88Å; S619-F622 WeakPolarHBondContact OG-CD2 3.4Å; S620-F622 VanDerWaalsContact C-N 3.31Å; S620-F622 PolarHBondContact O-N 2.69Å; F622-T624 PolarHBondContact O-N 2.95Å; F622-R625 CarbonylContact O-C 3.41Å; F622-R625 PolarHBondContact O-N 2.65Å
623	K	61.1	Low	79.8	Confident	160 Å²	160	54.2 Å²	54.2	70%	0.696	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.4	179.8	-169.4	173	-177.8	174	0	113.9	S619	S619-K623 PolarHBondContact O-N 3.22Å
624	T	65	Low	80.1	Confident	109 Å²	109	53.3 Å²	53.3	67%	0.669	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	2.4	176.9	54.1	0	0	0	0	113.9	F622	F622-T624 PolarHBondContact O-N 2.95Å
625	R	76.9	Confident	80.5	Confident	34 Å²	34	51 Å²	51	13%	0.128	27%	0.273	C	S	.	.			trans	-129.1	57.4	-173	-61.1	-177.2	-172.2	-104.5	11.7	111.1	H504 T508 Y516 F622	H504-R625 PolarHBondContact CE1-NH2 3.13Å; H504-R625 PolarHBondContact ND1-NH2 3.15Å; H504-R625 PolarHBondContact NE2-NH1 3.36Å; T508-R625 PolarHBondContact OG1-NH1 3.1Å; Y516-R625 PolarHBondContact OH-O 2.87Å; F622-R625 CarbonylContact O-C 3.41Å; F622-R625 PolarHBondContact O-N 2.65Å
626	S	86.7	Confident	81	Confident	34 Å²	34	52.1 Å²	52.1	24%	0.238	28%	0.278	C	S	.	.			trans	-63	160.2	171	76.7	0	0	0	0	110.7	Y516 D629 C630	Y516-S626 WeakPolarHBondContact OH-CA 3.48Å; S626-D629 WeakPolarHBondContact CB-OD2 3.15Å; S626-D629 PolarHBondContact N-OD2 3.47Å; S626-D629 WeakPolarHBondContact O-CB 3.24Å; S626-D629 PolarHBondContact O-N 3.19Å; S626-D629 VanDerWaalsContact O-N 3.07Å; S626-D629 PolarHBondContact OG-N 3.07Å; S626-D629 PolarHBondContact OG-OD2 2.93Å; S626-C630 PolarHBondContact O-N 2.79Å; S626-C630 PolarHBondContact O-SG 3.43Å
627	L	89.1	Confident	81.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.3	-49.6	178.6	176.2	62.9	0	0	0	112.3	L512 Y516 L534 M535 Y599 D629 C630 L631	L512-L627 HydrophobicContact CD1-CD1 3.2Å; Y516-L627 HydrophobicContact CD1-CB 4.09Å; Y516-L627 HydrophobicContact CD1-CD1 4.35Å; Y516-L627 HydrophobicContact CE1-CB 3.71Å; Y516-L627 HydrophobicContact CG-CD1 4.33Å; Y516-L627 PolarHBondContact OH-N 3.48Å; L534-L627 HydrophobicContact CD2-CD2 3.95Å; L534-L627 HydrophobicContact CG-CD2 4.37Å; M535-L627 HydrophobicContact CE-CD1 3.82Å; M535-L627 HydrophobicContact CE-CD2 4.19Å; Y599-L627 HydrophobicContact CD2-CB 4.03Å; Y599-L627 HydrophobicContact CD2-CD2 3.7Å; Y599-L627 HydrophobicContact CD2-CG 4.3Å; Y599-L627 HydrophobicContact CE2-CB 3.98Å; Y599-L627 HydrophobicContact CE2-CD2 4.4Å; Y599-L627 HydrophobicContact CG-CD2 4.39Å; L627-D629 VanDerWaalsContact C-N 3.25Å; L627-D629 PolarHBondContact O-N 2.89Å; L627-C630 PolarHBondContact O-N 2.63Å; L627-C630 VanDerWaalsContact O-N 3.16Å; L627-L631 HydrophobicContact CD1-CD2 4.42Å; L627-L631 HydrophobicContact CD1-CG 4.2Å; L627-L631 HydrophobicContact CG-CD1 4.39Å; L627-L631 HydrophobicContact CG-CG 4.48Å; L627-L631 WeakPolarHBondContact O-CG 3.34Å; L627-L631 PolarHBondContact O-N 2.98Å
628	P	91.2	Very high	82.6	Confident	24 Å²	24	50.3 Å²	50.3	16%	0.156	26%	0.263	C	S	.	.	H	α-helix	trans	-56.4	-36.8	174.6	-27	35.5	0	0	0	114.1	V596 Y599 L632	V596-P628 HydrophobicContact CG2-CB 4.44Å; Y599-P628 HydrophobicContact CD1-CG 3.49Å; Y599-P628 VanDerWaalsContact CD1-CG 3.49Å; Y599-P628 HydrophobicContact CE1-CG 3.52Å; Y599-P628 HydrophobicContact CG-CG 4.1Å; P628-L632 WeakPolarHBondContact O-CB 3.36Å; P628-L632 PolarHBondContact O-N 2.71Å
629	D	90.6	Very high	83.5	Confident	69 Å²	69	45.2 Å²	45.2	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-68.1	-42.8	177.7	-61.7	-37.9	0	0	0	111	S626 L627 L632 L633	S626-D629 WeakPolarHBondContact CB-OD2 3.15Å; S626-D629 PolarHBondContact N-OD2 3.47Å; S626-D629 WeakPolarHBondContact O-CB 3.24Å; S626-D629 PolarHBondContact O-N 3.19Å; S626-D629 VanDerWaalsContact O-N 3.07Å; S626-D629 PolarHBondContact OG-N 3.07Å; S626-D629 PolarHBondContact OG-OD2 2.93Å; L627-D629 VanDerWaalsContact C-N 3.25Å; L627-D629 PolarHBondContact O-N 2.89Å; D629-L632 WeakPolarHBondContact O-CB 3.39Å; D629-L632 PolarHBondContact O-N 3.18Å; D629-L633 WeakPolarHBondContact O-CG 3.34Å; D629-L633 PolarHBondContact O-N 3.35Å
630	C	91.7	Very high	84.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-47	176	-63.7	0	0	0	0	111.3	T508 L512 S626 L627 L632 L633 I634	T508-C630 HydrophobicContact CG2-CB 4.12Å; L512-C630 HydrophobicContact CD1-CB 4.38Å; S626-C630 PolarHBondContact O-N 2.79Å; S626-C630 PolarHBondContact O-SG 3.43Å; L627-C630 PolarHBondContact O-N 2.63Å; L627-C630 VanDerWaalsContact O-N 3.16Å; C630-L632 VanDerWaalsContact C-N 3.26Å; C630-L632 PolarHBondContact O-N 2.61Å; C630-L633 PolarHBondContact O-N 3.03Å; C630-I634 WeakPolarHBondContact O-CD1 3.45Å; C630-I634 WeakPolarHBondContact O-CG1 3.43Å; C630-I634 PolarHBondContact O-N 3.08Å
631	L	93.2	Very high	86.4	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-41.5	174.9	-64.4	179.2	0	0	0	111.2	L512 F588 K592 V596 L627 T635	L512-L631 HydrophobicContact CD2-CD2 4.28Å; F588-L631 HydrophobicContact CE1-CD2 4.2Å; F588-L631 HydrophobicContact CE2-CD2 4.08Å; F588-L631 HydrophobicContact CZ-CD2 3.46Å; F588-L631 VanDerWaalsContact CZ-CD2 3.46Å; K592-L631 HydrophobicContact CG-CB 4.47Å; V596-L631 HydrophobicContact CG2-CD1 4.09Å; L627-L631 HydrophobicContact CD1-CD2 4.42Å; L627-L631 HydrophobicContact CD1-CG 4.2Å; L627-L631 HydrophobicContact CG-CD1 4.39Å; L627-L631 HydrophobicContact CG-CG 4.48Å; L627-L631 WeakPolarHBondContact O-CG 3.34Å; L627-L631 PolarHBondContact O-N 2.98Å; L631-T635 VanDerWaalsContact O-CG2 3.24Å; L631-T635 WeakPolarHBondContact O-CG2 3.47Å; L631-T635 PolarHBondContact O-N 3.35Å; L631-T635 VanDerWaalsContact O-N 3.1Å; L631-T635 PolarHBondContact O-OG1 2.68Å; L631-T635 VanDerWaalsContact O-OG1 3.08Å
632	L	92.9	Very high	87.8	Confident	70 Å²	70	39.7 Å²	39.7	37%	0.366	21%	0.205	S	C	.	.	H	α-helix	trans	-63.7	-49.5	176.8	-179.1	62.5	0	0	0	111.9	P628 D629 C630 I634 T635 Q636	P628-L632 WeakPolarHBondContact O-CB 3.36Å; P628-L632 PolarHBondContact O-N 2.71Å; D629-L632 WeakPolarHBondContact O-CB 3.39Å; D629-L632 PolarHBondContact O-N 3.18Å; C630-L632 VanDerWaalsContact C-N 3.26Å; C630-L632 PolarHBondContact O-N 2.61Å; L632-I634 VanDerWaalsContact C-N 3.33Å; L632-I634 PolarHBondContact O-N 2.84Å; L632-T635 PolarHBondContact O-N 3.4Å; L632-T635 PolarHBondContact O-OG1 2.92Å; L632-Q636 HydrophobicContact CD1-CG 4.28Å; L632-Q636 VanDerWaalsContact CD1-NE2 3.34Å; L632-Q636 VanDerWaalsContact O-CG 3.29Å; L632-Q636 WeakPolarHBondContact O-CG 3.32Å; L632-Q636 PolarHBondContact O-N 3.12Å; L632-Q636 VanDerWaalsContact O-N 3.07Å
633	L	92.5	Very high	89.2	Confident	66 Å²	66	42 Å²	42	35%	0.346	22%	0.222	S	C	.	.	H	α-helix	trans	-58.2	-45.5	179.7	-71.7	172.4	0	0	0	111.5	T508 D629 C630 Q636 R637	T508-L633 HydrophobicContact CG2-CB 4.46Å; T508-L633 HydrophobicContact CG2-CD1 4.18Å; D629-L633 WeakPolarHBondContact O-CG 3.34Å; D629-L633 PolarHBondContact O-N 3.35Å; C630-L633 PolarHBondContact O-N 3.03Å; L633-Q636 PolarHBondContact O-N 2.87Å; L633-R637 PolarHBondContact O-N 2.85Å
634	I	93.6	Very high	90.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-48.8	179.9	-66.2	161.3	0	0	0	110.9	L509 L512 M541 Y585 F588 C630 L632 Q636 R637	L509-I634 HydrophobicContact CD2-CD1 3.53Å; L509-I634 HydrophobicContact CD2-CG1 3.82Å; L509-I634 HydrophobicContact CD2-CG2 4.32Å; L509-I634 HydrophobicContact CG-CD1 4.38Å; L509-I634 HydrophobicContact CG-CG1 4.36Å; L512-I634 HydrophobicContact CD2-CD1 3.24Å; L512-I634 HydrophobicContact CG-CD1 4.5Å; M541-I634 HydrophobicContact CE-CG2 3.89Å; Y585-I634 WeakPolarHBondContact CE1-O 3.4Å; F588-I634 HydrophobicContact CD1-CG2 4.04Å; F588-I634 HydrophobicContact CE1-CB 3.86Å; F588-I634 HydrophobicContact CE1-CG2 3.53Å; F588-I634 HydrophobicContact CZ-CB 4.14Å; F588-I634 HydrophobicContact CZ-CD1 3.99Å; F588-I634 HydrophobicContact CZ-CG2 3.87Å; C630-I634 WeakPolarHBondContact O-CD1 3.45Å; C630-I634 WeakPolarHBondContact O-CG1 3.43Å; C630-I634 PolarHBondContact O-N 3.08Å; L632-I634 VanDerWaalsContact C-N 3.33Å; L632-I634 PolarHBondContact O-N 2.84Å; I634-Q636 PolarHBondContact O-N 3.26Å; I634-R637 PolarHBondContact O-N 2.93Å; I634-R637 VanDerWaalsContact O-N 3.15Å
635	T	93	Very high	92.2	Very high	25 Å²	25	30.1 Å²	30.1	15%	0.153	16%	0.161	C	C	.	.	H	α-helix	trans	-62.2	-25.9	178.5	58	0	0	0	0	113.6	F588 K592 L631 L632	F588-T635 HydrophobicContact CD1-CG2 3.78Å; F588-T635 HydrophobicContact CE1-CG2 3.79Å; K592-T635 HydrophobicContact CB-CG2 4.3Å; K592-T635 HydrophobicContact CD-CG2 3.62Å; K592-T635 WeakPolarHBondContact CE-OG1 3.29Å; K592-T635 HydrophobicContact CG-CG2 4.04Å; K592-T635 PolarHBondContact NZ-OG1 3.12Å; L631-T635 VanDerWaalsContact O-CG2 3.24Å; L631-T635 WeakPolarHBondContact O-CG2 3.47Å; L631-T635 PolarHBondContact O-N 3.35Å; L631-T635 VanDerWaalsContact O-N 3.1Å; L631-T635 PolarHBondContact O-OG1 2.68Å; L631-T635 VanDerWaalsContact O-OG1 3.08Å; L632-T635 PolarHBondContact O-N 3.4Å; L632-T635 PolarHBondContact O-OG1 2.92Å
636	Q	93.5	Very high	93.1	Very high	36 Å²	36	31.3 Å²	31.3	17%	0.168	17%	0.168	C	C	.	.	H	α-helix	trans	-79.5	-30.3	177.6	-72.9	178.2	5	0	0	112.9	L632 L633 I634 L638 S639 K640	L632-Q636 HydrophobicContact CD1-CG 4.28Å; L632-Q636 VanDerWaalsContact CD1-NE2 3.34Å; L632-Q636 VanDerWaalsContact O-CG 3.29Å; L632-Q636 WeakPolarHBondContact O-CG 3.32Å; L632-Q636 PolarHBondContact O-N 3.12Å; L632-Q636 VanDerWaalsContact O-N 3.07Å; L633-Q636 PolarHBondContact O-N 2.87Å; I634-Q636 PolarHBondContact O-N 3.26Å; Q636-L638 VanDerWaalsContact C-N 3.34Å; Q636-L638 PolarHBondContact O-N 3.5Å; Q636-S639 PolarHBondContact O-N 2.82Å; Q636-S639 VanDerWaalsContact O-N 3.13Å; Q636-S639 PolarHBondContact O-OG 3.43Å; Q636-K640 PolarHBondContact O-N 3.19Å
637	R	95.9	Very high	93.4	Very high	17 Å²	17	32 Å²	32	6%	0.064	17%	0.173	C	C	.	.	H	α-helix	trans	-54.3	-45.8	-171.5	-176.5	68.5	-177.4	170.4	3.5	112.9	T501 E502 L633 I634 S639 K640 Y641	T501-R637 PolarHBondContact OG1-NH1 2.92Å; T501-R637 VanDerWaalsContact OG1-NH1 3.08Å; E502-R637 IonicContact OE2-CZ 2.7Å; E502-R637 VanDerWaalsContact OE2-CZ 3.27Å; E502-R637 IonicContact OE2-NE 3.16Å; E502-R637 PolarHBondContact OE2-NE 3.3Å; E502-R637 IonicContact OE2-NH2 2.8Å; E502-R637 PolarHBondContact OE2-NH2 3.16Å; L633-R637 PolarHBondContact O-N 2.85Å; I634-R637 PolarHBondContact O-N 2.93Å; I634-R637 VanDerWaalsContact O-N 3.15Å; R637-S639 PolarHBondContact O-N 3.41Å; R637-K640 WeakPolarHBondContact O-CB 3.39Å; R637-K640 PolarHBondContact O-N 2.9Å; R637-Y641 HydrophobicContact CG-CE2 3.84Å; R637-Y641 PolarHBondContact NE-OH 2.9Å
638	L	94.6	Very high	93.7	Very high	10 Å²	10	32 Å²	32	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-54	-41.6	-178.5	-175.7	64.6	0	0	0	112.3	F573 M581 Y585 Q636 K640 L671 I672 V675	F573-L638 HydrophobicContact CE1-CD1 4.4Å; M581-L638 HydrophobicContact CE-CD1 3.9Å; M581-L638 HydrophobicContact SD-CD1 4.14Å; Y585-L638 HydrophobicContact CD1-CB 3.95Å; Y585-L638 HydrophobicContact CD1-CD2 4.08Å; Y585-L638 HydrophobicContact CD2-CD1 4.44Å; Y585-L638 HydrophobicContact CD2-CD2 4.45Å; Y585-L638 HydrophobicContact CE1-CB 3.73Å; Y585-L638 HydrophobicContact CE2-CB 4.47Å; Y585-L638 HydrophobicContact CE2-CD1 4.46Å; Y585-L638 HydrophobicContact CG-CB 4.41Å; Y585-L638 HydrophobicContact CG-CD2 3.94Å; Q636-L638 VanDerWaalsContact C-N 3.34Å; Q636-L638 PolarHBondContact O-N 3.5Å; L638-K640 VanDerWaalsContact C-N 3.31Å; L638-K640 PolarHBondContact O-N 3.13Å; L638-L671 HydrophobicContact CD1-CD2 3.9Å; L638-L671 HydrophobicContact CD1-CG 4.43Å; L638-I672 HydrophobicContact CD2-CG1 4.41Å; L638-I672 HydrophobicContact CG-CG1 4.05Å; L638-V675 HydrophobicContact CD2-CB 4.18Å; L638-V675 HydrophobicContact CD2-CG1 4.09Å; L638-V675 HydrophobicContact CD2-CG2 3.95Å
639	S	92.5	Very high	93.8	Very high	40 Å²	40	33.9 Å²	33.9	28%	0.28	18%	0.177	S	C	.	.	H	α-helix	trans	-72.1	-21.4	178.7	71.5	0	0	0	0	114	Q636 R637	Q636-S639 PolarHBondContact O-N 2.82Å; Q636-S639 VanDerWaalsContact O-N 3.13Å; Q636-S639 PolarHBondContact O-OG 3.43Å; R637-S639 PolarHBondContact O-N 3.41Å
640	K	94.9	Very high	93.9	Very high	83 Å²	83	36.3 Å²	36.3	36%	0.361	19%	0.185	S	C	.	.	H	α-helix	trans	-73.9	-31.4	-179.3	-61.5	-63	-177.5	174.8	0	112.2	Q636 R637 L638 H642 S643 F644	Q636-K640 PolarHBondContact O-N 3.19Å; R637-K640 WeakPolarHBondContact O-CB 3.39Å; R637-K640 PolarHBondContact O-N 2.9Å; L638-K640 VanDerWaalsContact C-N 3.31Å; L638-K640 PolarHBondContact O-N 3.13Å; K640-H642 PolarHBondContact O-N 3.28Å; K640-S643 WeakPolarHBondContact O-CB 3.42Å; K640-S643 PolarHBondContact O-N 3.42Å; K640-F644 HydrophobicContact CB-CD2 4.48Å; K640-F644 HydrophobicContact CB-CE2 4.28Å; K640-F644 WeakPolarHBondContact O-CD2 3.49Å; K640-F644 PolarHBondContact O-N 3.11Å
641	Y	96.1	Very high	93.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.1	-37.1	178.2	-66.8	-64.2	0	0	0	112.7	L498 E502 H545 F548 F569 F573 M581 R637 S643 F644 V645	L498-Y641 HydrophobicContact CD1-CD1 4.35Å; L498-Y641 HydrophobicContact CD1-CE1 4.28Å; E502-Y641 PolarHBondContact OE1-OH 3.21Å; E502-Y641 WeakPolarHBondContact OE2-CE1 3.46Å; E502-Y641 PolarHBondContact OE2-OH 2.94Å; H545-Y641 PolarHBondContact CE1-OH 3.35Å; H545-Y641 PolarHBondContact ND1-OH 3.27Å; H545-Y641 VanDerWaalsContact ND1-OH 3.16Å; F548-Y641 HydrophobicContact CD1-CE1 4.37Å; F548-Y641 AromaticContact CE1-CE1 3.79Å; F548-Y641 HydrophobicContact CE1-CE1 3.79Å; F569-Y641 HydrophobicContact CE1-CD1 4.05Å; F573-Y641 HydrophobicContact CE1-CD2 4.27Å; F573-Y641 HydrophobicContact CE2-CD1 4.35Å; F573-Y641 HydrophobicContact CE2-CG 4.13Å; F573-Y641 HydrophobicContact CZ-CD1 4.11Å; F573-Y641 AromaticContact CZ-CD2 3.54Å; F573-Y641 HydrophobicContact CZ-CD2 3.54Å; F573-Y641 HydrophobicContact CZ-CE2 4.12Å; F573-Y641 AromaticContact CZ-CG 3.52Å; F573-Y641 HydrophobicContact CZ-CG 3.52Å; M581-Y641 HydrophobicContact CE-CD2 4.42Å; M581-Y641 HydrophobicContact CE-CE2 3.76Å; R637-Y641 HydrophobicContact CG-CE2 3.84Å; R637-Y641 PolarHBondContact NE-OH 2.9Å; Y641-S643 VanDerWaalsContact C-N 3.26Å; Y641-S643 PolarHBondContact O-N 3.3Å; Y641-F644 PolarHBondContact O-N 3.43Å; Y641-V645 WeakPolarHBondContact O-CG2 3.46Å; Y641-V645 PolarHBondContact O-N 3.46Å
642	H	93.5	Very high	93.6	Very high	47 Å²	47	36.8 Å²	36.8	22%	0.218	19%	0.187	C	C	.	.	H	α-helix	trans	-56	-42.3	173.9	176.2	-85.7	0	0	0	112.1	K640 E646 V668 K669 I672	K640-H642 PolarHBondContact O-N 3.28Å; H642-E646 IonicContact CE1-OE2 2.63Å; H642-E646 WeakPolarHBondContact O-CB 3.4Å; H642-E646 PolarHBondContact O-N 2.92Å; H642-V668 HydrophobicContact CB-CG1 4.07Å; H642-K669 VanDerWaalsContact CD2-CE 3.44Å; H642-K669 WeakPolarHBondContact CD2-CE 3.44Å; H642-K669 WeakPolarHBondContact NE2-CE 3.49Å; H642-I672 HydrophobicContact CB-CD1 4.28Å
643	S	94.4	Very high	93.3	Very high	57 Å²	57	37.6 Å²	37.6	40%	0.399	20%	0.196	S	C	.	.	H	α-helix	trans	-69.4	-37.3	-179.4	-58.5	0	0	0	0	112.3	K640 Y641 S647	K640-S643 WeakPolarHBondContact O-CB 3.42Å; K640-S643 PolarHBondContact O-N 3.42Å; Y641-S643 VanDerWaalsContact C-N 3.26Å; Y641-S643 PolarHBondContact O-N 3.3Å; S643-S647 WeakPolarHBondContact O-CB 3.47Å; S643-S647 PolarHBondContact O-N 3.39Å; S643-S647 VanDerWaalsContact O-N 3.15Å; S643-S647 PolarHBondContact O-OG 2.97Å
644	F	94.9	Very high	93	Very high	20 Å²	20	38.5 Å²	38.5	9%	0.088	20%	0.201	C	C	.	.	H	α-helix	trans	-64.9	-51.1	174.6	-76.2	-68.5	0	0	0	110.9	I494 E497 L498 F569 K640 Y641 E646 S647 L648	I494-F644 HydrophobicContact CG2-CD1 4.08Å; E497-F644 HydrophobicContact CB-CE1 4.47Å; E497-F644 HydrophobicContact CG-CE1 4.13Å; L498-F644 HydrophobicContact CB-CD1 4.08Å; L498-F644 HydrophobicContact CB-CE1 4.15Å; L498-F644 HydrophobicContact CD1-CB 4.37Å; L498-F644 HydrophobicContact CD1-CD1 4.24Å; L498-F644 HydrophobicContact CD1-CD2 3.84Å; L498-F644 HydrophobicContact CD1-CE2 4.13Å; L498-F644 HydrophobicContact CD1-CG 3.9Å; L498-F644 HydrophobicContact CD1-CZ 4.47Å; F569-F644 HydrophobicContact CZ-CB 4.27Å; K640-F644 HydrophobicContact CB-CD2 4.48Å; K640-F644 HydrophobicContact CB-CE2 4.28Å; K640-F644 WeakPolarHBondContact O-CD2 3.49Å; K640-F644 PolarHBondContact O-N 3.11Å; Y641-F644 PolarHBondContact O-N 3.43Å; F644-E646 PolarHBondContact O-N 3.44Å; F644-S647 PolarHBondContact O-N 3.5Å; F644-L648 WeakPolarHBondContact O-CB 3.37Å; F644-L648 WeakPolarHBondContact O-CG 3.39Å; F644-L648 PolarHBondContact O-N 3.32Å
645	V	95.5	Very high	92.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-44.3	-179.6	170.9	0	0	0	0	111.9	F569 Y641 S647 L648 R649 M661 A664 E665 V668	F569-V645 HydrophobicContact CD1-CG2 3.42Å; F569-V645 VanDerWaalsContact CD1-CG2 3.42Å; F569-V645 HydrophobicContact CD2-CG2 4.27Å; F569-V645 HydrophobicContact CE1-CG2 3.34Å; F569-V645 HydrophobicContact CE2-CG2 4.19Å; F569-V645 HydrophobicContact CG-CG2 3.93Å; F569-V645 HydrophobicContact CZ-CG2 3.74Å; Y641-V645 WeakPolarHBondContact O-CG2 3.46Å; Y641-V645 PolarHBondContact O-N 3.46Å; V645-S647 VanDerWaalsContact C-N 3.32Å; V645-S647 PolarHBondContact O-N 3.27Å; V645-L648 PolarHBondContact O-N 2.95Å; V645-R649 WeakPolarHBondContact O-CB 3.04Å; V645-R649 PolarHBondContact O-N 2.84Å; V645-M661 HydrophobicContact CB-CE 4.15Å; V645-M661 HydrophobicContact CG1-CE 3.75Å; V645-M661 HydrophobicContact CG2-CE 4.18Å; V645-A664 HydrophobicContact CG1-CB 4.32Å; V645-E665 VanDerWaalsContact CG1-CA 3.46Å; V645-E665 HydrophobicContact CG1-CB 3.55Å; V645-E665 HydrophobicContact CG1-CG 4.02Å; V645-V668 HydrophobicContact CG2-CG2 4.22Å
646	E	94.6	Very high	92.5	Very high	59 Å²	59	45.4 Å²	45.4	28%	0.276	25%	0.252	S	S	.	.	H	α-helix	trans	-61.3	-41.5	177.2	-173.4	-173	167.1	0	0	111.8	H642 F644 K650	H642-E646 IonicContact CE1-OE2 2.63Å; H642-E646 WeakPolarHBondContact O-CB 3.4Å; H642-E646 PolarHBondContact O-N 2.92Å; F644-E646 PolarHBondContact O-N 3.44Å; E646-K650 WeakPolarHBondContact O-CG 3.25Å; E646-K650 PolarHBondContact O-N 3.34Å; E646-K650 WeakPolarHBondContact OE1-CE 3.45Å; E646-K650 IonicContact OE1-NZ 3.95Å; E646-K650 PolarHBondContact OE1-NZ 3.01Å
647	S	94	Very high	92.2	Very high	48 Å²	48	44.1 Å²	44.1	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-68.6	-43.6	179.3	-59	0	0	0	0	111.4	S643 F644 V645 K650 S651	S643-S647 WeakPolarHBondContact O-CB 3.47Å; S643-S647 PolarHBondContact O-N 3.39Å; S643-S647 VanDerWaalsContact O-N 3.15Å; S643-S647 PolarHBondContact O-OG 2.97Å; F644-S647 PolarHBondContact O-N 3.5Å; V645-S647 VanDerWaalsContact C-N 3.32Å; V645-S647 PolarHBondContact O-N 3.27Å; S647-K650 PolarHBondContact O-N 2.9Å; S647-S651 PolarHBondContact O-N 3.05Å; S647-S651 VanDerWaalsContact O-N 3.08Å; S647-S651 PolarHBondContact O-OG 2.9Å; S647-S651 VanDerWaalsContact O-OG 3.09Å
648	L	93.9	Very high	92	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-44.1	176.1	-74.5	171	0	0	0	111.8	R491 I494 I495 I565 F569 F644 V645 K650 S651 T652 M661	R491-L648 HydrophobicContact CG-CD2 4.07Å; I494-L648 HydrophobicContact CB-CD2 4Å; I494-L648 HydrophobicContact CG2-CD2 3.7Å; I494-L648 HydrophobicContact CG2-CG 3.79Å; I495-L648 HydrophobicContact CD1-CD2 4.37Å; I495-L648 HydrophobicContact CG1-CD2 3.65Å; I565-L648 HydrophobicContact CG1-CD1 4.09Å; F569-L648 HydrophobicContact CD2-CD1 4.49Å; F569-L648 HydrophobicContact CE2-CD1 3.61Å; F569-L648 HydrophobicContact CZ-CD1 4.24Å; F644-L648 WeakPolarHBondContact O-CB 3.37Å; F644-L648 WeakPolarHBondContact O-CG 3.39Å; F644-L648 PolarHBondContact O-N 3.32Å; V645-L648 PolarHBondContact O-N 2.95Å; L648-K650 VanDerWaalsContact C-N 3.3Å; L648-K650 PolarHBondContact O-N 3.29Å; L648-S651 WeakPolarHBondContact CA-OG 3.46Å; L648-S651 CarbonylContact O-C 3.47Å; L648-S651 PolarHBondContact O-N 3.44Å; L648-S651 VanDerWaalsContact O-N 3.14Å; L648-S651 PolarHBondContact O-OG 3.11Å; L648-T652 WeakPolarHBondContact O-CB 3.44Å; L648-T652 PolarHBondContact O-N 3.49Å; L648-T652 PolarHBondContact O-OG1 2.72Å; L648-M661 HydrophobicContact CB-CE 3.62Å; L648-M661 HydrophobicContact CB-SD 4.3Å; L648-M661 HydrophobicContact CD1-CE 4.04Å; L648-M661 HydrophobicContact CG-CE 4.5Å
649	R	93.2	Very high	91.9	Very high	63 Å²	63	51.5 Å²	51.5	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-59.5	-39.4	176.1	-172.8	-174.9	61	76.9	-0.6	112.3	V645 K658 M661 I662 E665	V645-R649 WeakPolarHBondContact O-CB 3.04Å; V645-R649 PolarHBondContact O-N 2.84Å; R649-K658 HydrophobicContact CG-CG 4.43Å; R649-M661 HydrophobicContact CB-CB 4.08Å; R649-M661 HydrophobicContact CG-CB 4.27Å; R649-I662 HydrophobicContact CG-CG1 4.27Å; R649-E665 VanDerWaalsContact CD-OE2 3.31Å; R649-E665 WeakPolarHBondContact CD-OE2 3.45Å; R649-E665 IonicContact CZ-OE2 2.79Å; R649-E665 IonicContact NE-OE2 3.27Å; R649-E665 PolarHBondContact NE-OE2 3.15Å; R649-E665 IonicContact NH2-OE2 3.84Å
650	K	92.7	Very high	92	Very high	121 Å²	121	50 Å²	50	53%	0.526	27%	0.271	S	S	.	.	H	α-helix	trans	-69.2	-34.6	176.6	-71.3	171.1	-172.6	169.5	0	112.3	K487 E646 S647 L648	K487-K650 WeakPolarHBondContact CE-O 3.31Å; E646-K650 WeakPolarHBondContact O-CG 3.25Å; E646-K650 PolarHBondContact O-N 3.34Å; E646-K650 WeakPolarHBondContact OE1-CE 3.45Å; E646-K650 IonicContact OE1-NZ 3.95Å; E646-K650 PolarHBondContact OE1-NZ 3.01Å; S647-K650 PolarHBondContact O-N 2.9Å; L648-K650 VanDerWaalsContact C-N 3.3Å; L648-K650 PolarHBondContact O-N 3.29Å
651	S	89.6	Confident	91.9	Very high	7 Å²	7	46 Å²	46	5%	0.049	25%	0.254	C	S	.	.	H	α-helix	trans	-83	-19.6	177.9	53.1	0	0	0	0	114.2	K487 S647 L648	K487-S651 WeakPolarHBondContact CE-O 3.45Å; K487-S651 WeakPolarHBondContact CG-O 3.31Å; S647-S651 PolarHBondContact O-N 3.05Å; S647-S651 VanDerWaalsContact O-N 3.08Å; S647-S651 PolarHBondContact O-OG 2.9Å; S647-S651 VanDerWaalsContact O-OG 3.09Å; L648-S651 WeakPolarHBondContact CA-OG 3.46Å; L648-S651 CarbonylContact O-C 3.47Å; L648-S651 PolarHBondContact O-N 3.44Å; L648-S651 VanDerWaalsContact O-N 3.14Å; L648-S651 PolarHBondContact O-OG 3.11Å
652	T	90	Very high	91.9	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	27%	0.267	C	S	.	.			trans	-73.4	137.5	179.2	-56.7	0	0	0	0	111.1	K487 L648 A657 K658	K487-T652 PolarHBondContact NZ-O 2.95Å; L648-T652 WeakPolarHBondContact O-CB 3.44Å; L648-T652 PolarHBondContact O-N 3.49Å; L648-T652 PolarHBondContact O-OG1 2.72Å; T652-A657 HydrophobicContact CG2-CB 3.74Å; T652-K658 HydrophobicContact CG2-CB 4.11Å
653	T	86.5	Confident	92	Very high	88 Å²	88	51.5 Å²	51.5	54%	0.54	28%	0.279	S	S	.	.			trans	-114.5	-35.9	-178	-51.7	0	0	0	0	111.9	K487	K487-T653 PolarHBondContact NZ-OG1 2.68Å
654	D	87	Confident	92.1	Very high	85 Å²	85	48.8 Å²	48.8	46%	0.455	26%	0.26	S	S	.	.	S	Bend	trans	-59.6	124.3	174.2	171.8	40.8	0	0	0	110.8	A656 A657 K658	D654-A656 VanDerWaalsContact C-N 3.32Å; D654-A656 PolarHBondContact O-N 3.19Å; D654-A656 PolarHBondContact OD1-N 3.21Å; D654-A657 HydrophobicContact CB-CB 4.17Å; D654-A657 VanDerWaalsContact OD2-CB 3.3Å; D654-A657 WeakPolarHBondContact OD2-CB 3.26Å; D654-A657 PolarHBondContact OD2-N 2.95Å; D654-K658 WeakPolarHBondContact O-CB 3.31Å; D654-K658 PolarHBondContact O-N 2.79Å
655	P	87.3	Confident	92.1	Very high	102 Å²	102	49 Å²	49	66%	0.662	26%	0.262	S	S	*	.	H	α-helix	trans	-60.2	-37.6	180	22.5	-34.4	0	0	0	113.3	K658 E659	P655-K658 PolarHBondContact O-N 2.98Å; P655-E659 PolarHBondContact O-N 3.45Å
656	A	87.1	Confident	92.1	Very high	67 Å²	67	55 Å²	55	55%	0.554	29%	0.29	S	S	*	.	H	α-helix	trans	-67.8	-52.5	-178.6	0	0	0	0	0	111.4	D654 K658 E659 G660	D654-A656 VanDerWaalsContact C-N 3.32Å; D654-A656 PolarHBondContact O-N 3.19Å; D654-A656 PolarHBondContact OD1-N 3.21Å; A656-K658 PolarHBondContact O-N 3.33Å; A656-E659 PolarHBondContact O-N 2.93Å; A656-G660 PolarHBondContact O-N 2.93Å; A656-G660 VanDerWaalsContact O-N 3.09Å
657	A	88.9	Confident	92.2	Very high	10 Å²	10	53 Å²	53	8%	0.083	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-34	174.7	0	0	0	0	0	112.2	T652 D654 G660 M661	T652-A657 HydrophobicContact CG2-CB 3.74Å; D654-A657 HydrophobicContact CB-CB 4.17Å; D654-A657 VanDerWaalsContact OD2-CB 3.3Å; D654-A657 WeakPolarHBondContact OD2-CB 3.26Å; D654-A657 PolarHBondContact OD2-N 2.95Å; A657-G660 PolarHBondContact O-N 2.97Å; A657-M661 VanDerWaalsContact O-CG 3.29Å; A657-M661 WeakPolarHBondContact O-CG 3.47Å; A657-M661 PolarHBondContact O-N 2.89Å
658	K	90.7	Very high	92.3	Very high	90 Å²	90	50.7 Å²	50.7	39%	0.391	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-37.4	177.5	-172.2	178	179.2	-171	0	112.2	R649 T652 D654 P655 A656 M661 I662	R649-K658 HydrophobicContact CG-CG 4.43Å; T652-K658 HydrophobicContact CG2-CB 4.11Å; D654-K658 WeakPolarHBondContact O-CB 3.31Å; D654-K658 PolarHBondContact O-N 2.79Å; P655-K658 PolarHBondContact O-N 2.98Å; A656-K658 PolarHBondContact O-N 3.33Å; K658-M661 PolarHBondContact O-N 3.38Å; K658-I662 WeakPolarHBondContact O-CG1 3.4Å; K658-I662 PolarHBondContact O-N 3.38Å
659	E	93	Very high	92.4	Very high	92 Å²	92	55.2 Å²	55.2	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-44.1	172.9	-179.9	55.1	-153	0	0	111.1	P655 A656 M661 I662 K663	P655-E659 PolarHBondContact O-N 3.45Å; A656-E659 PolarHBondContact O-N 2.93Å; E659-M661 VanDerWaalsContact C-N 3.31Å; E659-M661 PolarHBondContact O-N 3.16Å; E659-I662 WeakPolarHBondContact O-CB 3.37Å; E659-I662 PolarHBondContact O-N 3.45Å; E659-I662 VanDerWaalsContact O-N 3.08Å; E659-K663 PolarHBondContact O-N 3.17Å; E659-K663 VanDerWaalsContact OE1-CE 3.3Å; E659-K663 WeakPolarHBondContact OE1-CE 3.34Å
660	G	93.4	Very high	92.5	Very high	7 Å²	7	58.9 Å²	58.9	7%	0.072	30%	0.304	C	S	.	.	H	α-helix	trans	-55.8	-44.2	171.9	0	0	0	0	0	112.6	A656 A657 I662 K663 A664	A656-G660 PolarHBondContact O-N 2.93Å; A656-G660 VanDerWaalsContact O-N 3.09Å; A657-G660 PolarHBondContact O-N 2.97Å; G660-I662 VanDerWaalsContact C-N 3.34Å; G660-I662 PolarHBondContact O-N 2.93Å; G660-K663 PolarHBondContact O-N 3.46Å; G660-A664 WeakPolarHBondContact O-CB 3.34Å; G660-A664 PolarHBondContact O-N 3.32Å
661	M	94.7	Very high	92.7	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-65.7	-32	175.7	-68.3	-55.5	-44.7	0	0	113.4	I565 D566 F569 V645 L648 R649 A657 K658 E659 E665	I565-M661 HydrophobicContact CG2-SD 4Å; D566-M661 HydrophobicContact CB-CG 4.14Å; D566-M661 HydrophobicContact CB-SD 3.71Å; F569-M661 HydrophobicContact CD2-CE 4.31Å; V645-M661 HydrophobicContact CB-CE 4.15Å; V645-M661 HydrophobicContact CG1-CE 3.75Å; V645-M661 HydrophobicContact CG2-CE 4.18Å; L648-M661 HydrophobicContact CB-CE 3.62Å; L648-M661 HydrophobicContact CB-SD 4.3Å; L648-M661 HydrophobicContact CD1-CE 4.04Å; L648-M661 HydrophobicContact CG-CE 4.5Å; R649-M661 HydrophobicContact CB-CB 4.08Å; R649-M661 HydrophobicContact CG-CB 4.27Å; A657-M661 VanDerWaalsContact O-CG 3.29Å; A657-M661 WeakPolarHBondContact O-CG 3.47Å; A657-M661 PolarHBondContact O-N 2.89Å; K658-M661 PolarHBondContact O-N 3.38Å; E659-M661 VanDerWaalsContact C-N 3.31Å; E659-M661 PolarHBondContact O-N 3.16Å; M661-E665 WeakPolarHBondContact O-CB 3.17Å; M661-E665 PolarHBondContact O-N 2.58Å
662	I	95.3	Very high	93	Very high	53 Å²	53	54.8 Å²	54.8	27%	0.272	29%	0.287	S	S	.	.	H	α-helix	trans	-66.7	-45.1	174.2	-71	163.4	0	0	0	110.1	R649 K658 E659 G660 A664 E665 Q666	R649-I662 HydrophobicContact CG-CG1 4.27Å; K658-I662 WeakPolarHBondContact O-CG1 3.4Å; K658-I662 PolarHBondContact O-N 3.38Å; E659-I662 WeakPolarHBondContact O-CB 3.37Å; E659-I662 PolarHBondContact O-N 3.45Å; E659-I662 VanDerWaalsContact O-N 3.08Å; G660-I662 VanDerWaalsContact C-N 3.34Å; G660-I662 PolarHBondContact O-N 2.93Å; I662-A664 VanDerWaalsContact C-N 3.35Å; I662-E665 WeakPolarHBondContact O-CB 3.26Å; I662-E665 PolarHBondContact O-N 3.41Å; I662-E665 VanDerWaalsContact O-N 3.16Å; I662-Q666 WeakPolarHBondContact O-CG 3.43Å; I662-Q666 PolarHBondContact O-N 2.99Å
663	K	95.4	Very high	93.3	Very high	108 Å²	108	57.4 Å²	57.4	47%	0.47	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-43.6	175.3	-68.1	177.9	-178.9	177.2	0	111.4	L570 E659 G660 E665 Q666 A667	L570-K663 HydrophobicContact CD2-CB 3.88Å; E659-K663 PolarHBondContact O-N 3.17Å; E659-K663 VanDerWaalsContact OE1-CE 3.3Å; E659-K663 WeakPolarHBondContact OE1-CE 3.34Å; G660-K663 PolarHBondContact O-N 3.46Å; K663-E665 VanDerWaalsContact C-N 3.32Å; K663-E665 PolarHBondContact O-N 3.08Å; K663-Q666 PolarHBondContact O-N 3.45Å; K663-A667 WeakPolarHBondContact O-CB 3.26Å; K663-A667 PolarHBondContact O-N 2.98Å
664	A	95.6	Very high	93.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-41.6	172.8	0	0	0	0	0	112.1	F569 L570 V645 G660 I662 Q666 A667 V668	F569-A664 HydrophobicContact CB-CB 3.68Å; F569-A664 HydrophobicContact CG-CB 4.44Å; L570-A664 HydrophobicContact CD2-CB 4.38Å; V645-A664 HydrophobicContact CG1-CB 4.32Å; G660-A664 WeakPolarHBondContact O-CB 3.34Å; G660-A664 PolarHBondContact O-N 3.32Å; I662-A664 VanDerWaalsContact C-N 3.35Å; A664-Q666 VanDerWaalsContact C-N 3.33Å; A664-Q666 PolarHBondContact O-N 3.04Å; A664-A667 PolarHBondContact O-N 2.96Å; A664-V668 VanDerWaalsContact O-CG2 3.31Å; A664-V668 WeakPolarHBondContact O-CG2 3.47Å; A664-V668 PolarHBondContact O-N 3.37Å
665	E	95.6	Very high	94.1	Very high	26 Å²	26	51.8 Å²	51.8	12%	0.121	28%	0.276	C	S	.	.	H	α-helix	trans	-61.6	-43.4	178.1	-163.8	-174.8	134.5	0	0	111.3	V645 R649 M661 I662 K663 K669	V645-E665 VanDerWaalsContact CG1-CA 3.46Å; V645-E665 HydrophobicContact CG1-CB 3.55Å; V645-E665 HydrophobicContact CG1-CG 4.02Å; R649-E665 VanDerWaalsContact CD-OE2 3.31Å; R649-E665 WeakPolarHBondContact CD-OE2 3.45Å; R649-E665 IonicContact CZ-OE2 2.79Å; R649-E665 IonicContact NE-OE2 3.27Å; R649-E665 PolarHBondContact NE-OE2 3.15Å; R649-E665 IonicContact NH2-OE2 3.84Å; M661-E665 WeakPolarHBondContact O-CB 3.17Å; M661-E665 PolarHBondContact O-N 2.58Å; I662-E665 WeakPolarHBondContact O-CB 3.26Å; I662-E665 PolarHBondContact O-N 3.41Å; I662-E665 VanDerWaalsContact O-N 3.16Å; K663-E665 VanDerWaalsContact C-N 3.32Å; K663-E665 PolarHBondContact O-N 3.08Å; E665-K669 HydrophobicContact CG-CD 4.47Å; E665-K669 WeakPolarHBondContact O-CB 3.24Å; E665-K669 VanDerWaalsContact O-CG 3.28Å; E665-K669 WeakPolarHBondContact O-CG 3.42Å; E665-K669 PolarHBondContact O-N 2.82Å; E665-K669 WeakPolarHBondContact OE1-CE 3.48Å; E665-K669 IonicContact OE1-NZ 2.74Å; E665-K669 PolarHBondContact OE1-NZ 2.98Å
666	Q	96.4	Very high	94.5	Very high	126 Å²	126	49 Å²	49	59%	0.589	26%	0.255	S	S	*	.	H	α-helix	trans	-66	-42.7	176.5	-68.3	173.6	-3.6	0	0	111.7	I662 K663 A664 K669 K670	I662-Q666 WeakPolarHBondContact O-CG 3.43Å; I662-Q666 PolarHBondContact O-N 2.99Å; K663-Q666 PolarHBondContact O-N 3.45Å; A664-Q666 VanDerWaalsContact C-N 3.33Å; A664-Q666 PolarHBondContact O-N 3.04Å; Q666-K669 PolarHBondContact O-N 3.42Å; Q666-K670 WeakPolarHBondContact O-CB 3.47Å; Q666-K670 PolarHBondContact O-N 3.02Å
667	A	95.9	Very high	94.7	Very high	16 Å²	16	49 Å²	49	13%	0.132	26%	0.255	C	S	.	.	H	α-helix	trans	-62.2	-45.6	178.3	0	0	0	0	0	112	F573 T574 K663 A664 K669 K670 L671	F573-A667 HydrophobicContact CB-CB 3.81Å; T574-A667 HydrophobicContact CG2-CB 4.07Å; K663-A667 WeakPolarHBondContact O-CB 3.26Å; K663-A667 PolarHBondContact O-N 2.98Å; A664-A667 PolarHBondContact O-N 2.96Å; A667-K669 PolarHBondContact O-N 3.48Å; A667-K670 PolarHBondContact O-N 3.34Å; A667-L671 PolarHBondContact O-N 2.9Å
668	V	96.4	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-45	175.4	173.7	0	0	0	0	111.2	F573 H642 V645 A664 K670 L671 I672	F573-V668 HydrophobicContact CB-CG2 4.35Å; F573-V668 HydrophobicContact CD1-CB 4.4Å; F573-V668 HydrophobicContact CD1-CG2 3.72Å; F573-V668 HydrophobicContact CD2-CG2 3.48Å; F573-V668 VanDerWaalsContact CD2-CG2 3.48Å; F573-V668 HydrophobicContact CE1-CG2 3.87Å; F573-V668 HydrophobicContact CE2-CG2 3.64Å; F573-V668 HydrophobicContact CG-CG2 3.55Å; F573-V668 HydrophobicContact CZ-CG2 3.85Å; H642-V668 HydrophobicContact CB-CG1 4.07Å; V645-V668 HydrophobicContact CG2-CG2 4.22Å; A664-V668 VanDerWaalsContact O-CG2 3.31Å; A664-V668 WeakPolarHBondContact O-CG2 3.47Å; A664-V668 PolarHBondContact O-N 3.37Å; V668-K670 VanDerWaalsContact C-N 3.35Å; V668-K670 PolarHBondContact O-N 2.84Å; V668-L671 PolarHBondContact O-N 3.28Å; V668-I672 HydrophobicContact CG1-CD1 3.8Å; V668-I672 HydrophobicContact CG1-CG1 4.49Å; V668-I672 WeakPolarHBondContact O-CG1 3.42Å; V668-I672 PolarHBondContact O-N 3.08Å
669	K	96.1	Very high	95	Very high	94 Å²	94	45.6 Å²	45.6	41%	0.409	24%	0.244	S	C	.	.	H	α-helix	trans	-61.3	-43.4	177.4	-77.2	173.9	175.5	172.4	0	112	H642 E665 Q666 A667 I672 A673	H642-K669 VanDerWaalsContact CD2-CE 3.44Å; H642-K669 WeakPolarHBondContact CD2-CE 3.44Å; H642-K669 WeakPolarHBondContact NE2-CE 3.49Å; E665-K669 HydrophobicContact CG-CD 4.47Å; E665-K669 WeakPolarHBondContact O-CB 3.24Å; E665-K669 VanDerWaalsContact O-CG 3.28Å; E665-K669 WeakPolarHBondContact O-CG 3.42Å; E665-K669 PolarHBondContact O-N 2.82Å; E665-K669 WeakPolarHBondContact OE1-CE 3.48Å; E665-K669 IonicContact OE1-NZ 2.74Å; E665-K669 PolarHBondContact OE1-NZ 2.98Å; Q666-K669 PolarHBondContact O-N 3.42Å; A667-K669 PolarHBondContact O-N 3.48Å; K669-I672 PolarHBondContact O-N 3.03Å; K669-A673 WeakPolarHBondContact O-CB 3.45Å; K669-A673 PolarHBondContact O-N 3.44Å
670	K	95.8	Very high	94.9	Very high	140 Å²	140	42.4 Å²	42.4	61%	0.609	24%	0.236	S	C	*	.	H	α-helix	trans	-60.3	-50.5	176.2	-176.9	-179	176.8	-178	0	110.4	Q666 A667 V668 I672 A673 D674	Q666-K670 WeakPolarHBondContact O-CB 3.47Å; Q666-K670 PolarHBondContact O-N 3.02Å; A667-K670 PolarHBondContact O-N 3.34Å; V668-K670 VanDerWaalsContact C-N 3.35Å; V668-K670 PolarHBondContact O-N 2.84Å; K670-I672 VanDerWaalsContact C-N 3.35Å; K670-I672 PolarHBondContact O-N 2.94Å; K670-A673 WeakPolarHBondContact O-CB 3.28Å; K670-A673 PolarHBondContact O-N 2.83Å; K670-A673 VanDerWaalsContact O-N 3.1Å; K670-D674 VanDerWaalsContact O-CG 3.3Å; K670-D674 PolarHBondContact O-N 3.39Å
671	L	96.4	Very high	94.8	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-59.1	-44.3	180	-176.8	65	0	0	0	112.4	F573 S578 M581 R582 L638 A667 V668 A673 D674 V675	F573-L671 HydrophobicContact CD1-CB 4.43Å; F573-L671 HydrophobicContact CD1-CD2 3.51Å; F573-L671 HydrophobicContact CE1-CD2 3.7Å; S578-L671 WeakPolarHBondContact O-CD1 3.48Å; M581-L671 HydrophobicContact CB-CD2 4.23Å; M581-L671 HydrophobicContact CG-CD2 4.02Å; M581-L671 HydrophobicContact SD-CD2 3.65Å; R582-L671 HydrophobicContact CB-CD1 3.53Å; R582-L671 HydrophobicContact CG-CD1 4.2Å; L638-L671 HydrophobicContact CD1-CD2 3.9Å; L638-L671 HydrophobicContact CD1-CG 4.43Å; A667-L671 PolarHBondContact O-N 2.9Å; V668-L671 PolarHBondContact O-N 3.28Å; L671-A673 VanDerWaalsContact C-N 3.31Å; L671-A673 PolarHBondContact O-N 3.03Å; L671-D674 PolarHBondContact O-N 3.42Å; L671-V675 HydrophobicContact CD1-CG2 4.45Å; L671-V675 WeakPolarHBondContact O-CB 3.33Å; L671-V675 VanDerWaalsContact O-CG2 3.3Å; L671-V675 WeakPolarHBondContact O-CG2 3.44Å; L671-V675 PolarHBondContact O-N 3.47Å
672	I	96	Very high	94.5	Very high	36 Å²	36	46.9 Å²	46.9	19%	0.185	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-41.6	176.8	-68.4	166.9	0	0	0	110.9	L638 H642 V668 K669 K670 V675 D676	L638-I672 HydrophobicContact CD2-CG1 4.41Å; L638-I672 HydrophobicContact CG-CG1 4.05Å; H642-I672 HydrophobicContact CB-CD1 4.28Å; V668-I672 HydrophobicContact CG1-CD1 3.8Å; V668-I672 HydrophobicContact CG1-CG1 4.49Å; V668-I672 WeakPolarHBondContact O-CG1 3.42Å; V668-I672 PolarHBondContact O-N 3.08Å; K669-I672 PolarHBondContact O-N 3.03Å; K670-I672 VanDerWaalsContact C-N 3.35Å; K670-I672 PolarHBondContact O-N 2.94Å; I672-V675 PolarHBondContact O-N 2.99Å; I672-D676 PolarHBondContact O-N 3.44Å
673	A	95.9	Very high	94.3	Very high	58 Å²	58	48.1 Å²	48.1	48%	0.479	26%	0.262	S	S	.	.	H	α-helix	trans	-66.2	-42.3	177.6	0	0	0	0	0	112	K669 K670 L671 V675 D676 A677	K669-A673 WeakPolarHBondContact O-CB 3.45Å; K669-A673 PolarHBondContact O-N 3.44Å; K670-A673 WeakPolarHBondContact O-CB 3.28Å; K670-A673 PolarHBondContact O-N 2.83Å; K670-A673 VanDerWaalsContact O-N 3.1Å; L671-A673 VanDerWaalsContact C-N 3.31Å; L671-A673 PolarHBondContact O-N 3.03Å; A673-V675 VanDerWaalsContact C-N 3.34Å; A673-V675 PolarHBondContact O-N 3.45Å; A673-D676 PolarHBondContact O-N 2.9Å; A673-A677 WeakPolarHBondContact O-CB 3.44Å; A673-A677 PolarHBondContact O-N 3.43Å
674	D	95.2	Very high	94	Very high	52 Å²	52	44.8 Å²	44.8	28%	0.278	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-40.7	176.9	-69	-5.7	0	0	0	111.2	R582 K670 L671 A677 G678	R582-D674 HydrophobicContact CG-CB 4.13Å; R582-D674 IonicContact NH1-OD2 2.63Å; K670-D674 VanDerWaalsContact O-CG 3.3Å; K670-D674 PolarHBondContact O-N 3.39Å; L671-D674 PolarHBondContact O-N 3.42Å; D674-A677 PolarHBondContact O-N 3.16Å; D674-G678 PolarHBondContact O-N 3.07Å
675	V	95.5	Very high	93.7	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-65.6	-44.3	175	169.4	0	0	0	0	111.4	R582 L638 L671 I672 A673 A677 G678 I679	R582-V675 HydrophobicContact CG-CG2 4.23Å; L638-V675 HydrophobicContact CD2-CB 4.18Å; L638-V675 HydrophobicContact CD2-CG1 4.09Å; L638-V675 HydrophobicContact CD2-CG2 3.95Å; L671-V675 HydrophobicContact CD1-CG2 4.45Å; L671-V675 WeakPolarHBondContact O-CB 3.33Å; L671-V675 VanDerWaalsContact O-CG2 3.3Å; L671-V675 WeakPolarHBondContact O-CG2 3.44Å; L671-V675 PolarHBondContact O-N 3.47Å; I672-V675 PolarHBondContact O-N 2.99Å; A673-V675 VanDerWaalsContact C-N 3.34Å; A673-V675 PolarHBondContact O-N 3.45Å; V675-A677 VanDerWaalsContact C-N 3.32Å; V675-A677 PolarHBondContact O-N 3.25Å; V675-G678 PolarHBondContact O-N 2.94Å; V675-I679 HydrophobicContact CG1-CD1 3.7Å; V675-I679 HydrophobicContact CG1-CG1 4.35Å; V675-I679 WeakPolarHBondContact O-CB 3.4Å; V675-I679 WeakPolarHBondContact O-CD1 3.31Å; V675-I679 WeakPolarHBondContact O-CG1 3.38Å; V675-I679 PolarHBondContact O-N 3.29Å
676	D	94.3	Very high	93.4	Very high	43 Å²	43	50 Å²	50	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-39.4	176.7	-168.9	67.2	0	0	0	111.4	S402 I403 I672 A673 G680	S402-D676 WeakPolarHBondContact CB-OD2 3.46Å; I403-D676 WeakPolarHBondContact CB-OD1 3.4Å; I403-D676 PolarHBondContact N-OD1 3.28Å; I403-D676 VanDerWaalsContact N-OD1 3.08Å; I672-D676 PolarHBondContact O-N 3.44Å; A673-D676 PolarHBondContact O-N 2.9Å; D676-G680 PolarHBondContact O-N 3.39Å
677	A	92.5	Very high	93.1	Very high	66 Å²	66	47 Å²	47	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-63.6	-46.4	174	0	0	0	0	0	111.9	A673 D674 V675 I679 G680 L681	A673-A677 WeakPolarHBondContact O-CB 3.44Å; A673-A677 PolarHBondContact O-N 3.43Å; D674-A677 PolarHBondContact O-N 3.16Å; V675-A677 VanDerWaalsContact C-N 3.32Å; V675-A677 PolarHBondContact O-N 3.25Å; A677-I679 PolarHBondContact O-N 2.92Å; A677-G680 WeakPolarHBondContact O-CA 3.33Å; A677-G680 PolarHBondContact O-N 3.02Å; A677-L681 PolarHBondContact O-N 3.04Å
678	G	93.6	Very high	92.7	Very high	19 Å²	19	47.6 Å²	47.6	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-41.7	176.9	0	0	0	0	0	112.9	T586 D674 V675 G680 L681 I682	T586-G678 VanDerWaalsContact CG2-C 3.42Å; D674-G678 PolarHBondContact O-N 3.07Å; V675-G678 PolarHBondContact O-N 2.94Å; G678-G680 VanDerWaalsContact C-N 3.3Å; G678-G680 PolarHBondContact O-N 3.35Å; G678-L681 PolarHBondContact O-N 3.48Å; G678-I682 WeakPolarHBondContact O-CG1 3.37Å; G678-I682 PolarHBondContact O-N 2.92Å
679	I	92.8	Very high	92.4	Very high	10 Å²	10	52.1 Å²	52.1	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-43	174	-66.9	160.8	0	0	0	109.9	I403 T586 C589 A590 V675 A677 L681 I682 Q683	I403-I679 HydrophobicContact CD1-CD1 3.76Å; T586-I679 HydrophobicContact CG2-CG1 4.4Å; C589-I679 HydrophobicContact CB-CD1 3.41Å; C589-I679 VanDerWaalsContact CB-CD1 3.41Å; C589-I679 HydrophobicContact CB-CG1 4.05Å; A590-I679 HydrophobicContact CB-CG1 4.45Å; A590-I679 HydrophobicContact CB-CG2 4.34Å; V675-I679 HydrophobicContact CG1-CD1 3.7Å; V675-I679 HydrophobicContact CG1-CG1 4.35Å; V675-I679 WeakPolarHBondContact O-CB 3.4Å; V675-I679 WeakPolarHBondContact O-CD1 3.31Å; V675-I679 WeakPolarHBondContact O-CG1 3.38Å; V675-I679 PolarHBondContact O-N 3.29Å; A677-I679 PolarHBondContact O-N 2.92Å; I679-L681 VanDerWaalsContact C-N 3.33Å; I679-L681 PolarHBondContact O-N 3.43Å; I679-I682 PolarHBondContact O-N 3.1Å; I679-Q683 HydrophobicContact CG2-CG 4.36Å; I679-Q683 WeakPolarHBondContact O-CB 3.31Å; I679-Q683 VanDerWaalsContact O-CG 3.28Å; I679-Q683 WeakPolarHBondContact O-CG 3.34Å; I679-Q683 PolarHBondContact O-N 2.66Å
680	G	90.2	Very high	92	Very high	25 Å²	25	53.3 Å²	53.3	26%	0.258	29%	0.287	S	S	.	.	H	α-helix	trans	-57.4	-44.5	175.5	0	0	0	0	0	112.5	D676 A677 G678 Q683 L684	D676-G680 PolarHBondContact O-N 3.39Å; A677-G680 WeakPolarHBondContact O-CA 3.33Å; A677-G680 PolarHBondContact O-N 3.02Å; G678-G680 VanDerWaalsContact C-N 3.3Å; G678-G680 PolarHBondContact O-N 3.35Å; G680-Q683 PolarHBondContact O-N 3.24Å; G680-L684 WeakPolarHBondContact O-CG 3.15Å; G680-L684 PolarHBondContact O-N 2.99Å
681	L	90.6	Very high	91.6	Very high	77 Å²	77	47.3 Å²	47.3	40%	0.403	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-48.4	177.3	-176.9	62.7	0	0	0	112	A677 G678 I679 Q683 L684 Q685	A677-L681 PolarHBondContact O-N 3.04Å; G678-L681 PolarHBondContact O-N 3.48Å; I679-L681 VanDerWaalsContact C-N 3.33Å; I679-L681 PolarHBondContact O-N 3.43Å; L681-Q683 VanDerWaalsContact C-N 3.29Å; L681-Q683 PolarHBondContact O-N 3.27Å; L681-L684 PolarHBondContact O-N 3.03Å; L681-L684 VanDerWaalsContact O-N 3.16Å; L681-Q685 PolarHBondContact O-N 3.3Å
682	I	89.6	Confident	91.1	Very high	25 Å²	25	47.2 Å²	47.2	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-42.1	177	-67.1	174.2	0	0	0	110.7	T586 F587 A590 G678 I679 L684 Q685 Q686	T586-I682 HydrophobicContact CG2-CD1 3.7Å; F587-I682 HydrophobicContact CD1-CD1 3.79Å; F587-I682 HydrophobicContact CE1-CD1 3.85Å; F587-I682 HydrophobicContact CG-CD1 4.48Å; A590-I682 HydrophobicContact CB-CB 4.21Å; A590-I682 HydrophobicContact CB-CD1 4.04Å; A590-I682 HydrophobicContact CB-CG2 3.89Å; G678-I682 WeakPolarHBondContact O-CG1 3.37Å; G678-I682 PolarHBondContact O-N 2.92Å; I679-I682 PolarHBondContact O-N 3.1Å; I682-L684 VanDerWaalsContact C-N 3.34Å; I682-L684 PolarHBondContact O-N 2.92Å; I682-Q685 PolarHBondContact O-N 3.42Å; I682-Q686 HydrophobicContact CG2-CG 4.37Å; I682-Q686 WeakPolarHBondContact O-CB 3.47Å; I682-Q686 VanDerWaalsContact O-CG 3.32Å; I682-Q686 WeakPolarHBondContact O-CG 3.17Å; I682-Q686 PolarHBondContact O-N 2.75Å
683	Q	90.4	Very high	90.7	Very high	80 Å²	80	48.5 Å²	48.5	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-39.2	177.4	-74.6	178	5.8	0	0	112.3	I679 G680 L681 Q686 L687	I679-Q683 HydrophobicContact CG2-CG 4.36Å; I679-Q683 WeakPolarHBondContact O-CB 3.31Å; I679-Q683 VanDerWaalsContact O-CG 3.28Å; I679-Q683 WeakPolarHBondContact O-CG 3.34Å; I679-Q683 PolarHBondContact O-N 2.66Å; G680-Q683 PolarHBondContact O-N 3.24Å; L681-Q683 VanDerWaalsContact C-N 3.29Å; L681-Q683 PolarHBondContact O-N 3.27Å; Q683-Q686 PolarHBondContact O-N 2.85Å; Q683-L687 VanDerWaalsContact O-CB 3.29Å; Q683-L687 WeakPolarHBondContact O-CB 3.3Å; Q683-L687 PolarHBondContact O-N 2.95Å
684	L	90.1	Very high	90.2	Very high	38 Å²	38	49.8 Å²	49.8	20%	0.199	27%	0.273	C	S	.	.	H	α-helix	trans	-66.3	-41.2	174.6	-73.1	165.8	0	0	0	111.3	G680 L681 I682 L687 R688 L720 L721	G680-L684 WeakPolarHBondContact O-CG 3.15Å; G680-L684 PolarHBondContact O-N 2.99Å; L681-L684 PolarHBondContact O-N 3.03Å; L681-L684 VanDerWaalsContact O-N 3.16Å; I682-L684 VanDerWaalsContact C-N 3.34Å; I682-L684 PolarHBondContact O-N 2.92Å; L684-L687 PolarHBondContact O-N 3.46Å; L684-R688 WeakPolarHBondContact O-CB 3.19Å; L684-R688 PolarHBondContact O-N 2.97Å; L684-L720 WeakPolarHBondContact CB-O 3.3Å; L684-L720 HydrophobicContact CD2-CD2 4.21Å; L684-L720 HydrophobicContact CD2-CG 4.32Å; L684-L721 WeakPolarHBondContact CD1-O 3.32Å
685	Q	88.7	Confident	89.7	Confident	82 Å²	82	47.5 Å²	47.5	38%	0.383	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-44.8	175.1	-169.5	-177.4	13.4	0	0	111.7	L681 I682 L687 R688 Q689	L681-Q685 PolarHBondContact O-N 3.3Å; I682-Q685 PolarHBondContact O-N 3.42Å; Q685-L687 VanDerWaalsContact C-N 3.32Å; Q685-L687 PolarHBondContact O-N 3.44Å; Q685-R688 WeakPolarHBondContact O-CB 3.44Å; Q685-R688 PolarHBondContact O-N 3.12Å; Q685-Q689 WeakPolarHBondContact O-CG 3.41Å; Q685-Q689 PolarHBondContact O-N 2.89Å
686	Q	89.2	Confident	89	Confident	53 Å²	53	50.6 Å²	50.6	25%	0.248	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-38.3	174.4	-72.2	178.9	0.9	0	0	111.9	I682 Q683 Q689 K690	I682-Q686 HydrophobicContact CG2-CG 4.37Å; I682-Q686 WeakPolarHBondContact O-CB 3.47Å; I682-Q686 VanDerWaalsContact O-CG 3.32Å; I682-Q686 WeakPolarHBondContact O-CG 3.17Å; I682-Q686 PolarHBondContact O-N 2.75Å; Q683-Q686 PolarHBondContact O-N 2.85Å; Q686-Q689 PolarHBondContact O-N 3.47Å; Q686-K690 WeakPolarHBondContact O-CB 3.4Å; Q686-K690 VanDerWaalsContact O-CG 3.24Å; Q686-K690 WeakPolarHBondContact O-CG 3.39Å; Q686-K690 PolarHBondContact O-N 3.03Å
687	L	89.2	Confident	88	Confident	63 Å²	63	53.4 Å²	53.4	33%	0.33	30%	0.298	S	S	.	.	H	α-helix	trans	-64.9	-45.7	175.6	178.8	61	0	0	0	111.1	Q683 L684 Q685 Q689 K690 L691 L720 A723	Q683-L687 VanDerWaalsContact O-CB 3.29Å; Q683-L687 WeakPolarHBondContact O-CB 3.3Å; Q683-L687 PolarHBondContact O-N 2.95Å; L684-L687 PolarHBondContact O-N 3.46Å; Q685-L687 VanDerWaalsContact C-N 3.32Å; Q685-L687 PolarHBondContact O-N 3.44Å; L687-Q689 PolarHBondContact O-N 3.07Å; L687-K690 PolarHBondContact O-N 3.38Å; L687-L691 HydrophobicContact CD1-CD1 4.17Å; L687-L691 HydrophobicContact CD1-CG 4.12Å; L687-L691 HydrophobicContact CG-CD1 4.01Å; L687-L691 HydrophobicContact CG-CG 4.39Å; L687-L691 WeakPolarHBondContact O-CB 3.33Å; L687-L691 WeakPolarHBondContact O-CG 3.3Å; L687-L691 PolarHBondContact O-N 3.24Å; L687-L720 HydrophobicContact CD2-CD2 4.44Å; L687-L720 HydrophobicContact CG-CD2 4.49Å; L687-A723 HydrophobicContact CD2-CB 3.68Å
688	R	88.9	Confident	87.2	Confident	28 Å²	28	59.1 Å²	59.1	11%	0.106	31%	0.31	C	S	.	.	H	α-helix	trans	-54.5	-51.2	173.6	175.8	-172.1	174.3	-174.9	8.5	110.7	L684 Q685 K690 L691 V692 L713 N714 S715 R718 L720 F743	L684-R688 WeakPolarHBondContact O-CB 3.19Å; L684-R688 PolarHBondContact O-N 2.97Å; Q685-R688 WeakPolarHBondContact O-CB 3.44Å; Q685-R688 PolarHBondContact O-N 3.12Å; R688-K690 VanDerWaalsContact C-N 3.33Å; R688-K690 PolarHBondContact O-N 2.99Å; R688-L691 PolarHBondContact O-N 3.46Å; R688-V692 HydrophobicContact CG-CG2 4.44Å; R688-V692 WeakPolarHBondContact O-CB 3.42Å; R688-V692 VanDerWaalsContact O-CG2 3.28Å; R688-V692 WeakPolarHBondContact O-CG2 3.25Å; R688-V692 PolarHBondContact O-N 3.39Å; R688-L713 PolarHBondContact NE-O 3.24Å; R688-L713 PolarHBondContact NH2-O 2.86Å; R688-N714 VanDerWaalsContact NH2-CA 3.3Å; R688-S715 PolarHBondContact NH2-O 3.02Å; R688-R718 PolarHBondContact NH1-O 3.29Å; R688-R718 PolarHBondContact NH2-O 3Å; R688-L720 HydrophobicContact CB-CB 4.21Å; R688-L720 HydrophobicContact CB-CD2 4.02Å; R688-F743 HydrophobicContact CG-CE1 4.46Å
689	Q	88.6	Confident	86.4	Confident	95 Å²	95	60.9 Å²	60.9	44%	0.444	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-42	178.4	-72.4	175	-4.2	0	0	112.2	Q685 Q686 L687 A693	Q685-Q689 WeakPolarHBondContact O-CG 3.41Å; Q685-Q689 PolarHBondContact O-N 2.89Å; Q686-Q689 PolarHBondContact O-N 3.47Å; L687-Q689 PolarHBondContact O-N 3.07Å; Q689-A693 WeakPolarHBondContact O-CB 3.46Å; Q689-A693 PolarHBondContact O-N 3.22Å
690	K	88.9	Confident	85.6	Confident	120 Å²	120	64 Å²	64	52%	0.522	34%	0.336	S	S	.	.	H	α-helix	trans	-64	-46.1	176.9	-75.4	169	-175.4	169.9	0	112.4	Q686 L687 R688 A693 Q694	Q686-K690 WeakPolarHBondContact O-CB 3.4Å; Q686-K690 VanDerWaalsContact O-CG 3.24Å; Q686-K690 WeakPolarHBondContact O-CG 3.39Å; Q686-K690 PolarHBondContact O-N 3.03Å; L687-K690 PolarHBondContact O-N 3.38Å; R688-K690 VanDerWaalsContact C-N 3.33Å; R688-K690 PolarHBondContact O-N 2.99Å; K690-A693 PolarHBondContact O-N 3.09Å; K690-Q694 WeakPolarHBondContact O-CG 3.26Å; K690-Q694 PolarHBondContact O-N 3.17Å; K690-Q694 VanDerWaalsContact O-N 3.1Å
691	L	86.9	Confident	85.1	Confident	13 Å²	13	63.2 Å²	63.2	7%	0.068	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-49.5	178.4	-70.6	172.7	0	0	0	110.5	L687 R688 A693 Q694 M695 L741 Y757	L687-L691 HydrophobicContact CD1-CD1 4.17Å; L687-L691 HydrophobicContact CD1-CG 4.12Å; L687-L691 HydrophobicContact CG-CD1 4.01Å; L687-L691 HydrophobicContact CG-CG 4.39Å; L687-L691 WeakPolarHBondContact O-CB 3.33Å; L687-L691 WeakPolarHBondContact O-CG 3.3Å; L687-L691 PolarHBondContact O-N 3.24Å; R688-L691 PolarHBondContact O-N 3.46Å; L691-A693 VanDerWaalsContact C-N 3.32Å; L691-A693 PolarHBondContact O-N 2.92Å; L691-Q694 PolarHBondContact O-N 3.25Å; L691-Q694 VanDerWaalsContact O-N 3.11Å; L691-M695 WeakPolarHBondContact O-CG 3.06Å; L691-M695 PolarHBondContact O-N 2.91Å; L691-M695 VanDerWaalsContact O-N 3.14Å; L691-L741 HydrophobicContact CD1-CD1 4.02Å; L691-L741 HydrophobicContact CD1-CD2 3.61Å; L691-L741 HydrophobicContact CD1-CG 4.47Å; L691-Y757 HydrophobicContact CD2-CD2 3.95Å; L691-Y757 HydrophobicContact CD2-CE1 4.22Å; L691-Y757 HydrophobicContact CD2-CE2 3.45Å; L691-Y757 VanDerWaalsContact CD2-CE2 3.45Å
692	V	86.4	Confident	84.4	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.03	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-40.7	178	171.9	0	0	0	0	111.3	R688 Q694 M695 R710 L713 N714	R688-V692 HydrophobicContact CG-CG2 4.44Å; R688-V692 WeakPolarHBondContact O-CB 3.42Å; R688-V692 VanDerWaalsContact O-CG2 3.28Å; R688-V692 WeakPolarHBondContact O-CG2 3.25Å; R688-V692 PolarHBondContact O-N 3.39Å; V692-Q694 VanDerWaalsContact C-N 3.28Å; V692-Q694 PolarHBondContact O-N 3.27Å; V692-M695 PolarHBondContact O-N 3.13Å; V692-R710 HydrophobicContact CG1-CG 3.6Å; V692-R710 PolarHBondContact O-NE 2.9Å; V692-R710 PolarHBondContact O-NH1 3.3Å; V692-R710 PolarHBondContact O-NH2 3.03Å; V692-L713 HydrophobicContact CG2-CB 3.84Å; V692-L713 HydrophobicContact CG2-CD1 4.3Å; V692-N714 WeakPolarHBondContact CG1-ND2 3.31Å; V692-N714 WeakPolarHBondContact CG1-OD1 3.32Å
693	A	86.5	Confident	83.7	Confident	64 Å²	64	62.4 Å²	62.4	53%	0.529	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-33.6	176.2	0	0	0	0	0	113.4	Q689 K690 L691	Q689-A693 WeakPolarHBondContact O-CB 3.46Å; Q689-A693 PolarHBondContact O-N 3.22Å; K690-A693 PolarHBondContact O-N 3.09Å; L691-A693 VanDerWaalsContact C-N 3.32Å; L691-A693 PolarHBondContact O-N 2.92Å
694	Q	86.6	Confident	82.8	Confident	85 Å²	85	62.2 Å²	62.2	40%	0.397	33%	0.327	S	S	.	.	H	α-helix	trans	-83.7	-7.1	178.1	-70	175.7	14	0	0	113.7	K690 L691 V692 S756 Y757	K690-Q694 WeakPolarHBondContact O-CG 3.26Å; K690-Q694 PolarHBondContact O-N 3.17Å; K690-Q694 VanDerWaalsContact O-N 3.1Å; L691-Q694 PolarHBondContact O-N 3.25Å; L691-Q694 VanDerWaalsContact O-N 3.11Å; V692-Q694 VanDerWaalsContact C-N 3.28Å; V692-Q694 PolarHBondContact O-N 3.27Å; Q694-S756 VanDerWaalsContact O-CA 3.27Å; Q694-S756 WeakPolarHBondContact O-CA 3.41Å; Q694-S756 WeakPolarHBondContact O-CB 3.43Å; Q694-Y757 HydrophobicContact CB-CD2 3.91Å; Q694-Y757 HydrophobicContact CB-CE2 4.44Å; Q694-Y757 PolarHBondContact O-N 3.2Å; Q694-Y757 VanDerWaalsContact OE1-CE2 3.3Å
695	M	84.1	Confident	81.9	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.02	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-78.4	137.7	172.9	-69.8	179.6	72.4	0	0	111.2	L691 V692 R710 L713 L750 Y757 F759	L691-M695 WeakPolarHBondContact O-CG 3.06Å; L691-M695 PolarHBondContact O-N 2.91Å; L691-M695 VanDerWaalsContact O-N 3.14Å; V692-M695 PolarHBondContact O-N 3.13Å; M695-R710 PolarHBondContact O-NH1 3.33Å; M695-L713 HydrophobicContact CE-CD1 3.95Å; M695-L713 HydrophobicContact SD-CD1 3.48Å; M695-L713 WeakPolarHBondContact SD-CD1 3.34Å; M695-L750 HydrophobicContact CE-CD2 3.83Å; M695-L750 HydrophobicContact SD-CD1 4.06Å; M695-L750 HydrophobicContact SD-CD2 4.11Å; M695-Y757 WeakPolarHBondContact CA-O 3.38Å; M695-F759 HydrophobicContact CE-CD1 4.4Å; M695-F759 HydrophobicContact CE-CD2 4Å; M695-F759 HydrophobicContact CE-CE1 3.99Å; M695-F759 HydrophobicContact CE-CE2 3.55Å; M695-F759 HydrophobicContact CE-CG 4.41Å; M695-F759 HydrophobicContact CE-CZ 3.56Å
696	D	80	Confident	81.3	Confident	67 Å²	67	66 Å²	66	36%	0.358	36%	0.358	S	S	.	.			trans	-65.1	129.4	173.8	-177.2	-25.9	0	0	0	109.1	K698 E699	D696-K698 PolarHBondContact O-N 3Å; D696-K698 PolarHBondContact OD1-N 2.96Å; D696-E699 HydrophobicContact CB-CG 3.83Å; D696-E699 WeakPolarHBondContact O-CB 3.38Å; D696-E699 WeakPolarHBondContact O-CG 3.34Å; D696-E699 PolarHBondContact O-N 3.29Å
697	P	75	Confident	80.8	Confident	103 Å²	103	68.3 Å²	68.3	67%	0.669	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-22.2	178.6	-25.8	33.4	0	0	0	115.2	E699	P697-E699 VanDerWaalsContact C-N 3.34Å
698	K	74.5	Confident	80.4	Confident	185 Å²	185	65.6 Å²	65.6	80%	0.804	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.7	-179.9	-64.1	179.6	-178.7	176.9	0	113.8	D696 S700	D696-K698 PolarHBondContact O-N 3Å; D696-K698 PolarHBondContact OD1-N 2.96Å; K698-S700 PolarHBondContact O-N 3.44Å
699	E	76.9	Confident	80.1	Confident	56 Å²	56	66.6 Å²	66.6	26%	0.262	37%	0.373	S	S	.	.			trans	-73.1	119.6	-179.2	-67.3	-74.6	165.3	0	0	110.4	D696 P697 S758 F759	D696-E699 HydrophobicContact CB-CG 3.83Å; D696-E699 WeakPolarHBondContact O-CB 3.38Å; D696-E699 WeakPolarHBondContact O-CG 3.34Å; D696-E699 PolarHBondContact O-N 3.29Å; P697-E699 VanDerWaalsContact C-N 3.34Å; E699-S758 VanDerWaalsContact CD-CB 3.43Å; E699-S758 WeakPolarHBondContact OE1-CB 3.5Å; E699-S758 WeakPolarHBondContact OE2-CB 3.28Å; E699-F759 HydrophobicContact CB-CD2 4.27Å; E699-F759 HydrophobicContact CB-CE2 4.47Å
700	S	75.7	Confident	79.8	Confident	75 Å²	75	65.3 Å²	65.3	52%	0.524	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.5	172.5	64.6	0	0	0	0	109.3	K698 F708	K698-S700 PolarHBondContact O-N 3.44Å; S700-F708 CarbonylContact C-O 3.57Å; S700-F708 VanDerWaalsContact CA-O 3.28Å; S700-F708 WeakPolarHBondContact CA-O 3.44Å
701	T	79.9	Confident	79.3	Confident	10 Å²	10	63.8 Å²	63.8	6%	0.061	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	162.2	172.3	-177.7	0	0	0	0	109.5	F708 F759 I768	T701-F708 HydrophobicContact CG2-CB 4.04Å; T701-F708 HydrophobicContact CG2-CD1 4.31Å; T701-F708 PolarHBondContact N-O 2.89Å; T701-F708 WeakPolarHBondContact O-CA 3.44Å; T701-F708 WeakPolarHBondContact O-CB 3.45Å; T701-F708 PolarHBondContact O-N 2.89Å; T701-F759 HydrophobicContact CG2-CB 4.06Å; T701-F759 HydrophobicContact CG2-CD1 3.82Å; T701-F759 HydrophobicContact CG2-CD2 3.92Å; T701-F759 HydrophobicContact CG2-CE1 4.19Å; T701-F759 HydrophobicContact CG2-CE2 4.28Å; T701-F759 HydrophobicContact CG2-CG 3.66Å; T701-F759 HydrophobicContact CG2-CZ 4.4Å; T701-I768 HydrophobicContact CG2-CD1 3.35Å; T701-I768 HydrophobicContact CG2-CG1 3.91Å
702	S	75.3	Confident	79.2	Confident	57 Å²	57	65.4 Å²	65.4	40%	0.399	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	145	164.1	60.8	0	0	0	0	110.1	K706 E766	S702-K706 CarbonylContact C-O 3.53Å; S702-K706 WeakPolarHBondContact CA-O 3.47Å; S702-E766 WeakPolarHBondContact CB-OE1 3.48Å; S702-E766 VanDerWaalsContact O-CD 3.32Å; S702-E766 PolarHBondContact OG-OE1 3.04Å
703	F	76.6	Confident	79	Confident	27 Å²	27	65.2 Å²	65.2	12%	0.118	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	118	168.4	173.9	-116.7	0	0	0	108.5	G705 K706 F708 V746 I768	F703-G705 PolarHBondContact O-N 3.32Å; F703-G705 VanDerWaalsContact O-N 3.15Å; F703-K706 PolarHBondContact N-O 3.03Å; F703-K706 PolarHBondContact O-N 3.37Å; F703-F708 HydrophobicContact CB-CB 3.87Å; F703-F708 HydrophobicContact CB-CD2 4.19Å; F703-F708 HydrophobicContact CB-CG 4.31Å; F703-F708 HydrophobicContact CD1-CD2 4.21Å; F703-F708 HydrophobicContact CG-CD2 4.45Å; F703-V746 HydrophobicContact CE1-CG1 3.98Å; F703-V746 HydrophobicContact CE2-CG1 4.21Å; F703-V746 HydrophobicContact CZ-CG1 3.56Å; F703-I768 HydrophobicContact CB-CB 4.46Å; F703-I768 HydrophobicContact CB-CD1 4.38Å; F703-I768 HydrophobicContact CD2-CB 3.77Å; F703-I768 HydrophobicContact CD2-CG2 3.43Å; F703-I768 VanDerWaalsContact CD2-CG2 3.43Å; F703-I768 HydrophobicContact CE2-CB 4.39Å; F703-I768 HydrophobicContact CE2-CG2 3.67Å; F703-I768 HydrophobicContact CG-CB 4.33Å; F703-I768 HydrophobicContact CG-CG2 3.96Å; F703-I768 HydrophobicContact CZ-CG2 4.37Å
704	L	71.6	Confident	78.8	Confident	76 Å²	76	66.1 Å²	66.1	40%	0.398	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	36.5	-176.4	-59.6	173.3	0	0	0	112.7	K706 E766 A794	L704-K706 VanDerWaalsContact C-N 3.28Å; L704-K706 PolarHBondContact O-N 3.05Å; L704-E766 PolarHBondContact N-OE2 3.36Å; L704-A794 HydrophobicContact CD2-CB 3.97Å
705	G	69.6	Low	78.5	Confident	63 Å²	63	63.8 Å²	63.8	65%	0.649	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-1.3	-179.4	0	0	0	0	0	115.9	F703	F703-G705 PolarHBondContact O-N 3.32Å; F703-G705 VanDerWaalsContact O-N 3.15Å
706	K	77.3	Confident	78	Confident	136 Å²	136	69 Å²	69	59%	0.591	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	146.9	175	-65	-175.9	-179.5	-177.3	0	110.8	S702 F703 L704 F708	S702-K706 CarbonylContact C-O 3.53Å; S702-K706 WeakPolarHBondContact CA-O 3.47Å; F703-K706 PolarHBondContact N-O 3.03Å; F703-K706 PolarHBondContact O-N 3.37Å; L704-K706 VanDerWaalsContact C-N 3.28Å; L704-K706 PolarHBondContact O-N 3.05Å; K706-F708 PolarHBondContact O-N 3.22Å
707	P	77.8	Confident	77.9	Confident	103 Å²	103	70.1 Å²	70.1	67%	0.669	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	127.4	171.1	28.3	-32.9	0	0	0	109.2
708	F	82.4	Confident	78.4	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.026	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	124	175.5	-170.6	-82.8	0	0	0	108.6	S700 T701 F703 K706 D712 L713 F759 I768	S700-F708 CarbonylContact C-O 3.57Å; S700-F708 VanDerWaalsContact CA-O 3.28Å; S700-F708 WeakPolarHBondContact CA-O 3.44Å; T701-F708 HydrophobicContact CG2-CB 4.04Å; T701-F708 HydrophobicContact CG2-CD1 4.31Å; T701-F708 PolarHBondContact N-O 2.89Å; T701-F708 WeakPolarHBondContact O-CA 3.44Å; T701-F708 WeakPolarHBondContact O-CB 3.45Å; T701-F708 PolarHBondContact O-N 2.89Å; F703-F708 HydrophobicContact CB-CB 3.87Å; F703-F708 HydrophobicContact CB-CD2 4.19Å; F703-F708 HydrophobicContact CB-CG 4.31Å; F703-F708 HydrophobicContact CD1-CD2 4.21Å; F703-F708 HydrophobicContact CG-CD2 4.45Å; K706-F708 PolarHBondContact O-N 3.22Å; F708-D712 HydrophobicContact CD1-CB 4.36Å; F708-D712 HydrophobicContact CD2-CB 3.91Å; F708-D712 HydrophobicContact CE1-CB 4.09Å; F708-D712 HydrophobicContact CE2-CB 3.58Å; F708-D712 HydrophobicContact CG-CB 4.3Å; F708-D712 HydrophobicContact CZ-CB 3.69Å; F708-L713 HydrophobicContact CE1-CD2 3.64Å; F708-L713 HydrophobicContact CE1-CG 3.77Å; F708-L713 HydrophobicContact CZ-CD2 3.81Å; F708-L713 HydrophobicContact CZ-CG 4.22Å; F708-F759 AromaticContact CD1-CE1 3.95Å; F708-F759 HydrophobicContact CD1-CE1 3.95Å; F708-F759 AromaticContact CD1-CZ 3.71Å; F708-F759 HydrophobicContact CD1-CZ 3.71Å; F708-F759 AromaticContact CE1-CE1 3.95Å; F708-F759 HydrophobicContact CE1-CE1 3.95Å; F708-F759 AromaticContact CE1-CZ 3.9Å; F708-F759 HydrophobicContact CE1-CZ 3.9Å; F708-I768 HydrophobicContact CB-CD1 3.89Å; F708-I768 HydrophobicContact CD1-CD1 3.07Å; F708-I768 HydrophobicContact CD2-CD1 3.94Å; F708-I768 HydrophobicContact CE1-CD1 3.42Å; F708-I768 VanDerWaalsContact CE1-CD1 3.42Å; F708-I768 HydrophobicContact CE2-CD1 4.23Å; F708-I768 HydrophobicContact CG-CD1 3.35Å; F708-I768 HydrophobicContact CZ-CD1 3.99Å
709	T	81.8	Confident	78.9	Confident	49 Å²	49	61 Å²	61	30%	0.301	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	172.7	-169.5	68	0	0	0	0	111.6	S711 D712	T709-S711 PolarHBondContact O-N 3.4Å; T709-S711 PolarHBondContact OG1-N 3.47Å; T709-D712 WeakPolarHBondContact CA-OD2 3.48Å; T709-D712 PolarHBondContact N-OD2 3.18Å; T709-D712 WeakPolarHBondContact O-CB 3.34Å; T709-D712 PolarHBondContact O-N 3.4Å; T709-D712 PolarHBondContact OG1-OD2 3.37Å
710	R	82	Confident	79.6	Confident	68 Å²	68	58.7 Å²	58.7	26%	0.257	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-34.1	168.9	-176.9	-176.7	155.5	162.4	-4.2	113	V692 M695 D712 L713	V692-R710 HydrophobicContact CG1-CG 3.6Å; V692-R710 PolarHBondContact O-NE 2.9Å; V692-R710 PolarHBondContact O-NH1 3.3Å; V692-R710 PolarHBondContact O-NH2 3.03Å; M695-R710 PolarHBondContact O-NH1 3.33Å; R710-D712 VanDerWaalsContact C-N 3.33Å; R710-L713 WeakPolarHBondContact O-CB 3.5Å; R710-L713 PolarHBondContact O-N 3.24Å
711	S	79.3	Confident	80.2	Confident	87 Å²	87	58.1 Å²	58.1	61%	0.608	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-34.9	-179.4	-60.2	0	0	0	0	112	T709 L713 N714 S715	T709-S711 PolarHBondContact O-N 3.4Å; T709-S711 PolarHBondContact OG1-N 3.47Å; S711-L713 VanDerWaalsContact C-N 3.27Å; S711-L713 PolarHBondContact O-N 3.46Å; S711-N714 CarbonylContact O-C 3.59Å; S711-N714 WeakPolarHBondContact O-CA 3.29Å; S711-N714 WeakPolarHBondContact O-CB 3.22Å; S711-N714 PolarHBondContact O-N 3.01Å; S711-S715 PolarHBondContact O-N 3.04Å
712	D	83.4	Confident	80.8	Confident	47 Å²	47	60.3 Å²	60.3	25%	0.251	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-66.2	-31.4	178	-59.8	-72.9	0	0	0	112.2	F708 T709 R710 N714 S715	F708-D712 HydrophobicContact CD1-CB 4.36Å; F708-D712 HydrophobicContact CD2-CB 3.91Å; F708-D712 HydrophobicContact CE1-CB 4.09Å; F708-D712 HydrophobicContact CE2-CB 3.58Å; F708-D712 HydrophobicContact CG-CB 4.3Å; F708-D712 HydrophobicContact CZ-CB 3.69Å; T709-D712 WeakPolarHBondContact CA-OD2 3.48Å; T709-D712 PolarHBondContact N-OD2 3.18Å; T709-D712 WeakPolarHBondContact O-CB 3.34Å; T709-D712 PolarHBondContact O-N 3.4Å; T709-D712 PolarHBondContact OG1-OD2 3.37Å; R710-D712 VanDerWaalsContact C-N 3.33Å; D712-N714 PolarHBondContact O-N 2.84Å; D712-S715 WeakPolarHBondContact O-CB 3.3Å; D712-S715 PolarHBondContact O-N 3.45Å; D712-S715 PolarHBondContact O-OG 3.44Å; D712-S715 VanDerWaalsContact O-OG 3.12Å
713	L	83.8	Confident	81.6	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-68.5	-18.4	171.3	-65.9	176.3	0	0	0	112.9	R688 V692 M695 F708 R710 S711 F743 V748 F759	R688-L713 PolarHBondContact NE-O 3.24Å; R688-L713 PolarHBondContact NH2-O 2.86Å; V692-L713 HydrophobicContact CG2-CB 3.84Å; V692-L713 HydrophobicContact CG2-CD1 4.3Å; M695-L713 HydrophobicContact CE-CD1 3.95Å; M695-L713 HydrophobicContact SD-CD1 3.48Å; M695-L713 WeakPolarHBondContact SD-CD1 3.34Å; F708-L713 HydrophobicContact CE1-CD2 3.64Å; F708-L713 HydrophobicContact CE1-CG 3.77Å; F708-L713 HydrophobicContact CZ-CD2 3.81Å; F708-L713 HydrophobicContact CZ-CG 4.22Å; R710-L713 WeakPolarHBondContact O-CB 3.5Å; R710-L713 PolarHBondContact O-N 3.24Å; S711-L713 VanDerWaalsContact C-N 3.27Å; S711-L713 PolarHBondContact O-N 3.46Å; L713-F743 HydrophobicContact CD2-CE2 3.95Å; L713-F743 HydrophobicContact CD2-CZ 3.87Å; L713-V748 HydrophobicContact CD2-CG1 4.39Å; L713-V748 HydrophobicContact CD2-CG2 3.95Å; L713-F759 HydrophobicContact CD1-CE1 4.07Å; L713-F759 HydrophobicContact CD1-CZ 3.93Å; L713-F759 HydrophobicContact CG-CZ 4.42Å
714	N	80.4	Confident	82.2	Confident	82 Å²	82	58.9 Å²	58.9	44%	0.439	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-100.3	2.5	177.1	-87	-8.4	0	0	0	113.4	R688 V692 S711 D712 S716	R688-N714 VanDerWaalsContact NH2-CA 3.3Å; V692-N714 WeakPolarHBondContact CG1-ND2 3.31Å; V692-N714 WeakPolarHBondContact CG1-OD1 3.32Å; S711-N714 CarbonylContact O-C 3.59Å; S711-N714 WeakPolarHBondContact O-CA 3.29Å; S711-N714 WeakPolarHBondContact O-CB 3.22Å; S711-N714 PolarHBondContact O-N 3.01Å; D712-N714 PolarHBondContact O-N 2.84Å; N714-S716 PolarHBondContact O-N 2.89Å
715	S	81.6	Confident	83.1	Confident	37 Å²	37	59.5 Å²	59.5	26%	0.259	35%	0.349	S	S	.	.			trans	-56.4	135.5	177.2	-63.6	0	0	0	0	111.7	R688 S711 D712 S717 R718	R688-S715 PolarHBondContact NH2-O 3.02Å; S711-S715 PolarHBondContact O-N 3.04Å; D712-S715 WeakPolarHBondContact O-CB 3.3Å; D712-S715 PolarHBondContact O-N 3.45Å; D712-S715 PolarHBondContact O-OG 3.44Å; D712-S715 VanDerWaalsContact O-OG 3.12Å; S715-S717 PolarHBondContact O-N 3.43Å; S715-R718 PolarHBondContact O-N 3.1Å; S715-R718 VanDerWaalsContact O-N 3.15Å
716	S	73.8	Confident	84.2	Confident	113 Å²	113	56.6 Å²	56.6	79%	0.79	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.1	179.7	50.4	0	0	0	0	113	N714 R718	N714-S716 PolarHBondContact O-N 2.89Å; S716-R718 VanDerWaalsContact C-N 3.29Å; S716-R718 PolarHBondContact O-N 3.42Å
717	S	77.8	Confident	84.8	Confident	91 Å²	91	50.9 Å²	50.9	64%	0.636	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-7	179.2	66.9	0	0	0	0	114.9	S715	S715-S717 PolarHBondContact O-N 3.43Å
718	R	84.5	Confident	85.4	Confident	31 Å²	31	46 Å²	46	12%	0.117	26%	0.264	C	S	.	.			trans	-115.3	126.5	-177.4	-61.1	-173.2	-163.5	-132	6.7	109.6	R688 S715 S716 F743 D745 V746	R688-R718 PolarHBondContact NH1-O 3.29Å; R688-R718 PolarHBondContact NH2-O 3Å; S715-R718 PolarHBondContact O-N 3.1Å; S715-R718 VanDerWaalsContact O-N 3.15Å; S716-R718 VanDerWaalsContact C-N 3.29Å; S716-R718 PolarHBondContact O-N 3.42Å; R718-F743 HydrophobicContact CB-CD1 4.14Å; R718-D745 WeakPolarHBondContact CG-OD1 3.43Å; R718-D745 IonicContact CZ-OD2 2.81Å; R718-D745 IonicContact NE-OD2 2.62Å; R718-D745 PolarHBondContact NE-OD2 3.03Å; R718-D745 IonicContact NH1-OD1 2.66Å; R718-D745 IonicContact NH1-OD2 3.52Å; R718-D745 PolarHBondContact NH1-OD2 3.32Å; R718-D745 IonicContact NH2-OD2 3.43Å; R718-V746 VanDerWaalsContact NH1-CG2 3.33Å
719	E	86	Confident	85.7	Confident	66 Å²	66	47 Å²	47	31%	0.308	27%	0.268	S	S	.	.			trans	-118.2	143.1	176.3	-57.6	-165.8	145.4	0	0	110.7	L721 F743 T744	E719-L721 PolarHBondContact O-N 3.26Å; E719-F743 CarbonylContact O-C 3.54Å; E719-F743 WeakPolarHBondContact O-CA 3.19Å; E719-F743 WeakPolarHBondContact O-CD1 3.45Å; E719-T744 HydrophobicContact CB-CG2 3.91Å; E719-T744 PolarHBondContact N-OG1 3.07Å; E719-T744 PolarHBondContact O-N 2.87Å; E719-T744 VanDerWaalsContact O-N 3.14Å
720	L	90.4	Very high	85.9	Confident	6 Å²	6	45 Å²	45	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	112.6	176.8	-178.6	70	0	0	0	108.7	L684 L687 R688 Y722 A723 L741 F743	L684-L720 WeakPolarHBondContact CB-O 3.3Å; L684-L720 HydrophobicContact CD2-CD2 4.21Å; L684-L720 HydrophobicContact CD2-CG 4.32Å; L687-L720 HydrophobicContact CD2-CD2 4.44Å; L687-L720 HydrophobicContact CG-CD2 4.49Å; R688-L720 HydrophobicContact CB-CB 4.21Å; R688-L720 HydrophobicContact CB-CD2 4.02Å; L720-Y722 WeakPolarHBondContact CD1-O 3.2Å; L720-A723 HydrophobicContact CD2-CB 4.27Å; L720-L741 HydrophobicContact CD1-CB 3.78Å; L720-L741 HydrophobicContact CD1-CD2 4.27Å; L720-L741 HydrophobicContact CD1-CG 4.47Å; L720-F743 HydrophobicContact CB-CD1 4.39Å; L720-F743 HydrophobicContact CB-CE1 4.1Å; L720-F743 HydrophobicContact CD1-CD2 4.34Å; L720-F743 HydrophobicContact CD1-CE1 4.28Å; L720-F743 HydrophobicContact CD1-CE2 4.03Å; L720-F743 HydrophobicContact CD1-CZ 4Å
721	L	89.7	Confident	85.8	Confident	64 Å²	64	45.6 Å²	45.6	34%	0.335	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-33.8	179.4	-58.6	-179.9	0	0	0	112.2	L684 E719 L742 T744 A821	L684-L721 WeakPolarHBondContact CD1-O 3.32Å; E719-L721 PolarHBondContact O-N 3.26Å; L721-L742 HydrophobicContact CB-CD2 4.27Å; L721-L742 HydrophobicContact CB-CG 4.19Å; L721-L742 HydrophobicContact CD1-CG 4.39Å; L721-L742 PolarHBondContact N-O 3.44Å; L721-T744 HydrophobicContact CD1-CG2 4.31Å; L721-T744 HydrophobicContact CD2-CG2 4.05Å; L721-T744 HydrophobicContact CG-CG2 4.22Å; L721-A821 HydrophobicContact CD1-CB 3.92Å
722	Y	91.3	Very high	85.9	Confident	56 Å²	56	51.4 Å²	51.4	22%	0.22	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	150.9	-178.9	-160.1	-129.7	0	0	0	113	L720 L742 W814	L720-Y722 WeakPolarHBondContact CD1-O 3.2Å; Y722-L742 PolarHBondContact N-O 3.08Å; Y722-L742 PolarHBondContact O-N 3.22Å; Y722-W814 AromaticContact CD1-CD2 3.74Å; Y722-W814 HydrophobicContact CD1-CD2 3.74Å; Y722-W814 AromaticContact CD1-CE2 3.42Å; Y722-W814 VanDerWaalsContact CD1-CE2 3.42Å; Y722-W814 AromaticContact CD1-CE3 3.99Å; Y722-W814 HydrophobicContact CD1-CE3 3.99Å; Y722-W814 HydrophobicContact CD1-CG 4.44Å; Y722-W814 AromaticContact CD1-CH2 3.69Å; Y722-W814 HydrophobicContact CD1-CH2 3.69Å; Y722-W814 AromaticContact CD1-CZ2 3.38Å; Y722-W814 HydrophobicContact CD1-CZ2 3.38Å; Y722-W814 HydrophobicContact CD1-CZ3 4Å; Y722-W814 AromaticContact CD1-NE1 3.96Å; Y722-W814 AromaticContact CE1-CD1 3.87Å; Y722-W814 AromaticContact CE1-CD2 3.88Å; Y722-W814 HydrophobicContact CE1-CD2 3.88Å; Y722-W814 AromaticContact CE1-CE2 3.4Å; Y722-W814 VanDerWaalsContact CE1-CE2 3.4Å; Y722-W814 HydrophobicContact CE1-CG 4.18Å; Y722-W814 HydrophobicContact CE1-CH2 4.46Å; Y722-W814 AromaticContact CE1-CZ2 3.73Å; Y722-W814 HydrophobicContact CE1-CZ2 3.73Å; Y722-W814 AromaticContact CE1-NE1 3.41Å; Y722-W814 HydrophobicContact CG-CH2 4.46Å; Y722-W814 HydrophobicContact CG-CZ2 4.39Å
723	A	91.8	Very high	85.6	Confident	25 Å²	25	59.2 Å²	59.2	21%	0.207	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	136.7	177.8	0	0	0	0	0	111.3	L687 L720 M740 L741	L687-A723 HydrophobicContact CD2-CB 3.68Å; L720-A723 HydrophobicContact CD2-CB 4.27Å; A723-M740 WeakPolarHBondContact CA-O 3.39Å; A723-L741 HydrophobicContact CB-CD2 3.51Å
724	S	89.3	Confident	85.6	Confident	28 Å²	28	66.4 Å²	66.4	20%	0.196	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	152.6	175.9	-179.1	0	0	0	0	110.5	M740 N810	S724-M740 PolarHBondContact N-O 3.38Å; S724-M740 VanDerWaalsContact N-O 3.09Å; S724-M740 PolarHBondContact O-N 3.16Å; S724-N810 PolarHBondContact OG-ND2 3.49Å
725	E	91.7	Very high	85.8	Confident	90 Å²	90	66 Å²	66	42%	0.421	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	132.5	162.8	-53.9	-58.9	161.6	0	0	109.7	S739	E725-S739 PolarHBondContact OE1-OG 3.49Å; E725-S739 VanDerWaalsContact OE2-CA 3.3Å; E725-S739 WeakPolarHBondContact OE2-CA 3.44Å; E725-S739 WeakPolarHBondContact OE2-CB 3.28Å; E725-S739 PolarHBondContact OE2-N 3.31Å; E725-S739 PolarHBondContact OE2-OG 3.1Å
726	V	91.9	Very high	86.2	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	159.7	179.2	-57.1	0	0	0	0	109.7	V738 M740 F749 I803 F805	V726-V738 HydrophobicContact CG2-CG2 3.74Å; V726-V738 PolarHBondContact N-O 2.89Å; V726-V738 PolarHBondContact O-N 3.06Å; V726-V738 VanDerWaalsContact O-O 3.09Å; V726-M740 HydrophobicContact CG1-CB 4.12Å; V726-M740 HydrophobicContact CG1-SD 4.29Å; V726-M740 HydrophobicContact CG2-CB 3.6Å; V726-M740 HydrophobicContact CG2-CG 4.49Å; V726-M740 HydrophobicContact CG2-SD 4.24Å; V726-F749 HydrophobicContact CG2-CE1 4.45Å; V726-I803 HydrophobicContact CB-CG2 3.69Å; V726-I803 HydrophobicContact CG1-CG2 4.21Å; V726-I803 HydrophobicContact CG2-CG2 3.68Å; V726-F805 HydrophobicContact CB-CE1 4.36Å; V726-F805 HydrophobicContact CG1-CD1 3.88Å; V726-F805 HydrophobicContact CG1-CE1 3.46Å; V726-F805 VanDerWaalsContact CG1-CE1 3.46Å; V726-F805 HydrophobicContact CG1-CZ 4.34Å
727	S	90.6	Very high	87	Confident	16 Å²	16	66.8 Å²	66.8	11%	0.112	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	107.2	176	-57.8	0	0	0	0	109.4	I736 L804	S727-I736 CarbonylContact C-O 3.58Å; S727-I736 WeakPolarHBondContact CA-O 3.48Å; S727-L804 PolarHBondContact N-O 3.02Å; S727-L804 WeakPolarHBondContact O-CA 3.2Å; S727-L804 WeakPolarHBondContact O-CB 3.4Å; S727-L804 PolarHBondContact O-N 3.27Å
728	W	90.6	Very high	87.7	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.4	175	179.1	13.6	0	0	0	110.2	P735 I736 V738 C760 Q762 K765 Y801 I803	W728-P735 CarbonylContact O-C 3.57Å; W728-P735 WeakPolarHBondContact O-CA 3.18Å; W728-I736 PolarHBondContact N-O 3.09Å; W728-I736 PolarHBondContact O-N 3.45Å; W728-V738 HydrophobicContact CB-CG2 3.84Å; W728-V738 HydrophobicContact CE3-CG1 4.42Å; W728-C760 HydrophobicContact CZ3-CB 4.15Å; W728-Q762 HydrophobicContact CH2-CB 4.25Å; W728-Q762 HydrophobicContact CZ3-CB 4.32Å; W728-K765 HydrophobicContact CH2-CB 4.19Å; W728-K765 HydrophobicContact CZ2-CB 4.12Å; W728-K765 HydrophobicContact CZ2-CD 4.06Å; W728-Y801 AromaticContact CE2-CD1 3.92Å; W728-Y801 HydrophobicContact CH2-CD1 4.28Å; W728-Y801 HydrophobicContact CH2-CE1 4.14Å; W728-Y801 AromaticContact CZ2-CD1 3.58Å; W728-Y801 HydrophobicContact CZ2-CD1 3.58Å; W728-Y801 AromaticContact CZ2-CE1 3.78Å; W728-Y801 HydrophobicContact CZ2-CE1 3.78Å; W728-I803 HydrophobicContact CB-CD1 4.12Å; W728-I803 HydrophobicContact CG-CD1 4.05Å
729	Q	87.4	Confident	88.1	Confident	28 Å²	28	61.2 Å²	61.2	13%	0.131	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	116.4	176.6	-169.9	70.6	2.7	0	0	110.9	R733 E802 L804	Q729-R733 PolarHBondContact NE2-O 3.38Å; Q729-E802 HydrophobicContact CB-CB 4.02Å; Q729-E802 HydrophobicContact CB-CG 3.84Å; Q729-E802 WeakPolarHBondContact CB-O 3.28Å; Q729-E802 HydrophobicContact CG-CG 4.37Å; Q729-E802 PolarHBondContact N-O 3.34Å; Q729-L804 HydrophobicContact CB-CD1 4.09Å; Q729-L804 HydrophobicContact CB-CG 4.29Å; Q729-L804 HydrophobicContact CG-CD1 4.42Å
730	T	86.4	Confident	88.5	Confident	7 Å²	7	58 Å²	58	4%	0.043	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-76.7	164.3	176.7	61	0	0	0	0	112.5	R732 R733 K734 I736 Q762 D763	T730-R732 PolarHBondContact O-N 3.48Å; T730-R733 WeakPolarHBondContact O-CA 3.49Å; T730-R733 PolarHBondContact O-N 3.15Å; T730-K734 WeakPolarHBondContact CB-O 3.3Å; T730-K734 WeakPolarHBondContact CG2-O 3.49Å; T730-K734 PolarHBondContact N-O 2.9Å; T730-K734 PolarHBondContact OG1-N 3.26Å; T730-K734 PolarHBondContact OG1-O 3.49Å; T730-I736 HydrophobicContact CG2-CD1 3.44Å; T730-I736 VanDerWaalsContact CG2-CD1 3.44Å; T730-I736 HydrophobicContact CG2-CG1 3.8Å; T730-Q762 HydrophobicContact CG2-CG 3.69Å; T730-D763 VanDerWaalsContact CB-OD2 3.28Å; T730-D763 WeakPolarHBondContact CB-OD2 3.36Å
731	A	80.8	Confident	88.7	Confident	79 Å²	79	58 Å²	58	65%	0.653	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.6	173.6	0	0	0	0	0	112.1	R733 D763	A731-R733 PolarHBondContact O-N 2.66Å; A731-D763 HydrophobicContact CB-CB 4.43Å; A731-D763 WeakPolarHBondContact CB-OD2 3.49Å; A731-D763 PolarHBondContact N-OD2 3.31Å
732	R	80.5	Confident	88.9	Confident	209 Å²	209	55 Å²	55	79%	0.789	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	4.3	174.1	-56.6	-172.5	-174.3	-155.2	0	113.9	T730 K734	T730-R732 PolarHBondContact O-N 3.48Å; R732-K734 PolarHBondContact O-N 2.91Å
733	R	77.3	Confident	89	Confident	212 Å²	212	52.5 Å²	52.5	80%	0.8	26%	0.256	S	S	*	.	S	Bend	trans	56.4	22.7	-174.2	-64.8	-169.5	172.7	179.2	0.9	115.4	Q729 T730 A731	Q729-R733 PolarHBondContact NE2-O 3.38Å; T730-R733 WeakPolarHBondContact O-CA 3.49Å; T730-R733 PolarHBondContact O-N 3.15Å; A731-R733 PolarHBondContact O-N 2.66Å
734	K	83.8	Confident	88.8	Confident	153 Å²	153	53.1 Å²	53.1	67%	0.665	26%	0.257	S	S	*	.			trans	-97	119.8	170.8	-170.9	177	178.6	-176.9	0	108.6	T730 R732	T730-K734 WeakPolarHBondContact CB-O 3.3Å; T730-K734 WeakPolarHBondContact CG2-O 3.49Å; T730-K734 PolarHBondContact N-O 2.9Å; T730-K734 PolarHBondContact OG1-N 3.26Å; T730-K734 PolarHBondContact OG1-O 3.49Å; R732-K734 PolarHBondContact O-N 2.91Å
735	P	84.4	Confident	88.8	Confident	72 Å²	72	53.2 Å²	53.2	47%	0.468	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	137.3	176.3	27.5	-32.2	0	0	0	110.5	W728	W728-P735 CarbonylContact O-C 3.57Å; W728-P735 WeakPolarHBondContact O-CA 3.18Å
736	I	89.8	Confident	88.7	Confident	34 Å²	34	49 Å²	49	17%	0.174	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.4	171.7	-59.7	176.3	0	0	0	107.6	S727 W728 T730 V738 Q762	S727-I736 CarbonylContact C-O 3.58Å; S727-I736 WeakPolarHBondContact CA-O 3.48Å; W728-I736 PolarHBondContact N-O 3.09Å; W728-I736 PolarHBondContact O-N 3.45Å; T730-I736 HydrophobicContact CG2-CD1 3.44Å; T730-I736 VanDerWaalsContact CG2-CD1 3.44Å; T730-I736 HydrophobicContact CG2-CG1 3.8Å; I736-V738 HydrophobicContact CG2-CG1 3.88Å; I736-Q762 HydrophobicContact CD1-CB 4.45Å; I736-Q762 HydrophobicContact CD1-CG 3.79Å
737	E	91.6	Very high	88.8	Confident	133 Å²	133	49 Å²	49	62%	0.621	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	125	171.9	-69.4	-174.1	172.5	0	0	110
738	V	92.5	Very high	88.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.8	-178.8	-62.9	0	0	0	0	110.1	V726 W728 I736 M740 F749 L750 C760	V726-V738 HydrophobicContact CG2-CG2 3.74Å; V726-V738 PolarHBondContact N-O 2.89Å; V726-V738 PolarHBondContact O-N 3.06Å; V726-V738 VanDerWaalsContact O-O 3.09Å; W728-V738 HydrophobicContact CB-CG2 3.84Å; W728-V738 HydrophobicContact CE3-CG1 4.42Å; I736-V738 HydrophobicContact CG2-CG1 3.88Å; V738-M740 PolarHBondContact O-N 3.36Å; V738-F749 HydrophobicContact CG2-CD1 3.74Å; V738-F749 HydrophobicContact CG2-CE1 4.5Å; V738-L750 CarbonylContact C-O 3.57Å; V738-L750 WeakPolarHBondContact CA-O 3.42Å; V738-C760 HydrophobicContact CG1-CB 4.11Å
739	S	92.5	Very high	89	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.028	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.7	170.1	-48.1	0	0	0	0	108.6	E725 F749 L750 Y757	E725-S739 PolarHBondContact OE1-OG 3.49Å; E725-S739 VanDerWaalsContact OE2-CA 3.3Å; E725-S739 WeakPolarHBondContact OE2-CA 3.44Å; E725-S739 WeakPolarHBondContact OE2-CB 3.28Å; E725-S739 PolarHBondContact OE2-N 3.31Å; E725-S739 PolarHBondContact OE2-OG 3.1Å; S739-F749 WeakPolarHBondContact O-CA 3.45Å; S739-L750 PolarHBondContact N-O 3.47Å; S739-L750 PolarHBondContact O-N 3.07Å; S739-Y757 WeakPolarHBondContact OG-CE1 3.36Å
740	M	94.3	Very high	89.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	124.3	176.2	-178	-178.5	-175.9	0	0	109.5	A723 S724 V726 V738 I747 F749 L790 I803 W814 I818	A723-M740 WeakPolarHBondContact CA-O 3.39Å; S724-M740 PolarHBondContact N-O 3.38Å; S724-M740 VanDerWaalsContact N-O 3.09Å; S724-M740 PolarHBondContact O-N 3.16Å; V726-M740 HydrophobicContact CG1-CB 4.12Å; V726-M740 HydrophobicContact CG1-SD 4.29Å; V726-M740 HydrophobicContact CG2-CB 3.6Å; V726-M740 HydrophobicContact CG2-CG 4.49Å; V726-M740 HydrophobicContact CG2-SD 4.24Å; V738-M740 PolarHBondContact O-N 3.36Å; M740-I747 HydrophobicContact CE-CD1 4.04Å; M740-I747 HydrophobicContact CE-CG2 3.59Å; M740-I747 HydrophobicContact CG-CG2 3.95Å; M740-F749 HydrophobicContact CB-CD1 3.96Å; M740-F749 HydrophobicContact CB-CE1 3.82Å; M740-F749 HydrophobicContact CE-CE1 4.3Å; M740-F749 HydrophobicContact CE-CZ 4.14Å; M740-F749 HydrophobicContact CG-CD1 4.06Å; M740-F749 HydrophobicContact CG-CE1 3.51Å; M740-F749 HydrophobicContact CG-CZ 4.15Å; M740-F749 HydrophobicContact SD-CE1 3.83Å; M740-F749 HydrophobicContact SD-CZ 4.27Å; M740-L790 HydrophobicContact CE-CD1 3.62Å; M740-I803 HydrophobicContact SD-CG2 4.41Å; M740-W814 HydrophobicContact CB-CH2 4.05Å; M740-W814 HydrophobicContact CB-CZ2 4.24Å; M740-W814 HydrophobicContact CE-CE3 3.92Å; M740-W814 HydrophobicContact CE-CH2 4.44Å; M740-W814 HydrophobicContact CE-CZ3 3.72Å; M740-W814 HydrophobicContact CG-CH2 3.63Å; M740-W814 HydrophobicContact CG-CZ2 4.21Å; M740-W814 HydrophobicContact CG-CZ3 3.86Å; M740-W814 WeakPolarHBondContact O-CH2 2.94Å; M740-W814 HydrophobicContact SD-CD2 4.28Å; M740-W814 HydrophobicContact SD-CE3 3.95Å; M740-W814 HydrophobicContact SD-CH2 3.92Å; M740-W814 HydrophobicContact SD-CZ2 4.25Å; M740-W814 HydrophobicContact SD-CZ3 3.72Å; M740-I818 HydrophobicContact CE-CD1 3.8Å
741	L	93.9	Very high	89.3	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.9	-179.8	-52.4	-178.2	0	0	0	109.3	L691 L720 A723 F743 I747 V748 L750	L691-L741 HydrophobicContact CD1-CD1 4.02Å; L691-L741 HydrophobicContact CD1-CD2 3.61Å; L691-L741 HydrophobicContact CD1-CG 4.47Å; L720-L741 HydrophobicContact CD1-CB 3.78Å; L720-L741 HydrophobicContact CD1-CD2 4.27Å; L720-L741 HydrophobicContact CD1-CG 4.47Å; A723-L741 HydrophobicContact CB-CD2 3.51Å; L741-F743 HydrophobicContact CB-CD2 4.24Å; L741-F743 HydrophobicContact CB-CE2 3.7Å; L741-F743 HydrophobicContact CD1-CE2 4.08Å; L741-F743 HydrophobicContact CD1-CZ 4.41Å; L741-I747 CarbonylContact O-C 3.56Å; L741-I747 VanDerWaalsContact O-CA 3.3Å; L741-I747 WeakPolarHBondContact O-CA 3.34Å; L741-V748 HydrophobicContact CB-CB 4.3Å; L741-V748 PolarHBondContact N-O 2.76Å; L741-V748 PolarHBondContact O-N 2.91Å; L741-L750 HydrophobicContact CD1-CD1 3.62Å; L741-L750 HydrophobicContact CD1-CG 4.12Å
742	L	94.2	Very high	89.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	114.8	172.8	178.5	63.4	0	0	0	109	L721 Y722 I747 L771 W814 R817 I818 A821	L721-L742 HydrophobicContact CB-CD2 4.27Å; L721-L742 HydrophobicContact CB-CG 4.19Å; L721-L742 HydrophobicContact CD1-CG 4.39Å; L721-L742 PolarHBondContact N-O 3.44Å; Y722-L742 PolarHBondContact N-O 3.08Å; Y722-L742 PolarHBondContact O-N 3.22Å; L742-I747 HydrophobicContact CD1-CD1 4.22Å; L742-I747 HydrophobicContact CD1-CG1 3.65Å; L742-L771 HydrophobicContact CD1-CD1 4.27Å; L742-L771 HydrophobicContact CD1-CD2 4.08Å; L742-W814 HydrophobicContact CB-CH2 4.32Å; L742-W814 HydrophobicContact CB-CZ3 3.86Å; L742-R817 HydrophobicContact CD2-CB 4.01Å; L742-I818 HydrophobicContact CD1-CG1 4.36Å; L742-I818 HydrophobicContact CD2-CG1 4.28Å; L742-A821 HydrophobicContact CD1-CB 4.09Å; L742-A821 HydrophobicContact CD2-CB 4.16Å; L742-A821 HydrophobicContact CG-CB 4.4Å
743	F	93.3	Very high	89.7	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.009	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	176.8	168.1	-67.8	-96.4	0	0	0	110.9	R688 L713 R718 E719 L720 L741 D745 V746 V748	R688-F743 HydrophobicContact CG-CE1 4.46Å; L713-F743 HydrophobicContact CD2-CE2 3.95Å; L713-F743 HydrophobicContact CD2-CZ 3.87Å; R718-F743 HydrophobicContact CB-CD1 4.14Å; E719-F743 CarbonylContact O-C 3.54Å; E719-F743 WeakPolarHBondContact O-CA 3.19Å; E719-F743 WeakPolarHBondContact O-CD1 3.45Å; L720-F743 HydrophobicContact CB-CD1 4.39Å; L720-F743 HydrophobicContact CB-CE1 4.1Å; L720-F743 HydrophobicContact CD1-CD2 4.34Å; L720-F743 HydrophobicContact CD1-CE1 4.28Å; L720-F743 HydrophobicContact CD1-CE2 4.03Å; L720-F743 HydrophobicContact CD1-CZ 4Å; L741-F743 HydrophobicContact CB-CD2 4.24Å; L741-F743 HydrophobicContact CB-CE2 3.7Å; L741-F743 HydrophobicContact CD1-CE2 4.08Å; L741-F743 HydrophobicContact CD1-CZ 4.41Å; F743-D745 PolarHBondContact O-N 3.33Å; F743-V746 WeakPolarHBondContact CA-O 3.23Å; F743-V746 HydrophobicContact CB-CG2 4.01Å; F743-V746 WeakPolarHBondContact CB-O 3.4Å; F743-V746 HydrophobicContact CD2-CG2 4.25Å; F743-V746 HydrophobicContact CG-CG2 4.36Å; F743-V746 PolarHBondContact N-O 3.25Å; F743-V748 HydrophobicContact CD2-CG2 3.98Å; F743-V748 HydrophobicContact CE2-CB 4.25Å; F743-V748 HydrophobicContact CE2-CG2 3.93Å
744	T	89	Confident	89.7	Confident	39 Å²	39	39.9 Å²	39.9	24%	0.239	21%	0.205	C	C	.	.	S	Bend	trans	-62.5	-28.1	176.1	46.1	0	0	0	0	113.8	E719 L721 L771	E719-T744 HydrophobicContact CB-CG2 3.91Å; E719-T744 PolarHBondContact N-OG1 3.07Å; E719-T744 PolarHBondContact O-N 2.87Å; E719-T744 VanDerWaalsContact O-N 3.14Å; L721-T744 HydrophobicContact CD1-CG2 4.31Å; L721-T744 HydrophobicContact CD2-CG2 4.05Å; L721-T744 HydrophobicContact CG-CG2 4.22Å; T744-L771 WeakPolarHBondContact O-CD1 3.41Å
745	D	87.9	Confident	89.5	Confident	29 Å²	29	39.6 Å²	39.6	16%	0.155	21%	0.206	C	C	.	.	S	Bend	trans	-124.7	-24.7	-174	66.4	-34.7	0	0	0	114.1	R718 F743 L771 Y825	R718-D745 WeakPolarHBondContact CG-OD1 3.43Å; R718-D745 IonicContact CZ-OD2 2.81Å; R718-D745 IonicContact NE-OD2 2.62Å; R718-D745 PolarHBondContact NE-OD2 3.03Å; R718-D745 IonicContact NH1-OD1 2.66Å; R718-D745 IonicContact NH1-OD2 3.52Å; R718-D745 PolarHBondContact NH1-OD2 3.32Å; R718-D745 IonicContact NH2-OD2 3.43Å; F743-D745 PolarHBondContact O-N 3.33Å; D745-L771 WeakPolarHBondContact O-CB 3.42Å; D745-L771 WeakPolarHBondContact O-CG 3.27Å; D745-L771 PolarHBondContact O-N 3.44Å; D745-Y825 HydrophobicContact CB-CD2 4.26Å; D745-Y825 HydrophobicContact CB-CE2 3.9Å
746	V	90.7	Very high	89.4	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	158.6	-175.6	-61.8	0	0	0	0	113.2	F703 R718 F743 V748 I768 I769	F703-V746 HydrophobicContact CE1-CG1 3.98Å; F703-V746 HydrophobicContact CE2-CG1 4.21Å; F703-V746 HydrophobicContact CZ-CG1 3.56Å; R718-V746 VanDerWaalsContact NH1-CG2 3.33Å; F743-V746 WeakPolarHBondContact CA-O 3.23Å; F743-V746 HydrophobicContact CB-CG2 4.01Å; F743-V746 WeakPolarHBondContact CB-O 3.4Å; F743-V746 HydrophobicContact CD2-CG2 4.25Å; F743-V746 HydrophobicContact CG-CG2 4.36Å; F743-V746 PolarHBondContact N-O 3.25Å; V746-V748 HydrophobicContact CG2-CG2 3.93Å; V746-I768 HydrophobicContact CB-CG2 3.99Å; V746-I768 HydrophobicContact CG1-CG2 4.22Å; V746-I768 HydrophobicContact CG2-CG2 4.38Å; V746-I769 CarbonylContact C-O 3.58Å; V746-I769 VanDerWaalsContact CA-O 3.27Å; V746-I769 WeakPolarHBondContact CA-O 3.26Å
747	I	93.2	Very high	89.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.9	164.3	-63	170.2	0	0	0	107.8	M740 L741 L742 F749 I768 I769 L771 L774 L790 I818	M740-I747 HydrophobicContact CE-CD1 4.04Å; M740-I747 HydrophobicContact CE-CG2 3.59Å; M740-I747 HydrophobicContact CG-CG2 3.95Å; L741-I747 CarbonylContact O-C 3.56Å; L741-I747 VanDerWaalsContact O-CA 3.3Å; L741-I747 WeakPolarHBondContact O-CA 3.34Å; L742-I747 HydrophobicContact CD1-CD1 4.22Å; L742-I747 HydrophobicContact CD1-CG1 3.65Å; I747-F749 HydrophobicContact CG2-CE1 4.5Å; I747-F749 HydrophobicContact CG2-CE2 3.92Å; I747-F749 HydrophobicContact CG2-CZ 3.88Å; I747-I768 CarbonylContact O-C 3.59Å; I747-I768 VanDerWaalsContact O-CA 3.29Å; I747-I768 WeakPolarHBondContact O-CA 3.46Å; I747-I769 HydrophobicContact CB-CB 4.28Å; I747-I769 PolarHBondContact N-O 3.15Å; I747-I769 PolarHBondContact O-N 3.21Å; I747-L771 HydrophobicContact CD1-CD2 3.82Å; I747-L771 HydrophobicContact CG1-CD2 3.75Å; I747-L774 HydrophobicContact CD1-CD2 3.73Å; I747-L790 HydrophobicContact CD1-CD1 4.15Å; I747-I818 HydrophobicContact CD1-CD1 4.27Å; I747-I818 HydrophobicContact CD1-CG1 4.34Å; I747-I818 HydrophobicContact CD1-CG2 4.17Å
748	V	92.1	Very high	89.1	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133	-178.9	-179.5	0	0	0	0	109.8	L713 L741 F743 V746 L750 F759 I768	L713-V748 HydrophobicContact CD2-CG1 4.39Å; L713-V748 HydrophobicContact CD2-CG2 3.95Å; L741-V748 HydrophobicContact CB-CB 4.3Å; L741-V748 PolarHBondContact N-O 2.76Å; L741-V748 PolarHBondContact O-N 2.91Å; F743-V748 HydrophobicContact CD2-CG2 3.98Å; F743-V748 HydrophobicContact CE2-CB 4.25Å; F743-V748 HydrophobicContact CE2-CG2 3.93Å; V746-V748 HydrophobicContact CG2-CG2 3.93Å; V748-L750 HydrophobicContact CG1-CD2 3.87Å; V748-L750 HydrophobicContact CG1-CG 4.24Å; V748-F759 HydrophobicContact CG1-CD1 3.98Å; V748-F759 HydrophobicContact CG1-CE1 3.83Å; V748-I768 HydrophobicContact CG1-CG1 4.36Å; V748-I768 HydrophobicContact CG2-CG1 4.29Å; V748-I768 HydrophobicContact CG2-CG2 4.24Å
749	F	93	Very high	88.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.4	173	-61.7	-79.8	0	0	0	110.3	V726 V738 S739 M740 I747 C760 G767 I769 L790 I803	V726-F749 HydrophobicContact CG2-CE1 4.45Å; V738-F749 HydrophobicContact CG2-CD1 3.74Å; V738-F749 HydrophobicContact CG2-CE1 4.5Å; S739-F749 WeakPolarHBondContact O-CA 3.45Å; M740-F749 HydrophobicContact CB-CD1 3.96Å; M740-F749 HydrophobicContact CB-CE1 3.82Å; M740-F749 HydrophobicContact CE-CE1 4.3Å; M740-F749 HydrophobicContact CE-CZ 4.14Å; M740-F749 HydrophobicContact CG-CD1 4.06Å; M740-F749 HydrophobicContact CG-CE1 3.51Å; M740-F749 HydrophobicContact CG-CZ 4.15Å; M740-F749 HydrophobicContact SD-CE1 3.83Å; M740-F749 HydrophobicContact SD-CZ 4.27Å; I747-F749 HydrophobicContact CG2-CE1 4.5Å; I747-F749 HydrophobicContact CG2-CE2 3.92Å; I747-F749 HydrophobicContact CG2-CZ 3.88Å; F749-C760 HydrophobicContact CB-CB 4.12Å; F749-C760 PolarHBondContact O-N 2.99Å; F749-G767 PolarHBondContact N-O 3Å; F749-I769 HydrophobicContact CE2-CD1 3.6Å; F749-I769 HydrophobicContact CE2-CG1 4.1Å; F749-I769 HydrophobicContact CZ-CD1 4.24Å; F749-L790 HydrophobicContact CZ-CD1 4.32Å; F749-I803 HydrophobicContact CE1-CD1 3.7Å; F749-I803 HydrophobicContact CE1-CG1 4.44Å; F749-I803 HydrophobicContact CZ-CD1 3.77Å; F749-I803 HydrophobicContact CZ-CG1 4.36Å
750	L	91.7	Very high	88.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137.3	174.7	-57.8	-179	0	0	0	110.2	M695 V738 S739 L741 V748 Y757 S758 F759	M695-L750 HydrophobicContact CE-CD2 3.83Å; M695-L750 HydrophobicContact SD-CD1 4.06Å; M695-L750 HydrophobicContact SD-CD2 4.11Å; V738-L750 CarbonylContact C-O 3.57Å; V738-L750 WeakPolarHBondContact CA-O 3.42Å; S739-L750 PolarHBondContact N-O 3.47Å; S739-L750 PolarHBondContact O-N 3.07Å; L741-L750 HydrophobicContact CD1-CD1 3.62Å; L741-L750 HydrophobicContact CD1-CG 4.12Å; V748-L750 HydrophobicContact CG1-CD2 3.87Å; V748-L750 HydrophobicContact CG1-CG 4.24Å; L750-Y757 HydrophobicContact CB-CD1 3.89Å; L750-Y757 HydrophobicContact CD1-CD1 4.4Å; L750-Y757 HydrophobicContact CD1-CG 4.43Å; L750-S758 CarbonylContact C-O 3.57Å; L750-S758 WeakPolarHBondContact CA-O 3.4Å; L750-F759 HydrophobicContact CD2-CD1 3.79Å; L750-F759 HydrophobicContact CD2-CE1 4.07Å; L750-F759 HydrophobicContact CD2-CG 4.43Å
751	H	89.3	Confident	87.9	Confident	63 Å²	63	36 Å²	36	29%	0.292	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	140.2	169.7	-175.6	-103.6	0	0	0	109.4	N753 Y757 S758 C760	H751-N753 PolarHBondContact CE1-OD1 2.92Å; H751-N753 VanDerWaalsContact CE1-OD1 3.26Å; H751-N753 PolarHBondContact ND1-OD1 3.04Å; H751-Y757 WeakPolarHBondContact O-CA 3.49Å; H751-S758 PolarHBondContact N-O 2.63Å; H751-S758 PolarHBondContact O-N 3.31Å; H751-C760 HydrophobicContact CB-CB 4.09Å
752	R	87.5	Confident	87	Confident	121 Å²	121	38.9 Å²	38.9	46%	0.457	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	105.6	-179.8	-171.5	177.1	179.5	133	2.3	110.4	S754 Y757	R752-S754 PolarHBondContact O-N 3.36Å; R752-Y757 HydrophobicContact CB-CD1 4.2Å; R752-Y757 HydrophobicContact CB-CE1 3.89Å; R752-Y757 HydrophobicContact CG-CE1 4.14Å; R752-Y757 PolarHBondContact NH1-OH 3.01Å
753	N	82.1	Confident	86	Confident	63 Å²	63	41.3 Å²	41.3	34%	0.337	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	93.9	176.3	-65.8	-19.4	0	0	0	110	H751 Q755 S756 S758	H751-N753 PolarHBondContact CE1-OD1 2.92Å; H751-N753 VanDerWaalsContact CE1-OD1 3.26Å; H751-N753 PolarHBondContact ND1-OD1 3.04Å; N753-Q755 VanDerWaalsContact C-N 3.27Å; N753-Q755 PolarHBondContact O-N 3.33Å; N753-S756 PolarHBondContact N-O 3.33Å; N753-S756 PolarHBondContact O-N 3.49Å; N753-S756 PolarHBondContact O-OG 2.87Å; N753-S758 PolarHBondContact ND2-OG 2.88Å
754	S	77.3	Confident	85	Confident	114 Å²	114	49.2 Å²	49.2	80%	0.797	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-78.3	-177	-54.9	0	0	0	0	113.6	R752	R752-S754 PolarHBondContact O-N 3.36Å
755	Q	78.6	Confident	84.6	Confident	147 Å²	147	49.2 Å²	49.2	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	-4.5	179.7	-61.5	-62.6	-7.4	0	0	114.6	N753	N753-Q755 VanDerWaalsContact C-N 3.27Å; N753-Q755 PolarHBondContact O-N 3.33Å
756	S	83.6	Confident	84.2	Confident	42 Å²	42	49.3 Å²	49.3	29%	0.294	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	156.9	176.5	60.5	0	0	0	0	111.5	Q694 N753	Q694-S756 VanDerWaalsContact O-CA 3.27Å; Q694-S756 WeakPolarHBondContact O-CA 3.41Å; Q694-S756 WeakPolarHBondContact O-CB 3.43Å; N753-S756 PolarHBondContact N-O 3.33Å; N753-S756 PolarHBondContact O-N 3.49Å; N753-S756 PolarHBondContact O-OG 2.87Å
757	Y	87.7	Confident	83.8	Confident	11 Å²	11	49.2 Å²	49.2	4%	0.043	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.8	171.7	-74.2	-80.4	0	0	0	110.2	L691 Q694 M695 S739 L750 H751 R752	L691-Y757 HydrophobicContact CD2-CD2 3.95Å; L691-Y757 HydrophobicContact CD2-CE1 4.22Å; L691-Y757 HydrophobicContact CD2-CE2 3.45Å; L691-Y757 VanDerWaalsContact CD2-CE2 3.45Å; Q694-Y757 HydrophobicContact CB-CD2 3.91Å; Q694-Y757 HydrophobicContact CB-CE2 4.44Å; Q694-Y757 PolarHBondContact O-N 3.2Å; Q694-Y757 VanDerWaalsContact OE1-CE2 3.3Å; M695-Y757 WeakPolarHBondContact CA-O 3.38Å; S739-Y757 WeakPolarHBondContact OG-CE1 3.36Å; L750-Y757 HydrophobicContact CB-CD1 3.89Å; L750-Y757 HydrophobicContact CD1-CD1 4.4Å; L750-Y757 HydrophobicContact CD1-CG 4.43Å; H751-Y757 WeakPolarHBondContact O-CA 3.49Å; R752-Y757 HydrophobicContact CB-CD1 4.2Å; R752-Y757 HydrophobicContact CB-CE1 3.89Å; R752-Y757 HydrophobicContact CG-CE1 4.14Å; R752-Y757 PolarHBondContact NH1-OH 3.01Å
758	S	86.1	Confident	83.6	Confident	11 Å²	11	49.3 Å²	49.3	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	157.8	171.2	67.5	0	0	0	0	109.7	E699 L750 H751 N753	E699-S758 VanDerWaalsContact CD-CB 3.43Å; E699-S758 WeakPolarHBondContact OE1-CB 3.5Å; E699-S758 WeakPolarHBondContact OE2-CB 3.28Å; L750-S758 CarbonylContact C-O 3.57Å; L750-S758 WeakPolarHBondContact CA-O 3.4Å; H751-S758 PolarHBondContact N-O 2.63Å; H751-S758 PolarHBondContact O-N 3.31Å; N753-S758 PolarHBondContact ND2-OG 2.88Å
759	F	88	Confident	83.4	Confident	11 Å²	11	49.4 Å²	49.4	5%	0.048	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	137.2	172.6	-67.1	-75.6	0	0	0	110	M695 E699 T701 F708 L713 V748 L750 T761 I768	M695-F759 HydrophobicContact CE-CD1 4.4Å; M695-F759 HydrophobicContact CE-CD2 4Å; M695-F759 HydrophobicContact CE-CE1 3.99Å; M695-F759 HydrophobicContact CE-CE2 3.55Å; M695-F759 HydrophobicContact CE-CG 4.41Å; M695-F759 HydrophobicContact CE-CZ 3.56Å; E699-F759 HydrophobicContact CB-CD2 4.27Å; E699-F759 HydrophobicContact CB-CE2 4.47Å; T701-F759 HydrophobicContact CG2-CB 4.06Å; T701-F759 HydrophobicContact CG2-CD1 3.82Å; T701-F759 HydrophobicContact CG2-CD2 3.92Å; T701-F759 HydrophobicContact CG2-CE1 4.19Å; T701-F759 HydrophobicContact CG2-CE2 4.28Å; T701-F759 HydrophobicContact CG2-CG 3.66Å; T701-F759 HydrophobicContact CG2-CZ 4.4Å; F708-F759 AromaticContact CD1-CE1 3.95Å; F708-F759 HydrophobicContact CD1-CE1 3.95Å; F708-F759 AromaticContact CD1-CZ 3.71Å; F708-F759 HydrophobicContact CD1-CZ 3.71Å; F708-F759 AromaticContact CE1-CE1 3.95Å; F708-F759 HydrophobicContact CE1-CE1 3.95Å; F708-F759 AromaticContact CE1-CZ 3.9Å; F708-F759 HydrophobicContact CE1-CZ 3.9Å; L713-F759 HydrophobicContact CD1-CE1 4.07Å; L713-F759 HydrophobicContact CD1-CZ 3.93Å; L713-F759 HydrophobicContact CG-CZ 4.42Å; V748-F759 HydrophobicContact CG1-CD1 3.98Å; V748-F759 HydrophobicContact CG1-CE1 3.83Å; L750-F759 HydrophobicContact CD2-CD1 3.79Å; L750-F759 HydrophobicContact CD2-CE1 4.07Å; L750-F759 HydrophobicContact CD2-CG 4.43Å; F759-T761 PolarHBondContact O-N 3.46Å; F759-I768 HydrophobicContact CD1-CD1 4.27Å; F759-I768 HydrophobicContact CD1-CG1 4.45Å; F759-I768 HydrophobicContact CE1-CD1 4.01Å
760	C	85.8	Confident	83.2	Confident	9 Å²	9	49.9 Å²	49.9	6%	0.061	26%	0.262	C	S	.	.			trans	-87.9	102.3	179.6	-168.2	0	0	0	0	110.3	W728 V738 F749 H751 G767	W728-C760 HydrophobicContact CZ3-CB 4.15Å; V738-C760 HydrophobicContact CG1-CB 4.11Å; F749-C760 HydrophobicContact CB-CB 4.12Å; F749-C760 PolarHBondContact O-N 2.99Å; H751-C760 HydrophobicContact CB-CB 4.09Å; C760-G767 WeakPolarHBondContact O-CA 3.5Å; C760-G767 PolarHBondContact O-N 3.49Å
761	T	80.5	Confident	83	Confident	84 Å²	84	49.9 Å²	49.9	52%	0.515	26%	0.262	S	S	.	.			trans	-108.8	113	172.9	55.6	0	0	0	0	109.4	F759	F759-T761 PolarHBondContact O-N 3.46Å
762	Q	76.7	Confident	82.6	Confident	68 Å²	68	52 Å²	52	32%	0.318	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-139.5	143.6	-176.7	-172.8	68.5	-15.5	0	0	110.9	W728 T730 I736 N764 K765	W728-Q762 HydrophobicContact CH2-CB 4.25Å; W728-Q762 HydrophobicContact CZ3-CB 4.32Å; T730-Q762 HydrophobicContact CG2-CG 3.69Å; I736-Q762 HydrophobicContact CD1-CB 4.45Å; I736-Q762 HydrophobicContact CD1-CG 3.79Å; Q762-N764 PolarHBondContact O-N 3.48Å; Q762-K765 PolarHBondContact N-O 3.34Å; Q762-K765 VanDerWaalsContact O-CB 3.28Å; Q762-K765 WeakPolarHBondContact O-CB 3.43Å; Q762-K765 PolarHBondContact O-N 2.93Å
763	D	72.2	Confident	82.3	Confident	51 Å²	51	52.6 Å²	52.6	27%	0.273	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	34.8	-179	-58.5	-38.8	0	0	0	113.7	T730 A731 K765	T730-D763 VanDerWaalsContact CB-OD2 3.28Å; T730-D763 WeakPolarHBondContact CB-OD2 3.36Å; A731-D763 HydrophobicContact CB-CB 4.43Å; A731-D763 WeakPolarHBondContact CB-OD2 3.49Å; A731-D763 PolarHBondContact N-OD2 3.31Å; D763-K765 PolarHBondContact O-N 3.49Å
764	N	72.6	Confident	82.6	Confident	169 Å²	169	50 Å²	50	90%	0.904	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	17.4	-174.7	-150.5	42.8	0	0	0	114.2	Q762	Q762-N764 PolarHBondContact O-N 3.48Å
765	K	79.2	Confident	83	Confident	38 Å²	38	47.9 Å²	47.9	17%	0.165	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-93.8	139.9	174	-57.9	-176.8	178.4	-173	0	110.6	W728 Q762 D763 E799 M800 Y801	W728-K765 HydrophobicContact CH2-CB 4.19Å; W728-K765 HydrophobicContact CZ2-CB 4.12Å; W728-K765 HydrophobicContact CZ2-CD 4.06Å; Q762-K765 PolarHBondContact N-O 3.34Å; Q762-K765 VanDerWaalsContact O-CB 3.28Å; Q762-K765 WeakPolarHBondContact O-CB 3.43Å; Q762-K765 PolarHBondContact O-N 2.93Å; D763-K765 PolarHBondContact O-N 3.49Å; K765-E799 WeakPolarHBondContact CE-OE2 3.46Å; K765-E799 IonicContact NZ-OE2 3.62Å; K765-M800 PolarHBondContact NZ-O 3.45Å; K765-Y801 HydrophobicContact CB-CE1 3.96Å; K765-Y801 HydrophobicContact CD-CD1 4.46Å; K765-Y801 HydrophobicContact CD-CE1 4.21Å
766	E	79.7	Confident	83.6	Confident	31 Å²	31	41.9 Å²	41.9	15%	0.145	22%	0.217	C	C	.	.			trans	-70.5	142.9	175.5	-58.6	-170	145.7	0	0	110.1	S702 L704 I768 Y801	S702-E766 WeakPolarHBondContact CB-OE1 3.48Å; S702-E766 VanDerWaalsContact O-CD 3.32Å; S702-E766 PolarHBondContact OG-OE1 3.04Å; L704-E766 PolarHBondContact N-OE2 3.36Å; E766-I768 PolarHBondContact O-N 2.84Å; E766-I768 VanDerWaalsContact O-N 3.15Å; E766-Y801 PolarHBondContact O-OH 3.1Å
767	G	83.5	Confident	83.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-74.3	5.4	176.3	0	0	0	0	0	114	F749 C760	F749-G767 PolarHBondContact N-O 3Å; C760-G767 WeakPolarHBondContact O-CA 3.5Å; C760-G767 PolarHBondContact O-N 3.49Å
768	I	87.7	Confident	83.8	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.7	-173.1	-53.4	-178.4	0	0	0	109.5	T701 F703 F708 V746 I747 V748 F759 E766	T701-I768 HydrophobicContact CG2-CD1 3.35Å; T701-I768 HydrophobicContact CG2-CG1 3.91Å; F703-I768 HydrophobicContact CB-CB 4.46Å; F703-I768 HydrophobicContact CB-CD1 4.38Å; F703-I768 HydrophobicContact CD2-CB 3.77Å; F703-I768 HydrophobicContact CD2-CG2 3.43Å; F703-I768 VanDerWaalsContact CD2-CG2 3.43Å; F703-I768 HydrophobicContact CE2-CB 4.39Å; F703-I768 HydrophobicContact CE2-CG2 3.67Å; F703-I768 HydrophobicContact CG-CB 4.33Å; F703-I768 HydrophobicContact CG-CG2 3.96Å; F703-I768 HydrophobicContact CZ-CG2 4.37Å; F708-I768 HydrophobicContact CB-CD1 3.89Å; F708-I768 HydrophobicContact CD1-CD1 3.07Å; F708-I768 HydrophobicContact CD2-CD1 3.94Å; F708-I768 HydrophobicContact CE1-CD1 3.42Å; F708-I768 VanDerWaalsContact CE1-CD1 3.42Å; F708-I768 HydrophobicContact CE2-CD1 4.23Å; F708-I768 HydrophobicContact CG-CD1 3.35Å; F708-I768 HydrophobicContact CZ-CD1 3.99Å; V746-I768 HydrophobicContact CB-CG2 3.99Å; V746-I768 HydrophobicContact CG1-CG2 4.22Å; V746-I768 HydrophobicContact CG2-CG2 4.38Å; I747-I768 CarbonylContact O-C 3.59Å; I747-I768 VanDerWaalsContact O-CA 3.29Å; I747-I768 WeakPolarHBondContact O-CA 3.46Å; V748-I768 HydrophobicContact CG1-CG1 4.36Å; V748-I768 HydrophobicContact CG2-CG1 4.29Å; V748-I768 HydrophobicContact CG2-CG2 4.24Å; F759-I768 HydrophobicContact CD1-CD1 4.27Å; F759-I768 HydrophobicContact CD1-CG1 4.45Å; F759-I768 HydrophobicContact CE1-CD1 4.01Å; E766-I768 PolarHBondContact O-N 2.84Å; E766-I768 VanDerWaalsContact O-N 3.15Å
769	I	88.9	Confident	83.6	Confident	2 Å²	2	55 Å²	55	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.7	-179.5	-55.4	177	0	0	0	109.1	V746 I747 F749 L774 L790 Y801	V746-I769 CarbonylContact C-O 3.58Å; V746-I769 VanDerWaalsContact CA-O 3.27Å; V746-I769 WeakPolarHBondContact CA-O 3.26Å; I747-I769 HydrophobicContact CB-CB 4.28Å; I747-I769 PolarHBondContact N-O 3.15Å; I747-I769 PolarHBondContact O-N 3.21Å; F749-I769 HydrophobicContact CE2-CD1 3.6Å; F749-I769 HydrophobicContact CE2-CG1 4.1Å; F749-I769 HydrophobicContact CZ-CD1 4.24Å; I769-L774 HydrophobicContact CG2-CD1 3.64Å; I769-L790 HydrophobicContact CD1-CB 4.35Å; I769-L790 HydrophobicContact CD1-CD1 4.24Å; I769-Y801 HydrophobicContact CD1-CD1 3.89Å; I769-Y801 HydrophobicContact CD1-CD2 3.31Å; I769-Y801 HydrophobicContact CD1-CE1 4.05Å; I769-Y801 HydrophobicContact CD1-CE2 3.5Å; I769-Y801 HydrophobicContact CD1-CG 3.54Å; I769-Y801 HydrophobicContact CG1-CD2 4.04Å; I769-Y801 HydrophobicContact CG1-CE1 4.2Å; I769-Y801 HydrophobicContact CG1-CE2 3.67Å; I769-Y801 HydrophobicContact CG1-CG 4.48Å
770	S	87.6	Confident	82.7	Confident	9 Å²	9	59.2 Å²	59.2	6%	0.063	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136.7	170.4	-177	0	0	0	0	110.7	Q772	S770-Q772 PolarHBondContact O-N 3.47Å; S770-Q772 WeakPolarHBondContact OG-CB 3.08Å; S770-Q772 PolarHBondContact OG-N 3.48Å
771	L	87.5	Confident	81.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-70.5	-14.9	171.1	-65.4	-176.6	0	0	0	112.4	L742 T744 D745 I747 K773 L774 A821 V822 Y825	L742-L771 HydrophobicContact CD1-CD1 4.27Å; L742-L771 HydrophobicContact CD1-CD2 4.08Å; T744-L771 WeakPolarHBondContact O-CD1 3.41Å; D745-L771 WeakPolarHBondContact O-CB 3.42Å; D745-L771 WeakPolarHBondContact O-CG 3.27Å; D745-L771 PolarHBondContact O-N 3.44Å; I747-L771 HydrophobicContact CD1-CD2 3.82Å; I747-L771 HydrophobicContact CG1-CD2 3.75Å; L771-K773 PolarHBondContact O-N 3.27Å; L771-K773 VanDerWaalsContact O-N 3.15Å; L771-L774 HydrophobicContact CD2-CD2 3.67Å; L771-L774 WeakPolarHBondContact O-CB 3.27Å; L771-L774 PolarHBondContact O-N 3.07Å; L771-A821 HydrophobicContact CD1-CB 3.82Å; L771-V822 HydrophobicContact CB-CG2 4.31Å; L771-V822 HydrophobicContact CD2-CG2 4.05Å; L771-Y825 HydrophobicContact CB-CD1 4.42Å; L771-Y825 HydrophobicContact CB-CG 4.44Å
772	Q	82.4	Confident	80	Confident	107 Å²	107	69.1 Å²	69.1	50%	0.5	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	116.9	178.5	-163.4	174.7	17.4	0	0	111	S770 L774 Y825	S770-Q772 PolarHBondContact O-N 3.47Å; S770-Q772 WeakPolarHBondContact OG-CB 3.08Å; S770-Q772 PolarHBondContact OG-N 3.48Å; Q772-L774 PolarHBondContact O-N 3.28Å; Q772-Y825 HydrophobicContact CB-CD1 4.46Å; Q772-Y825 HydrophobicContact CB-CE1 3.69Å; Q772-Y825 HydrophobicContact CG-CE1 4.03Å
773	K	80.5	Confident	78.6	Confident	134 Å²	134	75.3 Å²	75.3	58%	0.583	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	32.5	-177.5	-53	175.6	176.9	178.6	0	113.1	L771 T793	L771-K773 PolarHBondContact O-N 3.27Å; L771-K773 VanDerWaalsContact O-N 3.15Å; K773-T793 WeakPolarHBondContact CB-OG1 3.46Å; K773-T793 PolarHBondContact O-OG1 2.99Å
774	L	87.6	Confident	77.8	Confident	9 Å²	9	74.2 Å²	74.2	5%	0.047	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.8	172.5	-175.9	65.3	0	0	0	109.7	I747 I769 L771 Q772 V776 L790 I818 V822	I747-L774 HydrophobicContact CD1-CD2 3.73Å; I769-L774 HydrophobicContact CG2-CD1 3.64Å; L771-L774 HydrophobicContact CD2-CD2 3.67Å; L771-L774 WeakPolarHBondContact O-CB 3.27Å; L771-L774 PolarHBondContact O-N 3.07Å; Q772-L774 PolarHBondContact O-N 3.28Å; L774-V776 HydrophobicContact CD2-CG2 4.4Å; L774-V776 HydrophobicContact CG-CG2 4.38Å; L774-L790 HydrophobicContact CD1-CB 4.2Å; L774-I818 HydrophobicContact CD2-CG2 3.78Å; L774-V822 HydrophobicContact CB-CG2 4.04Å; L774-V822 HydrophobicContact CD2-CG2 4.15Å
775	I	86.2	Confident	77.4	Confident	69 Å²	69	68 Å²	68	35%	0.354	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.2	175.1	-55.1	170.7	0	0	0	108.3	R777 I791 T793	I775-R777 HydrophobicContact CG2-CG 4.13Å; I775-I791 HydrophobicContact CB-CB 4.21Å; I775-I791 PolarHBondContact N-O 2.74Å; I775-I791 PolarHBondContact O-N 3.09Å; I775-T793 HydrophobicContact CD1-CG2 3.79Å; I775-T793 HydrophobicContact CG1-CG2 4.34Å
776	V	90.8	Very high	77.3	Confident	22 Å²	22	69.7 Å²	69.7	13%	0.133	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	123.7	178.3	-174.7	0	0	0	0	109.1	L774 L788 L790 T815 I818	L774-V776 HydrophobicContact CD2-CG2 4.4Å; L774-V776 HydrophobicContact CG-CG2 4.38Å; V776-L788 HydrophobicContact CG1-CD1 3.63Å; V776-L788 HydrophobicContact CG1-CD2 4.19Å; V776-L788 HydrophobicContact CG1-CG 4.13Å; V776-L790 HydrophobicContact CG1-CD2 4.22Å; V776-L790 HydrophobicContact CG2-CD2 4.06Å; V776-T815 HydrophobicContact CG1-CG2 4.24Å; V776-I818 HydrophobicContact CG2-CB 4.29Å; V776-I818 HydrophobicContact CG2-CG2 3.51Å
777	R	88.9	Confident	77.6	Confident	162 Å²	162	68.2 Å²	68.2	61%	0.611	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.7	177.3	-70.8	-171.7	177.3	-169.6	0.1	111.9	I775 Y789	I775-R777 HydrophobicContact CG2-CG 4.13Å; R777-Y789 PolarHBondContact N-O 2.62Å; R777-Y789 PolarHBondContact O-N 3.5Å
778	E	87.2	Confident	78	Confident	110 Å²	110	68.2 Å²	68.2	51%	0.514	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.1	173.5	-62	-169.6	170.8	0	0	111.3	A780 L788 T815	E778-A780 PolarHBondContact O-N 3.16Å; E778-A780 VanDerWaalsContact O-N 3.13Å; E778-L788 HydrophobicContact CG-CD1 4.07Å; E778-T815 HydrophobicContact CG-CG2 4.43Å; E778-T815 PolarHBondContact OE1-OG1 3.21Å; E778-T815 VanDerWaalsContact OE1-OG1 3.12Å
779	K	81.6	Confident	78.1	Confident	66 Å²	66	70.9 Å²	70.9	29%	0.287	36%	0.357	S	S	.	.			trans	-73.5	107	179.8	-179.1	175.7	-177.7	175.4	0	110	G781 S785 G787 Y789 E802	K779-G781 PolarHBondContact O-N 3.18Å; K779-S785 WeakPolarHBondContact CB-OG 3.34Å; K779-S785 WeakPolarHBondContact CG-OG 3.26Å; K779-S785 WeakPolarHBondContact O-CB 2.96Å; K779-S785 PolarHBondContact O-OG 3.39Å; K779-G787 VanDerWaalsContact CB-O 3.3Å; K779-G787 WeakPolarHBondContact CB-O 3.47Å; K779-G787 PolarHBondContact N-O 3.49Å; K779-Y789 HydrophobicContact CB-CD2 4.1Å; K779-Y789 HydrophobicContact CB-CE2 3.59Å; K779-Y789 HydrophobicContact CD-CE2 4.17Å; K779-Y789 WeakPolarHBondContact CD-OH 2.96Å; K779-Y789 WeakPolarHBondContact CE-OH 3.49Å; K779-Y789 HydrophobicContact CG-CE2 3.62Å; K779-E802 IonicContact NZ-OE1 3.68Å; K779-E802 PolarHBondContact NZ-OE1 2.97Å
780	A	70.1	Confident	78.3	Confident	100 Å²	100	70.8 Å²	70.8	83%	0.826	36%	0.357	S	S	*	.			trans	-64.4	126.8	170.8	0	0	0	0	0	110.7	E778	E778-A780 PolarHBondContact O-N 3.16Å; E778-A780 VanDerWaalsContact O-N 3.13Å
781	G	61.6	Low	78.3	Confident	49 Å²	49	72 Å²	72	51%	0.505	36%	0.362	S	S	.	.			trans	-162.3	148.5	176.6	0	0	0	0	0	112.3	K779 M783	K779-G781 PolarHBondContact O-N 3.18Å; G781-M783 PolarHBondContact O-N 3.42Å
782	R	48.3	Very low	78.1	Confident	253 Å²	253	72.5 Å²	72.5	96%	0.955	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	124.5	177.6	-68.7	-124.2	-84	-131.6	-0.2	109.3
783	M	47.3	Very low	78	Confident	198 Å²	198	69.8 Å²	69.8	98%	0.975	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	69.7	175.4	-61.2	-106.4	-169.5	0	0	114.8	G781	G781-M783 PolarHBondContact O-N 3.42Å
784	G	55.2	Low	77.5	Confident	28 Å²	28	64 Å²	64	29%	0.289	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	31.5	155.1	0	0	0	0	0	117.2	Q786	G784-Q786 VanDerWaalsContact O-CG 3.3Å; G784-Q786 WeakPolarHBondContact O-CG 3.47Å; G784-Q786 PolarHBondContact O-N 2.91Å
785	S	62.9	Low	76.2	Confident	39 Å²	39	69.6 Å²	69.6	27%	0.273	37%	0.37	S	S	.	.			trans	-45.1	124.6	166.6	177	0	0	0	0	111.5	K779	K779-S785 WeakPolarHBondContact CB-OG 3.34Å; K779-S785 WeakPolarHBondContact CG-OG 3.26Å; K779-S785 WeakPolarHBondContact O-CB 2.96Å; K779-S785 PolarHBondContact O-OG 3.39Å
786	Q	77.9	Confident	75	Confident	73 Å²	73	70.8 Å²	70.8	34%	0.341	38%	0.384	S	S	.	.			trans	-107	26	-178.7	-52.3	178.7	-70.3	0	0	111.6	G784 F805 H806 T807 K808	G784-Q786 VanDerWaalsContact O-CG 3.3Å; G784-Q786 WeakPolarHBondContact O-CG 3.47Å; G784-Q786 PolarHBondContact O-N 2.91Å; Q786-F805 WeakPolarHBondContact CB-O 3.36Å; Q786-F805 WeakPolarHBondContact O-CD2 3.39Å; Q786-F805 PolarHBondContact O-N 3.22Å; Q786-F805 PolarHBondContact OE1-O 2.71Å; Q786-H806 PolarHBondContact NE2-O 2.88Å; Q786-T807 VanDerWaalsContact NE2-CA 3.29Å; Q786-K808 HydrophobicContact CG-CG 4.21Å
787	G	85.9	Confident	73.6	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	149.6	-176.1	0	0	0	0	0	113.7	K779 I803	K779-G787 VanDerWaalsContact CB-O 3.3Å; K779-G787 WeakPolarHBondContact CB-O 3.47Å; K779-G787 PolarHBondContact N-O 3.49Å; G787-I803 CarbonylContact C-O 3.59Å; G787-I803 VanDerWaalsContact CA-O 3.25Å; G787-I803 WeakPolarHBondContact CA-O 3.45Å
788	L	91.5	Very high	72.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.6	175.5	-170.2	70.2	0	0	0	109.4	V776 E778 L790 I803 F805 L811 I818	V776-L788 HydrophobicContact CG1-CD1 3.63Å; V776-L788 HydrophobicContact CG1-CD2 4.19Å; V776-L788 HydrophobicContact CG1-CG 4.13Å; E778-L788 HydrophobicContact CG-CD1 4.07Å; L788-L790 HydrophobicContact CD2-CD2 3.89Å; L788-L790 HydrophobicContact CG-CD2 4.22Å; L788-I803 PolarHBondContact N-O 3.29Å; L788-I803 PolarHBondContact O-N 3.19Å; L788-F805 HydrophobicContact CB-CD2 4.45Å; L788-F805 HydrophobicContact CB-CE2 3.63Å; L788-F805 HydrophobicContact CD2-CE2 4.03Å; L788-F805 HydrophobicContact CD2-CZ 4.2Å; L788-F805 HydrophobicContact CG-CE2 4.48Å; L788-L811 HydrophobicContact CB-CD1 3.71Å; L788-L811 HydrophobicContact CD1-CD1 4.03Å; L788-L811 HydrophobicContact CG-CD1 4.38Å; L788-I818 HydrophobicContact CD2-CD1 4Å
789	Y	91	Very high	72.8	Confident	59 Å²	59	68.4 Å²	68.4	23%	0.231	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	124.9	170.6	-64	-67.6	0	0	0	109.9	R777 K779 M800 Y801 E802	R777-Y789 PolarHBondContact N-O 2.62Å; R777-Y789 PolarHBondContact O-N 3.5Å; K779-Y789 HydrophobicContact CB-CD2 4.1Å; K779-Y789 HydrophobicContact CB-CE2 3.59Å; K779-Y789 HydrophobicContact CD-CE2 4.17Å; K779-Y789 WeakPolarHBondContact CD-OH 2.96Å; K779-Y789 WeakPolarHBondContact CE-OH 3.49Å; K779-Y789 HydrophobicContact CG-CE2 3.62Å; Y789-M800 HydrophobicContact CD1-CG 4.19Å; Y789-M800 HydrophobicContact CD1-SD 3.94Å; Y789-M800 HydrophobicContact CE1-SD 4.35Å; Y789-M800 HydrophobicContact CG-SD 4.5Å; Y789-Y801 CarbonylContact C-O 3.59Å; Y789-Y801 VanDerWaalsContact CA-O 3.31Å; Y789-Y801 WeakPolarHBondContact CA-O 3.48Å; Y789-E802 HydrophobicContact CD1-CB 3.98Å; Y789-E802 HydrophobicContact CD1-CG 4.15Å; Y789-E802 HydrophobicContact CE1-CB 3.81Å; Y789-E802 HydrophobicContact CE1-CG 3.66Å
790	L	91.7	Very high	73	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	113.8	169.9	-56.3	176.3	0	0	0	107.5	M740 I747 F749 I769 L774 V776 L788 Y801 I803 I818	M740-L790 HydrophobicContact CE-CD1 3.62Å; I747-L790 HydrophobicContact CD1-CD1 4.15Å; F749-L790 HydrophobicContact CZ-CD1 4.32Å; I769-L790 HydrophobicContact CD1-CB 4.35Å; I769-L790 HydrophobicContact CD1-CD1 4.24Å; L774-L790 HydrophobicContact CD1-CB 4.2Å; V776-L790 HydrophobicContact CG1-CD2 4.22Å; V776-L790 HydrophobicContact CG2-CD2 4.06Å; L788-L790 HydrophobicContact CD2-CD2 3.89Å; L788-L790 HydrophobicContact CG-CD2 4.22Å; L790-Y801 PolarHBondContact N-O 2.87Å; L790-Y801 PolarHBondContact O-N 3.41Å; L790-I803 HydrophobicContact CD1-CG1 4.11Å; L790-I818 HydrophobicContact CD2-CD1 3.91Å
791	I	88	Confident	73.9	Confident	35 Å²	35	65.3 Å²	65.3	18%	0.179	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	105.5	-177.6	-54	164.9	0	0	0	107.3	I775 T793 E799 M800	I775-I791 HydrophobicContact CB-CB 4.21Å; I775-I791 PolarHBondContact N-O 2.74Å; I775-I791 PolarHBondContact O-N 3.09Å; I791-T793 HydrophobicContact CG2-CG2 4.28Å; I791-E799 CarbonylContact C-O 3.5Å; I791-E799 WeakPolarHBondContact CA-O 3.32Å; I791-M800 HydrophobicContact CD1-CE 3.88Å; I791-M800 HydrophobicContact CG1-CB 4.37Å; I791-M800 HydrophobicContact CG1-CE 3.97Å; I791-M800 HydrophobicContact CG1-CG 3.96Å
792	S	84.5	Confident	75.3	Confident	9 Å²	9	65 Å²	65	6%	0.063	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.3	171.6	-167.6	0	0	0	0	108.6	A798 E799	S792-A798 CarbonylContact O-C 3.58Å; S792-A798 VanDerWaalsContact O-CA 3.24Å; S792-A798 WeakPolarHBondContact O-CA 3.4Å; S792-E799 PolarHBondContact N-O 3.22Å; S792-E799 PolarHBondContact O-N 3.43Å; S792-E799 VanDerWaalsContact O-N 3.07Å
793	T	80.3	Confident	77.4	Confident	51 Å²	51	52.9 Å²	52.9	31%	0.313	30%	0.301	S	S	.	.			trans	-105.8	27.4	176.6	63.1	0	0	0	0	111.8	K773 I775 I791	K773-T793 WeakPolarHBondContact CB-OG1 3.46Å; K773-T793 PolarHBondContact O-OG1 2.99Å; I775-T793 HydrophobicContact CD1-CG2 3.79Å; I775-T793 HydrophobicContact CG1-CG2 4.34Å; I791-T793 HydrophobicContact CG2-CG2 4.28Å
794	A	69.3	Low	79.4	Confident	11 Å²	11	45.7 Å²	45.7	9%	0.091	27%	0.266	C	S	.	.			trans	-60.2	134.8	178.2	0	0	0	0	0	110.4	L704 C796 H797 A798	L704-A794 HydrophobicContact CD2-CB 3.97Å; A794-C796 VanDerWaalsContact C-N 3.26Å; A794-C796 PolarHBondContact O-N 3.45Å; A794-C796 VanDerWaalsContact O-N 3.14Å; A794-H797 CarbonylContact O-C 3.49Å; A794-H797 PolarHBondContact O-N 2.99Å; A794-A798 PolarHBondContact O-N 2.95Å
795	P	59.3	Low	81.1	Confident	128 Å²	128	44.6 Å²	44.6	83%	0.831	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-31	-171	-24.2	32	0	0	0	115.1
796	C	61.2	Low	82.1	Confident	94 Å²	94	48.1 Å²	48.1	64%	0.635	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-31	-179.2	-84	0	0	0	0	113.2	A794	A794-C796 VanDerWaalsContact C-N 3.26Å; A794-C796 PolarHBondContact O-N 3.45Å; A794-C796 VanDerWaalsContact O-N 3.14Å
797	H	61.9	Low	82.5	Confident	99 Å²	99	48 Å²	48	46%	0.458	27%	0.269	S	S	.	.			trans	-153.3	81.6	-172.9	-50.8	-65.8	0	0	0	111.1	A794 E799	A794-H797 CarbonylContact O-C 3.49Å; A794-H797 PolarHBondContact O-N 2.99Å; H797-E799 PolarHBondContact O-N 3.43Å
798	A	75.5	Confident	82.4	Confident	77 Å²	77	54 Å²	54	64%	0.636	30%	0.295	S	S	*	.			trans	-74.2	116.2	174.8	0	0	0	0	0	110.1	S792 A794	S792-A798 CarbonylContact O-C 3.58Å; S792-A798 VanDerWaalsContact O-CA 3.24Å; S792-A798 WeakPolarHBondContact O-CA 3.4Å; A794-A798 PolarHBondContact O-N 2.95Å
799	E	83.2	Confident	82.1	Confident	68 Å²	68	62.6 Å²	62.6	32%	0.318	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.2	-171.9	-81.8	-65.4	168.4	0	0	111.7	K765 I791 S792 H797 Y801	K765-E799 WeakPolarHBondContact CE-OE2 3.46Å; K765-E799 IonicContact NZ-OE2 3.62Å; I791-E799 CarbonylContact C-O 3.5Å; I791-E799 WeakPolarHBondContact CA-O 3.32Å; S792-E799 PolarHBondContact N-O 3.22Å; S792-E799 PolarHBondContact O-N 3.43Å; S792-E799 VanDerWaalsContact O-N 3.07Å; H797-E799 PolarHBondContact O-N 3.43Å; E799-Y801 HydrophobicContact CB-CD2 4.49Å; E799-Y801 HydrophobicContact CB-CE2 3.7Å
800	M	86	Confident	82	Confident	93 Å²	93	61 Å²	61	46%	0.458	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.3	176.6	-179.1	-176.9	-58.7	0	0	110.4	K765 Y789 I791	K765-M800 PolarHBondContact NZ-O 3.45Å; Y789-M800 HydrophobicContact CD1-CG 4.19Å; Y789-M800 HydrophobicContact CD1-SD 3.94Å; Y789-M800 HydrophobicContact CE1-SD 4.35Å; Y789-M800 HydrophobicContact CG-SD 4.5Å; I791-M800 HydrophobicContact CD1-CE 3.88Å; I791-M800 HydrophobicContact CG1-CB 4.37Å; I791-M800 HydrophobicContact CG1-CE 3.97Å; I791-M800 HydrophobicContact CG1-CG 3.96Å
801	Y	89.7	Confident	81.9	Confident	8 Å²	8	61.6 Å²	61.6	3%	0.031	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.9	178.3	-58.6	-104	0	0	0	109.4	W728 K765 E766 I769 Y789 L790 E799	W728-Y801 AromaticContact CE2-CD1 3.92Å; W728-Y801 HydrophobicContact CH2-CD1 4.28Å; W728-Y801 HydrophobicContact CH2-CE1 4.14Å; W728-Y801 AromaticContact CZ2-CD1 3.58Å; W728-Y801 HydrophobicContact CZ2-CD1 3.58Å; W728-Y801 AromaticContact CZ2-CE1 3.78Å; W728-Y801 HydrophobicContact CZ2-CE1 3.78Å; K765-Y801 HydrophobicContact CB-CE1 3.96Å; K765-Y801 HydrophobicContact CD-CD1 4.46Å; K765-Y801 HydrophobicContact CD-CE1 4.21Å; E766-Y801 PolarHBondContact O-OH 3.1Å; I769-Y801 HydrophobicContact CD1-CD1 3.89Å; I769-Y801 HydrophobicContact CD1-CD2 3.31Å; I769-Y801 HydrophobicContact CD1-CE1 4.05Å; I769-Y801 HydrophobicContact CD1-CE2 3.5Å; I769-Y801 HydrophobicContact CD1-CG 3.54Å; I769-Y801 HydrophobicContact CG1-CD2 4.04Å; I769-Y801 HydrophobicContact CG1-CE1 4.2Å; I769-Y801 HydrophobicContact CG1-CE2 3.67Å; I769-Y801 HydrophobicContact CG1-CG 4.48Å; Y789-Y801 CarbonylContact C-O 3.59Å; Y789-Y801 VanDerWaalsContact CA-O 3.31Å; Y789-Y801 WeakPolarHBondContact CA-O 3.48Å; L790-Y801 PolarHBondContact N-O 2.87Å; L790-Y801 PolarHBondContact O-N 3.41Å; E799-Y801 HydrophobicContact CB-CD2 4.49Å; E799-Y801 HydrophobicContact CB-CE2 3.7Å
802	E	90.6	Very high	81.9	Confident	41 Å²	41	62.4 Å²	62.4	19%	0.192	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.1	177.2	-179.4	-179.1	177.7	0	0	109.6	Q729 K779 Y789	Q729-E802 HydrophobicContact CB-CB 4.02Å; Q729-E802 HydrophobicContact CB-CG 3.84Å; Q729-E802 WeakPolarHBondContact CB-O 3.28Å; Q729-E802 HydrophobicContact CG-CG 4.37Å; Q729-E802 PolarHBondContact N-O 3.34Å; K779-E802 IonicContact NZ-OE1 3.68Å; K779-E802 PolarHBondContact NZ-OE1 2.97Å; Y789-E802 HydrophobicContact CD1-CB 3.98Å; Y789-E802 HydrophobicContact CD1-CG 4.15Å; Y789-E802 HydrophobicContact CE1-CB 3.81Å; Y789-E802 HydrophobicContact CE1-CG 3.66Å
803	I	92.6	Very high	82.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	128.9	-178.1	-50.7	-56.2	0	0	0	109.4	V726 W728 M740 F749 G787 L788 L790 F805	V726-I803 HydrophobicContact CB-CG2 3.69Å; V726-I803 HydrophobicContact CG1-CG2 4.21Å; V726-I803 HydrophobicContact CG2-CG2 3.68Å; W728-I803 HydrophobicContact CB-CD1 4.12Å; W728-I803 HydrophobicContact CG-CD1 4.05Å; M740-I803 HydrophobicContact SD-CG2 4.41Å; F749-I803 HydrophobicContact CE1-CD1 3.7Å; F749-I803 HydrophobicContact CE1-CG1 4.44Å; F749-I803 HydrophobicContact CZ-CD1 3.77Å; F749-I803 HydrophobicContact CZ-CG1 4.36Å; G787-I803 CarbonylContact C-O 3.59Å; G787-I803 VanDerWaalsContact CA-O 3.25Å; G787-I803 WeakPolarHBondContact CA-O 3.45Å; L788-I803 PolarHBondContact N-O 3.29Å; L788-I803 PolarHBondContact O-N 3.19Å; L790-I803 HydrophobicContact CD1-CG1 4.11Å; I803-F805 HydrophobicContact CB-CE2 4.27Å; I803-F805 HydrophobicContact CB-CZ 4.41Å; I803-F805 HydrophobicContact CG2-CE1 4.21Å; I803-F805 HydrophobicContact CG2-CE2 3.88Å; I803-F805 HydrophobicContact CG2-CZ 3.7Å
804	L	89.5	Confident	82.8	Confident	46 Å²	46	60.3 Å²	60.3	24%	0.241	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.2	178.5	-57.4	174.3	0	0	0	110	S727 Q729	S727-L804 PolarHBondContact N-O 3.02Å; S727-L804 WeakPolarHBondContact O-CA 3.2Å; S727-L804 WeakPolarHBondContact O-CB 3.4Å; S727-L804 PolarHBondContact O-N 3.27Å; Q729-L804 HydrophobicContact CB-CD1 4.09Å; Q729-L804 HydrophobicContact CB-CG 4.29Å; Q729-L804 HydrophobicContact CG-CD1 4.42Å
805	F	90	Very high	83.8	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.026	34%	0.336	C	S	.	.			trans	-111.1	141.8	179	-61.9	-85.3	0	0	0	111.6	V726 Q786 L788 I803 T807 N810 L811 W814	V726-F805 HydrophobicContact CB-CE1 4.36Å; V726-F805 HydrophobicContact CG1-CD1 3.88Å; V726-F805 HydrophobicContact CG1-CE1 3.46Å; V726-F805 VanDerWaalsContact CG1-CE1 3.46Å; V726-F805 HydrophobicContact CG1-CZ 4.34Å; Q786-F805 WeakPolarHBondContact CB-O 3.36Å; Q786-F805 WeakPolarHBondContact O-CD2 3.39Å; Q786-F805 PolarHBondContact O-N 3.22Å; Q786-F805 PolarHBondContact OE1-O 2.71Å; L788-F805 HydrophobicContact CB-CD2 4.45Å; L788-F805 HydrophobicContact CB-CE2 3.63Å; L788-F805 HydrophobicContact CD2-CE2 4.03Å; L788-F805 HydrophobicContact CD2-CZ 4.2Å; L788-F805 HydrophobicContact CG-CE2 4.48Å; I803-F805 HydrophobicContact CB-CE2 4.27Å; I803-F805 HydrophobicContact CB-CZ 4.41Å; I803-F805 HydrophobicContact CG2-CE1 4.21Å; I803-F805 HydrophobicContact CG2-CE2 3.88Å; I803-F805 HydrophobicContact CG2-CZ 3.7Å; F805-T807 VanDerWaalsContact C-N 3.25Å; F805-T807 PolarHBondContact O-N 3.26Å; F805-N810 HydrophobicContact CB-CB 4.48Å; F805-N810 HydrophobicContact CD1-CB 4.27Å; F805-L811 HydrophobicContact CB-CB 4.34Å; F805-L811 HydrophobicContact CD2-CB 4Å; F805-L811 HydrophobicContact CD2-CD1 3.57Å; F805-L811 HydrophobicContact CD2-CG 4.41Å; F805-L811 HydrophobicContact CE2-CD1 3.74Å; F805-L811 HydrophobicContact CG-CB 4.28Å; F805-W814 AromaticContact CD1-CD1 3.78Å; F805-W814 HydrophobicContact CD1-CG 4.46Å; F805-W814 HydrophobicContact CE1-CB 3.96Å; F805-W814 AromaticContact CE1-CD1 3.13Å; F805-W814 HydrophobicContact CE1-CD2 4.17Å; F805-W814 AromaticContact CE1-CG 3.49Å; F805-W814 HydrophobicContact CE1-CG 3.49Å; F805-W814 VanDerWaalsContact CE1-CG 3.49Å; F805-W814 AromaticContact CE1-NE1 3.6Å; F805-W814 HydrophobicContact CZ-CB 3.78Å; F805-W814 AromaticContact CZ-CD1 3.88Å; F805-W814 HydrophobicContact CZ-CD2 4.44Å; F805-W814 AromaticContact CZ-CG 3.76Å; F805-W814 HydrophobicContact CZ-CG 3.76Å
806	H	85	Confident	85.3	Confident	112 Å²	112	59.9 Å²	59.9	52%	0.519	32%	0.319	S	S	.	.	S	Bend	trans	-64.5	-26.4	175.9	-59.1	92.1	0	0	0	113.9	Q786	Q786-H806 PolarHBondContact NE2-O 2.88Å
807	T	85.7	Confident	86.8	Confident	71 Å²	71	59.5 Å²	59.5	44%	0.436	30%	0.304	S	S	.	.			trans	-137.3	145.1	-176.9	69.3	0	0	0	0	111.4	Q786 F805 K809 N810 L811	Q786-T807 VanDerWaalsContact NE2-CA 3.29Å; F805-T807 VanDerWaalsContact C-N 3.25Å; F805-T807 PolarHBondContact O-N 3.26Å; T807-K809 PolarHBondContact O-N 3.44Å; T807-N810 PolarHBondContact O-N 3.31Å; T807-N810 VanDerWaalsContact O-N 3.14Å; T807-N810 WeakPolarHBondContact OG1-CB 3.15Å; T807-N810 PolarHBondContact OG1-N 2.99Å; T807-N810 VanDerWaalsContact OG1-N 3.17Å; T807-L811 PolarHBondContact O-N 3.5Å; T807-L811 VanDerWaalsContact O-N 3.12Å
808	K	84.4	Confident	88.3	Confident	125 Å²	125	54.8 Å²	54.8	54%	0.543	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-30.4	174.4	-66.9	-174.5	-179.8	-177.7	0	112.6	Q786 N810 L811 A812	Q786-K808 HydrophobicContact CG-CG 4.21Å; K808-N810 VanDerWaalsContact C-N 3.34Å; K808-L811 PolarHBondContact O-N 3.16Å; K808-A812 PolarHBondContact O-N 3.39Å
809	K	85.6	Confident	89	Confident	181 Å²	181	54.7 Å²	54.7	79%	0.787	27%	0.269	S	S	*	.	H	α-helix	trans	-63.1	-41.4	174.3	-173.7	-178.8	178.4	-177	0	111.1	T807 A813	T807-K809 PolarHBondContact O-N 3.44Å; K809-A813 VanDerWaalsContact O-CB 3.26Å; K809-A813 WeakPolarHBondContact O-CB 3.4Å; K809-A813 PolarHBondContact O-N 2.76Å
810	N	87.4	Confident	89.3	Confident	27 Å²	27	57.7 Å²	57.7	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-69.1	-42	177.8	-154.2	20.1	0	0	0	111	S724 F805 T807 K808 A812 A813 W814	S724-N810 PolarHBondContact OG-ND2 3.49Å; F805-N810 HydrophobicContact CB-CB 4.48Å; F805-N810 HydrophobicContact CD1-CB 4.27Å; T807-N810 PolarHBondContact O-N 3.31Å; T807-N810 VanDerWaalsContact O-N 3.14Å; T807-N810 WeakPolarHBondContact OG1-CB 3.15Å; T807-N810 PolarHBondContact OG1-N 2.99Å; T807-N810 VanDerWaalsContact OG1-N 3.17Å; K808-N810 VanDerWaalsContact C-N 3.34Å; N810-A812 PolarHBondContact O-N 3.43Å; N810-A813 PolarHBondContact O-N 2.97Å; N810-W814 WeakPolarHBondContact O-CB 3.4Å; N810-W814 VanDerWaalsContact O-CD1 3.25Å; N810-W814 PolarHBondContact O-N 3.49Å; N810-W814 PolarHBondContact OD1-NE1 3.34Å
811	L	89.3	Confident	89.5	Confident	11 Å²	11	53.3 Å²	53.3	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-52.5	-56.7	172	175.3	69.9	0	0	0	111	L788 F805 T807 K808 A813 W814 T815	L788-L811 HydrophobicContact CB-CD1 3.71Å; L788-L811 HydrophobicContact CD1-CD1 4.03Å; L788-L811 HydrophobicContact CG-CD1 4.38Å; F805-L811 HydrophobicContact CB-CB 4.34Å; F805-L811 HydrophobicContact CD2-CB 4Å; F805-L811 HydrophobicContact CD2-CD1 3.57Å; F805-L811 HydrophobicContact CD2-CG 4.41Å; F805-L811 HydrophobicContact CE2-CD1 3.74Å; F805-L811 HydrophobicContact CG-CB 4.28Å; T807-L811 PolarHBondContact O-N 3.5Å; T807-L811 VanDerWaalsContact O-N 3.12Å; K808-L811 PolarHBondContact O-N 3.16Å; L811-A813 VanDerWaalsContact C-N 3.32Å; L811-A813 PolarHBondContact O-N 3.36Å; L811-W814 PolarHBondContact O-N 3.02Å; L811-T815 PolarHBondContact O-N 3Å; L811-T815 PolarHBondContact O-OG1 3.42Å
812	A	88.7	Confident	89.5	Confident	52 Å²	52	53.4 Å²	53.4	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-59	-42.2	-179.7	0	0	0	0	0	112.5	K808 N810 W814 T815 E816	K808-A812 PolarHBondContact O-N 3.39Å; N810-A812 PolarHBondContact O-N 3.43Å; A812-W814 VanDerWaalsContact C-N 3.35Å; A812-W814 PolarHBondContact O-N 3.43Å; A812-T815 PolarHBondContact O-N 3.5Å; A812-E816 WeakPolarHBondContact O-CB 3.45Å; A812-E816 PolarHBondContact O-N 2.94Å
813	A	90.2	Very high	89.2	Confident	17 Å²	17	55.7 Å²	55.7	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-37.5	178.4	0	0	0	0	0	113	K809 N810 L811 R817	K809-A813 VanDerWaalsContact O-CB 3.26Å; K809-A813 WeakPolarHBondContact O-CB 3.4Å; K809-A813 PolarHBondContact O-N 2.76Å; N810-A813 PolarHBondContact O-N 2.97Å; L811-A813 VanDerWaalsContact C-N 3.32Å; L811-A813 PolarHBondContact O-N 3.36Å; A813-R817 WeakPolarHBondContact O-CB 3.38Å; A813-R817 WeakPolarHBondContact O-CD 3.36Å; A813-R817 WeakPolarHBondContact O-CG 3.49Å; A813-R817 PolarHBondContact O-N 3.13Å; A813-R817 PolarHBondContact O-NH1 3.42Å; A813-R817 VanDerWaalsContact O-NH1 3.12Å
814	W	93.1	Very high	88.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-45.5	175.2	-87.7	102.2	0	0	0	111.7	Y722 M740 L742 F805 N810 L811 A812 E816 R817 I818	Y722-W814 AromaticContact CD1-CD2 3.74Å; Y722-W814 HydrophobicContact CD1-CD2 3.74Å; Y722-W814 AromaticContact CD1-CE2 3.42Å; Y722-W814 VanDerWaalsContact CD1-CE2 3.42Å; Y722-W814 AromaticContact CD1-CE3 3.99Å; Y722-W814 HydrophobicContact CD1-CE3 3.99Å; Y722-W814 HydrophobicContact CD1-CG 4.44Å; Y722-W814 AromaticContact CD1-CH2 3.69Å; Y722-W814 HydrophobicContact CD1-CH2 3.69Å; Y722-W814 AromaticContact CD1-CZ2 3.38Å; Y722-W814 HydrophobicContact CD1-CZ2 3.38Å; Y722-W814 HydrophobicContact CD1-CZ3 4Å; Y722-W814 AromaticContact CD1-NE1 3.96Å; Y722-W814 AromaticContact CE1-CD1 3.87Å; Y722-W814 AromaticContact CE1-CD2 3.88Å; Y722-W814 HydrophobicContact CE1-CD2 3.88Å; Y722-W814 AromaticContact CE1-CE2 3.4Å; Y722-W814 VanDerWaalsContact CE1-CE2 3.4Å; Y722-W814 HydrophobicContact CE1-CG 4.18Å; Y722-W814 HydrophobicContact CE1-CH2 4.46Å; Y722-W814 AromaticContact CE1-CZ2 3.73Å; Y722-W814 HydrophobicContact CE1-CZ2 3.73Å; Y722-W814 AromaticContact CE1-NE1 3.41Å; Y722-W814 HydrophobicContact CG-CH2 4.46Å; Y722-W814 HydrophobicContact CG-CZ2 4.39Å; M740-W814 HydrophobicContact CB-CH2 4.05Å; M740-W814 HydrophobicContact CB-CZ2 4.24Å; M740-W814 HydrophobicContact CE-CE3 3.92Å; M740-W814 HydrophobicContact CE-CH2 4.44Å; M740-W814 HydrophobicContact CE-CZ3 3.72Å; M740-W814 HydrophobicContact CG-CH2 3.63Å; M740-W814 HydrophobicContact CG-CZ2 4.21Å; M740-W814 HydrophobicContact CG-CZ3 3.86Å; M740-W814 WeakPolarHBondContact O-CH2 2.94Å; M740-W814 HydrophobicContact SD-CD2 4.28Å; M740-W814 HydrophobicContact SD-CE3 3.95Å; M740-W814 HydrophobicContact SD-CH2 3.92Å; M740-W814 HydrophobicContact SD-CZ2 4.25Å; M740-W814 HydrophobicContact SD-CZ3 3.72Å; L742-W814 HydrophobicContact CB-CH2 4.32Å; L742-W814 HydrophobicContact CB-CZ3 3.86Å; F805-W814 AromaticContact CD1-CD1 3.78Å; F805-W814 HydrophobicContact CD1-CG 4.46Å; F805-W814 HydrophobicContact CE1-CB 3.96Å; F805-W814 AromaticContact CE1-CD1 3.13Å; F805-W814 HydrophobicContact CE1-CD2 4.17Å; F805-W814 AromaticContact CE1-CG 3.49Å; F805-W814 HydrophobicContact CE1-CG 3.49Å; F805-W814 VanDerWaalsContact CE1-CG 3.49Å; F805-W814 AromaticContact CE1-NE1 3.6Å; F805-W814 HydrophobicContact CZ-CB 3.78Å; F805-W814 AromaticContact CZ-CD1 3.88Å; F805-W814 HydrophobicContact CZ-CD2 4.44Å; F805-W814 AromaticContact CZ-CG 3.76Å; F805-W814 HydrophobicContact CZ-CG 3.76Å; N810-W814 WeakPolarHBondContact O-CB 3.4Å; N810-W814 VanDerWaalsContact O-CD1 3.25Å; N810-W814 PolarHBondContact O-N 3.49Å; N810-W814 PolarHBondContact OD1-NE1 3.34Å; L811-W814 PolarHBondContact O-N 3.02Å; A812-W814 VanDerWaalsContact C-N 3.35Å; A812-W814 PolarHBondContact O-N 3.43Å; W814-E816 VanDerWaalsContact C-N 3.32Å; W814-E816 PolarHBondContact O-N 3.37Å; W814-R817 PolarHBondContact O-N 3.44Å; W814-I818 HydrophobicContact CE3-CD1 3.9Å; W814-I818 HydrophobicContact CE3-CG1 3.99Å; W814-I818 WeakPolarHBondContact O-CB 3.39Å; W814-I818 VanDerWaalsContact O-CG1 3.24Å; W814-I818 WeakPolarHBondContact O-CG1 3.24Å; W814-I818 PolarHBondContact O-N 3.01Å
815	T	90.7	Very high	88.3	Confident	28 Å²	28	61.9 Å²	61.9	17%	0.172	30%	0.304	C	S	.	.	H	α-helix	trans	-54.3	-50.2	175.3	-54	0	0	0	0	110.5	V776 E778 L811 A812 R817 Q819	V776-T815 HydrophobicContact CG1-CG2 4.24Å; E778-T815 HydrophobicContact CG-CG2 4.43Å; E778-T815 PolarHBondContact OE1-OG1 3.21Å; E778-T815 VanDerWaalsContact OE1-OG1 3.12Å; L811-T815 PolarHBondContact O-N 3Å; L811-T815 PolarHBondContact O-OG1 3.42Å; A812-T815 PolarHBondContact O-N 3.5Å; T815-R817 PolarHBondContact O-N 2.95Å; T815-Q819 VanDerWaalsContact O-CB 3.29Å; T815-Q819 WeakPolarHBondContact O-CB 3.38Å; T815-Q819 PolarHBondContact O-N 2.95Å
816	E	91.7	Very high	87.1	Confident	102 Å²	102	64.9 Å²	64.9	48%	0.477	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-43.9	179.3	-172.9	-162.3	155.3	0	0	112.6	A812 W814 R820	A812-E816 WeakPolarHBondContact O-CB 3.45Å; A812-E816 PolarHBondContact O-N 2.94Å; W814-E816 VanDerWaalsContact C-N 3.32Å; W814-E816 PolarHBondContact O-N 3.37Å; E816-R820 WeakPolarHBondContact O-CB 3.3Å; E816-R820 PolarHBondContact O-N 3.37Å; E816-R820 IonicContact OE1-CZ 3.7Å; E816-R820 IonicContact OE1-NH1 2.68Å; E816-R820 IonicContact OE1-NH2 3.87Å; E816-R820 PolarHBondContact OE1-NH2 3Å
817	R	91.5	Very high	85.1	Confident	85 Å²	85	62.5 Å²	62.5	32%	0.321	33%	0.325	S	S	.	.	H	α-helix	trans	-71	-43.2	-178	-78	168.7	176.2	64.4	6	112.8	L742 A813 W814 T815 Q819 R820 A821	L742-R817 HydrophobicContact CD2-CB 4.01Å; A813-R817 WeakPolarHBondContact O-CB 3.38Å; A813-R817 WeakPolarHBondContact O-CD 3.36Å; A813-R817 WeakPolarHBondContact O-CG 3.49Å; A813-R817 PolarHBondContact O-N 3.13Å; A813-R817 PolarHBondContact O-NH1 3.42Å; A813-R817 VanDerWaalsContact O-NH1 3.12Å; W814-R817 PolarHBondContact O-N 3.44Å; T815-R817 PolarHBondContact O-N 2.95Å; R817-Q819 VanDerWaalsContact C-N 3.35Å; R817-R820 PolarHBondContact O-N 3.01Å; R817-A821 WeakPolarHBondContact O-CB 3.49Å; R817-A821 PolarHBondContact O-N 2.82Å
818	I	93.1	Very high	82.9	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-65.3	-44.1	177.2	-62.1	167.9	0	0	0	109.1	M740 L742 I747 L774 V776 L788 L790 W814 R820 A821 V822	M740-I818 HydrophobicContact CE-CD1 3.8Å; L742-I818 HydrophobicContact CD1-CG1 4.36Å; L742-I818 HydrophobicContact CD2-CG1 4.28Å; I747-I818 HydrophobicContact CD1-CD1 4.27Å; I747-I818 HydrophobicContact CD1-CG1 4.34Å; I747-I818 HydrophobicContact CD1-CG2 4.17Å; L774-I818 HydrophobicContact CD2-CG2 3.78Å; V776-I818 HydrophobicContact CG2-CB 4.29Å; V776-I818 HydrophobicContact CG2-CG2 3.51Å; L788-I818 HydrophobicContact CD2-CD1 4Å; L790-I818 HydrophobicContact CD2-CD1 3.91Å; W814-I818 HydrophobicContact CE3-CD1 3.9Å; W814-I818 HydrophobicContact CE3-CG1 3.99Å; W814-I818 WeakPolarHBondContact O-CB 3.39Å; W814-I818 VanDerWaalsContact O-CG1 3.24Å; W814-I818 WeakPolarHBondContact O-CG1 3.24Å; W814-I818 PolarHBondContact O-N 3.01Å; I818-R820 VanDerWaalsContact C-N 3.34Å; I818-R820 PolarHBondContact O-N 3.43Å; I818-A821 PolarHBondContact O-N 3.45Å; I818-A821 VanDerWaalsContact O-N 3.15Å; I818-V822 HydrophobicContact CG2-CG2 4.12Å; I818-V822 WeakPolarHBondContact O-CB 3.38Å; I818-V822 VanDerWaalsContact O-CG2 3.28Å; I818-V822 WeakPolarHBondContact O-CG2 3.46Å; I818-V822 PolarHBondContact O-N 2.99Å
819	Q	90.6	Very high	80.5	Confident	76 Å²	76	62.2 Å²	62.2	36%	0.355	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-46.8	177.6	-169	60.8	51	0	0	111	T815 R817 A821 V822 D823	T815-Q819 VanDerWaalsContact O-CB 3.29Å; T815-Q819 WeakPolarHBondContact O-CB 3.38Å; T815-Q819 PolarHBondContact O-N 2.95Å; R817-Q819 VanDerWaalsContact C-N 3.35Å; Q819-A821 VanDerWaalsContact C-N 3.31Å; Q819-A821 PolarHBondContact O-N 2.8Å; Q819-V822 PolarHBondContact O-N 2.99Å; Q819-D823 PolarHBondContact NE2-OD1 3.32Å; Q819-D823 WeakPolarHBondContact O-CB 3.5Å; Q819-D823 PolarHBondContact O-N 3.44Å
820	R	90.4	Very high	77.7	Confident	130 Å²	130	64.8 Å²	64.8	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-57.4	-43	174.8	-173.3	-174	-65.3	105.7	0.1	112.4	E816 R817 I818 D823 S824	E816-R820 WeakPolarHBondContact O-CB 3.3Å; E816-R820 PolarHBondContact O-N 3.37Å; E816-R820 IonicContact OE1-CZ 3.7Å; E816-R820 IonicContact OE1-NH1 2.68Å; E816-R820 IonicContact OE1-NH2 3.87Å; E816-R820 PolarHBondContact OE1-NH2 3Å; R817-R820 PolarHBondContact O-N 3.01Å; I818-R820 VanDerWaalsContact C-N 3.34Å; I818-R820 PolarHBondContact O-N 3.43Å; R820-D823 PolarHBondContact O-N 2.91Å; R820-S824 WeakPolarHBondContact O-CB 3.44Å; R820-S824 PolarHBondContact O-N 3.24Å; R820-S824 PolarHBondContact O-OG 3.45Å; R820-S824 VanDerWaalsContact O-OG 3.13Å
821	A	90.3	Very high	75	Confident	2 Å²	2	72 Å²	72	2%	0.017	38%	0.379	C	S	.	.	H	α-helix	trans	-65.9	-43.4	178.5	0	0	0	0	0	111.9	L721 L742 L771 R817 I818 Q819 D823 S824 Y825	L721-A821 HydrophobicContact CD1-CB 3.92Å; L742-A821 HydrophobicContact CD1-CB 4.09Å; L742-A821 HydrophobicContact CD2-CB 4.16Å; L742-A821 HydrophobicContact CG-CB 4.4Å; L771-A821 HydrophobicContact CD1-CB 3.82Å; R817-A821 WeakPolarHBondContact O-CB 3.49Å; R817-A821 PolarHBondContact O-N 2.82Å; I818-A821 PolarHBondContact O-N 3.45Å; I818-A821 VanDerWaalsContact O-N 3.15Å; Q819-A821 VanDerWaalsContact C-N 3.31Å; Q819-A821 PolarHBondContact O-N 2.8Å; A821-D823 VanDerWaalsContact C-N 3.34Å; A821-D823 PolarHBondContact O-N 3.03Å; A821-S824 WeakPolarHBondContact CA-OG 3.46Å; A821-S824 PolarHBondContact O-N 2.94Å; A821-S824 PolarHBondContact O-OG 3.24Å; A821-Y825 VanDerWaalsContact O-CB 3.29Å; A821-Y825 WeakPolarHBondContact O-CB 3.45Å; A821-Y825 PolarHBondContact O-N 3.08Å
822	V	88.3	Confident	72.2	Confident	10 Å²	10	76.1 Å²	76.1	6%	0.061	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-41.6	175.2	172.5	0	0	0	0	111	L771 L774 I818 Q819 Y825 S826	L771-V822 HydrophobicContact CB-CG2 4.31Å; L771-V822 HydrophobicContact CD2-CG2 4.05Å; L774-V822 HydrophobicContact CB-CG2 4.04Å; L774-V822 HydrophobicContact CD2-CG2 4.15Å; I818-V822 HydrophobicContact CG2-CG2 4.12Å; I818-V822 WeakPolarHBondContact O-CB 3.38Å; I818-V822 VanDerWaalsContact O-CG2 3.28Å; I818-V822 WeakPolarHBondContact O-CG2 3.46Å; I818-V822 PolarHBondContact O-N 2.99Å; Q819-V822 PolarHBondContact O-N 2.99Å; V822-Y825 PolarHBondContact O-N 3.42Å; V822-S826 WeakPolarHBondContact O-CB 3.49Å; V822-S826 PolarHBondContact O-N 3.16Å; V822-S826 PolarHBondContact O-OG 2.85Å
823	D	86.1	Confident	69.3	Low	89 Å²	89	78.6 Å²	78.6	48%	0.476	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-43.2	177.6	-64.3	-19	0	0	0	110.8	Q819 R820 A821 Y825 S826 A827	Q819-D823 PolarHBondContact NE2-OD1 3.32Å; Q819-D823 WeakPolarHBondContact O-CB 3.5Å; Q819-D823 PolarHBondContact O-N 3.44Å; R820-D823 PolarHBondContact O-N 2.91Å; A821-D823 VanDerWaalsContact C-N 3.34Å; A821-D823 PolarHBondContact O-N 3.03Å; D823-Y825 VanDerWaalsContact C-N 3.31Å; D823-Y825 PolarHBondContact O-N 3.06Å; D823-S826 PolarHBondContact O-N 3.1Å; D823-A827 PolarHBondContact O-N 3.23Å
824	S	82.3	Confident	66.3	Low	77 Å²	77	87.1 Å²	87.1	54%	0.538	46%	0.457	S	S	.	.	H	α-helix	trans	-65.6	-33.5	175.8	60.3	0	0	0	0	113	R820 A821	R820-S824 WeakPolarHBondContact O-CB 3.44Å; R820-S824 PolarHBondContact O-N 3.24Å; R820-S824 PolarHBondContact O-OG 3.45Å; R820-S824 VanDerWaalsContact O-OG 3.13Å; A821-S824 WeakPolarHBondContact CA-OG 3.46Å; A821-S824 PolarHBondContact O-N 2.94Å; A821-S824 PolarHBondContact O-OG 3.24Å
825	Y	79.4	Confident	63.4	Low	98 Å²	98	95.3 Å²	95.3	38%	0.384	50%	0.499	S	S	.	.	H	α-helix	trans	-77.6	-30.7	176.3	-173.4	-96.6	0	0	0	112.3	D745 L771 Q772 A821 V822 D823	D745-Y825 HydrophobicContact CB-CD2 4.26Å; D745-Y825 HydrophobicContact CB-CE2 3.9Å; L771-Y825 HydrophobicContact CB-CD1 4.42Å; L771-Y825 HydrophobicContact CB-CG 4.44Å; Q772-Y825 HydrophobicContact CB-CD1 4.46Å; Q772-Y825 HydrophobicContact CB-CE1 3.69Å; Q772-Y825 HydrophobicContact CG-CE1 4.03Å; A821-Y825 VanDerWaalsContact O-CB 3.29Å; A821-Y825 WeakPolarHBondContact O-CB 3.45Å; A821-Y825 PolarHBondContact O-N 3.08Å; V822-Y825 PolarHBondContact O-N 3.42Å; D823-Y825 VanDerWaalsContact C-N 3.31Å; D823-Y825 PolarHBondContact O-N 3.06Å
826	S	65	Low	60.4	Low	69 Å²	69	97.4 Å²	97.4	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-87.9	-11.5	179.4	-55.7	0	0	0	0	113.4	V822 D823	V822-S826 WeakPolarHBondContact O-CB 3.49Å; V822-S826 PolarHBondContact O-N 3.16Å; V822-S826 PolarHBondContact O-OG 2.85Å; D823-S826 PolarHBondContact O-N 3.1Å
827	A	43.2	Very low	57.8	Low	63 Å²	63	97.6 Å²	97.6	52%	0.521	54%	0.538	S	S	.	.	S	Bend	trans	-51.2	134.9	172.1	0	0	0	0	0	109.7	D823 G829	D823-A827 PolarHBondContact O-N 3.23Å; A827-G829 PolarHBondContact O-N 3.37Å
828	P	40.5	Very low	55.2	Low	124 Å²	124	102.1 Å²	102.1	81%	0.805	56%	0.563	S	S	*	*	S	Bend		-71.7	91.5	-127.1	26.4	-35.9	0	0	0	114.6	R830	P828-R830 VanDerWaalsContact C-N 3.32Å; P828-R830 PolarHBondContact O-N 3.42Å
829	G	32.9	Very low	52.7	Low	65 Å²	65	108.7 Å²	108.7	67%	0.67	60%	0.598	S	S	*	*			trans	-80.4	78.1	144.6	0	0	0	0	0	109.9	A827 R831	A827-G829 PolarHBondContact O-N 3.37Å; G829-R831 PolarHBondContact O-N 2.91Å
830	R	27.9	Very low	50.3	Low	236 Å²	236	110.1 Å²	110.1	89%	0.891	61%	0.607	S	S	*	*			trans	-70.8	60.9	161.2	-154.1	-167.4	-135.3	-114.2	8.5	108.7	P828	P828-R830 VanDerWaalsContact C-N 3.32Å; P828-R830 PolarHBondContact O-N 3.42Å
831	R	30.3	Very low	48.3	Very low	177 Å²	177	105.5 Å²	105.5	67%	0.668	60%	0.595	S	S	*	*			trans	-120.8	58.1	166.4	-71.1	-172.8	179.6	-179	0.8	106.9	G829 S833	G829-R831 PolarHBondContact O-N 2.91Å; R831-S833 PolarHBondContact O-N 3.44Å
832	S	29.4	Very low	46.4	Very low	98 Å²	98	111.1 Å²	111.1	69%	0.685	63%	0.625	S	S	*	*			trans	-63.2	106.6	161.1	52.3	0	0	0	0	107.2
833	S	27.8	Very low	44.7	Very low	105 Å²	105	117 Å²	117	73%	0.734	65%	0.651	S	S	*	*	S	Bend	trans	-3.5	124.8	158.3	59.3	0	0	0	0	116.2	R831	R831-S833 PolarHBondContact O-N 3.44Å
834	K	28.7	Very low	43	Very low	195 Å²	195	116.3 Å²	116.3	85%	0.848	65%	0.648	S	S	*	*	S	Bend	trans	102.7	113.9	162.7	-61	179.2	176.3	179.6	0	114.9
835	I	31.6	Very low	41.7	Very low	173 Å²	173	118.1 Å²	118.1	89%	0.887	65%	0.648	S	S	*	*	S	Bend	trans	84.3	69.3	169.3	-39.6	167.6	0	0	0	115
836	A	28.1	Very low	41.1	Very low	71 Å²	71	119.8 Å²	119.8	59%	0.587	66%	0.659	S	S	*	*			trans	-177.2	57.4	145.7	0	0	0	0	0	108.7	E838	A836-E838 PolarHBondContact O-N 2.85Å
837	A	36.7	Very low	40.9	Very low	107 Å²	107	121.6 Å²	121.6	88%	0.884	66%	0.66	S	S	*	*	S	Bend	trans	-75	4.5	167.9	0	0	0	0	0	112.3
838	E	36.8	Very low	41.8	Very low	179 Å²	179	122.6 Å²	122.6	84%	0.836	66%	0.656	S	S	*	*	S	Bend	trans	-120.1	-11.3	-177.6	-77.4	-175.3	158.6	0	0	116.3	A836	A836-E838 PolarHBondContact O-N 2.85Å
839	N	40	Very low	43.2	Very low	139 Å²	139	123.5 Å²	123.5	74%	0.743	65%	0.647	S	S	*	*			trans	-127.3	49.6	178.3	-67.4	-19.5	0	0	0	112.1	S841	N839-S841 PolarHBondContact O-N 2.79Å
840	I	40.3	Very low	45.4	Very low	105 Å²	105	126.3 Å²	126.3	54%	0.538	64%	0.641	S	S	.	*	S	Bend	trans	-71.2	76.1	156.2	-63.4	175.7	0	0	0	106.4
841	S	49	Very low	47.3	Very low	34 Å²	34	120.2 Å²	120.2	24%	0.238	63%	0.626	C	S	.	*			trans	45.1	87	146.7	-173.9	0	0	0	0	113.1	N839 E843 N844 Q845	N839-S841 PolarHBondContact O-N 2.79Å; S841-E843 PolarHBondContact O-N 3.21Å; S841-E843 WeakPolarHBondContact OG-CB 3.49Å; S841-N844 PolarHBondContact O-N 3.32Å; S841-N844 PolarHBondContact OG-N 3.29Å; S841-Q845 PolarHBondContact O-N 3.24Å
842	D	49.6	Very low	49.3	Very low	120 Å²	120	116 Å²	116	64%	0.642	61%	0.612	S	S	*	*	H	α-helix	trans	-42.6	-33.3	160.3	-69	-36.8	0	0	0	110.7	N844 Q845 E846	D842-N844 PolarHBondContact O-N 3.17Å; D842-Q845 CarbonylContact O-C 3.53Å; D842-Q845 PolarHBondContact O-N 2.91Å; D842-E846 WeakPolarHBondContact O-CB 3.24Å; D842-E846 PolarHBondContact O-N 3.47Å
843	E	52.4	Low	51.4	Low	133 Å²	133	112.8 Å²	112.8	62%	0.621	60%	0.595	S	S	*	*	H	α-helix	trans	-59.1	-41.7	173.8	-158.7	179.5	-171.7	0	0	114.1	S841 E846 Q847	S841-E843 PolarHBondContact O-N 3.21Å; S841-E843 WeakPolarHBondContact OG-CB 3.49Å; E843-E846 PolarHBondContact O-N 3.22Å; E843-Q847 WeakPolarHBondContact O-CB 3.33Å; E843-Q847 VanDerWaalsContact O-CG 3.29Å; E843-Q847 WeakPolarHBondContact O-CG 3.22Å; E843-Q847 PolarHBondContact O-N 3.3Å
844	N	50.1	Low	53.7	Low	74 Å²	74	113.3 Å²	113.3	40%	0.396	58%	0.584	S	S	.	*	H	α-helix	trans	-70.5	-36.6	174.6	-74.3	-21.3	0	0	0	111.8	S841 D842 E846 L848	S841-N844 PolarHBondContact O-N 3.32Å; S841-N844 PolarHBondContact OG-N 3.29Å; D842-N844 PolarHBondContact O-N 3.17Å; N844-E846 VanDerWaalsContact C-N 3.29Å; N844-L848 WeakPolarHBondContact O-CB 3.25Å; N844-L848 PolarHBondContact O-N 3.26Å
845	Q	55.8	Low	55.2	Low	115 Å²	115	106.3 Å²	106.3	54%	0.537	56%	0.562	S	S	.	*	H	α-helix	trans	-68.6	-34.8	176.2	-159.2	177.4	12.4	0	0	110.7	S841 D842 K849	S841-Q845 PolarHBondContact O-N 3.24Å; D842-Q845 CarbonylContact O-C 3.53Å; D842-Q845 PolarHBondContact O-N 2.91Å; Q845-K849 WeakPolarHBondContact O-CB 3.33Å; Q845-K849 VanDerWaalsContact O-CG 3.29Å; Q845-K849 WeakPolarHBondContact O-CG 3.28Å; Q845-K849 PolarHBondContact O-N 2.82Å
846	E	66.6	Low	56.9	Low	134 Å²	134	100.8 Å²	100.8	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-74.2	-38.5	176.2	-165.9	142.8	-145.5	0	0	111.9	D842 E843 N844 K849 F850	D842-E846 WeakPolarHBondContact O-CB 3.24Å; D842-E846 PolarHBondContact O-N 3.47Å; E843-E846 PolarHBondContact O-N 3.22Å; N844-E846 VanDerWaalsContact C-N 3.29Å; E846-K849 PolarHBondContact O-N 3.44Å; E846-F850 WeakPolarHBondContact O-CB 3.2Å; E846-F850 PolarHBondContact O-N 3.41Å
847	Q	60.5	Low	59	Low	107 Å²	107	102.9 Å²	102.9	50%	0.5	54%	0.54	S	S	.	.	H	α-helix	trans	-62.6	-41.9	169.8	-79	-178.8	0.2	0	0	112.1	E843 F850 L851	E843-Q847 WeakPolarHBondContact O-CB 3.33Å; E843-Q847 VanDerWaalsContact O-CG 3.29Å; E843-Q847 WeakPolarHBondContact O-CG 3.22Å; E843-Q847 PolarHBondContact O-N 3.3Å; Q847-F850 PolarHBondContact O-N 3.06Å; Q847-L851 WeakPolarHBondContact O-CG 3.45Å; Q847-L851 PolarHBondContact O-N 2.79Å
848	L	63.3	Low	60.4	Low	84 Å²	84	100 Å²	100	44%	0.44	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-45.5	173.6	-93.7	155.9	0	0	0	111.3	N844 F850 L851 F852	N844-L848 WeakPolarHBondContact O-CB 3.25Å; N844-L848 PolarHBondContact O-N 3.26Å; L848-F850 VanDerWaalsContact C-N 3.29Å; L848-F850 PolarHBondContact O-N 3.29Å; L848-L851 PolarHBondContact O-N 2.93Å; L848-F852 HydrophobicContact CD2-CD2 4.32Å; L848-F852 HydrophobicContact CD2-CE2 3.75Å; L848-F852 WeakPolarHBondContact O-CB 3.42Å; L848-F852 WeakPolarHBondContact O-CD2 3.37Å; L848-F852 PolarHBondContact O-N 3.44Å
849	K	69.2	Low	61.7	Low	142 Å²	142	94.8 Å²	94.8	62%	0.617	49%	0.494	S	S	*	.	H	α-helix	trans	-58.3	-41.1	174	-77.4	175.4	-179.2	178.7	0	111.8	Q845 E846 G853	Q845-K849 WeakPolarHBondContact O-CB 3.33Å; Q845-K849 VanDerWaalsContact O-CG 3.29Å; Q845-K849 WeakPolarHBondContact O-CG 3.28Å; Q845-K849 PolarHBondContact O-N 2.82Å; E846-K849 PolarHBondContact O-N 3.44Å; K849-G853 PolarHBondContact O-N 3.26Å
850	F	79.6	Confident	63.3	Low	124 Å²	124	94 Å²	94	54%	0.544	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-44.2	176.8	178.5	-100.7	0	0	0	112.5	E846 Q847 L848 G853 K854	E846-F850 WeakPolarHBondContact O-CB 3.2Å; E846-F850 PolarHBondContact O-N 3.41Å; Q847-F850 PolarHBondContact O-N 3.06Å; L848-F850 VanDerWaalsContact C-N 3.29Å; L848-F850 PolarHBondContact O-N 3.29Å; F850-G853 PolarHBondContact O-N 3.46Å; F850-K854 HydrophobicContact CE1-CD 3.97Å; F850-K854 HydrophobicContact CZ-CD 4.21Å; F850-K854 VanDerWaalsContact CZ-CE 3.48Å; F850-K854 PolarHBondContact O-N 2.89Å
851	L	67.9	Low	64.8	Low	108 Å²	108	95.3 Å²	95.3	57%	0.565	49%	0.49	S	S	*	.	H	α-helix	trans	-67.8	-40.2	177.4	-70.6	174.1	0	0	0	112.3	Q847 L848 G853 K854 A855	Q847-L851 WeakPolarHBondContact O-CG 3.45Å; Q847-L851 PolarHBondContact O-N 2.79Å; L848-L851 PolarHBondContact O-N 2.93Å; L851-G853 VanDerWaalsContact C-N 3.28Å; L851-G853 PolarHBondContact O-N 3.02Å; L851-K854 PolarHBondContact O-N 2.95Å; L851-A855 PolarHBondContact O-N 3.17Å
852	F	71.2	Confident	65.7	Low	89 Å²	89	98.2 Å²	98.2	39%	0.39	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-35.8	172	-80.5	-61.9	0	0	0	111.7	L848 A855 A856	L848-F852 HydrophobicContact CD2-CD2 4.32Å; L848-F852 HydrophobicContact CD2-CE2 3.75Å; L848-F852 WeakPolarHBondContact O-CB 3.42Å; L848-F852 WeakPolarHBondContact O-CD2 3.37Å; L848-F852 PolarHBondContact O-N 3.44Å; F852-A855 PolarHBondContact O-N 3.5Å; F852-A856 WeakPolarHBondContact O-CB 3.33Å; F852-A856 PolarHBondContact O-N 3.36Å
853	G	75.4	Confident	66.6	Low	30 Å²	30	96.5 Å²	96.5	31%	0.309	49%	0.489	S	S	.	.	H	α-helix	trans	-59.8	-50.9	171.5	0	0	0	0	0	112.4	K849 F850 L851 A855 A856 E857	K849-G853 PolarHBondContact O-N 3.26Å; F850-G853 PolarHBondContact O-N 3.46Å; L851-G853 VanDerWaalsContact C-N 3.28Å; L851-G853 PolarHBondContact O-N 3.02Å; G853-A855 VanDerWaalsContact C-N 3.31Å; G853-A855 PolarHBondContact O-N 3.45Å; G853-A856 WeakPolarHBondContact O-CA 3.44Å; G853-A856 WeakPolarHBondContact O-CB 3.41Å; G853-A856 PolarHBondContact O-N 3.36Å; G853-E857 PolarHBondContact O-N 3.28Å
854	K	75.2	Confident	67.6	Low	116 Å²	116	94.2 Å²	94.2	50%	0.504	48%	0.481	S	S	.	.	H	α-helix	trans	-59.8	-37.9	175.8	-84.8	-172	171.1	-177.3	0	113.8	F850 L851 A856 E857 A858	F850-K854 HydrophobicContact CE1-CD 3.97Å; F850-K854 HydrophobicContact CZ-CD 4.21Å; F850-K854 VanDerWaalsContact CZ-CE 3.48Å; F850-K854 PolarHBondContact O-N 2.89Å; L851-K854 PolarHBondContact O-N 2.95Å; K854-A856 VanDerWaalsContact C-N 3.32Å; K854-E857 PolarHBondContact O-N 3.46Å; K854-A858 PolarHBondContact O-N 2.97Å
855	A	59.3	Low	68.4	Low	49 Å²	49	94.4 Å²	94.4	41%	0.405	49%	0.487	S	S	.	.	H	α-helix	trans	-66.8	-36.5	175.6	0	0	0	0	0	111.5	L851 F852 G853 A858 N859	L851-A855 PolarHBondContact O-N 3.17Å; F852-A855 PolarHBondContact O-N 3.5Å; G853-A855 VanDerWaalsContact C-N 3.31Å; G853-A855 PolarHBondContact O-N 3.45Å; A855-A858 PolarHBondContact O-N 2.9Å; A855-N859 VanDerWaalsContact O-CG 3.27Å; A855-N859 PolarHBondContact O-N 3.46Å; A855-N859 VanDerWaalsContact O-N 3.1Å; A855-N859 PolarHBondContact O-ND2 3.38Å
856	A	68.8	Low	68.7	Low	57 Å²	57	91.6 Å²	91.6	47%	0.471	48%	0.475	S	S	.	.	H	α-helix	trans	-67	-43.3	174.1	0	0	0	0	0	112.2	F852 G853 K854 A858 N859 E860	F852-A856 WeakPolarHBondContact O-CB 3.33Å; F852-A856 PolarHBondContact O-N 3.36Å; G853-A856 WeakPolarHBondContact O-CA 3.44Å; G853-A856 WeakPolarHBondContact O-CB 3.41Å; G853-A856 PolarHBondContact O-N 3.36Å; K854-A856 VanDerWaalsContact C-N 3.32Å; A856-A858 VanDerWaalsContact C-N 3.33Å; A856-A858 PolarHBondContact O-N 2.94Å; A856-N859 WeakPolarHBondContact O-CB 3.39Å; A856-N859 PolarHBondContact O-N 3.08Å; A856-N859 VanDerWaalsContact O-N 3.16Å; A856-E860 PolarHBondContact O-N 2.88Å
857	E	71.2	Confident	68.8	Low	114 Å²	114	88.3 Å²	88.3	53%	0.533	46%	0.462	S	S	.	.	H	α-helix	trans	-58.6	-42.6	173.6	-71.6	172.5	-177.6	0	0	111.8	G853 K854 N859 E860 H861	G853-E857 PolarHBondContact O-N 3.28Å; K854-E857 PolarHBondContact O-N 3.46Å; E857-N859 VanDerWaalsContact C-N 3.33Å; E857-N859 PolarHBondContact O-N 2.87Å; E857-E860 WeakPolarHBondContact O-CB 3.5Å; E857-E860 PolarHBondContact O-N 3.45Å; E857-H861 PolarHBondContact O-CD2 3.38Å; E857-H861 VanDerWaalsContact O-CD2 3.24Å; E857-H861 PolarHBondContact O-N 3.42Å
858	A	65.9	Low	69.3	Low	48 Å²	48	89.6 Å²	89.6	40%	0.397	47%	0.468	S	S	.	.	H	α-helix	trans	-64.3	-37.4	176.1	0	0	0	0	0	112.5	K854 A855 A856 E860 H861 I862	K854-A858 PolarHBondContact O-N 2.97Å; A855-A858 PolarHBondContact O-N 2.9Å; A856-A858 VanDerWaalsContact C-N 3.33Å; A856-A858 PolarHBondContact O-N 2.94Å; A858-E860 VanDerWaalsContact C-N 3.34Å; A858-H861 PolarHBondContact O-N 3.38Å; A858-I862 WeakPolarHBondContact O-CG1 3.19Å; A858-I862 PolarHBondContact O-N 3.19Å
859	N	64	Low	69.2	Low	68 Å²	68	90 Å²	90	36%	0.364	47%	0.467	S	S	.	.	H	α-helix	trans	-68.1	-34.7	175.2	-70.7	-26.6	0	0	0	111.9	A855 A856 E857 I862 K863	A855-N859 VanDerWaalsContact O-CG 3.27Å; A855-N859 PolarHBondContact O-N 3.46Å; A855-N859 VanDerWaalsContact O-N 3.1Å; A855-N859 PolarHBondContact O-ND2 3.38Å; A856-N859 WeakPolarHBondContact O-CB 3.39Å; A856-N859 PolarHBondContact O-N 3.08Å; A856-N859 VanDerWaalsContact O-N 3.16Å; E857-N859 VanDerWaalsContact C-N 3.33Å; E857-N859 PolarHBondContact O-N 2.87Å; N859-I862 PolarHBondContact O-N 3.35Å; N859-K863 PolarHBondContact O-N 2.76Å
860	E	73.5	Confident	68.8	Low	122 Å²	122	85.1 Å²	85.1	57%	0.57	45%	0.448	S	S	*	.	H	α-helix	trans	-64.3	-45.9	173.2	-165.6	-179.3	-164.4	0	0	110.9	A856 E857 A858 I862 K863 D864	A856-E860 PolarHBondContact O-N 2.88Å; E857-E860 WeakPolarHBondContact O-CB 3.5Å; E857-E860 PolarHBondContact O-N 3.45Å; A858-E860 VanDerWaalsContact C-N 3.34Å; E860-I862 VanDerWaalsContact C-N 3.32Å; E860-I862 PolarHBondContact O-N 2.77Å; E860-K863 WeakPolarHBondContact O-CA 3.24Å; E860-K863 VanDerWaalsContact O-CB 3.27Å; E860-K863 WeakPolarHBondContact O-CB 3.33Å; E860-K863 PolarHBondContact O-N 3.36Å; E860-D864 PolarHBondContact O-N 2.79Å
861	H	72	Confident	68.4	Low	134 Å²	134	85.6 Å²	85.6	62%	0.62	45%	0.452	S	S	*	.	H	α-helix	trans	-60.3	-37.3	174.2	-77.8	-57.4	0	0	0	113.9	E857 A858 K863 C865	E857-H861 PolarHBondContact O-CD2 3.38Å; E857-H861 VanDerWaalsContact O-CD2 3.24Å; E857-H861 PolarHBondContact O-N 3.42Å; A858-H861 PolarHBondContact O-N 3.38Å; H861-K863 VanDerWaalsContact C-N 3.29Å; H861-C865 WeakPolarHBondContact O-CB 3.32Å; H861-C865 PolarHBondContact O-N 2.98Å; H861-C865 VanDerWaalsContact O-N 3.07Å
862	I	68.5	Low	68	Low	95 Å²	95	84 Å²	84	49%	0.487	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-38.9	174	-69.5	165.8	0	0	0	110	A858 N859 E860 C865 L866	A858-I862 WeakPolarHBondContact O-CG1 3.19Å; A858-I862 PolarHBondContact O-N 3.19Å; N859-I862 PolarHBondContact O-N 3.35Å; E860-I862 VanDerWaalsContact C-N 3.32Å; E860-I862 PolarHBondContact O-N 2.77Å; I862-C865 PolarHBondContact O-N 3.31Å; I862-L866 HydrophobicContact CG2-CD1 4.08Å; I862-L866 VanDerWaalsContact O-CG 3.31Å; I862-L866 WeakPolarHBondContact O-CG 3.5Å; I862-L866 PolarHBondContact O-N 3.34Å
863	K	67.3	Low	67.5	Low	84 Å²	84	85.1 Å²	85.1	37%	0.365	45%	0.449	S	S	.	.	H	α-helix	trans	-63.2	-50.2	176.6	-169.1	-175.3	175.9	173.7	0	111.2	N859 E860 H861 C865 L866 D867 D908	N859-K863 PolarHBondContact O-N 2.76Å; E860-K863 WeakPolarHBondContact O-CA 3.24Å; E860-K863 VanDerWaalsContact O-CB 3.27Å; E860-K863 WeakPolarHBondContact O-CB 3.33Å; E860-K863 PolarHBondContact O-N 3.36Å; H861-K863 VanDerWaalsContact C-N 3.29Å; K863-C865 VanDerWaalsContact C-N 3.28Å; K863-C865 PolarHBondContact O-N 2.67Å; K863-L866 WeakPolarHBondContact O-CB 3.44Å; K863-L866 PolarHBondContact O-N 2.97Å; K863-L866 VanDerWaalsContact O-N 3.09Å; K863-D867 PolarHBondContact O-N 3.48Å; K863-D908 WeakPolarHBondContact CE-OD1 3.38Å; K863-D908 IonicContact NZ-OD1 3Å; K863-D908 PolarHBondContact NZ-OD1 3.39Å
864	D	73.6	Confident	67	Low	85 Å²	85	88.3 Å²	88.3	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-57.4	-42.1	178.2	-66.2	-18.3	0	0	0	111.7	E860 L866 D867 E868	E860-D864 PolarHBondContact O-N 2.79Å; D864-L866 PolarHBondContact O-N 3.41Å; D864-D867 PolarHBondContact O-N 3.25Å; D864-E868 WeakPolarHBondContact O-CB 3.29Å; D864-E868 PolarHBondContact O-N 2.89Å
865	C	66.9	Low	66.8	Low	77 Å²	77	86.1 Å²	86.1	52%	0.52	45%	0.454	S	S	.	.	H	α-helix	trans	-65.5	-37.4	178.2	-168.3	0	0	0	0	112.4	H861 I862 K863 Q869	H861-C865 WeakPolarHBondContact O-CB 3.32Å; H861-C865 PolarHBondContact O-N 2.98Å; H861-C865 VanDerWaalsContact O-N 3.07Å; I862-C865 PolarHBondContact O-N 3.31Å; K863-C865 VanDerWaalsContact C-N 3.28Å; K863-C865 PolarHBondContact O-N 2.67Å; C865-Q869 WeakPolarHBondContact O-CB 3.19Å; C865-Q869 PolarHBondContact O-N 2.94Å
866	L	62.4	Low	66.9	Low	57 Å²	57	88 Å²	88	30%	0.298	46%	0.456	S	S	.	.	H	α-helix	trans	-69.4	-37.6	173.9	-71.8	169.4	0	0	0	111.8	I862 K863 D864 Q869 I870 A911	I862-L866 HydrophobicContact CG2-CD1 4.08Å; I862-L866 VanDerWaalsContact O-CG 3.31Å; I862-L866 WeakPolarHBondContact O-CG 3.5Å; I862-L866 PolarHBondContact O-N 3.34Å; K863-L866 WeakPolarHBondContact O-CB 3.44Å; K863-L866 PolarHBondContact O-N 2.97Å; K863-L866 VanDerWaalsContact O-N 3.09Å; D864-L866 PolarHBondContact O-N 3.41Å; L866-Q869 WeakPolarHBondContact O-CB 3.31Å; L866-Q869 PolarHBondContact O-N 3.33Å; L866-I870 WeakPolarHBondContact O-CG1 3.16Å; L866-I870 PolarHBondContact O-N 3.38Å; L866-A911 HydrophobicContact CD1-CB 4.18Å
867	D	68.6	Low	66.5	Low	65 Å²	65	86.7 Å²	86.7	35%	0.348	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.3	-72.9	-23.5	0	0	0	111.1	K863 D864 Q869 I870 E871	K863-D867 PolarHBondContact O-N 3.48Å; D864-D867 PolarHBondContact O-N 3.25Å; D867-Q869 VanDerWaalsContact C-N 3.28Å; D867-Q869 PolarHBondContact O-N 3.31Å; D867-I870 PolarHBondContact O-N 3.43Å; D867-I870 VanDerWaalsContact O-N 3.16Å; D867-E871 PolarHBondContact O-N 3.5Å
868	E	71.2	Confident	66.4	Low	134 Å²	134	86.6 Å²	86.6	63%	0.626	44%	0.444	S	S	*	.	H	α-helix	trans	-59.9	-38.8	172.8	-171.7	177	-168	0	0	111.5	D864 E871 T872	D864-E868 WeakPolarHBondContact O-CB 3.29Å; D864-E868 PolarHBondContact O-N 2.89Å; E868-E871 PolarHBondContact O-N 3.42Å; E868-T872 WeakPolarHBondContact O-CB 3.25Å; E868-T872 PolarHBondContact O-N 3.39Å; E868-T872 PolarHBondContact O-OG1 3.45Å
869	Q	62	Low	66.3	Low	91 Å²	91	89.2 Å²	89.2	43%	0.425	45%	0.451	S	S	.	.	H	α-helix	trans	-64.5	-42	175.5	-161.3	-175.6	2.4	0	0	111.9	C865 L866 D867 T872 Y873	C865-Q869 WeakPolarHBondContact O-CB 3.19Å; C865-Q869 PolarHBondContact O-N 2.94Å; L866-Q869 WeakPolarHBondContact O-CB 3.31Å; L866-Q869 PolarHBondContact O-N 3.33Å; D867-Q869 VanDerWaalsContact C-N 3.28Å; D867-Q869 PolarHBondContact O-N 3.31Å; Q869-T872 WeakPolarHBondContact O-CB 3.49Å; Q869-T872 PolarHBondContact O-N 3.5Å; Q869-Y873 HydrophobicContact CG-CD2 4.17Å; Q869-Y873 HydrophobicContact CG-CE2 3.63Å; Q869-Y873 PolarHBondContact NE2-OH 3.46Å; Q869-Y873 WeakPolarHBondContact O-CD2 3.37Å; Q869-Y873 PolarHBondContact O-N 3.48Å
870	I	60	Low	66.1	Low	40 Å²	40	89.1 Å²	89.1	21%	0.205	45%	0.452	C	S	.	.	H	α-helix	trans	-65.3	-43.2	176.8	-72.5	167.2	0	0	0	111.1	L866 D867 T872 Y873 K874 L902 A907	L866-I870 WeakPolarHBondContact O-CG1 3.16Å; L866-I870 PolarHBondContact O-N 3.38Å; D867-I870 PolarHBondContact O-N 3.43Å; D867-I870 VanDerWaalsContact O-N 3.16Å; I870-T872 VanDerWaalsContact C-N 3.31Å; I870-T872 PolarHBondContact O-N 2.94Å; I870-Y873 PolarHBondContact O-N 2.98Å; I870-K874 HydrophobicContact CG2-CD 4.41Å; I870-K874 WeakPolarHBondContact O-CG 3.39Å; I870-K874 PolarHBondContact O-N 3.04Å; I870-L902 HydrophobicContact CB-CD2 4.45Å; I870-L902 HydrophobicContact CG1-CD2 4.35Å; I870-L902 HydrophobicContact CG2-CD2 4.01Å; I870-A907 HydrophobicContact CD1-CB 3.62Å
871	E	71.5	Confident	65.6	Low	134 Å²	134	85.2 Å²	85.2	63%	0.626	45%	0.445	S	S	*	.	H	α-helix	trans	-64.6	-37.3	177.7	-169.7	165.8	-163.3	0	0	111.9	D867 E868 K874 S875	D867-E871 PolarHBondContact O-N 3.5Å; E868-E871 PolarHBondContact O-N 3.42Å; E871-K874 PolarHBondContact O-N 3.45Å; E871-S875 PolarHBondContact O-N 2.95Å; E871-S875 PolarHBondContact O-OG 3.38Å
872	T	60.1	Low	65.2	Low	74 Å²	74	86.1 Å²	86.1	45%	0.454	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-45.1	171.5	-55.8	0	0	0	0	111.2	E868 Q869 I870 S875 I876	E868-T872 WeakPolarHBondContact O-CB 3.25Å; E868-T872 PolarHBondContact O-N 3.39Å; E868-T872 PolarHBondContact O-OG1 3.45Å; Q869-T872 WeakPolarHBondContact O-CB 3.49Å; Q869-T872 PolarHBondContact O-N 3.5Å; I870-T872 VanDerWaalsContact C-N 3.31Å; I870-T872 PolarHBondContact O-N 2.94Å; T872-S875 PolarHBondContact O-N 3.44Å; T872-I876 HydrophobicContact CG2-CD1 4.16Å; T872-I876 VanDerWaalsContact O-CG1 3.29Å; T872-I876 WeakPolarHBondContact O-CG1 3.39Å; T872-I876 PolarHBondContact O-N 3.29Å
873	Y	59.5	Low	64.6	Low	113 Å²	113	87.3 Å²	87.3	44%	0.443	46%	0.456	S	S	.	.	H	α-helix	trans	-66.1	-36.7	177.2	-73.2	-55.1	0	0	0	113.2	Q869 I870 I876 L877 L902	Q869-Y873 HydrophobicContact CG-CD2 4.17Å; Q869-Y873 HydrophobicContact CG-CE2 3.63Å; Q869-Y873 PolarHBondContact NE2-OH 3.46Å; Q869-Y873 WeakPolarHBondContact O-CD2 3.37Å; Q869-Y873 PolarHBondContact O-N 3.48Å; I870-Y873 PolarHBondContact O-N 2.98Å; Y873-I876 HydrophobicContact CD1-CD1 4.22Å; Y873-I876 PolarHBondContact O-N 3.48Å; Y873-L877 WeakPolarHBondContact O-CG 3.5Å; Y873-L877 PolarHBondContact O-N 3.38Å; Y873-L902 HydrophobicContact CD2-CD2 4.44Å
874	K	65.7	Low	63.7	Low	97 Å²	97	85.9 Å²	85.9	42%	0.422	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-47.5	172.3	-73.4	176.3	-179.8	172.9	0	111.2	I870 E871 I876 L877 D878 L902	I870-K874 HydrophobicContact CG2-CD 4.41Å; I870-K874 WeakPolarHBondContact O-CG 3.39Å; I870-K874 PolarHBondContact O-N 3.04Å; E871-K874 PolarHBondContact O-N 3.45Å; K874-I876 VanDerWaalsContact C-N 3.28Å; K874-I876 PolarHBondContact O-N 3.43Å; K874-L877 WeakPolarHBondContact O-CB 3.45Å; K874-L877 PolarHBondContact O-N 3Å; K874-D878 PolarHBondContact O-N 2.77Å; K874-L902 HydrophobicContact CG-CD1 4.33Å
875	S	70	Confident	62.4	Low	71 Å²	71	91.4 Å²	91.4	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-58.8	-39.4	176	-57.7	0	0	0	0	112.3	E871 T872 L879	E871-S875 PolarHBondContact O-N 2.95Å; E871-S875 PolarHBondContact O-OG 3.38Å; T872-S875 PolarHBondContact O-N 3.44Å; S875-L879 WeakPolarHBondContact O-CB 3.43Å; S875-L879 PolarHBondContact O-N 2.74Å; S875-L879 VanDerWaalsContact O-N 3.08Å
876	I	61.3	Low	61.7	Low	88 Å²	88	90 Å²	90	45%	0.451	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-42.8	174	-69.8	165.6	0	0	0	110.9	T872 Y873 K874 L879 V880	T872-I876 HydrophobicContact CG2-CD1 4.16Å; T872-I876 VanDerWaalsContact O-CG1 3.29Å; T872-I876 WeakPolarHBondContact O-CG1 3.39Å; T872-I876 PolarHBondContact O-N 3.29Å; Y873-I876 HydrophobicContact CD1-CD1 4.22Å; Y873-I876 PolarHBondContact O-N 3.48Å; K874-I876 VanDerWaalsContact C-N 3.28Å; K874-I876 PolarHBondContact O-N 3.43Å; I876-L879 PolarHBondContact O-N 3.25Å; I876-V880 VanDerWaalsContact O-CG2 3.24Å; I876-V880 WeakPolarHBondContact O-CG2 3.41Å; I876-V880 PolarHBondContact O-N 3.12Å
877	L	62	Low	61	Low	30 Å²	30	95.6 Å²	95.6	16%	0.157	50%	0.499	C	S	.	.	H	α-helix	trans	-68.4	-40.6	179.5	-71.3	162.1	0	0	0	112.6	Y873 K874 L879 V880 G881 L895 V898 L902	Y873-L877 WeakPolarHBondContact O-CG 3.5Å; Y873-L877 PolarHBondContact O-N 3.38Å; K874-L877 WeakPolarHBondContact O-CB 3.45Å; K874-L877 PolarHBondContact O-N 3Å; L877-L879 VanDerWaalsContact C-N 3.32Å; L877-L879 PolarHBondContact O-N 3.44Å; L877-V880 PolarHBondContact O-N 2.99Å; L877-G881 PolarHBondContact O-N 3.06Å; L877-L895 HydrophobicContact CB-CD2 4.17Å; L877-L895 HydrophobicContact CD2-CD2 3.58Å; L877-L895 HydrophobicContact CG-CD2 4.46Å; L877-V898 HydrophobicContact CD1-CB 4.3Å; L877-V898 HydrophobicContact CD1-CG1 3.69Å; L877-V898 HydrophobicContact CD2-CB 4.09Å; L877-V898 HydrophobicContact CD2-CG1 3.94Å; L877-V898 HydrophobicContact CG-CG1 4.33Å; L877-L902 HydrophobicContact CD1-CD1 3.17Å
878	D	68.9	Low	60.5	Low	111 Å²	111	97.7 Å²	97.7	59%	0.594	51%	0.511	S	S	*	.	H	α-helix	trans	-60.9	-44.6	175.8	-68.9	-25.6	0	0	0	110.2	K874 V880 G881 E882	K874-D878 PolarHBondContact O-N 2.77Å; D878-V880 PolarHBondContact O-N 2.98Å; D878-G881 PolarHBondContact O-N 2.99Å; D878-G881 VanDerWaalsContact O-N 3.14Å; D878-E882 PolarHBondContact O-N 3.22Å
879	L	62.9	Low	60.1	Low	104 Å²	104	95.8 Å²	95.8	55%	0.545	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-42.1	175.6	-152.4	81.6	0	0	0	111.9	S875 I876 L877 G881 E882 I883	S875-L879 WeakPolarHBondContact O-CB 3.43Å; S875-L879 PolarHBondContact O-N 2.74Å; S875-L879 VanDerWaalsContact O-N 3.08Å; I876-L879 PolarHBondContact O-N 3.25Å; L877-L879 VanDerWaalsContact C-N 3.32Å; L877-L879 PolarHBondContact O-N 3.44Å; L879-G881 VanDerWaalsContact C-N 3.32Å; L879-E882 PolarHBondContact O-N 3.03Å; L879-I883 HydrophobicContact CD2-CD1 4.44Å; L879-I883 HydrophobicContact CG-CD1 4.19Å; L879-I883 WeakPolarHBondContact O-CD1 3.5Å; L879-I883 WeakPolarHBondContact O-CG1 3.48Å; L879-I883 PolarHBondContact O-N 3.04Å; L879-I883 VanDerWaalsContact O-N 3.07Å
880	V	60.7	Low	59.8	Low	65 Å²	65	99.5 Å²	99.5	39%	0.394	52%	0.519	S	S	.	.	H	α-helix	trans	-65.1	-37.6	175.2	170	0	0	0	0	111.3	I876 L877 D878 I883 S884	I876-V880 VanDerWaalsContact O-CG2 3.24Å; I876-V880 WeakPolarHBondContact O-CG2 3.41Å; I876-V880 PolarHBondContact O-N 3.12Å; L877-V880 PolarHBondContact O-N 2.99Å; D878-V880 PolarHBondContact O-N 2.98Å; V880-I883 PolarHBondContact O-N 3.23Å; V880-S884 WeakPolarHBondContact O-CB 3.49Å; V880-S884 PolarHBondContact O-N 3.01Å; V880-S884 VanDerWaalsContact O-N 3.14Å
881	G	61.5	Low	59.4	Low	40 Å²	40	100 Å²	100	41%	0.412	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-43.5	175.5	0	0	0	0	0	112.5	L877 D878 L879 S884	L877-G881 PolarHBondContact O-N 3.06Å; D878-G881 PolarHBondContact O-N 2.99Å; D878-G881 VanDerWaalsContact O-N 3.14Å; L879-G881 VanDerWaalsContact C-N 3.32Å; G881-S884 PolarHBondContact O-N 2.94Å
882	E	63.8	Low	58.9	Low	154 Å²	154	99.4 Å²	99.4	72%	0.72	52%	0.52	S	S	*	.	H	α-helix	trans	-67.8	-36	176.5	-71.1	-165.6	163.8	0	0	112.9	D878 L879 S884	D878-E882 PolarHBondContact O-N 3.22Å; L879-E882 PolarHBondContact O-N 3.03Å; E882-S884 VanDerWaalsContact C-N 3.32Å; E882-S884 PolarHBondContact O-N 2.99Å
883	I	56.9	Low	59	Low	120 Å²	120	102.2 Å²	102.2	62%	0.615	53%	0.526	S	S	*	.	H	α-helix	trans	-75.1	-22.2	179.7	-64.2	163.5	0	0	0	111.8	L879 V880 F885	L879-I883 HydrophobicContact CD2-CD1 4.44Å; L879-I883 HydrophobicContact CG-CD1 4.19Å; L879-I883 WeakPolarHBondContact O-CD1 3.5Å; L879-I883 WeakPolarHBondContact O-CG1 3.48Å; L879-I883 PolarHBondContact O-N 3.04Å; L879-I883 VanDerWaalsContact O-N 3.07Å; V880-I883 PolarHBondContact O-N 3.23Å; I883-F885 VanDerWaalsContact C-N 3.31Å; I883-F885 PolarHBondContact O-N 3.42Å
884	S	48.9	Very low	58.7	Low	53 Å²	53	102.6 Å²	102.6	37%	0.371	54%	0.535	S	S	.	.			trans	-77.9	72.7	-173.9	-169.4	0	0	0	0	113.3	V880 G881 E882 G886	V880-S884 WeakPolarHBondContact O-CB 3.49Å; V880-S884 PolarHBondContact O-N 3.01Å; V880-S884 VanDerWaalsContact O-N 3.14Å; G881-S884 PolarHBondContact O-N 2.94Å; E882-S884 VanDerWaalsContact C-N 3.32Å; E882-S884 PolarHBondContact O-N 2.99Å; S884-G886 VanDerWaalsContact C-N 3.26Å; S884-G886 PolarHBondContact O-N 2.97Å
885	F	45.2	Very low	58.2	Low	202 Å²	202	99.7 Å²	99.7	89%	0.886	52%	0.523	S	S	*	.			trans	-71.7	77.6	161.2	-67.4	-84.3	0	0	0	110.5	I883	I883-F885 VanDerWaalsContact C-N 3.31Å; I883-F885 PolarHBondContact O-N 3.42Å
886	G	52.1	Low	57.7	Low	46 Å²	46	102 Å²	102	47%	0.474	53%	0.526	S	S	.	.	S	Bend	trans	165.7	120.2	172.7	0	0	0	0	0	113	S884 D888	S884-G886 VanDerWaalsContact C-N 3.26Å; S884-G886 PolarHBondContact O-N 2.97Å; G886-D888 PolarHBondContact O-N 2.92Å
887	E	49	Very low	57.5	Low	176 Å²	176	100.2 Å²	100.2	82%	0.822	53%	0.525	S	S	*	.			trans	-70.2	56.3	-178	-61.2	-176.8	131.7	0	0	113.7	D889	E887-D889 PolarHBondContact O-N 3.26Å
888	D	57.1	Low	57	Low	109 Å²	109	101.5 Å²	101.5	58%	0.583	53%	0.533	S	S	*	.			trans	-82.1	107.3	170.3	-118.9	-23.3	0	0	0	109.2	G886 K890 T891 K892	G886-D888 PolarHBondContact O-N 2.92Å; D888-K890 PolarHBondContact O-N 3.49Å; D888-T891 PolarHBondContact O-N 3.43Å; D888-K892 PolarHBondContact O-N 2.99Å
889	D	62.5	Low	56.4	Low	94 Å²	94	101.6 Å²	101.6	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-52.8	-23.7	-180	-172.6	49.7	0	0	0	112.9	E887 K893	E887-D889 PolarHBondContact O-N 3.26Å; D889-K893 WeakPolarHBondContact O-CB 3.49Å; D889-K893 VanDerWaalsContact O-CG 3.3Å; D889-K893 WeakPolarHBondContact O-CG 3.4Å; D889-K893 PolarHBondContact O-N 2.88Å; D889-K893 VanDerWaalsContact O-N 3.08Å; D889-K893 WeakPolarHBondContact OD2-CE 3.11Å; D889-K893 IonicContact OD2-NZ 2.85Å; D889-K893 PolarHBondContact OD2-NZ 3.06Å
890	K	55.7	Low	56.1	Low	168 Å²	168	102.2 Å²	102.2	73%	0.73	53%	0.53	S	S	*	.	H	α-helix	trans	-70.1	-42	173.3	-70.5	-179.5	-179.1	173.7	0	112.9	D888 K893 L894	D888-K890 PolarHBondContact O-N 3.49Å; K890-K893 PolarHBondContact O-N 3.29Å; K890-L894 WeakPolarHBondContact O-CB 3.38Å; K890-L894 PolarHBondContact O-N 3.5Å
891	T	52.8	Low	55.5	Low	51 Å²	51	103.7 Å²	103.7	31%	0.313	54%	0.542	S	S	.	.	H	α-helix	trans	-68.1	-40.8	179.3	-44.1	0	0	0	0	109.9	D888 L894 L895	D888-T891 PolarHBondContact O-N 3.43Å; T891-L894 PolarHBondContact O-N 3.04Å; T891-L895 HydrophobicContact CG2-CD1 4.08Å; T891-L895 WeakPolarHBondContact O-CB 3.46Å; T891-L895 PolarHBondContact O-N 3.34Å
892	K	60.8	Low	55	Low	121 Å²	121	103 Å²	103	53%	0.526	53%	0.529	S	S	.	.	H	α-helix	trans	-61.3	-44.1	173	-73.7	-176.3	178.9	175.4	0	112.7	D888 L894 L895 H896	D888-K892 PolarHBondContact O-N 2.99Å; K892-L894 VanDerWaalsContact C-N 3.31Å; K892-L894 PolarHBondContact O-N 3.49Å; K892-L895 PolarHBondContact O-N 3Å; K892-H896 VanDerWaalsContact O-CB 3.28Å; K892-H896 WeakPolarHBondContact O-CB 3.26Å; K892-H896 PolarHBondContact O-N 3.42Å
893	K	61.8	Low	54.4	Low	133 Å²	133	99.7 Å²	99.7	58%	0.578	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-36.7	176	-79.1	169	177.5	158.9	0	112.8	D889 K890 A897	D889-K893 WeakPolarHBondContact O-CB 3.49Å; D889-K893 VanDerWaalsContact O-CG 3.3Å; D889-K893 WeakPolarHBondContact O-CG 3.4Å; D889-K893 PolarHBondContact O-N 2.88Å; D889-K893 VanDerWaalsContact O-N 3.08Å; D889-K893 WeakPolarHBondContact OD2-CE 3.11Å; D889-K893 IonicContact OD2-NZ 2.85Å; D889-K893 PolarHBondContact OD2-NZ 3.06Å; K890-K893 PolarHBondContact O-N 3.29Å; K893-A897 VanDerWaalsContact O-CB 3.32Å; K893-A897 WeakPolarHBondContact O-CB 3.5Å; K893-A897 PolarHBondContact O-N 2.83Å
894	L	53	Low	54.1	Low	122 Å²	122	97.2 Å²	97.2	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-73.9	-43.7	179	-155.4	138.2	0	0	0	111	K890 T891 K892 H896 A897 V898	K890-L894 WeakPolarHBondContact O-CB 3.38Å; K890-L894 PolarHBondContact O-N 3.5Å; T891-L894 PolarHBondContact O-N 3.04Å; K892-L894 VanDerWaalsContact C-N 3.31Å; K892-L894 PolarHBondContact O-N 3.49Å; L894-H896 PolarHBondContact O-N 2.76Å; L894-A897 PolarHBondContact O-N 2.81Å; L894-V898 HydrophobicContact CD2-CG2 4.28Å; L894-V898 VanDerWaalsContact O-CG2 3.26Å; L894-V898 WeakPolarHBondContact O-CG2 3.48Å; L894-V898 PolarHBondContact O-N 2.75Å
895	L	54.5	Low	54	Low	35 Å²	35	100 Å²	100	18%	0.183	52%	0.521	C	S	.	.	H	α-helix	trans	-55.2	-49.5	169.8	-86	154.1	0	0	0	110.9	L877 T891 K892 A897 V898 E899	L877-L895 HydrophobicContact CB-CD2 4.17Å; L877-L895 HydrophobicContact CD2-CD2 3.58Å; L877-L895 HydrophobicContact CG-CD2 4.46Å; T891-L895 HydrophobicContact CG2-CD1 4.08Å; T891-L895 WeakPolarHBondContact O-CB 3.46Å; T891-L895 PolarHBondContact O-N 3.34Å; K892-L895 PolarHBondContact O-N 3Å; L895-A897 PolarHBondContact O-N 3.37Å; L895-V898 PolarHBondContact O-N 2.87Å; L895-E899 VanDerWaalsContact O-CB 3.27Å; L895-E899 WeakPolarHBondContact O-CB 3.38Å; L895-E899 PolarHBondContact O-N 2.83Å
896	H	60.4	Low	54.2	Low	121 Å²	121	94.9 Å²	94.9	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-35.9	179.3	-167.1	-65.7	0	0	0	112.7	K892 L894 E900	K892-H896 VanDerWaalsContact O-CB 3.28Å; K892-H896 WeakPolarHBondContact O-CB 3.26Å; K892-H896 PolarHBondContact O-N 3.42Å; L894-H896 PolarHBondContact O-N 2.76Å; H896-E900 WeakPolarHBondContact O-CB 3.4Å; H896-E900 PolarHBondContact O-N 2.9Å
897	A	57.4	Low	53.9	Low	50 Å²	50	93.8 Å²	93.8	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-69.7	-37.4	176	0	0	0	0	0	112.1	K893 L894 L895 C901	K893-A897 VanDerWaalsContact O-CB 3.32Å; K893-A897 WeakPolarHBondContact O-CB 3.5Å; K893-A897 PolarHBondContact O-N 2.83Å; L894-A897 PolarHBondContact O-N 2.81Å; L895-A897 PolarHBondContact O-N 3.37Å; A897-C901 PolarHBondContact O-N 2.88Å
898	V	51.6	Low	53.7	Low	56 Å²	56	88.1 Å²	88.1	34%	0.339	47%	0.468	S	S	.	.	H	α-helix	trans	-72.3	-39.4	175.5	-175.8	0	0	0	0	110.4	L877 L894 L895 C901 L902	L877-V898 HydrophobicContact CD1-CB 4.3Å; L877-V898 HydrophobicContact CD1-CG1 3.69Å; L877-V898 HydrophobicContact CD2-CB 4.09Å; L877-V898 HydrophobicContact CD2-CG1 3.94Å; L877-V898 HydrophobicContact CG-CG1 4.33Å; L894-V898 HydrophobicContact CD2-CG2 4.28Å; L894-V898 VanDerWaalsContact O-CG2 3.26Å; L894-V898 WeakPolarHBondContact O-CG2 3.48Å; L894-V898 PolarHBondContact O-N 2.75Å; L895-V898 PolarHBondContact O-N 2.87Å; V898-C901 PolarHBondContact O-N 2.76Å; V898-L902 HydrophobicContact CG1-CD1 3.91Å; V898-L902 HydrophobicContact CG1-CG 4.46Å; V898-L902 WeakPolarHBondContact O-CB 3.48Å; V898-L902 WeakPolarHBondContact O-CG 3.43Å; V898-L902 PolarHBondContact O-N 3.03Å
899	E	55.6	Low	53.3	Low	114 Å²	114	86.4 Å²	86.4	53%	0.533	46%	0.464	S	S	.	.	H	α-helix	trans	-63.6	-40	173.5	-166.6	175.9	-171.6	0	0	111.6	L895 L902 T903	L895-E899 VanDerWaalsContact O-CB 3.27Å; L895-E899 WeakPolarHBondContact O-CB 3.38Å; L895-E899 PolarHBondContact O-N 2.83Å; E899-L902 PolarHBondContact O-N 2.8Å; E899-T903 HydrophobicContact CG-CG2 4.35Å; E899-T903 WeakPolarHBondContact O-CB 3.21Å; E899-T903 VanDerWaalsContact O-CG2 3.26Å; E899-T903 WeakPolarHBondContact O-CG2 3.47Å; E899-T903 PolarHBondContact O-N 2.7Å; E899-T903 PolarHBondContact O-OG1 3.24Å
900	E	56.2	Low	52.6	Low	116 Å²	116	83.7 Å²	83.7	54%	0.542	46%	0.459	S	S	.	.	H	α-helix	trans	-61.4	-44.3	172.3	-172.1	175.8	-179.6	0	0	111.2	H896 L902 T903 T904	H896-E900 WeakPolarHBondContact O-CB 3.4Å; H896-E900 PolarHBondContact O-N 2.9Å; E900-L902 PolarHBondContact O-N 3.03Å; E900-T903 WeakPolarHBondContact CA-OG1 3.22Å; E900-T903 PolarHBondContact O-N 3.24Å; E900-T903 PolarHBondContact O-OG1 3.48Å; E900-T904 WeakPolarHBondContact O-CG2 3.42Å; E900-T904 PolarHBondContact O-N 3.49Å; E900-T904 PolarHBondContact O-OG1 2.89Å; E900-T904 VanDerWaalsContact O-OG1 3.08Å
901	C	49.5	Very low	52.1	Low	96 Å²	96	77 Å²	77	65%	0.649	44%	0.435	S	S	*	.	H	α-helix	trans	-64.6	-35.1	174.6	-96	0	0	0	0	113.6	A897 V898 T904	A897-C901 PolarHBondContact O-N 2.88Å; V898-C901 PolarHBondContact O-N 2.76Å; C901-T904 PolarHBondContact O-OG1 3.46Å
902	L	49.9	Very low	51.9	Low	26 Å²	26	77.5 Å²	77.5	14%	0.136	44%	0.444	C	S	.	.	H	α-helix	trans	-81	-26.4	179.2	-72.6	164.3	0	0	0	113.4	I870 Y873 K874 L877 V898 E899 E900	I870-L902 HydrophobicContact CB-CD2 4.45Å; I870-L902 HydrophobicContact CG1-CD2 4.35Å; I870-L902 HydrophobicContact CG2-CD2 4.01Å; Y873-L902 HydrophobicContact CD2-CD2 4.44Å; K874-L902 HydrophobicContact CG-CD1 4.33Å; L877-L902 HydrophobicContact CD1-CD1 3.17Å; V898-L902 HydrophobicContact CG1-CD1 3.91Å; V898-L902 HydrophobicContact CG1-CG 4.46Å; V898-L902 WeakPolarHBondContact O-CB 3.48Å; V898-L902 WeakPolarHBondContact O-CG 3.43Å; V898-L902 PolarHBondContact O-N 3.03Å; E899-L902 PolarHBondContact O-N 2.8Å; E900-L902 PolarHBondContact O-N 3.03Å
903	T	52.5	Low	51.3	Low	84 Å²	84	78.6 Å²	78.6	52%	0.515	45%	0.449	S	S	.	.	H	α-helix	trans	-86.1	-26.9	177.1	50.8	0	0	0	0	112.4	E899 E900 N905	E899-T903 HydrophobicContact CG-CG2 4.35Å; E899-T903 WeakPolarHBondContact O-CB 3.21Å; E899-T903 VanDerWaalsContact O-CG2 3.26Å; E899-T903 WeakPolarHBondContact O-CG2 3.47Å; E899-T903 PolarHBondContact O-N 2.7Å; E899-T903 PolarHBondContact O-OG1 3.24Å; E900-T903 WeakPolarHBondContact CA-OG1 3.22Å; E900-T903 PolarHBondContact O-N 3.24Å; E900-T903 PolarHBondContact O-OG1 3.48Å; T903-N905 PolarHBondContact O-N 2.95Å; T903-N905 VanDerWaalsContact O-N 3.15Å; T903-N905 PolarHBondContact O-OD1 3.46Å
904	T	50.1	Low	50.5	Low	68 Å²	68	78 Å²	78	42%	0.417	45%	0.451	S	S	.	.	S	Bend	trans	-65.9	115.3	164	52.6	0	0	0	0	108	E900 C901 V906	E900-T904 WeakPolarHBondContact O-CG2 3.42Å; E900-T904 PolarHBondContact O-N 3.49Å; E900-T904 PolarHBondContact O-OG1 2.89Å; E900-T904 VanDerWaalsContact O-OG1 3.08Å; C901-T904 PolarHBondContact O-OG1 3.46Å; T904-V906 PolarHBondContact O-N 3.33Å; T904-V906 WeakPolarHBondContact OG1-CG2 3.41Å
905	N	46.6	Very low	50.1	Low	112 Å²	112	73.2 Å²	73.2	60%	0.599	43%	0.43	S	S	*	.			trans	-64.6	50.6	176	-68.2	-5.7	0	0	0	112.4	T903 A907 D908 S909	T903-N905 PolarHBondContact O-N 2.95Å; T903-N905 VanDerWaalsContact O-N 3.15Å; T903-N905 PolarHBondContact O-OD1 3.46Å; N905-A907 PolarHBondContact O-N 3.16Å; N905-D908 HydrophobicContact CB-CB 4.08Å; N905-D908 PolarHBondContact ND2-OD2 3.21Å; N905-D908 PolarHBondContact O-N 2.88Å; N905-S909 PolarHBondContact O-N 2.82Å
906	V	49.7	Very low	50	Low	94 Å²	94	75.8 Å²	75.8	57%	0.57	44%	0.441	S	S	*	.	H	α-helix	trans	-65.7	-27.3	178.4	179.3	0	0	0	0	109.9	T904 G910	T904-V906 PolarHBondContact O-N 3.33Å; T904-V906 WeakPolarHBondContact OG1-CG2 3.41Å; V906-G910 VanDerWaalsContact O-CA 3.29Å; V906-G910 WeakPolarHBondContact O-CA 3.28Å; V906-G910 PolarHBondContact O-N 3.24Å
907	A	45.1	Very low	49.4	Very low	24 Å²	24	74.6 Å²	74.6	20%	0.198	44%	0.438	C	S	.	.	H	α-helix	trans	-67.9	-50.2	170.1	0	0	0	0	0	111.9	I870 N905 S909 G910 A911	I870-A907 HydrophobicContact CD1-CB 3.62Å; N905-A907 PolarHBondContact O-N 3.16Å; A907-S909 PolarHBondContact O-N 2.97Å; A907-G910 PolarHBondContact O-N 3.4Å; A907-A911 WeakPolarHBondContact O-CB 3.49Å; A907-A911 PolarHBondContact O-N 3.1Å
908	D	45.4	Very low	48.7	Very low	56 Å²	56	77 Å²	77	30%	0.299	44%	0.442	S	S	.	.	H	α-helix	trans	-60	-47.1	175.7	-73.5	-46.4	0	0	0	111.2	K863 N905 A912	K863-D908 WeakPolarHBondContact CE-OD1 3.38Å; K863-D908 IonicContact NZ-OD1 3Å; K863-D908 PolarHBondContact NZ-OD1 3.39Å; N905-D908 HydrophobicContact CB-CB 4.08Å; N905-D908 PolarHBondContact ND2-OD2 3.21Å; N905-D908 PolarHBondContact O-N 2.88Å; D908-A912 WeakPolarHBondContact O-CB 3.21Å; D908-A912 PolarHBondContact O-N 2.87Å; D908-A912 VanDerWaalsContact O-N 3.08Å
909	S	49.6	Very low	48.7	Very low	73 Å²	73	75.9 Å²	75.9	51%	0.51	44%	0.437	S	S	.	.	H	α-helix	trans	-68.1	-37.4	179.9	173.6	0	0	0	0	112.3	N905 A907 K913	N905-S909 PolarHBondContact O-N 2.82Å; A907-S909 PolarHBondContact O-N 2.97Å; S909-K913 WeakPolarHBondContact O-CB 3.37Å; S909-K913 PolarHBondContact O-N 2.96Å
910	G	46.6	Very low	48.5	Very low	37 Å²	37	75.1 Å²	75.1	38%	0.381	43%	0.433	S	S	.	.	H	α-helix	trans	-78.6	-50.7	-174.1	0	0	0	0	0	111.7	V906 A907 K913 L914	V906-G910 VanDerWaalsContact O-CA 3.29Å; V906-G910 WeakPolarHBondContact O-CA 3.28Å; V906-G910 PolarHBondContact O-N 3.24Å; A907-G910 PolarHBondContact O-N 3.4Å; G910-K913 PolarHBondContact O-N 2.66Å; G910-L914 WeakPolarHBondContact O-CB 3.26Å; G910-L914 PolarHBondContact O-N 2.81Å
911	A	45.8	Very low	48	Very low	28 Å²	28	74.4 Å²	74.4	23%	0.231	43%	0.433	C	S	.	.	H	α-helix	trans	-67.7	-44	179.2	0	0	0	0	0	111.3	L866 A907 K913 L914 A915	L866-A911 HydrophobicContact CD1-CB 4.18Å; A907-A911 WeakPolarHBondContact O-CB 3.49Å; A907-A911 PolarHBondContact O-N 3.1Å; A911-K913 VanDerWaalsContact C-N 3.32Å; A911-K913 PolarHBondContact O-N 3.45Å; A911-L914 PolarHBondContact O-N 2.82Å; A911-A915 VanDerWaalsContact O-CB 3.26Å; A911-A915 WeakPolarHBondContact O-CB 3.41Å; A911-A915 PolarHBondContact O-N 2.87Å
912	A	47.1	Very low	47.8	Very low	62 Å²	62	75 Å²	75	51%	0.512	42%	0.424	S	S	.	.	H	α-helix	trans	-65.1	-37.6	177.2	0	0	0	0	0	111.8	D908 A915 E916	D908-A912 WeakPolarHBondContact O-CB 3.21Å; D908-A912 PolarHBondContact O-N 2.87Å; D908-A912 VanDerWaalsContact O-N 3.08Å; A912-A915 PolarHBondContact O-N 2.87Å; A912-E916 VanDerWaalsContact O-CB 3.24Å; A912-E916 WeakPolarHBondContact O-CB 3.47Å; A912-E916 PolarHBondContact O-N 2.82Å
913	K	49.4	Very low	47.6	Very low	144 Å²	144	78.8 Å²	78.8	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-73.9	-34.2	179.4	-159.6	162	-168.8	176.2	0	112	S909 G910 A911 L917	S909-K913 WeakPolarHBondContact O-CB 3.37Å; S909-K913 PolarHBondContact O-N 2.96Å; G910-K913 PolarHBondContact O-N 2.66Å; A911-K913 VanDerWaalsContact C-N 3.32Å; A911-K913 PolarHBondContact O-N 3.45Å; K913-L917 WeakPolarHBondContact O-CB 3.33Å; K913-L917 PolarHBondContact O-N 2.97Å
914	L	43.8	Very low	47.3	Very low	119 Å²	119	79.1 Å²	79.1	62%	0.623	44%	0.436	S	S	*	.	H	α-helix	trans	-66.6	-46.3	170.9	-171.5	78.8	0	0	0	111.2	G910 A911 L917 M918	G910-L914 WeakPolarHBondContact O-CB 3.26Å; G910-L914 PolarHBondContact O-N 2.81Å; A911-L914 PolarHBondContact O-N 2.82Å; L914-L917 PolarHBondContact O-N 3.46Å; L914-M918 WeakPolarHBondContact O-CB 3.41Å; L914-M918 VanDerWaalsContact O-CG 3.25Å; L914-M918 WeakPolarHBondContact O-CG 3.38Å; L914-M918 PolarHBondContact O-N 3.47Å
915	A	45.3	Very low	47.1	Very low	23 Å²	23	81.1 Å²	81.1	19%	0.19	44%	0.44	C	S	.	.	H	α-helix	trans	-63.7	-40.4	178	0	0	0	0	0	111.8	A911 A912 S919	A911-A915 VanDerWaalsContact O-CB 3.26Å; A911-A915 WeakPolarHBondContact O-CB 3.41Å; A911-A915 PolarHBondContact O-N 2.87Å; A912-A915 PolarHBondContact O-N 2.87Å; A915-S919 VanDerWaalsContact O-CB 3.22Å; A915-S919 WeakPolarHBondContact O-CB 3.27Å; A915-S919 PolarHBondContact O-N 2.76Å; A915-S919 PolarHBondContact O-OG 3.38Å
916	E	52.5	Low	46.6	Very low	88 Å²	88	77.8 Å²	77.8	41%	0.411	43%	0.425	S	S	.	.	H	α-helix	trans	-66.7	-45.1	173.5	-174.5	56.6	-147.6	0	0	110.7	A912 M918 S919 Q920 R923	A912-E916 VanDerWaalsContact O-CB 3.24Å; A912-E916 WeakPolarHBondContact O-CB 3.47Å; A912-E916 PolarHBondContact O-N 2.82Å; E916-M918 VanDerWaalsContact C-N 3.34Å; E916-M918 PolarHBondContact O-N 2.74Å; E916-S919 PolarHBondContact O-N 3.02Å; E916-Q920 WeakPolarHBondContact O-CB 3.26Å; E916-Q920 PolarHBondContact O-N 3.41Å; E916-R923 IonicContact OE1-NH2 2.72Å; E916-R923 PolarHBondContact OE1-NH2 3.21Å; E916-R923 IonicContact OE2-NH2 3.57Å; E916-R923 PolarHBondContact OE2-NH2 2.91Å
917	L	48.4	Very low	46.1	Very low	97 Å²	97	76.7 Å²	76.7	51%	0.508	42%	0.418	S	S	.	.	H	α-helix	trans	-59.7	-45.1	176.5	-128.6	98.1	0	0	0	111.5	K913 L914 Q920 L921	K913-L917 WeakPolarHBondContact O-CB 3.33Å; K913-L917 PolarHBondContact O-N 2.97Å; L914-L917 PolarHBondContact O-N 3.46Å; L917-Q920 PolarHBondContact O-N 3.07Å; L917-L921 HydrophobicContact CD2-CD1 4.34Å; L917-L921 VanDerWaalsContact O-CB 3.28Å; L917-L921 WeakPolarHBondContact O-CB 3.47Å; L917-L921 WeakPolarHBondContact O-CG 3.41Å; L917-L921 PolarHBondContact O-N 3.02Å
918	M	43.1	Very low	45.9	Very low	100 Å²	100	82.2 Å²	82.2	49%	0.493	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-45	178.5	-75.3	-71.7	-71.3	0	0	110.8	L914 E916 Q920 F922	L914-M918 WeakPolarHBondContact O-CB 3.41Å; L914-M918 VanDerWaalsContact O-CG 3.25Å; L914-M918 WeakPolarHBondContact O-CG 3.38Å; L914-M918 PolarHBondContact O-N 3.47Å; E916-M918 VanDerWaalsContact C-N 3.34Å; E916-M918 PolarHBondContact O-N 2.74Å; M918-Q920 VanDerWaalsContact C-N 3.32Å; M918-Q920 PolarHBondContact O-N 3.16Å; M918-F922 HydrophobicContact CE-CE2 4.48Å; M918-F922 WeakPolarHBondContact O-CB 3.26Å; M918-F922 PolarHBondContact O-N 3.05Å
919	S	49.9	Very low	45.6	Very low	33 Å²	33	86.5 Å²	86.5	23%	0.231	46%	0.458	C	S	.	.	H	α-helix	trans	-64.6	-37.5	176.9	-61.6	0	0	0	0	112	A915 E916 R923	A915-S919 VanDerWaalsContact O-CB 3.22Å; A915-S919 WeakPolarHBondContact O-CB 3.27Å; A915-S919 PolarHBondContact O-N 2.76Å; A915-S919 PolarHBondContact O-OG 3.38Å; E916-S919 PolarHBondContact O-N 3.02Å; S919-R923 WeakPolarHBondContact O-CB 3.03Å; S919-R923 WeakPolarHBondContact O-CG 3.41Å; S919-R923 PolarHBondContact O-N 3.37Å; S919-R923 PolarHBondContact O-NE 2.95Å
920	Q	51.8	Low	44.8	Very low	98 Å²	98	88.5 Å²	88.5	46%	0.458	46%	0.463	S	S	.	.	H	α-helix	trans	-75	-41	-179.4	-158.9	157.8	34.7	0	0	111.3	E916 L917 M918 R923 D924	E916-Q920 WeakPolarHBondContact O-CB 3.26Å; E916-Q920 PolarHBondContact O-N 3.41Å; L917-Q920 PolarHBondContact O-N 3.07Å; M918-Q920 VanDerWaalsContact C-N 3.32Å; M918-Q920 PolarHBondContact O-N 3.16Å; Q920-R923 PolarHBondContact O-N 2.94Å; Q920-D924 VanDerWaalsContact O-CB 3.26Å; Q920-D924 WeakPolarHBondContact O-CB 3.28Å; Q920-D924 PolarHBondContact O-N 3.39Å
921	L	45.7	Very low	44.4	Very low	100 Å²	100	92.1 Å²	92.1	52%	0.524	47%	0.473	S	S	.	.	H	α-helix	trans	-61.1	-44.1	171.5	-75.1	170.8	0	0	0	111.5	L917 Q925	L917-L921 HydrophobicContact CD2-CD1 4.34Å; L917-L921 VanDerWaalsContact O-CB 3.28Å; L917-L921 WeakPolarHBondContact O-CB 3.47Å; L917-L921 WeakPolarHBondContact O-CG 3.41Å; L917-L921 PolarHBondContact O-N 3.02Å; L921-Q925 WeakPolarHBondContact O-CB 3.5Å; L921-Q925 PolarHBondContact O-N 3.12Å
922	F	46.8	Very low	44	Very low	108 Å²	108	93.8 Å²	93.8	47%	0.474	49%	0.493	S	S	.	.	H	α-helix	trans	-68.6	-43.6	176.5	-99.1	-85.8	0	0	0	112.2	M918 D924 Q925 C926	M918-F922 HydrophobicContact CE-CE2 4.48Å; M918-F922 WeakPolarHBondContact O-CB 3.26Å; M918-F922 PolarHBondContact O-N 3.05Å; F922-D924 VanDerWaalsContact C-N 3.35Å; F922-D924 PolarHBondContact O-N 3.2Å; F922-Q925 PolarHBondContact O-N 3.35Å; F922-C926 VanDerWaalsContact O-CB 3.3Å; F922-C926 WeakPolarHBondContact O-CB 3.48Å; F922-C926 PolarHBondContact O-N 3.42Å; F922-C926 PolarHBondContact O-SG 3.04Å
923	R	45.2	Very low	43.4	Very low	107 Å²	107	94.3 Å²	94.3	40%	0.404	50%	0.497	S	S	.	.	H	α-helix	trans	-59.9	-45.5	174.3	-80.2	-174.2	-68	-107.4	7.1	110.9	E916 S919 Q920 Q925 C926 V927	E916-R923 IonicContact OE1-NH2 2.72Å; E916-R923 PolarHBondContact OE1-NH2 3.21Å; E916-R923 IonicContact OE2-NH2 3.57Å; E916-R923 PolarHBondContact OE2-NH2 2.91Å; S919-R923 WeakPolarHBondContact O-CB 3.03Å; S919-R923 WeakPolarHBondContact O-CG 3.41Å; S919-R923 PolarHBondContact O-N 3.37Å; S919-R923 PolarHBondContact O-NE 2.95Å; Q920-R923 PolarHBondContact O-N 2.94Å; R923-Q925 PolarHBondContact O-N 3.07Å; R923-C926 PolarHBondContact O-N 2.93Å; R923-V927 WeakPolarHBondContact O-CB 3.47Å; R923-V927 WeakPolarHBondContact O-CG2 3.32Å; R923-V927 PolarHBondContact O-N 3.45Å
924	D	45.6	Very low	42.4	Very low	91 Å²	91	91 Å²	91	49%	0.487	50%	0.497	S	S	.	.	H	α-helix	trans	-63.9	-40.3	177.8	-81.5	-4.3	0	0	0	111.5	Q920 F922 Q928	Q920-D924 VanDerWaalsContact O-CB 3.26Å; Q920-D924 WeakPolarHBondContact O-CB 3.28Å; Q920-D924 PolarHBondContact O-N 3.39Å; F922-D924 VanDerWaalsContact C-N 3.35Å; F922-D924 PolarHBondContact O-N 3.2Å; D924-Q928 WeakPolarHBondContact O-CB 3.49Å; D924-Q928 WeakPolarHBondContact O-CG 3.36Å; D924-Q928 PolarHBondContact O-N 3.42Å
925	Q	45.1	Very low	41.7	Very low	109 Å²	109	89.4 Å²	89.4	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-46.5	174.3	-109.5	-177.3	-15.2	0	0	112.3	L921 F922 R923 Q928 Q929	L921-Q925 WeakPolarHBondContact O-CB 3.5Å; L921-Q925 PolarHBondContact O-N 3.12Å; F922-Q925 PolarHBondContact O-N 3.35Å; R923-Q925 PolarHBondContact O-N 3.07Å; Q925-Q928 PolarHBondContact O-N 3.08Å; Q925-Q929 WeakPolarHBondContact O-CG 3.35Å; Q925-Q929 PolarHBondContact O-N 3.38Å
926	C	38	Very low	41.2	Very low	43 Å²	43	94.9 Å²	94.9	29%	0.291	53%	0.526	S	S	.	.	H	α-helix	trans	-65.5	-41	178.9	-72.4	0	0	0	0	111.3	F922 R923 Q929 L930	F922-C926 VanDerWaalsContact O-CB 3.3Å; F922-C926 WeakPolarHBondContact O-CB 3.48Å; F922-C926 PolarHBondContact O-N 3.42Å; F922-C926 PolarHBondContact O-SG 3.04Å; R923-C926 PolarHBondContact O-N 2.93Å; C926-Q929 PolarHBondContact O-N 3.35Å; C926-L930 VanDerWaalsContact O-CB 3.29Å; C926-L930 WeakPolarHBondContact O-CB 3.34Å; C926-L930 VanDerWaalsContact O-CG 3.26Å; C926-L930 WeakPolarHBondContact O-CG 3.29Å; C926-L930 PolarHBondContact O-N 2.95Å
927	V	37.5	Very low	40	Very low	70 Å²	70	94 Å²	94	42%	0.424	54%	0.54	S	S	.	.	H	α-helix	trans	-68.6	-38	175.8	170.5	0	0	0	0	110.6	R923 Q929 L930 L931	R923-V927 WeakPolarHBondContact O-CB 3.47Å; R923-V927 WeakPolarHBondContact O-CG2 3.32Å; R923-V927 PolarHBondContact O-N 3.45Å; V927-Q929 VanDerWaalsContact C-N 3.34Å; V927-Q929 PolarHBondContact O-N 3.44Å; V927-L930 PolarHBondContact O-N 3.12Å; V927-L931 HydrophobicContact CG1-CD1 3.43Å; V927-L931 VanDerWaalsContact CG1-CD1 3.43Å; V927-L931 HydrophobicContact CG1-CG 3.95Å; V927-L931 WeakPolarHBondContact O-CB 3.49Å; V927-L931 VanDerWaalsContact O-CG 3.3Å; V927-L931 WeakPolarHBondContact O-CG 3.47Å; V927-L931 PolarHBondContact O-N 3.01Å
928	Q	40.5	Very low	39	Very low	140 Å²	140	94.8 Å²	94.8	65%	0.654	55%	0.554	S	S	*	*	H	α-helix	trans	-64.8	-38.1	172.4	-79.5	-178.8	17.8	0	0	112.2	D924 Q925 G932	D924-Q928 WeakPolarHBondContact O-CB 3.49Å; D924-Q928 WeakPolarHBondContact O-CG 3.36Å; D924-Q928 PolarHBondContact O-N 3.42Å; Q925-Q928 PolarHBondContact O-N 3.08Å; Q928-G932 PolarHBondContact O-N 3.44Å
929	Q	39.3	Very low	38.4	Very low	147 Å²	147	95.5 Å²	95.5	69%	0.687	57%	0.569	S	S	*	*	H	α-helix	trans	-71.3	-36.5	175	-71.7	-169.4	5.4	0	0	112.4	Q925 C926 V927 A933	Q925-Q929 WeakPolarHBondContact O-CG 3.35Å; Q925-Q929 PolarHBondContact O-N 3.38Å; C926-Q929 PolarHBondContact O-N 3.35Å; V927-Q929 VanDerWaalsContact C-N 3.34Å; V927-Q929 PolarHBondContact O-N 3.44Å; Q929-A933 PolarHBondContact O-N 3.45Å
930	L	33.8	Very low	37.2	Very low	114 Å²	114	102.5 Å²	102.5	60%	0.597	60%	0.598	S	S	*	*	H	α-helix	trans	-76	-40.2	177.6	-74.7	167	0	0	0	112.8	C926 V927 G932 A933 A934	C926-L930 VanDerWaalsContact O-CB 3.29Å; C926-L930 WeakPolarHBondContact O-CB 3.34Å; C926-L930 VanDerWaalsContact O-CG 3.26Å; C926-L930 WeakPolarHBondContact O-CG 3.29Å; C926-L930 PolarHBondContact O-N 2.95Å; V927-L930 PolarHBondContact O-N 3.12Å; L930-G932 VanDerWaalsContact C-N 3.31Å; L930-A933 CarbonylContact O-C 3.52Å; L930-A933 WeakPolarHBondContact O-CA 3.14Å; L930-A933 WeakPolarHBondContact O-CB 3.44Å; L930-A933 PolarHBondContact O-N 3.49Å; L930-A934 WeakPolarHBondContact O-CB 3.38Å; L930-A934 PolarHBondContact O-N 2.97Å
931	L	37.5	Very low	36.5	Very low	113 Å²	113	104 Å²	104	59%	0.592	62%	0.616	S	S	*	*	H	α-helix	trans	-69.1	-31.7	172.4	-72.7	171.4	0	0	0	111.5	V927 A933 A934 S935	V927-L931 HydrophobicContact CG1-CD1 3.43Å; V927-L931 VanDerWaalsContact CG1-CD1 3.43Å; V927-L931 HydrophobicContact CG1-CG 3.95Å; V927-L931 WeakPolarHBondContact O-CB 3.49Å; V927-L931 VanDerWaalsContact O-CG 3.3Å; V927-L931 WeakPolarHBondContact O-CG 3.47Å; V927-L931 PolarHBondContact O-N 3.01Å; L931-A933 PolarHBondContact O-N 3.44Å; L931-A934 PolarHBondContact O-N 2.97Å; L931-S935 PolarHBondContact O-N 2.94Å
932	G	38.1	Very low	35.6	Very low	64 Å²	64	103.7 Å²	103.7	66%	0.66	63%	0.628	S	S	*	*	H	α-helix	trans	-59.2	-30	167.8	0	0	0	0	0	112.8	Q928 L930	Q928-G932 PolarHBondContact O-N 3.44Å; L930-G932 VanDerWaalsContact C-N 3.31Å
933	A	34	Very low	34.8	Very low	73 Å²	73	104.2 Å²	104.2	60%	0.603	64%	0.642	S	S	*	*	H	α-helix	trans	-90.1	-27.8	176.4	0	0	0	0	0	114	Q929 L930 L931	Q929-A933 PolarHBondContact O-N 3.45Å; L930-A933 CarbonylContact O-C 3.52Å; L930-A933 WeakPolarHBondContact O-CA 3.14Å; L930-A933 WeakPolarHBondContact O-CB 3.44Å; L930-A933 PolarHBondContact O-N 3.49Å; L931-A933 PolarHBondContact O-N 3.44Å
934	A	29.5	Very low	33.9	Very low	74 Å²	74	106.7 Å²	106.7	61%	0.612	66%	0.662	S	S	*	*	H	α-helix	trans	-87.7	-5.6	-174.5	0	0	0	0	0	115.1	L930 L931 V936	L930-A934 WeakPolarHBondContact O-CB 3.38Å; L930-A934 PolarHBondContact O-N 2.97Å; L931-A934 PolarHBondContact O-N 2.97Å; A934-V936 PolarHBondContact O-N 3Å
935	S	29.3	Very low	32.9	Very low	85 Å²	85	110.1 Å²	110.1	59%	0.594	68%	0.681	S	S	*	*			trans	-78.2	54.9	172.8	167.2	0	0	0	0	112.4	L931	L931-S935 PolarHBondContact O-N 2.94Å
936	V	33.1	Very low	32	Very low	138 Å²	138	110.2 Å²	110.2	84%	0.836	69%	0.693	S	S	*	*			trans	-134.8	72.6	165.4	-173.7	0	0	0	0	107.5	A934	A934-V936 PolarHBondContact O-N 3Å
937	G	27.6	Very low	31.5	Very low	69 Å²	69	113.4 Å²	113.4	71%	0.711	72%	0.716	S	S	*	*			trans	-131.6	89.3	-179.3	0	0	0	0	0	111.4	S939	G937-S939 PolarHBondContact O-N 3.27Å
938	S	27.6	Very low	30.9	Very low	114 Å²	114	119.9 Å²	119.9	80%	0.797	74%	0.742	S	S	*	*			trans	12.6	93.6	147.6	168	0	0	0	0	117.5
939	S	30.5	Very low	30.3	Very low	116 Å²	116	117 Å²	117	81%	0.811	74%	0.741	S	S	*	*			trans	-97.1	102.8	153.7	56.1	0	0	0	0	108.8	G937	G937-S939 PolarHBondContact O-N 3.27Å
940	Q	25.8	Very low	29.7	Very low	180 Å²	180	114.7 Å²	114.7	84%	0.841	75%	0.747	S	S	*	*			trans	-59.2	142.3	167.6	-94.7	-174.3	-57.4	0	0	110.2
941	P	35.2	Very low	29.5	Very low	129 Å²	129	116.7 Å²	116.7	84%	0.838	76%	0.757	S	S	*	*			trans	-86.2	126.8	-174.5	33.4	-30.2	0	0	0	110.8
942	A	27.3	Very low	29.1	Very low	93 Å²	93	117.9 Å²	117.9	77%	0.769	76%	0.764	S	S	*	*			trans	-108.8	147.6	164.8	0	0	0	0	0	109.5
943	P	30.8	Very low	28.7	Very low	119 Å²	119	126.2 Å²	126.2	77%	0.773	78%	0.776	S	S	*	*			trans	-84.3	131.6	-150.3	31.4	-33.4	0	0	0	114	N945	P943-N945 PolarHBondContact O-N 2.98Å
944	I	25.1	Very low	28.5	Very low	160 Å²	160	126.8 Å²	126.8	82%	0.821	78%	0.775	S	S	*	*			trans	-0.7	98.2	142.3	-46.8	171.6	0	0	0	113.9
945	N	25.8	Very low	28.6	Very low	163 Å²	163	131.5 Å²	131.5	87%	0.872	78%	0.784	S	S	*	*			trans	-106.4	111.1	150	-92.2	-21.7	0	0	0	108	P943 S947	P943-N945 PolarHBondContact O-N 2.98Å; N945-S947 PolarHBondContact O-N 3.34Å
946	S	25.1	Very low	28.8	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	80%	0.798	S	S	*	*			trans	-59.1	118.6	173.3	48.2	0	0	0	0	111.4
947	S	27.5	Very low	28.6	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	80%	0.8	S	S	*	*			trans	-149.5	92.8	155.3	179.8	0	0	0	0	107.1	N945 A949	N945-S947 PolarHBondContact O-N 3.34Å; S947-A949 PolarHBondContact O-N 3.26Å
948	E	25.1	Very low	28.8	Very low	207 Å²	207	141.9 Å²	141.9	97%	0.967	80%	0.803	S	S	*	*			trans	-61.5	92.8	169.4	-77.5	173	125.8	0	0	109.5
949	A	27.5	Very low	29	Very low	78 Å²	78	145.1 Å²	145.1	65%	0.645	81%	0.805	S	S	*	*			trans	-100.6	98.4	160.7	0	0	0	0	0	107.8	S947 I951	S947-A949 PolarHBondContact O-N 3.26Å; A949-I951 PolarHBondContact O-N 2.9Å
950	A	28	Very low	28.9	Very low	99 Å²	99	147.6 Å²	147.6	82%	0.818	81%	0.809	S	S	*	*			trans	-56.4	100.5	173.6	0	0	0	0	0	110.5	N952	A950-N952 VanDerWaalsContact C-N 3.33Å; A950-N952 PolarHBondContact O-N 3.47Å
951	I	28.6	Very low	28.8	Very low	156 Å²	156	150 Å²	150	80%	0.8	81%	0.812	S	S	*	*			trans	-72.6	92.6	173.7	-62	175.3	0	0	0	107.9	A949 R953	A949-I951 PolarHBondContact O-N 2.9Å; I951-R953 PolarHBondContact O-N 3.28Å
952	N	29.6	Very low	28.4	Very low	138 Å²	138	154.8 Å²	154.8	74%	0.738	81%	0.813	S	S	*	*			trans	-69.8	104.8	176.8	-152.8	-15.2	0	0	0	108.9	A950 S954	A950-N952 VanDerWaalsContact C-N 3.33Å; A950-N952 PolarHBondContact O-N 3.47Å; N952-S954 PolarHBondContact O-N 2.92Å
953	R	29.5	Very low	28.4	Very low	239 Å²	239	159.9 Å²	159.9	90%	0.902	82%	0.818	S	S	*	*	S	Bend	trans	-71	48.1	-175.2	-80.7	-178.8	167.4	169.3	-2.8	114.3	I951	I951-R953 PolarHBondContact O-N 3.28Å
954	S	29.6	Very low	28.2	Very low	85 Å²	85	162.4 Å²	162.4	59%	0.594	82%	0.819	S	S	*	*			trans	-119	9	-177.1	58	0	0	0	0	116.2	N952	N952-S954 PolarHBondContact O-N 2.92Å
955	Q	32.9	Very low	28.2	Very low	173 Å²	173	160.7 Å²	160.7	81%	0.808	82%	0.816	S	S	*	*	S	Bend	trans	-111.2	-5.2	-179.4	-75.3	-173.3	-12.5	0	0	117.2
956	T	33.3	Very low	28.4	Very low	143 Å²	143	159.7 Å²	159.7	88%	0.877	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-2	179.7	-7.7	0	0	0	0	114.9
957	F	28.1	Very low	28.6	Very low	200 Å²	200	160.4 Å²	160.4	88%	0.877	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-7.5	-176.9	-151.5	-97.6	0	0	0	114.5
958	H	31.8	Very low	28.5	Very low	167 Å²	167	160.5 Å²	160.5	77%	0.773	82%	0.816	S	S	*	*	S	Bend	trans	-108.4	-1.2	-166.9	-135.3	-67.3	0	0	0	116.3
959	E	31	Very low	28.5	Very low	182 Å²	182	154 Å²	154	85%	0.85	80%	0.804	S	S	*	*	S	Bend	trans	-95.4	-14.1	-177.8	-91.3	-175.3	153.2	0	0	115.8	Y961	E959-Y961 PolarHBondContact O-N 3.47Å
960	L	28.8	Very low	28.4	Very low	168 Å²	168	158.2 Å²	158.2	88%	0.88	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	4.4	-172.4	-103.3	154.6	0	0	0	116.1
961	Y	24.7	Very low	28.4	Very low	231 Å²	231	159.4 Å²	159.4	91%	0.906	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	36.8	-175.5	-111.1	-83.8	0	0	0	116.3	E959	E959-Y961 PolarHBondContact O-N 3.47Å
962	R	27.3	Very low	28.3	Very low	229 Å²	229	157.9 Å²	157.9	86%	0.864	82%	0.817	S	S	*	*			trans	-124.5	12.7	173.1	-135	-171.4	-143.8	135.4	4.5	118	H964	R962-H964 PolarHBondContact O-N 2.8Å
963	K	25.9	Very low	28.3	Very low	200 Å²	200	155.7 Å²	155.7	87%	0.87	82%	0.818	S	S	*	*			trans	-80.2	69.5	166.4	-80.4	-171.8	176.7	178.5	0	111.2
964	H	27.1	Very low	28.2	Very low	172 Å²	172	151.6 Å²	151.6	80%	0.796	81%	0.812	S	S	*	*	S	Bend	trans	-152.4	104.2	155.8	-84	-59.1	0	0	0	111	R962	R962-H964 PolarHBondContact O-N 2.8Å
965	V	25.7	Very low	28.2	Very low	125 Å²	125	154.9 Å²	154.9	76%	0.758	82%	0.823	S	S	*	*			trans	48.2	82	142.2	-165.1	0	0	0	0	116.1	V967	V965-V967 HydrophobicContact CG1-CG2 4.38Å; V965-V967 PolarHBondContact O-N 2.76Å
966	T	29.5	Very low	28	Very low	142 Å²	142	155.2 Å²	155.2	87%	0.871	82%	0.822	S	S	*	*			trans	-80.2	103.5	156.7	47.5	0	0	0	0	108.7	S968	T966-S968 PolarHBondContact O-N 3.4Å
967	V	28.3	Very low	27.9	Very low	125 Å²	125	153.8 Å²	153.8	76%	0.758	82%	0.818	S	S	*	*			trans	-54	130.4	164.2	173.4	0	0	0	0	108.8	V965	V965-V967 HydrophobicContact CG1-CG2 4.38Å; V965-V967 PolarHBondContact O-N 2.76Å
968	S	26.3	Very low	27.8	Very low	111 Å²	111	156.2 Å²	156.2	78%	0.776	82%	0.821	S	S	*	*	S	Bend	trans	-46.4	135.4	180	51	0	0	0	0	114.9	T966	T966-S968 PolarHBondContact O-N 3.4Å
969	G	25.5	Very low	27.8	Very low	70 Å²	70	154.2 Å²	154.2	72%	0.722	83%	0.826	S	S	*	*			trans	94.6	66.1	139.7	0	0	0	0	0	118.1
970	I	25.7	Very low	27.6	Very low	167 Å²	167	153.8 Å²	153.8	86%	0.856	83%	0.826	S	S	*	*			trans	-135.6	107.3	148.8	-57.2	-179.4	0	0	0	107.9	S972	I970-S972 PolarHBondContact O-N 3.27Å
971	P	28.1	Very low	27.5	Very low	124 Å²	124	154.6 Å²	154.6	81%	0.805	83%	0.825	S	S	*	*			trans	-65.5	121.5	-179.6	-20.5	32.5	0	0	0	112	A973	P971-A973 PolarHBondContact O-N 2.89Å
972	S	25.1	Very low	27.7	Very low	124 Å²	124	151.4 Å²	151.4	87%	0.867	82%	0.823	S	S	*	*			trans	-75.2	96.2	172.7	53	0	0	0	0	110.7	I970	I970-S972 PolarHBondContact O-N 3.27Å
973	A	30	Very low	27.9	Very low	92 Å²	92	151 Å²	151	76%	0.76	83%	0.828	S	S	*	*			trans	-149.5	70	163.3	0	0	0	0	0	109.6	P971	P971-A973 PolarHBondContact O-N 2.89Å
974	I	28.6	Very low	27.9	Very low	153 Å²	153	150.3 Å²	150.3	79%	0.785	83%	0.828	S	S	*	*			trans	-99.8	78.2	164	-58.9	174.8	0	0	0	105.9	K976	I974-K976 HydrophobicContact CG2-CG 3.89Å
975	D	29.6	Very low	28.3	Very low	155 Å²	155	150 Å²	150	83%	0.829	83%	0.826	S	S	*	*			trans	-84.9	109.4	160.4	-163.9	0.5	0	0	0	107.4	S977	D975-S977 PolarHBondContact O-N 2.95Å; D975-S977 VanDerWaalsContact O-N 3.12Å
976	K	28.7	Very low	28.6	Very low	180 Å²	180	150.2 Å²	150.2	78%	0.783	82%	0.823	S	S	*	*			trans	-81.3	84.1	-174.2	-68.5	178.3	178.2	174.6	0	108.9	I974	I974-K976 HydrophobicContact CG2-CG 3.89Å
977	S	29.4	Very low	28.9	Very low	113 Å²	113	153.9 Å²	153.9	79%	0.79	82%	0.823	S	S	*	*			trans	-169.3	74.6	160.3	-81.8	0	0	0	0	112.2	D975	D975-S977 PolarHBondContact O-N 2.95Å; D975-S977 VanDerWaalsContact O-N 3.12Å
978	R	26.3	Very low	29.8	Very low	250 Å²	250	153.1 Å²	153.1	94%	0.943	82%	0.821	S	S	*	*			trans	-152.4	86.1	153.5	-134.9	176.1	-177.2	-178.1	0.5	110.8	M980	R978-M980 PolarHBondContact O-N 2.79Å
979	S	31.9	Very low	30.6	Very low	125 Å²	125	157 Å²	157	87%	0.874	83%	0.826	S	S	*	*			trans	-69.1	96.7	162.7	-75.1	0	0	0	0	108.9
980	M	26.7	Very low	31.8	Very low	174 Å²	174	158.2 Å²	158.2	86%	0.857	82%	0.824	S	S	*	*				49.8	72.3	116	-151.2	-173.3	87	0	0	118.1	R978	R978-M980 PolarHBondContact O-N 2.79Å
981	E	27.2	Very low	32.8	Very low	184 Å²	184	158.5 Å²	158.5	86%	0.86	81%	0.814	S	S	*	*			trans	-142.3	146.4	146.2	-70.4	-170.7	168.8	0	0	108
982	L	28.5	Very low	34.1	Very low	164 Å²	164	156 Å²	156	86%	0.859	80%	0.804	S	S	*	*			trans	87.7	79.5	-178.3	-50.5	169	0	0	0	115.8
983	F	31.3	Very low	35.5	Very low	221 Å²	221	156.5 Å²	156.5	97%	0.969	80%	0.797	S	S	*	*			trans	-158	65	141.2	-115.1	-78.8	0	0	0	109.9
984	E	27.1	Very low	36.8	Very low	186 Å²	186	155.1 Å²	155.1	87%	0.869	78%	0.782	S	S	*	*			trans	-93.1	109.2	156.1	-83.6	-171.1	148.7	0	0	107.7
985	H	34.8	Very low	38.9	Very low	164 Å²	164	153.8 Å²	153.8	76%	0.759	77%	0.77	S	S	*	*			trans	-173.9	108.4	141.1	-101.1	-65.4	0	0	0	111.2
986	N	32.3	Very low	41.1	Very low	131 Å²	131	149.7 Å²	149.7	70%	0.701	75%	0.753	S	S	*	*			trans	40	101.5	141.4	-62.8	-18.3	0	0	0	121.6
987	Y	36.2	Very low	43.3	Very low	219 Å²	219	147.4 Å²	147.4	86%	0.859	75%	0.746	S	S	*	*			trans	-152.6	105.1	139.8	-91.2	-80.6	0	0	0	109.3
988	P	47	Very low	45.5	Very low	109 Å²	109	146.9 Å²	146.9	71%	0.708	73%	0.733	S	S	*	*			trans	-81.1	-24.9	-168.9	-14.2	29.7	0	0	0	116.4
989	E	42.7	Very low	48.2	Very low	191 Å²	191	141.8 Å²	141.8	89%	0.893	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-16.5	-165.2	-71.4	-176.1	159.1	0	0	115.6	R991	E989-R991 VanDerWaalsContact C-N 3.27Å; E989-R991 PolarHBondContact O-N 3.41Å
990	S	50	Low	50.6	Low	96 Å²	96	139.2 Å²	139.2	67%	0.671	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-4.6	174.5	-175.1	0	0	0	0	113.9	S994	S990-S994 PolarHBondContact O-OG 3.44Å
991	R	48.2	Very low	53.1	Low	174 Å²	174	136 Å²	136	66%	0.657	68%	0.683	S	S	*	*	H	α-helix	trans	-85.1	-21	-167.6	-140.7	173.3	-170.8	162.8	2.5	114.6	E989 S994 K995	E989-R991 VanDerWaalsContact C-N 3.27Å; E989-R991 PolarHBondContact O-N 3.41Å; R991-S994 PolarHBondContact O-OG 3.41Å; R991-K995 WeakPolarHBondContact O-CG 3.14Å; R991-K995 PolarHBondContact O-N 3.46Å
992	A	54.7	Low	55.8	Low	72 Å²	72	131.2 Å²	131.2	60%	0.595	66%	0.663	S	S	*	*	H	α-helix	trans	-72.4	-44.5	-179.4	0	0	0	0	0	112	S996	A992-S996 PolarHBondContact O-N 3Å
993	N	54.1	Low	58.5	Low	134 Å²	134	125.6 Å²	125.6	72%	0.717	64%	0.64	S	S	*	*	H	α-helix	trans	-71.4	-34.7	-179.6	-75	-10.4	0	0	0	113.1	H997	N993-H997 PolarHBondContact O-N 2.81Å
994	S	58.2	Low	61.2	Low	63 Å²	63	121.7 Å²	121.7	44%	0.441	62%	0.623	S	S	.	*	H	α-helix	trans	-69.8	-35.8	178	55	0	0	0	0	112.8	S990 R991 H997 L998	S990-S994 PolarHBondContact O-OG 3.44Å; R991-S994 PolarHBondContact O-OG 3.41Å; S994-H997 PolarHBondContact O-N 2.92Å; S994-L998 WeakPolarHBondContact O-CB 3.16Å; S994-L998 PolarHBondContact O-N 3.07Å
995	K	71.7	Confident	63.8	Low	125 Å²	125	118.3 Å²	118.3	54%	0.543	61%	0.61	S	S	.	*	H	α-helix	trans	-63.3	-45.9	174.1	-78	-177.8	179.1	-177.2	0	112.1	R991 H997 L998 F999	R991-K995 WeakPolarHBondContact O-CG 3.14Å; R991-K995 PolarHBondContact O-N 3.46Å; K995-H997 PolarHBondContact O-N 3.15Å; K995-L998 PolarHBondContact O-N 3.45Å; K995-F999 WeakPolarHBondContact O-CD2 3.3Å; K995-F999 PolarHBondContact O-N 3.35Å
996	S	76.2	Confident	66.3	Low	68 Å²	68	115.4 Å²	115.4	48%	0.476	60%	0.6	S	S	.	*	H	α-helix	trans	-57.9	-46.2	176.6	162	0	0	0	0	112.3	A992 L998 F999 T1000	A992-S996 PolarHBondContact O-N 3Å; S996-L998 VanDerWaalsContact C-N 3.34Å; S996-L998 PolarHBondContact O-N 3Å; S996-F999 PolarHBondContact O-N 2.66Å; S996-T1000 PolarHBondContact O-N 2.77Å; S996-T1000 VanDerWaalsContact O-N 3.08Å; S996-T1000 PolarHBondContact O-OG1 3.28Å
997	H	75	Confident	69.1	Low	133 Å²	133	114.5 Å²	114.5	62%	0.616	60%	0.595	S	S	*	*	H	α-helix	trans	-62.5	-41.3	176.2	-102.3	68.2	0	0	0	112.2	N993 S994 K995 T1000 L1001	N993-H997 PolarHBondContact O-N 2.81Å; S994-H997 PolarHBondContact O-N 2.92Å; K995-H997 PolarHBondContact O-N 3.15Å; H997-T1000 PolarHBondContact O-N 2.69Å; H997-L1001 WeakPolarHBondContact O-CG 3.22Å; H997-L1001 PolarHBondContact O-N 3.42Å
998	L	76.1	Confident	71.4	Confident	101 Å²	101	106.3 Å²	106.3	53%	0.529	57%	0.573	S	S	.	*	H	α-helix	trans	-64.4	-41.5	178.7	-172.4	132.4	0	0	0	112.2	S994 K995 S996 T1000 L1001 L1002	S994-L998 WeakPolarHBondContact O-CB 3.16Å; S994-L998 PolarHBondContact O-N 3.07Å; K995-L998 PolarHBondContact O-N 3.45Å; S996-L998 VanDerWaalsContact C-N 3.34Å; S996-L998 PolarHBondContact O-N 3Å; L998-T1000 VanDerWaalsContact C-N 3.34Å; L998-T1000 PolarHBondContact O-N 3.01Å; L998-L1001 PolarHBondContact O-N 2.66Å; L998-L1002 HydrophobicContact CD2-CD1 3.63Å; L998-L1002 HydrophobicContact CG-CD1 4.4Å; L998-L1002 WeakPolarHBondContact O-CB 3.18Å; L998-L1002 WeakPolarHBondContact O-CG 3.38Å; L998-L1002 PolarHBondContact O-N 3.37Å
999	F	82.1	Confident	73.4	Confident	143 Å²	143	105.8 Å²	105.8	63%	0.627	56%	0.561	S	S	*	*	H	α-helix	trans	-63.4	-38.9	173.5	-79.1	-67.3	0	0	0	112.5	K995 S996 L1002 A1003	K995-F999 WeakPolarHBondContact O-CD2 3.3Å; K995-F999 PolarHBondContact O-N 3.35Å; S996-F999 PolarHBondContact O-N 2.66Å; F999-L1002 PolarHBondContact O-N 2.87Å; F999-A1003 PolarHBondContact O-N 3.22Å
1000	T	83.3	Confident	75.7	Confident	71 Å²	71	103.8 Å²	103.8	44%	0.436	55%	0.55	S	S	.	.	H	α-helix	trans	-65.9	-41.1	176.7	-54	0	0	0	0	111.8	S996 H997 L998 A1003 K1004	S996-T1000 PolarHBondContact O-N 2.77Å; S996-T1000 VanDerWaalsContact O-N 3.08Å; S996-T1000 PolarHBondContact O-OG1 3.28Å; H997-T1000 PolarHBondContact O-N 2.69Å; L998-T1000 VanDerWaalsContact C-N 3.34Å; L998-T1000 PolarHBondContact O-N 3.01Å; T1000-A1003 PolarHBondContact O-N 2.76Å; T1000-K1004 WeakPolarHBondContact O-CG 3.4Å; T1000-K1004 PolarHBondContact O-N 2.77Å; T1000-K1004 VanDerWaalsContact O-N 3.14Å
1001	L	79.5	Confident	77.6	Confident	108 Å²	108	102.4 Å²	102.4	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-66.7	-40.1	175.9	-72.9	173.3	0	0	0	112	H997 L998 K1004 L1005	H997-L1001 WeakPolarHBondContact O-CG 3.22Å; H997-L1001 PolarHBondContact O-N 3.42Å; L998-L1001 PolarHBondContact O-N 2.66Å; L1001-K1004 PolarHBondContact O-N 3.01Å; L1001-L1005 PolarHBondContact O-N 3.38Å
1002	L	82	Confident	79.6	Confident	82 Å²	82	98.5 Å²	98.5	43%	0.429	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-41.3	174.9	-82.4	166.9	0	0	0	112.2	L998 F999 L1005 N1006	L998-L1002 HydrophobicContact CD2-CD1 3.63Å; L998-L1002 HydrophobicContact CG-CD1 4.4Å; L998-L1002 WeakPolarHBondContact O-CB 3.18Å; L998-L1002 WeakPolarHBondContact O-CG 3.38Å; L998-L1002 PolarHBondContact O-N 3.37Å; F999-L1002 PolarHBondContact O-N 2.87Å; L1002-L1005 PolarHBondContact O-N 2.89Å; L1002-N1006 PolarHBondContact O-N 3.14Å
1003	A	86.6	Confident	81.3	Confident	47 Å²	47	100.8 Å²	100.8	39%	0.388	52%	0.52	S	S	.	.	H	α-helix	trans	-61	-47.4	175.1	0	0	0	0	0	111.6	F999 T1000 L1005 N1006 D1007	F999-A1003 PolarHBondContact O-N 3.22Å; T1000-A1003 PolarHBondContact O-N 2.76Å; A1003-L1005 VanDerWaalsContact C-N 3.32Å; A1003-L1005 PolarHBondContact O-N 3.11Å; A1003-N1006 WeakPolarHBondContact O-CB 3.5Å; A1003-N1006 PolarHBondContact O-N 3.3Å; A1003-D1007 PolarHBondContact O-N 2.82Å
1004	K	87.5	Confident	83.2	Confident	138 Å²	138	99.8 Å²	99.8	60%	0.6	51%	0.507	S	S	*	.	H	α-helix	trans	-62.7	-36.3	177.2	-71.8	-177.7	177.9	-176.4	0	113.2	T1000 L1001 D1007 A1008	T1000-K1004 WeakPolarHBondContact O-CG 3.4Å; T1000-K1004 PolarHBondContact O-N 2.77Å; T1000-K1004 VanDerWaalsContact O-N 3.14Å; L1001-K1004 PolarHBondContact O-N 3.01Å; K1004-D1007 PolarHBondContact O-N 3.2Å; K1004-A1008 WeakPolarHBondContact O-CB 3.43Å; K1004-A1008 PolarHBondContact O-N 3.37Å
1005	L	82.1	Confident	84.8	Confident	116 Å²	116	101 Å²	101	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-65.2	-41.4	174.9	-89	165	0	0	0	111.7	L1001 L1002 A1003 A1008 E1009	L1001-L1005 PolarHBondContact O-N 3.38Å; L1002-L1005 PolarHBondContact O-N 2.89Å; A1003-L1005 VanDerWaalsContact C-N 3.32Å; A1003-L1005 PolarHBondContact O-N 3.11Å; L1005-A1008 PolarHBondContact O-N 3.18Å; L1005-E1009 PolarHBondContact O-N 3.31Å
1006	N	87.1	Confident	85.8	Confident	102 Å²	102	101.9 Å²	101.9	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-64.1	-42.2	175.6	-76.4	-20.1	0	0	0	112	L1002 A1003 E1009 F1010	L1002-N1006 PolarHBondContact O-N 3.14Å; A1003-N1006 WeakPolarHBondContact O-CB 3.5Å; A1003-N1006 PolarHBondContact O-N 3.3Å; N1006-E1009 PolarHBondContact O-N 3.4Å; N1006-F1010 PolarHBondContact O-N 2.99Å
1007	D	89.9	Confident	86.6	Confident	112 Å²	112	105.6 Å²	105.6	60%	0.599	52%	0.521	S	S	*	.	H	α-helix	trans	-62.9	-43.1	176.2	-66.9	-22.7	0	0	0	111.4	A1003 K1004 E1009 F1010 E1011	A1003-D1007 PolarHBondContact O-N 2.82Å; K1004-D1007 PolarHBondContact O-N 3.2Å; D1007-E1009 VanDerWaalsContact C-N 3.34Å; D1007-E1009 PolarHBondContact O-N 3.14Å; D1007-F1010 PolarHBondContact O-N 2.68Å; D1007-E1011 PolarHBondContact O-N 3.12Å
1008	A	86.5	Confident	87.4	Confident	48 Å²	48	103.6 Å²	103.6	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-38.4	176.1	0	0	0	0	0	112.2	K1004 L1005 F1010 E1011 I1012	K1004-A1008 WeakPolarHBondContact O-CB 3.43Å; K1004-A1008 PolarHBondContact O-N 3.37Å; L1005-A1008 PolarHBondContact O-N 3.18Å; A1008-F1010 VanDerWaalsContact C-N 3.35Å; A1008-E1011 PolarHBondContact O-N 3.21Å; A1008-I1012 VanDerWaalsContact O-CG1 3.28Å; A1008-I1012 WeakPolarHBondContact O-CG1 3.36Å; A1008-I1012 PolarHBondContact O-N 2.86Å
1009	E	88.6	Confident	88.2	Confident	97 Å²	97	105.5 Å²	105.5	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-39.8	175.7	-162.1	-168.2	147.3	0	0	111.7	L1005 N1006 D1007 I1012 K1013	L1005-E1009 PolarHBondContact O-N 3.31Å; N1006-E1009 PolarHBondContact O-N 3.4Å; D1007-E1009 VanDerWaalsContact C-N 3.34Å; D1007-E1009 PolarHBondContact O-N 3.14Å; E1009-I1012 PolarHBondContact O-N 3.46Å; E1009-K1013 WeakPolarHBondContact O-CG 3.15Å; E1009-K1013 PolarHBondContact O-N 2.97Å; E1009-K1013 VanDerWaalsContact OE1-CE 3.27Å; E1009-K1013 WeakPolarHBondContact OE1-CE 3.45Å; E1009-K1013 IonicContact OE1-NZ 3.75Å; E1009-K1013 PolarHBondContact OE1-NZ 3.17Å
1010	F	90.8	Very high	88.7	Confident	149 Å²	149	101.5 Å²	101.5	65%	0.654	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-43.8	175.2	-169.4	-94.4	0	0	0	111.6	N1006 D1007 A1008 I1012 K1013 R1014	N1006-F1010 PolarHBondContact O-N 2.99Å; D1007-F1010 PolarHBondContact O-N 2.68Å; A1008-F1010 VanDerWaalsContact C-N 3.35Å; F1010-I1012 PolarHBondContact O-N 3.41Å; F1010-K1013 WeakPolarHBondContact O-CB 3.5Å; F1010-K1013 PolarHBondContact O-N 2.93Å; F1010-R1014 PolarHBondContact O-N 3.25Å
1011	E	90.3	Very high	89.2	Confident	68 Å²	68	103.7 Å²	103.7	32%	0.318	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-40.4	178.3	-166.1	65.6	-176.7	0	0	112.1	D1007 A1008 K1013 R1014 L1015	D1007-E1011 PolarHBondContact O-N 3.12Å; A1008-E1011 PolarHBondContact O-N 3.21Å; E1011-K1013 VanDerWaalsContact C-N 3.31Å; E1011-K1013 PolarHBondContact O-N 3.19Å; E1011-R1014 VanDerWaalsContact CD-CZ 3.47Å; E1011-R1014 VanDerWaalsContact CD-NH1 3.27Å; E1011-R1014 WeakPolarHBondContact O-CB 3.41Å; E1011-R1014 PolarHBondContact O-N 3.46Å; E1011-R1014 IonicContact OE1-CZ 2.66Å; E1011-R1014 IonicContact OE1-NE 3.66Å; E1011-R1014 IonicContact OE1-NH1 3.52Å; E1011-R1014 PolarHBondContact OE1-NH1 3.21Å; E1011-R1014 IonicContact OE1-NH2 2.61Å; E1011-R1014 PolarHBondContact OE1-NH2 3.47Å; E1011-R1014 IonicContact OE2-CZ 2.8Å; E1011-R1014 VanDerWaalsContact OE2-CZ 3.27Å; E1011-R1014 IonicContact OE2-NE 3.47Å; E1011-R1014 IonicContact OE2-NH1 3.8Å; E1011-R1014 PolarHBondContact OE2-NH1 2.93Å; E1011-R1014 IonicContact OE2-NH2 3.92Å; E1011-L1015 HydrophobicContact CG-CD1 4.4Å; E1011-L1015 WeakPolarHBondContact O-CG 3.32Å; E1011-L1015 PolarHBondContact O-N 2.79Å
1012	I	88.7	Confident	89.8	Confident	92 Å²	92	103.9 Å²	103.9	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-39.2	173.9	-70.9	168.1	0	0	0	111.1	A1008 E1009 F1010 K1016	A1008-I1012 VanDerWaalsContact O-CG1 3.28Å; A1008-I1012 WeakPolarHBondContact O-CG1 3.36Å; A1008-I1012 PolarHBondContact O-N 2.86Å; E1009-I1012 PolarHBondContact O-N 3.46Å; F1010-I1012 PolarHBondContact O-N 3.41Å; I1012-K1016 HydrophobicContact CG2-CD 4.33Å; I1012-K1016 WeakPolarHBondContact O-CB 3.39Å; I1012-K1016 VanDerWaalsContact O-CG 3.32Å; I1012-K1016 WeakPolarHBondContact O-CG 3.35Å; I1012-K1016 PolarHBondContact O-N 3.08Å
1013	K	91.3	Very high	90.2	Very high	119 Å²	119	104.4 Å²	104.4	52%	0.517	52%	0.519	S	S	.	.	H	α-helix	trans	-64.8	-42.2	175	-76.1	174.5	-173.4	161.3	0	111.4	E1009 F1010 E1011 K1016 Q1017	E1009-K1013 WeakPolarHBondContact O-CG 3.15Å; E1009-K1013 PolarHBondContact O-N 2.97Å; E1009-K1013 VanDerWaalsContact OE1-CE 3.27Å; E1009-K1013 WeakPolarHBondContact OE1-CE 3.45Å; E1009-K1013 IonicContact OE1-NZ 3.75Å; E1009-K1013 PolarHBondContact OE1-NZ 3.17Å; F1010-K1013 WeakPolarHBondContact O-CB 3.5Å; F1010-K1013 PolarHBondContact O-N 2.93Å; E1011-K1013 VanDerWaalsContact C-N 3.31Å; E1011-K1013 PolarHBondContact O-N 3.19Å; K1013-K1016 PolarHBondContact O-N 2.93Å; K1013-Q1017 PolarHBondContact O-N 3.36Å
1014	R	94	Very high	90.4	Very high	114 Å²	114	107.2 Å²	107.2	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-60.5	-49.1	175.7	-163.2	-174.5	87.4	-153	2.4	112	F1010 E1011 K1016 Q1017 E1018	F1010-R1014 PolarHBondContact O-N 3.25Å; E1011-R1014 VanDerWaalsContact CD-CZ 3.47Å; E1011-R1014 VanDerWaalsContact CD-NH1 3.27Å; E1011-R1014 WeakPolarHBondContact O-CB 3.41Å; E1011-R1014 PolarHBondContact O-N 3.46Å; E1011-R1014 IonicContact OE1-CZ 2.66Å; E1011-R1014 IonicContact OE1-NE 3.66Å; E1011-R1014 IonicContact OE1-NH1 3.52Å; E1011-R1014 PolarHBondContact OE1-NH1 3.21Å; E1011-R1014 IonicContact OE1-NH2 2.61Å; E1011-R1014 PolarHBondContact OE1-NH2 3.47Å; E1011-R1014 IonicContact OE2-CZ 2.8Å; E1011-R1014 VanDerWaalsContact OE2-CZ 3.27Å; E1011-R1014 IonicContact OE2-NE 3.47Å; E1011-R1014 IonicContact OE2-NH1 3.8Å; E1011-R1014 PolarHBondContact OE2-NH1 2.93Å; E1011-R1014 IonicContact OE2-NH2 3.92Å; R1014-K1016 VanDerWaalsContact C-N 3.31Å; R1014-K1016 PolarHBondContact O-N 3.4Å; R1014-Q1017 WeakPolarHBondContact O-CB 3.32Å; R1014-Q1017 PolarHBondContact O-N 3.46Å; R1014-Q1017 VanDerWaalsContact O-N 3.07Å; R1014-E1018 PolarHBondContact O-N 3.4Å
1015	L	91.6	Very high	90.6	Very high	87 Å²	87	105.2 Å²	105.2	46%	0.455	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-34	179.4	-69.8	172.5	0	0	0	112.7	E1011 Q1017 K1019	E1011-L1015 HydrophobicContact CG-CD1 4.4Å; E1011-L1015 WeakPolarHBondContact O-CG 3.32Å; E1011-L1015 PolarHBondContact O-N 2.79Å; L1015-Q1017 VanDerWaalsContact C-N 3.33Å; L1015-K1019 WeakPolarHBondContact O-CB 3.33Å; L1015-K1019 PolarHBondContact O-N 3.38Å
1016	K	92.1	Very high	90.9	Very high	145 Å²	145	104.4 Å²	104.4	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-63.5	-38.6	172.7	-79	176.2	-179.8	178.7	0	112	I1012 K1013 R1014 A1020	I1012-K1016 HydrophobicContact CG2-CD 4.33Å; I1012-K1016 WeakPolarHBondContact O-CB 3.39Å; I1012-K1016 VanDerWaalsContact O-CG 3.32Å; I1012-K1016 WeakPolarHBondContact O-CG 3.35Å; I1012-K1016 PolarHBondContact O-N 3.08Å; K1013-K1016 PolarHBondContact O-N 2.93Å; R1014-K1016 VanDerWaalsContact C-N 3.31Å; R1014-K1016 PolarHBondContact O-N 3.4Å; K1016-A1020 PolarHBondContact O-N 3Å; K1016-A1020 VanDerWaalsContact O-N 3.14Å
1017	Q	93.4	Very high	91	Very high	145 Å²	145	103.9 Å²	103.9	68%	0.678	51%	0.507	S	S	*	.	H	α-helix	trans	-70.1	-43.9	177.9	-170.1	171.9	-4	0	0	111.9	K1013 R1014 L1015 K1019 A1020 Q1021	K1013-Q1017 PolarHBondContact O-N 3.36Å; R1014-Q1017 WeakPolarHBondContact O-CB 3.32Å; R1014-Q1017 PolarHBondContact O-N 3.46Å; R1014-Q1017 VanDerWaalsContact O-N 3.07Å; L1015-Q1017 VanDerWaalsContact C-N 3.33Å; Q1017-K1019 VanDerWaalsContact C-N 3.35Å; Q1017-K1019 PolarHBondContact O-N 3.36Å; Q1017-A1020 WeakPolarHBondContact O-CB 3.49Å; Q1017-A1020 PolarHBondContact O-N 3.36Å; Q1017-Q1021 PolarHBondContact O-N 3.45Å; Q1017-Q1021 VanDerWaalsContact O-N 3.07Å
1018	E	92.8	Very high	91.1	Very high	91 Å²	91	104.8 Å²	104.8	43%	0.425	51%	0.506	S	S	.	.	H	α-helix	trans	-60.4	-42.8	173.8	-78.2	178.4	174.2	0	0	112	R1014 A1020 Q1021 L1022	R1014-E1018 PolarHBondContact O-N 3.4Å; E1018-A1020 VanDerWaalsContact C-N 3.3Å; E1018-A1020 PolarHBondContact O-N 3.14Å; E1018-Q1021 PolarHBondContact O-N 3.48Å; E1018-Q1021 VanDerWaalsContact O-N 3.16Å; E1018-L1022 PolarHBondContact O-N 2.95Å
1019	K	92.1	Very high	91.2	Very high	141 Å²	141	107.5 Å²	107.5	61%	0.613	51%	0.51	S	S	*	.	H	α-helix	trans	-59.3	-40.9	175.2	-177.1	178.3	177.8	178.5	0	112	L1015 Q1017 Q1021 L1023	L1015-K1019 WeakPolarHBondContact O-CB 3.33Å; L1015-K1019 PolarHBondContact O-N 3.38Å; Q1017-K1019 VanDerWaalsContact C-N 3.35Å; Q1017-K1019 PolarHBondContact O-N 3.36Å; K1019-Q1021 VanDerWaalsContact C-N 3.33Å; K1019-L1023 HydrophobicContact CG-CD1 4.37Å; K1019-L1023 WeakPolarHBondContact O-CG 3.48Å; K1019-L1023 PolarHBondContact O-N 3.49Å; K1019-L1023 VanDerWaalsContact O-N 3.1Å
1020	A	93.5	Very high	91.2	Very high	60 Å²	60	107.3 Å²	107.3	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-65.2	-37.7	177.2	0	0	0	0	0	112	K1016 Q1017 E1018 L1024	K1016-A1020 PolarHBondContact O-N 3Å; K1016-A1020 VanDerWaalsContact O-N 3.14Å; Q1017-A1020 WeakPolarHBondContact O-CB 3.49Å; Q1017-A1020 PolarHBondContact O-N 3.36Å; E1018-A1020 VanDerWaalsContact C-N 3.3Å; E1018-A1020 PolarHBondContact O-N 3.14Å; A1020-L1024 PolarHBondContact O-N 3Å
1021	Q	93.9	Very high	91.2	Very high	116 Å²	116	104.6 Å²	104.6	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-44.5	176.9	-172.9	171.4	-7.5	0	0	112.4	Q1017 E1018 K1019 L1023 L1024 E1025	Q1017-Q1021 PolarHBondContact O-N 3.45Å; Q1017-Q1021 VanDerWaalsContact O-N 3.07Å; E1018-Q1021 PolarHBondContact O-N 3.48Å; E1018-Q1021 VanDerWaalsContact O-N 3.16Å; K1019-Q1021 VanDerWaalsContact C-N 3.33Å; Q1021-L1023 VanDerWaalsContact C-N 3.3Å; Q1021-L1023 PolarHBondContact O-N 3.03Å; Q1021-L1024 WeakPolarHBondContact O-CB 3.35Å; Q1021-L1024 PolarHBondContact O-N 3Å; Q1021-L1024 VanDerWaalsContact O-N 3.12Å; Q1021-E1025 PolarHBondContact O-N 3.17Å
1022	L	91.2	Very high	91.2	Very high	112 Å²	112	107.4 Å²	107.4	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-62.6	-36.2	176.5	-72.7	172.6	0	0	0	112.5	E1018 L1024 E1025 Q1026	E1018-L1022 PolarHBondContact O-N 2.95Å; L1022-L1024 VanDerWaalsContact C-N 3.34Å; L1022-E1025 PolarHBondContact O-N 3.02Å; L1022-Q1026 WeakPolarHBondContact O-CB 3.43Å; L1022-Q1026 PolarHBondContact O-N 2.95Å
1023	L	90.4	Very high	91	Very high	94 Å²	94	110.2 Å²	110.2	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-38.3	174	-76.3	171.5	0	0	0	112	K1019 Q1021 Q1026 E1027	K1019-L1023 HydrophobicContact CG-CD1 4.37Å; K1019-L1023 WeakPolarHBondContact O-CG 3.48Å; K1019-L1023 PolarHBondContact O-N 3.49Å; K1019-L1023 VanDerWaalsContact O-N 3.1Å; Q1021-L1023 VanDerWaalsContact C-N 3.3Å; Q1021-L1023 PolarHBondContact O-N 3.03Å; L1023-Q1026 PolarHBondContact O-N 3.38Å; L1023-E1027 PolarHBondContact O-N 2.97Å
1024	L	91.6	Very high	90.8	Very high	105 Å²	105	109.2 Å²	109.2	55%	0.55	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-40.1	176.4	-167.9	76.6	0	0	0	111.9	A1020 Q1021 L1022 E1027 K1028	A1020-L1024 PolarHBondContact O-N 3Å; Q1021-L1024 WeakPolarHBondContact O-CB 3.35Å; Q1021-L1024 PolarHBondContact O-N 3Å; Q1021-L1024 VanDerWaalsContact O-N 3.12Å; L1022-L1024 VanDerWaalsContact C-N 3.34Å; L1024-E1027 PolarHBondContact O-N 3.05Å; L1024-K1028 WeakPolarHBondContact O-CG 3.36Å; L1024-K1028 PolarHBondContact O-N 3.27Å; L1024-K1028 VanDerWaalsContact O-N 3.08Å
1025	E	90.4	Very high	90.6	Very high	97 Å²	97	106.9 Å²	106.9	45%	0.453	52%	0.523	S	S	.	.	H	α-helix	trans	-66.1	-41.8	174.5	-81.3	174.3	178.1	0	0	112.1	Q1021 L1022 E1027 K1028 E1029	Q1021-E1025 PolarHBondContact O-N 3.17Å; L1022-E1025 PolarHBondContact O-N 3.02Å; E1025-E1027 VanDerWaalsContact C-N 3.27Å; E1025-E1027 PolarHBondContact O-N 3.18Å; E1025-K1028 WeakPolarHBondContact O-CB 3.24Å; E1025-K1028 PolarHBondContact O-N 3.46Å; E1025-E1029 PolarHBondContact O-N 3.28Å
1026	Q	89.4	Confident	90.3	Very high	98 Å²	98	106.8 Å²	106.8	46%	0.458	53%	0.528	S	S	.	.	H	α-helix	trans	-59.7	-39.3	175.3	-169.3	-177.6	40.7	0	0	111.8	L1022 L1023 E1029 K1030	L1022-Q1026 WeakPolarHBondContact O-CB 3.43Å; L1022-Q1026 PolarHBondContact O-N 2.95Å; L1023-Q1026 PolarHBondContact O-N 3.38Å; Q1026-E1029 PolarHBondContact O-N 3.39Å; Q1026-K1030 WeakPolarHBondContact O-CG 3.36Å; Q1026-K1030 PolarHBondContact O-N 3.37Å
1027	E	89.3	Confident	89.9	Confident	91 Å²	91	105.3 Å²	105.3	43%	0.425	53%	0.526	S	S	.	.	H	α-helix	trans	-70.2	-37.3	177.8	-160.1	60	-155.1	0	0	112.1	L1023 L1024 E1025 K1030 N1031	L1023-E1027 PolarHBondContact O-N 2.97Å; L1024-E1027 PolarHBondContact O-N 3.05Å; E1025-E1027 VanDerWaalsContact C-N 3.27Å; E1025-E1027 PolarHBondContact O-N 3.18Å; E1027-K1030 PolarHBondContact O-N 3.36Å; E1027-K1030 IonicContact OE2-NZ 2.75Å; E1027-N1031 WeakPolarHBondContact O-CB 3.42Å; E1027-N1031 PolarHBondContact O-N 3.47Å; E1027-N1031 PolarHBondContact O-ND2 2.97Å; E1027-N1031 VanDerWaalsContact O-ND2 3.12Å
1028	K	92.3	Very high	89.6	Confident	132 Å²	132	105.3 Å²	105.3	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-61.8	-43.4	171.9	-73.2	175.1	-178.5	176.7	0	111.9	L1024 E1025 N1031 L1032	L1024-K1028 WeakPolarHBondContact O-CG 3.36Å; L1024-K1028 PolarHBondContact O-N 3.27Å; L1024-K1028 VanDerWaalsContact O-N 3.08Å; E1025-K1028 WeakPolarHBondContact O-CB 3.24Å; E1025-K1028 PolarHBondContact O-N 3.46Å; K1028-N1031 PolarHBondContact O-N 3.2Å; K1028-L1032 PolarHBondContact O-N 3.49Å
1029	E	88	Confident	89.4	Confident	105 Å²	105	105 Å²	105	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-64	-41.1	176.2	-77.7	-167.4	176.2	0	0	112.8	E1025 Q1026 N1031 L1032 R1033	E1025-E1029 PolarHBondContact O-N 3.28Å; Q1026-E1029 PolarHBondContact O-N 3.39Å; E1029-N1031 VanDerWaalsContact C-N 3.34Å; E1029-L1032 PolarHBondContact O-N 3.04Å; E1029-R1033 WeakPolarHBondContact O-CG 3.48Å; E1029-R1033 PolarHBondContact O-N 3.21Å; E1029-R1033 IonicContact OE2-CZ 3.03Å; E1029-R1033 IonicContact OE2-NH2 3.19Å; E1029-R1033 PolarHBondContact OE2-NH2 2.81Å
1030	K	88.2	Confident	89.1	Confident	92 Å²	92	101.3 Å²	101.3	40%	0.4	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-44.7	175.3	-75.5	175.9	-173.6	167.4	0	111.1	Q1026 E1027 L1032 R1033 N1034	Q1026-K1030 WeakPolarHBondContact O-CG 3.36Å; Q1026-K1030 PolarHBondContact O-N 3.37Å; E1027-K1030 PolarHBondContact O-N 3.36Å; E1027-K1030 IonicContact OE2-NZ 2.75Å; K1030-L1032 VanDerWaalsContact C-N 3.33Å; K1030-L1032 PolarHBondContact O-N 3.1Å; K1030-R1033 PolarHBondContact O-N 3.22Å; K1030-N1034 WeakPolarHBondContact O-CB 3.42Å; K1030-N1034 PolarHBondContact O-N 2.95Å
1031	N	90	Very high	88.7	Confident	92 Å²	92	106.2 Å²	106.2	49%	0.492	53%	0.533	S	S	.	.	H	α-helix	trans	-63	-39.2	177.4	-74.1	-34	0	0	0	112.3	E1027 K1028 E1029 N1034 S1035	E1027-N1031 WeakPolarHBondContact O-CB 3.42Å; E1027-N1031 PolarHBondContact O-N 3.47Å; E1027-N1031 PolarHBondContact O-ND2 2.97Å; E1027-N1031 VanDerWaalsContact O-ND2 3.12Å; K1028-N1031 PolarHBondContact O-N 3.2Å; E1029-N1031 VanDerWaalsContact C-N 3.34Å; N1031-N1034 PolarHBondContact O-N 2.94Å; N1031-S1035 WeakPolarHBondContact O-CB 3.48Å; N1031-S1035 PolarHBondContact O-N 3.19Å
1032	L	90.3	Very high	88.4	Confident	127 Å²	127	103.8 Å²	103.8	67%	0.665	53%	0.529	S	S	*	.	H	α-helix	trans	-65.9	-42.5	175.8	-170.7	65.1	0	0	0	112.2	K1028 E1029 K1030 S1035 C1036	K1028-L1032 PolarHBondContact O-N 3.49Å; E1029-L1032 PolarHBondContact O-N 3.04Å; K1030-L1032 VanDerWaalsContact C-N 3.33Å; K1030-L1032 PolarHBondContact O-N 3.1Å; L1032-S1035 PolarHBondContact O-N 3.14Å; L1032-C1036 PolarHBondContact O-N 3.07Å
1033	R	85	Confident	88.2	Confident	151 Å²	151	101 Å²	101	57%	0.57	52%	0.523	S	S	*	.	H	α-helix	trans	-62	-44.6	175.1	-71.4	-179.2	-131	-155.4	1.1	111.5	E1029 K1030 S1035 C1036 I1037	E1029-R1033 WeakPolarHBondContact O-CG 3.48Å; E1029-R1033 PolarHBondContact O-N 3.21Å; E1029-R1033 IonicContact OE2-CZ 3.03Å; E1029-R1033 IonicContact OE2-NH2 3.19Å; E1029-R1033 PolarHBondContact OE2-NH2 2.81Å; K1030-R1033 PolarHBondContact O-N 3.22Å; R1033-S1035 PolarHBondContact O-N 3.4Å; R1033-C1036 PolarHBondContact O-N 3.31Å; R1033-I1037 VanDerWaalsContact O-CG1 3.3Å; R1033-I1037 WeakPolarHBondContact O-CG1 3.43Å; R1033-I1037 PolarHBondContact O-N 3.35Å
1034	N	88.2	Confident	88.1	Confident	98 Å²	98	98.6 Å²	98.6	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177.6	-72.9	-16.1	0	0	0	112	K1030 N1031 C1036 I1037 Q1038	K1030-N1034 WeakPolarHBondContact O-CB 3.42Å; K1030-N1034 PolarHBondContact O-N 2.95Å; N1031-N1034 PolarHBondContact O-N 2.94Å; N1034-C1036 PolarHBondContact O-N 3.32Å; N1034-I1037 PolarHBondContact O-N 3.3Å; N1034-Q1038 WeakPolarHBondContact O-CB 3.3Å; N1034-Q1038 PolarHBondContact O-N 3.49Å
1035	S	88.8	Confident	87.9	Confident	65 Å²	65	96.4 Å²	96.4	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-41.2	175.1	180	0	0	0	0	112.3	N1031 L1032 R1033 Q1038 T1039	N1031-S1035 WeakPolarHBondContact O-CB 3.48Å; N1031-S1035 PolarHBondContact O-N 3.19Å; L1032-S1035 PolarHBondContact O-N 3.14Å; R1033-S1035 PolarHBondContact O-N 3.4Å; S1035-Q1038 PolarHBondContact O-N 2.91Å; S1035-T1039 WeakPolarHBondContact O-CB 3.33Å; S1035-T1039 PolarHBondContact O-N 2.95Å; S1035-T1039 PolarHBondContact O-OG1 3.49Å
1036	C	85.5	Confident	87.8	Confident	85 Å²	85	96 Å²	96	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-65.3	-44.4	177.5	-167.7	0	0	0	0	111.9	L1032 R1033 N1034 T1039 A1040	L1032-C1036 PolarHBondContact O-N 3.07Å; R1033-C1036 PolarHBondContact O-N 3.31Å; N1034-C1036 PolarHBondContact O-N 3.32Å; C1036-T1039 PolarHBondContact O-N 3.48Å; C1036-A1040 WeakPolarHBondContact O-CB 3.13Å; C1036-A1040 PolarHBondContact O-N 2.75Å
1037	I	84.3	Confident	87.7	Confident	114 Å²	114	96.1 Å²	96.1	59%	0.585	51%	0.508	S	S	*	.	H	α-helix	trans	-61.7	-45.3	176.2	-67.1	165.8	0	0	0	110.7	R1033 N1034 T1039 A1040 Y1041	R1033-I1037 VanDerWaalsContact O-CG1 3.3Å; R1033-I1037 WeakPolarHBondContact O-CG1 3.43Å; R1033-I1037 PolarHBondContact O-N 3.35Å; N1034-I1037 PolarHBondContact O-N 3.3Å; I1037-T1039 VanDerWaalsContact C-N 3.32Å; I1037-T1039 PolarHBondContact O-N 2.8Å; I1037-A1040 PolarHBondContact O-N 3.31Å; I1037-Y1041 WeakPolarHBondContact O-CB 3.09Å; I1037-Y1041 PolarHBondContact O-N 2.82Å
1038	Q	86.6	Confident	87.5	Confident	145 Å²	145	97.4 Å²	97.4	68%	0.678	52%	0.517	S	S	*	.	H	α-helix	trans	-63.7	-38.7	179.5	-168.5	171.1	3.2	0	0	111.9	N1034 S1035 Y1041 S1042	N1034-Q1038 WeakPolarHBondContact O-CB 3.3Å; N1034-Q1038 PolarHBondContact O-N 3.49Å; S1035-Q1038 PolarHBondContact O-N 2.91Å; Q1038-Y1041 PolarHBondContact O-N 3.32Å; Q1038-S1042 WeakPolarHBondContact O-CB 3.36Å; Q1038-S1042 PolarHBondContact O-N 2.94Å; Q1038-S1042 PolarHBondContact O-OG 3.14Å
1039	T	88.7	Confident	87.4	Confident	84 Å²	84	97.9 Å²	97.9	52%	0.515	52%	0.515	S	S	.	.	H	α-helix	trans	-64.9	-47.6	175	-53.5	0	0	0	0	111.2	S1035 C1036 I1037 Y1041 S1042 A1043	S1035-T1039 WeakPolarHBondContact O-CB 3.33Å; S1035-T1039 PolarHBondContact O-N 2.95Å; S1035-T1039 PolarHBondContact O-OG1 3.49Å; C1036-T1039 PolarHBondContact O-N 3.48Å; I1037-T1039 VanDerWaalsContact C-N 3.32Å; I1037-T1039 PolarHBondContact O-N 2.8Å; T1039-Y1041 VanDerWaalsContact C-N 3.34Å; T1039-Y1041 PolarHBondContact O-N 3.27Å; T1039-S1042 PolarHBondContact O-N 3.34Å; T1039-S1042 PolarHBondContact O-OG 3.23Å; T1039-A1043 PolarHBondContact O-N 3.23Å
1040	A	85.5	Confident	87.6	Confident	65 Å²	65	98.2 Å²	98.2	54%	0.537	52%	0.515	S	S	.	.	H	α-helix	trans	-60.9	-41.5	177.2	0	0	0	0	0	112.2	C1036 I1037 A1043 G1044	C1036-A1040 WeakPolarHBondContact O-CB 3.13Å; C1036-A1040 PolarHBondContact O-N 2.75Å; I1037-A1040 PolarHBondContact O-N 3.31Å; A1040-A1043 PolarHBondContact O-N 3.12Å; A1040-G1044 PolarHBondContact O-N 3.41Å
1041	Y	84.3	Confident	87.7	Confident	162 Å²	162	98.9 Å²	98.9	64%	0.635	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-43.4	175.9	-173.9	-101.6	0	0	0	112.1	I1037 Q1038 T1039 G1044 L1045	I1037-Y1041 WeakPolarHBondContact O-CB 3.09Å; I1037-Y1041 PolarHBondContact O-N 2.82Å; Q1038-Y1041 PolarHBondContact O-N 3.32Å; T1039-Y1041 VanDerWaalsContact C-N 3.34Å; T1039-Y1041 PolarHBondContact O-N 3.27Å; Y1041-G1044 PolarHBondContact O-N 3.13Å; Y1041-L1045 HydrophobicContact CD1-CD1 3.82Å; Y1041-L1045 HydrophobicContact CE1-CD1 3.36Å; Y1041-L1045 HydrophobicContact CE1-CG 4.18Å; Y1041-L1045 PolarHBondContact O-N 3.36Å
1042	S	87.5	Confident	87.7	Confident	65 Å²	65	99.9 Å²	99.9	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-64.5	-39.1	176.7	71.7	0	0	0	0	113	Q1038 T1039 L1045 E1046	Q1038-S1042 WeakPolarHBondContact O-CB 3.36Å; Q1038-S1042 PolarHBondContact O-N 2.94Å; Q1038-S1042 PolarHBondContact O-OG 3.14Å; T1039-S1042 PolarHBondContact O-N 3.34Å; T1039-S1042 PolarHBondContact O-OG 3.23Å; S1042-L1045 PolarHBondContact O-N 2.93Å; S1042-E1046 PolarHBondContact O-N 3.39Å; S1042-E1046 VanDerWaalsContact O-N 3.12Å
1043	A	87.6	Confident	87.8	Confident	55 Å²	55	96.5 Å²	96.5	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-67.1	-42	175.8	0	0	0	0	0	111.7	T1039 A1040 L1045 E1046 E1047	T1039-A1043 PolarHBondContact O-N 3.23Å; A1040-A1043 PolarHBondContact O-N 3.12Å; A1043-L1045 PolarHBondContact O-N 3.43Å; A1043-E1046 PolarHBondContact O-N 3.3Å; A1043-E1047 PolarHBondContact O-N 3.25Å
1044	G	89.3	Confident	88.2	Confident	43 Å²	43	92.9 Å²	92.9	44%	0.443	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-41.4	174.9	0	0	0	0	0	112.9	A1040 Y1041 E1046 E1047 L1048	A1040-G1044 PolarHBondContact O-N 3.41Å; Y1041-G1044 PolarHBondContact O-N 3.13Å; G1044-E1046 VanDerWaalsContact C-N 3.32Å; G1044-E1046 PolarHBondContact O-N 2.78Å; G1044-E1047 PolarHBondContact O-N 3.35Å; G1044-L1048 PolarHBondContact O-N 3.15Å
1045	L	85.9	Confident	88.2	Confident	59 Å²	59	93.1 Å²	93.1	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-37.4	174.3	-84.4	171.4	0	0	0	112.6	Y1041 S1042 A1043 L1048 R1049	Y1041-L1045 HydrophobicContact CD1-CD1 3.82Å; Y1041-L1045 HydrophobicContact CE1-CD1 3.36Å; Y1041-L1045 HydrophobicContact CE1-CG 4.18Å; Y1041-L1045 PolarHBondContact O-N 3.36Å; S1042-L1045 PolarHBondContact O-N 2.93Å; A1043-L1045 PolarHBondContact O-N 3.43Å; L1045-L1048 WeakPolarHBondContact O-CB 3.45Å; L1045-L1048 PolarHBondContact O-N 3.43Å; L1045-R1049 WeakPolarHBondContact O-CG 3.45Å; L1045-R1049 PolarHBondContact O-N 3.49Å
1046	E	89.5	Confident	88.3	Confident	87 Å²	87	95.3 Å²	95.3	41%	0.407	51%	0.508	S	S	.	.	H	α-helix	trans	-70.9	-40.1	179.6	-168.1	55.9	-155	0	0	112.6	S1042 A1043 G1044 L1048 R1049 K1050	S1042-E1046 PolarHBondContact O-N 3.39Å; S1042-E1046 VanDerWaalsContact O-N 3.12Å; A1043-E1046 PolarHBondContact O-N 3.3Å; G1044-E1046 VanDerWaalsContact C-N 3.32Å; G1044-E1046 PolarHBondContact O-N 2.78Å; E1046-L1048 VanDerWaalsContact C-N 3.29Å; E1046-L1048 PolarHBondContact O-N 3.44Å; E1046-R1049 PolarHBondContact O-N 3.25Å; E1046-R1049 IonicContact OE2-NH1 2.72Å; E1046-R1049 PolarHBondContact OE2-NH1 3.17Å; E1046-K1050 PolarHBondContact O-N 3.48Å
1047	E	87.4	Confident	88.7	Confident	102 Å²	102	97.3 Å²	97.3	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-63.3	-36.4	171.6	-70.4	-56.9	127.4	0	0	111.9	A1043 G1044 R1049 K1050 L1051	A1043-E1047 PolarHBondContact O-N 3.25Å; G1044-E1047 PolarHBondContact O-N 3.35Å; E1047-R1049 PolarHBondContact O-N 3.35Å; E1047-K1050 PolarHBondContact O-N 3.19Å; E1047-K1050 IonicContact OE1-NZ 3.8Å; E1047-K1050 PolarHBondContact OE1-NZ 2.8Å; E1047-L1051 PolarHBondContact O-N 3.06Å
1048	L	84.9	Confident	89	Confident	118 Å²	118	98.5 Å²	98.5	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-39.2	174.5	-150.5	80.2	0	0	0	112	G1044 L1045 E1046 L1051 H1052	G1044-L1048 PolarHBondContact O-N 3.15Å; L1045-L1048 WeakPolarHBondContact O-CB 3.45Å; L1045-L1048 PolarHBondContact O-N 3.43Å; E1046-L1048 VanDerWaalsContact C-N 3.29Å; E1046-L1048 PolarHBondContact O-N 3.44Å; L1048-L1051 PolarHBondContact O-N 2.98Å; L1048-H1052 WeakPolarHBondContact O-CB 3.27Å; L1048-H1052 PolarHBondContact O-N 2.87Å
1049	R	90.3	Very high	89.2	Confident	142 Å²	142	100.9 Å²	100.9	54%	0.536	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-43.1	174.7	-72.8	-174.3	-167.3	100.1	7.1	112.1	L1045 E1046 E1047 H1052 A1053	L1045-R1049 WeakPolarHBondContact O-CG 3.45Å; L1045-R1049 PolarHBondContact O-N 3.49Å; E1046-R1049 PolarHBondContact O-N 3.25Å; E1046-R1049 IonicContact OE2-NH1 2.72Å; E1046-R1049 PolarHBondContact OE2-NH1 3.17Å; E1047-R1049 PolarHBondContact O-N 3.35Å; R1049-H1052 PolarHBondContact O-N 2.82Å; R1049-A1053 PolarHBondContact O-N 3.44Å
1050	K	92.9	Very high	89.4	Confident	112 Å²	112	99.6 Å²	99.6	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.5	-69.8	177.2	-168.8	163.8	0	112	E1046 E1047 H1052 A1053 E1054	E1046-K1050 PolarHBondContact O-N 3.48Å; E1047-K1050 PolarHBondContact O-N 3.19Å; E1047-K1050 IonicContact OE1-NZ 3.8Å; E1047-K1050 PolarHBondContact OE1-NZ 2.8Å; K1050-H1052 VanDerWaalsContact C-N 3.33Å; K1050-H1052 PolarHBondContact O-N 3.09Å; K1050-A1053 PolarHBondContact O-N 2.95Å; K1050-E1054 PolarHBondContact O-N 3.39Å
1051	L	89.3	Confident	89.8	Confident	105 Å²	105	100.6 Å²	100.6	55%	0.55	50%	0.501	S	S	.	.	H	α-helix	trans	-62.3	-40.1	176	-84.7	165.3	0	0	0	112	E1047 L1048 E1054 L1055	E1047-L1051 PolarHBondContact O-N 3.06Å; L1048-L1051 PolarHBondContact O-N 2.98Å; L1051-E1054 PolarHBondContact O-N 3.06Å; L1051-L1055 WeakPolarHBondContact O-CG 3.18Å; L1051-L1055 PolarHBondContact O-N 2.84Å
1052	H	89.4	Confident	89.9	Confident	114 Å²	114	99.5 Å²	99.5	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-63.3	-46	176.9	-163	65.7	0	0	0	111.9	L1048 R1049 K1050 E1054 L1055 E1056	L1048-H1052 WeakPolarHBondContact O-CB 3.27Å; L1048-H1052 PolarHBondContact O-N 2.87Å; R1049-H1052 PolarHBondContact O-N 2.82Å; K1050-H1052 VanDerWaalsContact C-N 3.33Å; K1050-H1052 PolarHBondContact O-N 3.09Å; H1052-E1054 PolarHBondContact O-N 2.9Å; H1052-L1055 PolarHBondContact O-N 3.46Å; H1052-E1056 IonicContact NE2-OE1 3.7Å; H1052-E1056 PolarHBondContact O-N 2.85Å
1053	A	92.3	Very high	90.1	Very high	56 Å²	56	101.1 Å²	101.1	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-61.8	-39.7	176.8	0	0	0	0	0	112.7	R1049 K1050 E1056 K1057	R1049-A1053 PolarHBondContact O-N 3.44Å; K1050-A1053 PolarHBondContact O-N 2.95Å; A1053-E1056 PolarHBondContact O-N 2.98Å; A1053-K1057 PolarHBondContact O-N 3.29Å
1054	E	94.2	Very high	90.3	Very high	74 Å²	74	104 Å²	104	35%	0.346	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-38.5	175.2	177.5	63.2	-165.6	0	0	112	K1050 L1051 H1052 K1057 R1058	K1050-E1054 PolarHBondContact O-N 3.39Å; L1051-E1054 PolarHBondContact O-N 3.06Å; H1052-E1054 PolarHBondContact O-N 2.9Å; E1054-K1057 PolarHBondContact O-N 3.17Å; E1054-R1058 WeakPolarHBondContact O-CG 3.18Å; E1054-R1058 PolarHBondContact O-N 2.82Å; E1054-R1058 IonicContact OE1-CZ 3.19Å; E1054-R1058 IonicContact OE1-NE 2.73Å; E1054-R1058 PolarHBondContact OE1-NE 2.91Å; E1054-R1058 IonicContact OE1-NH2 2.65Å; E1054-R1058 PolarHBondContact OE1-NH2 2.86Å
1055	L	87.8	Confident	90.5	Very high	103 Å²	103	106.9 Å²	106.9	54%	0.539	51%	0.509	S	S	.	.	H	α-helix	trans	-67.2	-38.8	175.1	-74.8	173	0	0	0	112.3	L1051 H1052 R1058 R1059	L1051-L1055 WeakPolarHBondContact O-CG 3.18Å; L1051-L1055 PolarHBondContact O-N 2.84Å; H1052-L1055 PolarHBondContact O-N 3.46Å; L1055-R1058 PolarHBondContact O-N 2.98Å; L1055-R1059 WeakPolarHBondContact O-CB 3.29Å; L1055-R1059 PolarHBondContact O-N 3.34Å
1056	E	91.2	Very high	90.7	Very high	112 Å²	112	108.2 Å²	108.2	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-63.9	-42.8	173.7	-74.7	-170	146.1	0	0	111.7	H1052 A1053 R1058 R1059 A1060	H1052-E1056 IonicContact NE2-OE1 3.7Å; H1052-E1056 PolarHBondContact O-N 2.85Å; A1053-E1056 PolarHBondContact O-N 2.98Å; E1056-R1058 PolarHBondContact O-N 2.82Å; E1056-R1059 WeakPolarHBondContact O-CB 3.26Å; E1056-R1059 PolarHBondContact O-N 3.48Å; E1056-A1060 PolarHBondContact O-N 2.98Å
1057	K	94.1	Very high	90.9	Very high	126 Å²	126	109.4 Å²	109.4	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-58.9	-48.2	174.4	-173.6	-177.5	175.8	-172	0	111.8	A1053 E1054 R1059 A1060 D1061	A1053-K1057 PolarHBondContact O-N 3.29Å; E1054-K1057 PolarHBondContact O-N 3.17Å; K1057-R1059 VanDerWaalsContact C-N 3.28Å; K1057-R1059 PolarHBondContact O-N 2.9Å; K1057-A1060 WeakPolarHBondContact O-CB 3.35Å; K1057-A1060 PolarHBondContact O-N 2.96Å; K1057-A1060 VanDerWaalsContact O-N 3.13Å; K1057-D1061 PolarHBondContact O-N 3.43Å
1058	R	91.4	Very high	91.2	Very high	139 Å²	139	108.8 Å²	108.8	53%	0.525	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-35.4	176.9	-73	-178.7	-169.2	167.9	4.4	113	E1054 L1055 E1056 F1062	E1054-R1058 WeakPolarHBondContact O-CG 3.18Å; E1054-R1058 PolarHBondContact O-N 2.82Å; E1054-R1058 IonicContact OE1-CZ 3.19Å; E1054-R1058 IonicContact OE1-NE 2.73Å; E1054-R1058 PolarHBondContact OE1-NE 2.91Å; E1054-R1058 IonicContact OE1-NH2 2.65Å; E1054-R1058 PolarHBondContact OE1-NH2 2.86Å; L1055-R1058 PolarHBondContact O-N 2.98Å; E1056-R1058 PolarHBondContact O-N 2.82Å; R1058-F1062 WeakPolarHBondContact O-CB 3.3Å; R1058-F1062 PolarHBondContact O-N 2.74Å
1059	R	89.8	Confident	91.6	Very high	195 Å²	195	109.3 Å²	109.3	74%	0.736	51%	0.514	S	S	*	.	H	α-helix	trans	-64.5	-42.7	174.8	-172.6	-170.1	-63.5	-126.2	2.2	110.9	L1055 E1056 K1057 F1062 Q1063	L1055-R1059 WeakPolarHBondContact O-CB 3.29Å; L1055-R1059 PolarHBondContact O-N 3.34Å; E1056-R1059 WeakPolarHBondContact O-CB 3.26Å; E1056-R1059 PolarHBondContact O-N 3.48Å; K1057-R1059 VanDerWaalsContact C-N 3.28Å; K1057-R1059 PolarHBondContact O-N 2.9Å; R1059-F1062 PolarHBondContact O-N 3.26Å; R1059-Q1063 WeakPolarHBondContact O-CB 3.29Å; R1059-Q1063 PolarHBondContact O-N 3.49Å
1060	A	92.2	Very high	91.7	Very high	58 Å²	58	105.7 Å²	105.7	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-45.4	176	0	0	0	0	0	111.7	E1056 K1057 F1062 Q1063 Q1064	E1056-A1060 PolarHBondContact O-N 2.98Å; K1057-A1060 WeakPolarHBondContact O-CB 3.35Å; K1057-A1060 PolarHBondContact O-N 2.96Å; K1057-A1060 VanDerWaalsContact O-N 3.13Å; A1060-F1062 VanDerWaalsContact C-N 3.33Å; A1060-F1062 PolarHBondContact O-N 3.45Å; A1060-Q1063 PolarHBondContact O-N 2.9Å; A1060-Q1064 PolarHBondContact O-N 3.27Å
1061	D	94	Very high	91.8	Very high	85 Å²	85	103.1 Å²	103.1	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-42	176.8	-65.4	-18.8	0	0	0	111.6	K1057 Q1064 L1065	K1057-D1061 PolarHBondContact O-N 3.43Å; D1061-Q1064 PolarHBondContact O-N 3.34Å; D1061-L1065 PolarHBondContact O-N 3.12Å
1062	F	86.8	Confident	92	Very high	140 Å²	140	102.7 Å²	102.7	61%	0.614	50%	0.503	S	S	*	.	H	α-helix	trans	-65	-40.4	175.6	-117.8	-84.2	0	0	0	112.5	R1058 R1059 A1060 L1065 I1066	R1058-F1062 WeakPolarHBondContact O-CB 3.3Å; R1058-F1062 PolarHBondContact O-N 2.74Å; R1059-F1062 PolarHBondContact O-N 3.26Å; A1060-F1062 VanDerWaalsContact C-N 3.33Å; A1060-F1062 PolarHBondContact O-N 3.45Å; F1062-L1065 WeakPolarHBondContact O-CB 3.49Å; F1062-L1065 PolarHBondContact O-N 2.79Å; F1062-I1066 WeakPolarHBondContact O-CG1 3.38Å; F1062-I1066 PolarHBondContact O-N 2.86Å
1063	Q	91.4	Very high	92	Very high	99 Å²	99	101.6 Å²	101.6	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-63.8	-43	177.8	-173.7	61.6	27.8	0	0	110.9	R1059 A1060 L1065 I1066 E1067	R1059-Q1063 WeakPolarHBondContact O-CB 3.29Å; R1059-Q1063 PolarHBondContact O-N 3.49Å; A1060-Q1063 PolarHBondContact O-N 2.9Å; Q1063-L1065 VanDerWaalsContact C-N 3.32Å; Q1063-L1065 PolarHBondContact O-N 3.36Å; Q1063-I1066 PolarHBondContact O-N 3.27Å; Q1063-E1067 PolarHBondContact NE2-OE1 3.29Å; Q1063-E1067 WeakPolarHBondContact O-CG 3.38Å; Q1063-E1067 PolarHBondContact O-N 2.99Å
1064	Q	92.9	Very high	92.1	Very high	115 Å²	115	102.9 Å²	102.9	54%	0.537	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-38.4	175	-167.3	179.6	12.3	0	0	111.9	A1060 D1061 E1067 N1068	A1060-Q1064 PolarHBondContact O-N 3.27Å; D1061-Q1064 PolarHBondContact O-N 3.34Å; Q1064-E1067 PolarHBondContact O-N 3.47Å; Q1064-N1068 WeakPolarHBondContact O-CB 3.45Å; Q1064-N1068 VanDerWaalsContact O-CG 3.25Å; Q1064-N1068 PolarHBondContact O-N 3.49Å; Q1064-N1068 PolarHBondContact O-ND2 3.21Å
1065	L	93.5	Very high	92.1	Very high	104 Å²	104	102.2 Å²	102.2	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-40	175.2	-175.4	65	0	0	0	112.2	D1061 F1062 Q1063 R1069	D1061-L1065 PolarHBondContact O-N 3.12Å; F1062-L1065 WeakPolarHBondContact O-CB 3.49Å; F1062-L1065 PolarHBondContact O-N 2.79Å; Q1063-L1065 VanDerWaalsContact C-N 3.32Å; Q1063-L1065 PolarHBondContact O-N 3.36Å; L1065-R1069 WeakPolarHBondContact O-CB 3.29Å; L1065-R1069 PolarHBondContact O-N 3.23Å
1066	I	89.2	Confident	92.3	Very high	86 Å²	86	104.1 Å²	104.1	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-44.7	175.8	-68.9	167	0	0	0	110.5	F1062 Q1063 R1069 T1070	F1062-I1066 WeakPolarHBondContact O-CG1 3.38Å; F1062-I1066 PolarHBondContact O-N 2.86Å; Q1063-I1066 PolarHBondContact O-N 3.27Å; I1066-R1069 PolarHBondContact O-N 3.38Å; I1066-T1070 WeakPolarHBondContact O-CB 3.5Å; I1066-T1070 PolarHBondContact O-N 2.76Å; I1066-T1070 PolarHBondContact O-OG1 2.84Å
1067	E	93.9	Very high	92.3	Very high	113 Å²	113	105.2 Å²	105.2	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-46.3	178.2	-74.1	172	-166.6	0	0	111.7	Q1063 Q1064 R1069 T1070 A1071	Q1063-E1067 PolarHBondContact NE2-OE1 3.29Å; Q1063-E1067 WeakPolarHBondContact O-CG 3.38Å; Q1063-E1067 PolarHBondContact O-N 2.99Å; Q1064-E1067 PolarHBondContact O-N 3.47Å; E1067-R1069 VanDerWaalsContact C-N 3.35Å; E1067-R1069 PolarHBondContact O-N 2.89Å; E1067-T1070 PolarHBondContact O-N 3.43Å; E1067-A1071 WeakPolarHBondContact O-CB 3.28Å; E1067-A1071 PolarHBondContact O-N 2.74Å
1068	N	94.2	Very high	92.3	Very high	89 Å²	89	106.7 Å²	106.7	48%	0.476	52%	0.518	S	S	.	.	H	α-helix	trans	-58.8	-45.7	175	-72.9	-17.3	0	0	0	111.6	Q1064 T1070 A1071 E1072	Q1064-N1068 WeakPolarHBondContact O-CB 3.45Å; Q1064-N1068 VanDerWaalsContact O-CG 3.25Å; Q1064-N1068 PolarHBondContact O-N 3.49Å; Q1064-N1068 PolarHBondContact O-ND2 3.21Å; N1068-T1070 VanDerWaalsContact C-N 3.33Å; N1068-T1070 PolarHBondContact O-N 2.81Å; N1068-A1071 PolarHBondContact O-N 3.04Å; N1068-E1072 WeakPolarHBondContact O-CG 3.3Å; N1068-E1072 PolarHBondContact O-N 3.47Å
1069	R	93.5	Very high	92.4	Very high	128 Å²	128	104.8 Å²	104.8	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-67.5	-35.2	-179.9	-170.3	54.2	168.6	-166.8	-7.1	112.5	L1065 I1066 E1067 E1072 L1073	L1065-R1069 WeakPolarHBondContact O-CB 3.29Å; L1065-R1069 PolarHBondContact O-N 3.23Å; I1066-R1069 PolarHBondContact O-N 3.38Å; E1067-R1069 VanDerWaalsContact C-N 3.35Å; E1067-R1069 PolarHBondContact O-N 2.89Å; R1069-E1072 WeakPolarHBondContact CD-OE2 3.49Å; R1069-E1072 IonicContact CZ-OE2 3.85Å; R1069-E1072 IonicContact NE-OE2 2.7Å; R1069-E1072 IonicContact NH1-OE2 3.73Å; R1069-E1072 PolarHBondContact NH1-OE2 2.72Å; R1069-E1072 PolarHBondContact O-N 2.98Å; R1069-L1073 WeakPolarHBondContact O-CG 3.4Å; R1069-L1073 PolarHBondContact O-N 3.22Å
1070	T	92.7	Very high	92.4	Very high	66 Å²	66	101.2 Å²	101.2	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-67	-41.6	175.5	-54.7	0	0	0	0	110.6	I1066 E1067 N1068 E1072 L1073 N1074	I1066-T1070 WeakPolarHBondContact O-CB 3.5Å; I1066-T1070 PolarHBondContact O-N 2.76Å; I1066-T1070 PolarHBondContact O-OG1 2.84Å; E1067-T1070 PolarHBondContact O-N 3.43Å; N1068-T1070 VanDerWaalsContact C-N 3.33Å; N1068-T1070 PolarHBondContact O-N 2.81Å; T1070-E1072 PolarHBondContact O-N 3.29Å; T1070-L1073 PolarHBondContact O-N 3.27Å; T1070-N1074 WeakPolarHBondContact O-CB 3.27Å; T1070-N1074 VanDerWaalsContact O-CG 3.25Å; T1070-N1074 PolarHBondContact O-N 2.93Å; T1070-N1074 PolarHBondContact O-ND2 3.26Å
1071	A	93.3	Very high	92.4	Very high	59 Å²	59	100.5 Å²	100.5	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-42.6	174.1	0	0	0	0	0	112.3	E1067 N1068 N1074 A1075	E1067-A1071 WeakPolarHBondContact O-CB 3.28Å; E1067-A1071 PolarHBondContact O-N 2.74Å; N1068-A1071 PolarHBondContact O-N 3.04Å; A1071-N1074 PolarHBondContact O-N 2.95Å; A1071-A1075 PolarHBondContact O-N 3.36Å
1072	E	93.8	Very high	92.4	Very high	96 Å²	96	102.1 Å²	102.1	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-61.8	-42.2	174.9	-74.3	179.8	174	0	0	112.9	N1068 R1069 T1070 A1075 R1076	N1068-E1072 WeakPolarHBondContact O-CG 3.3Å; N1068-E1072 PolarHBondContact O-N 3.47Å; R1069-E1072 WeakPolarHBondContact CD-OE2 3.49Å; R1069-E1072 IonicContact CZ-OE2 3.85Å; R1069-E1072 IonicContact NE-OE2 2.7Å; R1069-E1072 IonicContact NH1-OE2 3.73Å; R1069-E1072 PolarHBondContact NH1-OE2 2.72Å; R1069-E1072 PolarHBondContact O-N 2.98Å; T1070-E1072 PolarHBondContact O-N 3.29Å; E1072-A1075 PolarHBondContact O-N 3.5Å; E1072-R1076 WeakPolarHBondContact O-CG 3.49Å; E1072-R1076 PolarHBondContact O-N 2.81Å
1073	L	90.8	Very high	92.6	Very high	91 Å²	91	101.1 Å²	101.1	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-44.2	178.2	-72.5	173.4	0	0	0	111.3	R1069 T1070 A1075 R1076 E1077	R1069-L1073 WeakPolarHBondContact O-CG 3.4Å; R1069-L1073 PolarHBondContact O-N 3.22Å; T1070-L1073 PolarHBondContact O-N 3.27Å; L1073-A1075 VanDerWaalsContact C-N 3.29Å; L1073-A1075 PolarHBondContact O-N 3.33Å; L1073-R1076 PolarHBondContact O-N 3.38Å; L1073-E1077 PolarHBondContact O-N 3.3Å
1074	N	94	Very high	92.6	Very high	83 Å²	83	98.6 Å²	98.6	44%	0.444	50%	0.504	S	S	.	.	H	α-helix	trans	-61.4	-36.9	175.6	-70.5	-20.2	0	0	0	112	T1070 A1071 K1078	T1070-N1074 WeakPolarHBondContact O-CB 3.27Å; T1070-N1074 VanDerWaalsContact O-CG 3.25Å; T1070-N1074 PolarHBondContact O-N 2.93Å; T1070-N1074 PolarHBondContact O-ND2 3.26Å; A1071-N1074 PolarHBondContact O-N 2.95Å; N1074-K1078 WeakPolarHBondContact O-CG 3.28Å; N1074-K1078 PolarHBondContact O-N 2.88Å; N1074-K1078 VanDerWaalsContact O-N 3.16Å
1075	A	94.2	Very high	92.6	Very high	59 Å²	59	95.2 Å²	95.2	49%	0.488	50%	0.496	S	S	.	.	H	α-helix	trans	-66.5	-42.2	175	0	0	0	0	0	112.1	A1071 E1072 L1073 K1078 E1079	A1071-A1075 PolarHBondContact O-N 3.36Å; E1072-A1075 PolarHBondContact O-N 3.5Å; L1073-A1075 VanDerWaalsContact C-N 3.29Å; L1073-A1075 PolarHBondContact O-N 3.33Å; A1075-K1078 PolarHBondContact O-N 3.35Å; A1075-E1079 PolarHBondContact O-N 2.89Å
1076	R	91.3	Very high	92.5	Very high	144 Å²	144	92.2 Å²	92.2	54%	0.543	48%	0.483	S	S	.	.	H	α-helix	trans	-65.7	-39	175.7	-76	-177.8	176.8	-178.5	1.1	112.6	E1072 L1073 K1078 E1079 I1080	E1072-R1076 WeakPolarHBondContact O-CG 3.49Å; E1072-R1076 PolarHBondContact O-N 2.81Å; L1073-R1076 PolarHBondContact O-N 3.38Å; R1076-K1078 VanDerWaalsContact C-N 3.33Å; R1076-E1079 PolarHBondContact O-N 3.44Å; R1076-I1080 VanDerWaalsContact O-CG1 3.28Å; R1076-I1080 WeakPolarHBondContact O-CG1 3.45Å; R1076-I1080 PolarHBondContact O-N 2.89Å
1077	E	91.9	Very high	92.5	Very high	135 Å²	135	94 Å²	94	63%	0.631	49%	0.491	S	S	*	.	H	α-helix	trans	-61.7	-43	176.4	-172.2	174	-168.1	0	0	111.2	L1073 E1079 I1080 G1081	L1073-E1077 PolarHBondContact O-N 3.3Å; E1077-E1079 PolarHBondContact O-N 2.83Å; E1077-I1080 PolarHBondContact O-N 2.97Å; E1077-G1081 PolarHBondContact O-N 3.39Å
1078	K	93.6	Very high	92.4	Very high	156 Å²	156	94.9 Å²	94.9	68%	0.678	50%	0.496	S	S	*	.	H	α-helix	trans	-60.6	-43	172.5	-72.5	178.6	-180	-177.9	0	112.4	N1074 A1075 R1076 G1081 I1082	N1074-K1078 WeakPolarHBondContact O-CG 3.28Å; N1074-K1078 PolarHBondContact O-N 2.88Å; N1074-K1078 VanDerWaalsContact O-N 3.16Å; A1075-K1078 PolarHBondContact O-N 3.35Å; R1076-K1078 VanDerWaalsContact C-N 3.33Å; K1078-G1081 PolarHBondContact O-N 3.5Å; K1078-I1082 WeakPolarHBondContact O-CG1 3.29Å; K1078-I1082 PolarHBondContact O-N 2.83Å
1079	E	93.4	Very high	92.3	Very high	100 Å²	100	97.7 Å²	97.7	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-65	-39.9	178.2	-164	-171.2	160	0	0	112.2	A1075 R1076 E1077 I1082 K1083	A1075-E1079 PolarHBondContact O-N 2.89Å; R1076-E1079 PolarHBondContact O-N 3.44Å; E1077-E1079 PolarHBondContact O-N 2.83Å; E1079-I1082 PolarHBondContact O-N 2.81Å; E1079-K1083 WeakPolarHBondContact O-CG 3.45Å; E1079-K1083 PolarHBondContact O-N 3.43Å; E1079-K1083 VanDerWaalsContact OE1-CE 3.31Å; E1079-K1083 WeakPolarHBondContact OE1-CE 3.5Å; E1079-K1083 IonicContact OE1-NZ 3.27Å; E1079-K1083 PolarHBondContact OE1-NZ 3.02Å
1080	I	89.5	Confident	92.2	Very high	119 Å²	119	95.3 Å²	95.3	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-64.3	-42.7	174.6	-68.5	165.8	0	0	0	110.3	R1076 E1077 I1082 K1083 S1084	R1076-I1080 VanDerWaalsContact O-CG1 3.28Å; R1076-I1080 WeakPolarHBondContact O-CG1 3.45Å; R1076-I1080 PolarHBondContact O-N 2.89Å; E1077-I1080 PolarHBondContact O-N 2.97Å; I1080-I1082 PolarHBondContact O-N 3.24Å; I1080-K1083 PolarHBondContact O-N 2.85Å; I1080-S1084 WeakPolarHBondContact O-CB 3.34Å; I1080-S1084 PolarHBondContact O-N 2.72Å
1081	G	92.4	Very high	92.2	Very high	43 Å²	43	95.9 Å²	95.9	44%	0.443	50%	0.503	S	S	.	.	H	α-helix	trans	-58.1	-44.6	175.3	0	0	0	0	0	112.7	E1077 K1078 S1084 A1085	E1077-G1081 PolarHBondContact O-N 3.39Å; K1078-G1081 PolarHBondContact O-N 3.5Å; G1081-S1084 PolarHBondContact O-N 2.77Å; G1081-A1085 WeakPolarHBondContact O-CB 3.29Å; G1081-A1085 PolarHBondContact O-N 2.99Å
1082	I	93.2	Very high	92.1	Very high	120 Å²	120	95.3 Å²	95.3	62%	0.615	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-43.6	176.4	-66.1	165.1	0	0	0	111.2	K1078 E1079 I1080 A1085 S1086	K1078-I1082 WeakPolarHBondContact O-CG1 3.29Å; K1078-I1082 PolarHBondContact O-N 2.83Å; E1079-I1082 PolarHBondContact O-N 2.81Å; I1080-I1082 PolarHBondContact O-N 3.24Å; I1082-A1085 PolarHBondContact O-N 3.21Å; I1082-S1086 PolarHBondContact O-N 2.83Å
1083	K	91.9	Very high	92	Very high	118 Å²	118	95.1 Å²	95.1	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-40.3	177.9	-73.5	176.6	-174.1	166.1	0	112.2	E1079 I1080 S1086 M1087	E1079-K1083 WeakPolarHBondContact O-CG 3.45Å; E1079-K1083 PolarHBondContact O-N 3.43Å; E1079-K1083 VanDerWaalsContact OE1-CE 3.31Å; E1079-K1083 WeakPolarHBondContact OE1-CE 3.5Å; E1079-K1083 IonicContact OE1-NZ 3.27Å; E1079-K1083 PolarHBondContact OE1-NZ 3.02Å; I1080-K1083 PolarHBondContact O-N 2.85Å; K1083-S1086 WeakPolarHBondContact O-CB 3.37Å; K1083-S1086 PolarHBondContact O-N 2.88Å; K1083-M1087 WeakPolarHBondContact O-CG 3.25Å; K1083-M1087 PolarHBondContact O-N 3.46Å
1084	S	91.7	Very high	92	Very high	46 Å²	46	97.3 Å²	97.3	32%	0.322	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-47.7	175.6	-162.5	0	0	0	0	111.2	I1080 G1081 S1086 M1087 E1088	I1080-S1084 WeakPolarHBondContact O-CB 3.34Å; I1080-S1084 PolarHBondContact O-N 2.72Å; G1081-S1084 PolarHBondContact O-N 2.77Å; S1084-S1086 PolarHBondContact O-N 2.94Å; S1084-M1087 PolarHBondContact O-N 2.8Å; S1084-M1087 VanDerWaalsContact O-N 3.13Å; S1084-E1088 PolarHBondContact O-N 3.39Å
1085	A	91.8	Very high	91.9	Very high	45 Å²	45	98 Å²	98	37%	0.372	51%	0.507	S	S	.	.	H	α-helix	trans	-64.5	-25.7	176.9	0	0	0	0	0	113.2	G1081 I1082 R1089	G1081-A1085 WeakPolarHBondContact O-CB 3.29Å; G1081-A1085 PolarHBondContact O-N 2.99Å; I1082-A1085 PolarHBondContact O-N 3.21Å; A1085-R1089 WeakPolarHBondContact O-CG 3.41Å; A1085-R1089 PolarHBondContact O-N 3.34Å; A1085-R1089 PolarHBondContact O-NE 3.37Å; A1085-R1089 VanDerWaalsContact O-NE 3.1Å
1086	S	92.8	Very high	91.8	Very high	40 Å²	40	99.5 Å²	99.5	28%	0.28	51%	0.507	S	S	.	.	H	α-helix	trans	-72.7	-47.2	170.2	-161.5	0	0	0	0	111.5	I1082 K1083 S1084 E1088 R1089 D1090	I1082-S1086 PolarHBondContact O-N 2.83Å; K1083-S1086 WeakPolarHBondContact O-CB 3.37Å; K1083-S1086 PolarHBondContact O-N 2.88Å; S1084-S1086 PolarHBondContact O-N 2.94Å; S1086-E1088 VanDerWaalsContact C-N 3.31Å; S1086-E1088 PolarHBondContact O-N 2.97Å; S1086-R1089 PolarHBondContact O-N 2.81Å; S1086-D1090 VanDerWaalsContact O-CG 3.26Å; S1086-D1090 PolarHBondContact O-N 2.83Å
1087	M	89.1	Confident	91.9	Very high	123 Å²	123	98.8 Å²	98.8	61%	0.606	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-35.4	179.3	-70.1	-169.8	-57	0	0	112.6	K1083 S1084 D1090 S1091	K1083-M1087 WeakPolarHBondContact O-CG 3.25Å; K1083-M1087 PolarHBondContact O-N 3.46Å; S1084-M1087 PolarHBondContact O-N 2.8Å; S1084-M1087 VanDerWaalsContact O-N 3.13Å; M1087-D1090 PolarHBondContact O-N 3.12Å; M1087-S1091 VanDerWaalsContact O-CB 3.25Å; M1087-S1091 WeakPolarHBondContact O-CB 3.5Å; M1087-S1091 PolarHBondContact O-N 2.98Å
1088	E	91.1	Very high	91.8	Very high	132 Å²	132	96.6 Å²	96.6	62%	0.617	50%	0.5	S	S	*	.	H	α-helix	trans	-65.1	-40.9	174.7	-76.7	173.9	-166.6	0	0	111.9	S1084 S1086 S1091 A1092	S1084-E1088 PolarHBondContact O-N 3.39Å; S1086-E1088 VanDerWaalsContact C-N 3.31Å; S1086-E1088 PolarHBondContact O-N 2.97Å; E1088-S1091 PolarHBondContact O-N 2.76Å; E1088-A1092 WeakPolarHBondContact O-CB 3.3Å; E1088-A1092 PolarHBondContact O-N 2.77Å
1089	R	91.9	Very high	91.6	Very high	149 Å²	149	92.8 Å²	92.8	56%	0.562	49%	0.487	S	S	*	.	H	α-helix	trans	-63.6	-47.3	173.5	-77.4	-178	-72.3	130.5	-4.9	111.5	A1085 S1086 S1091 A1092 D1093	A1085-R1089 WeakPolarHBondContact O-CG 3.41Å; A1085-R1089 PolarHBondContact O-N 3.34Å; A1085-R1089 PolarHBondContact O-NE 3.37Å; A1085-R1089 VanDerWaalsContact O-NE 3.1Å; S1086-R1089 PolarHBondContact O-N 2.81Å; R1089-S1091 VanDerWaalsContact C-N 3.31Å; R1089-S1091 PolarHBondContact O-N 3.03Å; R1089-A1092 PolarHBondContact O-N 2.93Å; R1089-D1093 PolarHBondContact O-N 3.23Å
1090	D	92.1	Very high	91.5	Very high	78 Å²	78	97.6 Å²	97.6	42%	0.417	50%	0.501	S	S	.	.	H	α-helix	trans	-60.8	-42.7	177.7	-63.1	-22.1	0	0	0	110.9	S1086 M1087 A1092 D1093 F1094	S1086-D1090 VanDerWaalsContact O-CG 3.26Å; S1086-D1090 PolarHBondContact O-N 2.83Å; M1087-D1090 PolarHBondContact O-N 3.12Å; D1090-A1092 PolarHBondContact O-N 2.95Å; D1090-D1093 PolarHBondContact O-N 2.71Å; D1090-F1094 WeakPolarHBondContact O-CD2 3.48Å; D1090-F1094 PolarHBondContact O-N 3.26Å
1091	S	91.5	Very high	91.5	Very high	77 Å²	77	97.3 Å²	97.3	54%	0.538	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-39.9	177	-170.2	0	0	0	0	112.2	M1087 E1088 R1089 F1094 Q1095	M1087-S1091 VanDerWaalsContact O-CB 3.25Å; M1087-S1091 WeakPolarHBondContact O-CB 3.5Å; M1087-S1091 PolarHBondContact O-N 2.98Å; E1088-S1091 PolarHBondContact O-N 2.76Å; R1089-S1091 VanDerWaalsContact C-N 3.31Å; R1089-S1091 PolarHBondContact O-N 3.03Å; S1091-F1094 PolarHBondContact O-N 2.99Å; S1091-Q1095 WeakPolarHBondContact O-CB 3.48Å; S1091-Q1095 PolarHBondContact O-N 3.47Å
1092	A	91.5	Very high	91.4	Very high	48 Å²	48	102.1 Å²	102.1	40%	0.397	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-40.2	175	0	0	0	0	0	111.4	E1088 R1089 D1090 Q1095 N1096	E1088-A1092 WeakPolarHBondContact O-CB 3.3Å; E1088-A1092 PolarHBondContact O-N 2.77Å; R1089-A1092 PolarHBondContact O-N 2.93Å; D1090-A1092 PolarHBondContact O-N 2.95Å; A1092-Q1095 PolarHBondContact O-N 3.02Å; A1092-N1096 WeakPolarHBondContact O-CB 3.47Å; A1092-N1096 PolarHBondContact O-N 2.78Å; A1092-N1096 PolarHBondContact O-ND2 3.28Å
1093	D	92.7	Very high	91.2	Very high	91 Å²	91	97.6 Å²	97.6	49%	0.487	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-39.8	175.7	-74.9	-16.7	0	0	0	112.3	R1089 D1090 N1096 K1097	R1089-D1093 PolarHBondContact O-N 3.23Å; D1090-D1093 PolarHBondContact O-N 2.71Å; D1093-N1096 PolarHBondContact O-N 2.88Å; D1093-K1097 WeakPolarHBondContact O-CG 3.44Å; D1093-K1097 PolarHBondContact O-N 3.06Å
1094	F	90.5	Very high	91	Very high	137 Å²	137	93.3 Å²	93.3	60%	0.601	47%	0.474	S	S	*	.	H	α-helix	trans	-63.7	-42.3	173	-80.5	-64.1	0	0	0	112.1	D1090 S1091 K1097 L1098	D1090-F1094 WeakPolarHBondContact O-CD2 3.48Å; D1090-F1094 PolarHBondContact O-N 3.26Å; S1091-F1094 PolarHBondContact O-N 2.99Å; F1094-K1097 PolarHBondContact O-N 2.82Å; F1094-L1098 PolarHBondContact O-N 3.2Å
1095	Q	91.6	Very high	90.6	Very high	99 Å²	99	98.4 Å²	98.4	46%	0.463	49%	0.487	S	S	.	.	H	α-helix	trans	-64	-44.8	177.5	-169.6	61.7	27.3	0	0	111.2	S1091 A1092 K1097 L1098 D1099	S1091-Q1095 WeakPolarHBondContact O-CB 3.48Å; S1091-Q1095 PolarHBondContact O-N 3.47Å; A1092-Q1095 PolarHBondContact O-N 3.02Å; Q1095-K1097 VanDerWaalsContact C-N 3.3Å; Q1095-K1097 PolarHBondContact O-N 3.31Å; Q1095-L1098 WeakPolarHBondContact O-CB 3.5Å; Q1095-L1098 PolarHBondContact O-N 3.32Å; Q1095-L1098 VanDerWaalsContact O-N 3.11Å; Q1095-D1099 PolarHBondContact O-N 3.18Å
1096	N	91.9	Very high	90.2	Very high	90 Å²	90	101.3 Å²	101.3	48%	0.481	49%	0.493	S	S	.	.	H	α-helix	trans	-59.3	-39.1	174.8	-77.7	-31.2	0	0	0	112.4	A1092 D1093 R1100	A1092-N1096 WeakPolarHBondContact O-CB 3.47Å; A1092-N1096 PolarHBondContact O-N 2.78Å; A1092-N1096 PolarHBondContact O-ND2 3.28Å; D1093-N1096 PolarHBondContact O-N 2.88Å; N1096-R1100 VanDerWaalsContact O-CG 3.31Å; N1096-R1100 WeakPolarHBondContact O-CG 3.18Å; N1096-R1100 PolarHBondContact O-N 3.32Å
1097	K	93	Very high	89.8	Confident	129 Å²	129	107 Å²	107	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-65.7	-42.2	174	-76.5	175.8	-178.2	176.1	0	111.9	D1093 F1094 Q1095 R1100 L1101	D1093-K1097 WeakPolarHBondContact O-CG 3.44Å; D1093-K1097 PolarHBondContact O-N 3.06Å; F1094-K1097 PolarHBondContact O-N 2.82Å; Q1095-K1097 VanDerWaalsContact C-N 3.3Å; Q1095-K1097 PolarHBondContact O-N 3.31Å; K1097-R1100 PolarHBondContact O-N 3.4Å; K1097-L1101 WeakPolarHBondContact O-CG 3.35Å; K1097-L1101 PolarHBondContact O-N 2.77Å
1098	L	90.4	Very high	89.4	Confident	89 Å²	89	105.1 Å²	105.1	47%	0.466	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-43.5	175.6	-95.9	157.9	0	0	0	111.9	F1094 Q1095 L1101 R1102	F1094-L1098 PolarHBondContact O-N 3.2Å; Q1095-L1098 WeakPolarHBondContact O-CB 3.5Å; Q1095-L1098 PolarHBondContact O-N 3.32Å; Q1095-L1098 VanDerWaalsContact O-N 3.11Å; L1098-L1101 PolarHBondContact O-N 2.74Å; L1098-R1102 WeakPolarHBondContact O-CB 3.41Å; L1098-R1102 PolarHBondContact O-N 2.92Å
1099	D	90.5	Very high	88.6	Confident	76 Å²	76	102.5 Å²	102.5	41%	0.406	49%	0.492	S	S	.	.	H	α-helix	trans	-68.7	-36.6	179.6	-67.5	-24.8	0	0	0	111.7	Q1095 R1102 G1103	Q1095-D1099 PolarHBondContact O-N 3.18Å; D1099-R1102 PolarHBondContact O-N 3.35Å; D1099-G1103 PolarHBondContact O-N 2.85Å
1100	R	91.1	Very high	87.7	Confident	200 Å²	200	100 Å²	100	76%	0.755	49%	0.493	S	S	*	.	H	α-helix	trans	-61.8	-43.9	170.7	-74.3	176.5	-174.7	-170.9	3	112.4	N1096 K1097 R1102 G1103 A1104	N1096-R1100 VanDerWaalsContact O-CG 3.31Å; N1096-R1100 WeakPolarHBondContact O-CG 3.18Å; N1096-R1100 PolarHBondContact O-N 3.32Å; K1097-R1100 PolarHBondContact O-N 3.4Å; R1100-R1102 VanDerWaalsContact C-N 3.35Å; R1100-G1103 PolarHBondContact O-N 3.04Å; R1100-A1104 WeakPolarHBondContact O-CB 3.3Å; R1100-A1104 PolarHBondContact O-N 3.15Å
1101	L	89.7	Confident	86.5	Confident	114 Å²	114	100.4 Å²	100.4	60%	0.597	50%	0.498	S	S	*	.	H	α-helix	trans	-64.3	-41.2	177	-73.7	172.1	0	0	0	111.5	K1097 L1098 A1104 W1105	K1097-L1101 WeakPolarHBondContact O-CG 3.35Å; K1097-L1101 PolarHBondContact O-N 2.77Å; L1098-L1101 PolarHBondContact O-N 2.74Å; L1101-A1104 PolarHBondContact O-N 3.36Å; L1101-W1105 WeakPolarHBondContact O-CB 3.05Å; L1101-W1105 PolarHBondContact O-N 3.2Å
1102	R	89.3	Confident	84.9	Confident	143 Å²	143	102 Å²	102	54%	0.54	51%	0.505	S	S	.	.	H	α-helix	trans	-60.8	-48.4	175.2	-172.2	-177.3	-58	-78.7	-2.6	111.4	L1098 D1099 R1100 A1104 W1105 E1106	L1098-R1102 WeakPolarHBondContact O-CB 3.41Å; L1098-R1102 PolarHBondContact O-N 2.92Å; D1099-R1102 PolarHBondContact O-N 3.35Å; R1100-R1102 VanDerWaalsContact C-N 3.35Å; R1102-A1104 VanDerWaalsContact C-N 3.35Å; R1102-A1104 PolarHBondContact O-N 2.72Å; R1102-W1105 WeakPolarHBondContact O-CB 3.41Å; R1102-W1105 PolarHBondContact O-N 3.16Å; R1102-E1106 WeakPolarHBondContact O-CG 3.44Å; R1102-E1106 PolarHBondContact O-N 2.84Å
1103	G	88.7	Confident	83.1	Confident	26 Å²	26	109.9 Å²	109.9	27%	0.268	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-35.4	177.9	0	0	0	0	0	113.5	D1099 R1100 K1107	D1099-G1103 PolarHBondContact O-N 2.85Å; R1100-G1103 PolarHBondContact O-N 3.04Å; G1103-K1107 WeakPolarHBondContact O-CG 3.31Å; G1103-K1107 PolarHBondContact O-N 3.14Å; G1103-K1107 VanDerWaalsContact O-N 3.11Å
1104	A	87.8	Confident	81.1	Confident	27 Å²	27	110.5 Å²	110.5	22%	0.223	53%	0.532	C	S	.	.	H	α-helix	trans	-66.6	-40.6	173.2	0	0	0	0	0	112	R1100 L1101 R1102 K1107 L1108 F1133	R1100-A1104 WeakPolarHBondContact O-CB 3.3Å; R1100-A1104 PolarHBondContact O-N 3.15Å; L1101-A1104 PolarHBondContact O-N 3.36Å; R1102-A1104 VanDerWaalsContact C-N 3.35Å; R1102-A1104 PolarHBondContact O-N 2.72Å; A1104-K1107 PolarHBondContact O-N 3.15Å; A1104-L1108 PolarHBondContact O-N 3.46Å; A1104-L1108 VanDerWaalsContact O-N 3.11Å; A1104-F1133 HydrophobicContact CB-CZ 4.19Å
1105	W	83	Confident	78.8	Confident	154 Å²	154	109.5 Å²	109.5	58%	0.583	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-42.1	177	-171.6	81.8	0	0	0	112.2	L1101 R1102 K1107 L1108 Q1109	L1101-W1105 WeakPolarHBondContact O-CB 3.05Å; L1101-W1105 PolarHBondContact O-N 3.2Å; R1102-W1105 WeakPolarHBondContact O-CB 3.41Å; R1102-W1105 PolarHBondContact O-N 3.16Å; W1105-K1107 PolarHBondContact O-N 2.9Å; W1105-L1108 PolarHBondContact O-N 2.93Å; W1105-Q1109 HydrophobicContact CD2-CG 4.43Å; W1105-Q1109 HydrophobicContact CE3-CG 4.36Å; W1105-Q1109 HydrophobicContact CZ3-CG 4.41Å; W1105-Q1109 PolarHBondContact O-N 2.91Å; W1105-Q1109 VanDerWaalsContact O-N 3.1Å
1106	E	85	Confident	76.4	Confident	106 Å²	106	110.5 Å²	110.5	50%	0.495	55%	0.546	S	S	.	.	H	α-helix	trans	-62.4	-41.8	174.9	-74	171	-176	0	0	112	R1102 L1108 Q1109 V1110	R1102-E1106 WeakPolarHBondContact O-CG 3.44Å; R1102-E1106 PolarHBondContact O-N 2.84Å; E1106-L1108 PolarHBondContact O-N 2.88Å; E1106-Q1109 PolarHBondContact O-N 3.34Å; E1106-V1110 WeakPolarHBondContact O-CG2 3.45Å; E1106-V1110 PolarHBondContact O-N 2.62Å; E1106-V1110 VanDerWaalsContact O-N 3.14Å
1107	K	84.4	Confident	73.8	Confident	159 Å²	159	109.8 Å²	109.8	69%	0.691	56%	0.56	S	S	*	*	H	α-helix	trans	-59.2	-45.6	174.6	-75.9	178.2	-178.4	-177.1	0	112	G1103 A1104 W1105 Q1109 V1110 T1111	G1103-K1107 WeakPolarHBondContact O-CG 3.31Å; G1103-K1107 PolarHBondContact O-N 3.14Å; G1103-K1107 VanDerWaalsContact O-N 3.11Å; A1104-K1107 PolarHBondContact O-N 3.15Å; W1105-K1107 PolarHBondContact O-N 2.9Å; K1107-Q1109 VanDerWaalsContact C-N 3.31Å; K1107-Q1109 PolarHBondContact O-N 2.85Å; K1107-V1110 PolarHBondContact O-N 2.79Å; K1107-T1111 PolarHBondContact O-N 2.76Å; K1107-T1111 PolarHBondContact O-OG1 2.78Å
1108	L	79	Confident	71.1	Confident	84 Å²	84	108.5 Å²	108.5	44%	0.44	57%	0.568	S	S	.	*	H	α-helix	trans	-60	-39	176.9	-81.6	162.8	0	0	0	112.5	A1104 W1105 E1106 T1112 L1129	A1104-L1108 PolarHBondContact O-N 3.46Å; A1104-L1108 VanDerWaalsContact O-N 3.11Å; W1105-L1108 PolarHBondContact O-N 2.93Å; E1106-L1108 PolarHBondContact O-N 2.88Å; L1108-T1112 PolarHBondContact O-N 3.13Å; L1108-T1112 PolarHBondContact O-OG1 3.18Å; L1108-L1129 HydrophobicContact CD2-CD2 4.02Å
1109	Q	74.6	Confident	68.7	Low	77 Å²	77	110.7 Å²	110.7	36%	0.36	58%	0.584	S	S	.	*	H	α-helix	trans	-65.6	-37.3	176.8	-71.6	-156.9	-24.6	0	0	112.9	W1105 E1106 K1107 R1113	W1105-Q1109 HydrophobicContact CD2-CG 4.43Å; W1105-Q1109 HydrophobicContact CE3-CG 4.36Å; W1105-Q1109 HydrophobicContact CZ3-CG 4.41Å; W1105-Q1109 PolarHBondContact O-N 2.91Å; W1105-Q1109 VanDerWaalsContact O-N 3.1Å; E1106-Q1109 PolarHBondContact O-N 3.34Å; K1107-Q1109 VanDerWaalsContact C-N 3.31Å; K1107-Q1109 PolarHBondContact O-N 2.85Å; Q1109-R1113 WeakPolarHBondContact O-CG 3.36Å; Q1109-R1113 PolarHBondContact O-N 2.86Å
1110	V	73	Confident	66.5	Low	97 Å²	97	116.1 Å²	116.1	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-70	-45.3	178.2	177.2	0	0	0	0	110.7	E1106 K1107 T1112 R1113 T1114	E1106-V1110 WeakPolarHBondContact O-CG2 3.45Å; E1106-V1110 PolarHBondContact O-N 2.62Å; E1106-V1110 VanDerWaalsContact O-N 3.14Å; K1107-V1110 PolarHBondContact O-N 2.79Å; V1110-T1112 PolarHBondContact O-N 3.42Å; V1110-R1113 PolarHBondContact O-N 3.17Å; V1110-T1114 PolarHBondContact O-OG1 2.68Å; V1110-T1114 VanDerWaalsContact O-OG1 3.08Å
1111	T	67	Low	64.4	Low	85 Å²	85	114.8 Å²	114.8	52%	0.521	61%	0.607	S	S	.	*	H	α-helix	trans	-60.4	-31.5	179.2	-35.9	0	0	0	0	112.4	K1107 R1113	K1107-T1111 PolarHBondContact O-N 2.76Å; K1107-T1111 PolarHBondContact O-OG1 2.78Å; T1111-R1113 VanDerWaalsContact C-N 3.33Å; T1111-R1113 PolarHBondContact O-N 2.9Å
1112	T	59	Low	62.4	Low	112 Å²	112	112.6 Å²	112.6	69%	0.687	60%	0.601	S	S	*	*	H	α-helix	trans	-71.7	-26.6	177.5	-51.2	0	0	0	0	112.6	L1108 V1110	L1108-T1112 PolarHBondContact O-N 3.13Å; L1108-T1112 PolarHBondContact O-OG1 3.18Å; V1110-T1112 PolarHBondContact O-N 3.42Å
1113	R	53.7	Low	60.6	Low	212 Å²	212	108.6 Å²	108.6	80%	0.8	60%	0.598	S	S	*	*	H	α-helix	trans	-86.4	-14	-175.1	-73.4	-178.5	179.8	-179.2	2.3	114.4	Q1109 V1110 T1111	Q1109-R1113 WeakPolarHBondContact O-CG 3.36Å; Q1109-R1113 PolarHBondContact O-N 2.86Å; V1110-R1113 PolarHBondContact O-N 3.17Å; T1111-R1113 VanDerWaalsContact C-N 3.33Å; T1111-R1113 PolarHBondContact O-N 2.9Å
1114	T	49.2	Very low	58.9	Low	105 Å²	105	113 Å²	113	64%	0.644	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	18	-174.1	5.9	0	0	0	0	115.7	V1110 P1116	V1110-T1114 PolarHBondContact O-OG1 2.68Å; V1110-T1114 VanDerWaalsContact O-OG1 3.08Å; T1114-P1116 WeakPolarHBondContact O-CD 3.16Å
1115	I	43.3	Very low	57.2	Low	116 Å²	116	115.9 Å²	115.9	60%	0.595	63%	0.631	S	S	*	*			trans	-108.5	85.1	175.8	-49.4	176	0	0	0	110.9
1116	P	40.4	Very low	55.9	Low	119 Å²	119	112.8 Å²	112.8	77%	0.773	63%	0.629	S	S	*	*			trans	-86.5	112.2	161.4	31.8	-26.4	0	0	0	109.5	T1114	T1114-P1116 WeakPolarHBondContact O-CD 3.16Å
1117	G	38.6	Very low	54.5	Low	75 Å²	75	112.5 Å²	112.5	77%	0.773	63%	0.631	S	S	*	*	S	Bend	trans	80.9	86.6	157.3	0	0	0	0	0	116.9
1118	S	34.8	Very low	53.2	Low	102 Å²	102	110 Å²	110	71%	0.713	63%	0.625	S	S	*	*			trans	169.7	97.7	135	177.8	0	0	0	0	108.2	K1120	S1118-K1120 PolarHBondContact O-N 3.31Å
1119	V	39.9	Very low	52	Low	135 Å²	135	109.8 Å²	109.8	82%	0.818	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	99.4	173.5	177	0	0	0	0	107.6
1120	K	46.2	Very low	51.3	Low	190 Å²	190	110.3 Å²	110.3	83%	0.826	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.5	-0.1	140.8	-98.1	169	-175.1	-174.4	0	116.3	S1118	S1118-K1120 PolarHBondContact O-N 3.31Å
1121	Q	45.7	Very low	50.4	Low	172 Å²	172	111.7 Å²	111.7	80%	0.804	63%	0.632	S	S	*	*	S	Bend	trans	-109.7	-3	175.5	-75.4	-177.1	-10.9	0	0	115.6	A1123	Q1121-A1123 VanDerWaalsContact C-N 3.34Å; Q1121-A1123 PolarHBondContact O-N 2.88Å
1122	S	48.6	Very low	49.8	Very low	68 Å²	68	111.4 Å²	111.4	48%	0.476	63%	0.628	S	S	.	*	H	α-helix	trans	-75.6	-12.8	-177.8	59	0	0	0	0	115.6
1123	A	50.8	Low	49.5	Very low	59 Å²	59	111 Å²	111	49%	0.488	62%	0.616	S	S	.	*	H	α-helix	trans	-69.6	-45.5	178.4	0	0	0	0	0	111.8	Q1121 T1125 V1126 D1127	Q1121-A1123 VanDerWaalsContact C-N 3.34Å; Q1121-A1123 PolarHBondContact O-N 2.88Å; A1123-T1125 VanDerWaalsContact C-N 3.29Å; A1123-T1125 PolarHBondContact O-N 2.9Å; A1123-V1126 PolarHBondContact O-N 3.48Å; A1123-D1127 PolarHBondContact O-N 3.35Å
1124	N	52.8	Low	49.5	Very low	118 Å²	118	103.8 Å²	103.8	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-68.5	-25.6	-175.7	-72.1	12.5	0	0	0	113.5	N1128	N1124-N1128 WeakPolarHBondContact O-CB 3.48Å; N1124-N1128 VanDerWaalsContact O-CG 3.27Å; N1124-N1128 PolarHBondContact O-N 2.91Å; N1124-N1128 PolarHBondContact O-ND2 3.07Å
1125	T	52.2	Low	49.6	Very low	88 Å²	88	105.2 Å²	105.2	54%	0.54	60%	0.598	S	S	.	*	H	α-helix	trans	-74	-34.3	177.9	-37.9	0	0	0	0	111.9	A1123 L1129	A1123-T1125 VanDerWaalsContact C-N 3.29Å; A1123-T1125 PolarHBondContact O-N 2.9Å; T1125-L1129 PolarHBondContact O-N 3.07Å; T1125-L1129 VanDerWaalsContact O-N 3.13Å
1126	V	54.9	Low	49.8	Very low	90 Å²	90	106.4 Å²	106.4	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-72.1	-42.7	176.6	179.8	0	0	0	0	109.9	A1123 N1128 L1129 V1130	A1123-V1126 PolarHBondContact O-N 3.48Å; V1126-N1128 PolarHBondContact O-N 3.36Å; V1126-L1129 PolarHBondContact O-N 3.25Å; V1126-L1129 VanDerWaalsContact O-N 3.17Å; V1126-V1130 HydrophobicContact CG1-CG2 4.38Å; V1126-V1130 VanDerWaalsContact O-CG2 3.31Å; V1126-V1130 WeakPolarHBondContact O-CG2 3.24Å; V1126-V1130 PolarHBondContact O-N 2.99Å
1127	D	56.5	Low	50	Low	100 Å²	100	105.4 Å²	105.4	54%	0.535	59%	0.59	S	S	.	*	H	α-helix	trans	-63.8	-41.7	177.5	-72.9	-30.9	0	0	0	112	A1123 L1129 V1130 Q1131	A1123-D1127 PolarHBondContact O-N 3.35Å; D1127-L1129 VanDerWaalsContact C-N 3.33Å; D1127-L1129 PolarHBondContact O-N 3.15Å; D1127-V1130 PolarHBondContact O-N 3.41Å; D1127-Q1131 WeakPolarHBondContact O-CB 3.36Å; D1127-Q1131 PolarHBondContact O-N 3.22Å
1128	N	56.5	Low	50	Low	105 Å²	105	108.1 Å²	108.1	56%	0.561	59%	0.588	S	S	*	*	H	α-helix	trans	-62.8	-38.6	173.8	-75.5	-16.5	0	0	0	112	N1124 V1126 Q1131 D1132	N1124-N1128 WeakPolarHBondContact O-CB 3.48Å; N1124-N1128 VanDerWaalsContact O-CG 3.27Å; N1124-N1128 PolarHBondContact O-N 2.91Å; N1124-N1128 PolarHBondContact O-ND2 3.07Å; V1126-N1128 PolarHBondContact O-N 3.36Å; N1128-Q1131 PolarHBondContact O-N 2.7Å; N1128-D1132 VanDerWaalsContact O-CB 3.27Å; N1128-D1132 WeakPolarHBondContact O-CB 3.47Å; N1128-D1132 PolarHBondContact O-N 2.75Å
1129	L	55.3	Low	50.2	Low	80 Å²	80	109.8 Å²	109.8	42%	0.419	59%	0.588	S	S	.	*	H	α-helix	trans	-67.9	-37.8	177.3	-127.8	97.2	0	0	0	111.9	L1108 T1125 V1126 D1127 F1133	L1108-L1129 HydrophobicContact CD2-CD2 4.02Å; T1125-L1129 PolarHBondContact O-N 3.07Å; T1125-L1129 VanDerWaalsContact O-N 3.13Å; V1126-L1129 PolarHBondContact O-N 3.25Å; V1126-L1129 VanDerWaalsContact O-N 3.17Å; D1127-L1129 VanDerWaalsContact C-N 3.33Å; D1127-L1129 PolarHBondContact O-N 3.15Å; L1129-F1133 WeakPolarHBondContact O-CB 3.18Å; L1129-F1133 WeakPolarHBondContact O-CD2 3.46Å; L1129-F1133 PolarHBondContact O-N 2.84Å
1130	V	59.7	Low	50	Low	89 Å²	89	108.2 Å²	108.2	54%	0.539	58%	0.584	S	S	.	*	H	α-helix	trans	-68.1	-39.6	177.2	172.3	0	0	0	0	110.4	V1126 D1127 F1133 S1134	V1126-V1130 HydrophobicContact CG1-CG2 4.38Å; V1126-V1130 VanDerWaalsContact O-CG2 3.31Å; V1126-V1130 WeakPolarHBondContact O-CG2 3.24Å; V1126-V1130 PolarHBondContact O-N 2.99Å; D1127-V1130 PolarHBondContact O-N 3.41Å; V1130-F1133 WeakPolarHBondContact O-CB 3.07Å; V1130-F1133 PolarHBondContact O-N 2.95Å; V1130-S1134 PolarHBondContact O-N 2.87Å
1131	Q	52.4	Low	49.1	Very low	125 Å²	125	107.1 Å²	107.1	58%	0.584	59%	0.586	S	S	*	*	H	α-helix	trans	-68.3	-41	177.1	-151.2	168.7	14.9	0	0	111.5	D1127 N1128 F1133 S1134 E1135	D1127-Q1131 WeakPolarHBondContact O-CB 3.36Å; D1127-Q1131 PolarHBondContact O-N 3.22Å; N1128-Q1131 PolarHBondContact O-N 2.7Å; Q1131-F1133 VanDerWaalsContact C-N 3.26Å; Q1131-F1133 PolarHBondContact O-N 2.81Å; Q1131-S1134 WeakPolarHBondContact O-CB 3.28Å; Q1131-S1134 PolarHBondContact O-N 3.43Å; Q1131-S1134 VanDerWaalsContact O-N 3.15Å; Q1131-E1135 PolarHBondContact O-N 3.12Å
1132	D	55.2	Low	48.4	Very low	80 Å²	80	104.5 Å²	104.5	43%	0.428	58%	0.583	S	S	.	*	H	α-helix	trans	-66.7	-27.9	174.3	-148	59.8	0	0	0	112	N1128 K1136	N1128-D1132 VanDerWaalsContact O-CB 3.27Å; N1128-D1132 WeakPolarHBondContact O-CB 3.47Å; N1128-D1132 PolarHBondContact O-N 2.75Å; D1132-K1136 WeakPolarHBondContact O-CB 3.38Å; D1132-K1136 WeakPolarHBondContact O-CD 3.28Å; D1132-K1136 WeakPolarHBondContact O-CG 3.44Å; D1132-K1136 PolarHBondContact O-N 3.48Å; D1132-K1136 IonicContact OD2-NZ 3.2Å; D1132-K1136 PolarHBondContact OD2-NZ 2.96Å
1133	F	53.2	Low	47.4	Very low	102 Å²	102	107 Å²	107	45%	0.447	59%	0.592	S	S	.	*	H	α-helix	trans	-75.4	-36.1	171	-106.2	-86.9	0	0	0	113	A1104 L1129 V1130 Q1131 T1137	A1104-F1133 HydrophobicContact CB-CZ 4.19Å; L1129-F1133 WeakPolarHBondContact O-CB 3.18Å; L1129-F1133 WeakPolarHBondContact O-CD2 3.46Å; L1129-F1133 PolarHBondContact O-N 2.84Å; V1130-F1133 WeakPolarHBondContact O-CB 3.07Å; V1130-F1133 PolarHBondContact O-N 2.95Å; Q1131-F1133 VanDerWaalsContact C-N 3.26Å; Q1131-F1133 PolarHBondContact O-N 2.81Å; F1133-T1137 PolarHBondContact O-N 3.26Å; F1133-T1137 PolarHBondContact O-OG1 3.18Å
1134	S	52.9	Low	46.5	Very low	62 Å²	62	110 Å²	110	43%	0.434	61%	0.606	S	S	.	*	H	α-helix	trans	-65.7	-47.5	175.7	-175.3	0	0	0	0	111	V1130 Q1131 K1136 T1137 D1138	V1130-S1134 PolarHBondContact O-N 2.87Å; Q1131-S1134 WeakPolarHBondContact O-CB 3.28Å; Q1131-S1134 PolarHBondContact O-N 3.43Å; Q1131-S1134 VanDerWaalsContact O-N 3.15Å; S1134-K1136 VanDerWaalsContact C-N 3.28Å; S1134-K1136 PolarHBondContact O-N 3.24Å; S1134-T1137 PolarHBondContact O-N 2.73Å; S1134-T1137 VanDerWaalsContact O-N 3.13Å; S1134-T1137 PolarHBondContact O-OG1 2.86Å; S1134-D1138 PolarHBondContact O-N 3.21Å
1135	E	51.4	Low	45.3	Very low	134 Å²	134	111.6 Å²	111.6	63%	0.626	61%	0.61	S	S	*	*	H	α-helix	trans	-66.6	-30	178.9	-74.9	-171.5	162.7	0	0	112.8	Q1131 T1137	Q1131-E1135 PolarHBondContact O-N 3.12Å; E1135-T1137 VanDerWaalsContact C-N 3.33Å
1136	K	48.8	Very low	44.3	Very low	142 Å²	142	112.4 Å²	112.4	62%	0.617	62%	0.619	S	S	*	*	H	α-helix	trans	-75.8	-17.8	174.7	-79.8	172	-177.6	140.6	0	114.1	D1132 S1134	D1132-K1136 WeakPolarHBondContact O-CB 3.38Å; D1132-K1136 WeakPolarHBondContact O-CD 3.28Å; D1132-K1136 WeakPolarHBondContact O-CG 3.44Å; D1132-K1136 PolarHBondContact O-N 3.48Å; D1132-K1136 IonicContact OD2-NZ 3.2Å; D1132-K1136 PolarHBondContact OD2-NZ 2.96Å; S1134-K1136 VanDerWaalsContact C-N 3.28Å; S1134-K1136 PolarHBondContact O-N 3.24Å
1137	T	43.9	Very low	43	Very low	97 Å²	97	113.6 Å²	113.6	60%	0.595	63%	0.631	S	S	*	*	H	α-helix	trans	-89.4	-26.8	178.5	33.7	0	0	0	0	113.1	F1133 S1134 E1135 N1139	F1133-T1137 PolarHBondContact O-N 3.26Å; F1133-T1137 PolarHBondContact O-OG1 3.18Å; S1134-T1137 PolarHBondContact O-N 2.73Å; S1134-T1137 VanDerWaalsContact O-N 3.13Å; S1134-T1137 PolarHBondContact O-OG1 2.86Å; E1135-T1137 VanDerWaalsContact C-N 3.33Å; T1137-N1139 PolarHBondContact O-N 2.81Å
1138	D	38.8	Very low	41.9	Very low	133 Å²	133	118.2 Å²	118.2	71%	0.711	65%	0.649	S	S	*	*	H	α-helix	trans	-77.7	-16.8	178.3	-83.1	-24.6	0	0	0	114.4	S1134	S1134-D1138 PolarHBondContact O-N 3.21Å
1139	N	38.8	Very low	40.4	Very low	136 Å²	136	116.4 Å²	116.4	73%	0.727	66%	0.656	S	S	*	*	S	Bend	trans	-105.5	55.7	179.6	-77.6	-33.5	0	0	0	113.3	T1137	T1137-N1139 PolarHBondContact O-N 2.81Å
1140	S	35.1	Very low	39.2	Very low	103 Å²	103	124.2 Å²	124.2	72%	0.72	68%	0.679	S	S	*	*			trans	-168.9	32.9	164.3	-84	0	0	0	0	115.4	P1142	S1140-P1142 VanDerWaalsContact C-CD 3.43Å; S1140-P1142 WeakPolarHBondContact O-CD 3.42Å
1141	L	26.6	Very low	37.6	Very low	167 Å²	167	129.2 Å²	129.2	87%	0.874	69%	0.694	S	S	*	*			trans	-92.1	91.3	156.4	-83	162	0	0	0	108	N1143	L1141-N1143 PolarHBondContact O-N 3.33Å
1142	P	31.3	Very low	36.4	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	70%	0.702	S	S	*	*			trans	-66.2	106.4	172.3	28.8	-32.9	0	0	0	107.6	S1140 P1144	S1140-P1142 VanDerWaalsContact C-CD 3.43Å; S1140-P1142 WeakPolarHBondContact O-CD 3.42Å; P1142-P1144 WeakPolarHBondContact O-CD 3.38Å
1143	N	28.4	Very low	34.9	Very low	121 Å²	121	130.7 Å²	130.7	65%	0.647	72%	0.721	S	S	*	*			trans	-49.7	117.9	167.5	-168	8.1	0	0	0	108.1	L1141 Q1145	L1141-N1143 PolarHBondContact O-N 3.33Å; N1143-Q1145 PolarHBondContact O-N 3.34Å
1144	P	32.5	Very low	33.7	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	74%	0.737	S	S	*	*			trans	-77.4	70.9	179.8	31.9	-31.9	0	0	0	108.5	P1142 S1146	P1142-P1144 WeakPolarHBondContact O-CD 3.38Å; P1144-S1146 PolarHBondContact O-N 3.42Å; P1144-S1146 VanDerWaalsContact O-N 3.13Å
1145	Q	26.3	Very low	32.5	Very low	153 Å²	153	132.3 Å²	132.3	72%	0.715	74%	0.738	S	S	*	*			trans	-74.1	101.7	167.2	-78.8	-170	-24.5	0	0	108.7	N1143 S1147	N1143-Q1145 PolarHBondContact O-N 3.34Å; Q1145-S1147 PolarHBondContact O-N 3.14Å
1146	S	32.8	Very low	31.6	Very low	105 Å²	105	132 Å²	132	73%	0.734	75%	0.748	S	S	*	*			trans	37.7	71.2	134.2	62.2	0	0	0	0	116.1	P1144 E1148	P1144-S1146 PolarHBondContact O-N 3.42Å; P1144-S1146 VanDerWaalsContact O-N 3.13Å; S1146-E1148 PolarHBondContact O-N 3.19Å
1147	S	27.4	Very low	30.7	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	75%	0.751	S	S	*	*			trans	-83.9	97.4	157.5	63.5	0	0	0	0	108.3	Q1145 G1149	Q1145-S1147 PolarHBondContact O-N 3.14Å; S1147-G1149 PolarHBondContact O-N 2.94Å
1148	E	32.3	Very low	30	Very low	197 Å²	197	137.2 Å²	137.2	92%	0.921	77%	0.766	S	S	*	*			trans	-57.1	82.7	164.1	-76.9	179.1	134.2	0	0	109.8	S1146 R1150	S1146-E1148 PolarHBondContact O-N 3.19Å; E1148-R1150 VanDerWaalsContact C-N 3.31Å; E1148-R1150 PolarHBondContact O-N 3.44Å
1149	G	26.5	Very low	29.5	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	78%	0.775	S	S	*	*			trans	-75.3	84.6	172.2	0	0	0	0	0	110	S1147 K1151	S1147-G1149 PolarHBondContact O-N 2.94Å; G1149-K1151 PolarHBondContact O-N 2.95Å
1150	R	28.3	Very low	28.9	Very low	244 Å²	244	136.3 Å²	136.3	92%	0.921	78%	0.779	S	S	*	*			trans	-27.9	99.9	164.2	-132.2	177.2	-164.2	179.1	4.3	111.4	E1148	E1148-R1150 VanDerWaalsContact C-N 3.31Å; E1148-R1150 PolarHBondContact O-N 3.44Å
1151	K	26.3	Very low	28.5	Very low	195 Å²	195	136 Å²	136	85%	0.848	78%	0.776	S	S	*	*			trans	-68.4	132.2	168.2	-82.9	-178.7	178.4	176.4	0	108.3	G1149 S1153	G1149-K1151 PolarHBondContact O-N 2.95Å; K1151-S1153 PolarHBondContact O-N 3.34Å
1152	P	27.2	Very low	28.5	Very low	115 Å²	115	137.2 Å²	137.2	75%	0.747	78%	0.775	S	S	*	*			trans	-66.8	121.1	-177.4	26.3	-30.9	0	0	0	109.4	V1154	P1152-V1154 PolarHBondContact O-N 3.06Å; P1152-V1154 VanDerWaalsContact O-N 3.08Å
1153	S	25.3	Very low	28.5	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	78%	0.78	S	S	*	*			trans	-61.8	100.9	168.9	53.5	0	0	0	0	109.3	K1151	K1151-S1153 PolarHBondContact O-N 3.34Å
1154	V	27.5	Very low	28.4	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	79%	0.788	S	S	*	*			trans	-95.4	121.9	164.8	-177.7	0	0	0	0	107.2	P1152	P1152-V1154 PolarHBondContact O-N 3.06Å; P1152-V1154 VanDerWaalsContact O-N 3.08Å
1155	P	28	Very low	28	Very low	70 Å²	70	138.9 Å²	138.9	46%	0.455	79%	0.788	S	S	.	*			trans	-71.2	148.8	-167.3	-15.4	29.9	0	0	0	113.4	Y1157	P1155-Y1157 HydrophobicContact CB-CD1 4.34Å; P1155-Y1157 HydrophobicContact CB-CE1 3.57Å; P1155-Y1157 HydrophobicContact CG-CE1 4.29Å; P1155-Y1157 PolarHBondContact O-N 3.37Å
1156	P	30.7	Very low	28.2	Very low	129 Å²	129	135.3 Å²	135.3	84%	0.838	79%	0.792	S	S	*	*			trans	-89.7	104.6	-178.7	34.3	-29.5	0	0	0	111.4
1157	Y	29.9	Very low	27.8	Very low	175 Å²	175	142.1 Å²	142.1	69%	0.686	80%	0.801	S	S	*	*			trans	-140.9	115.7	156.4	23.4	-100.1	0	0	0	103.9	P1155	P1155-Y1157 HydrophobicContact CB-CD1 4.34Å; P1155-Y1157 HydrophobicContact CB-CE1 3.57Å; P1155-Y1157 HydrophobicContact CG-CE1 4.29Å; P1155-Y1157 PolarHBondContact O-N 3.37Å
1158	L	30.4	Very low	27.8	Very low	173 Å²	173	144.2 Å²	144.2	91%	0.906	80%	0.803	S	S	*	*				-152.5	113.3	53.1	-72	160.2	0	0	0	109.6	G1160	L1158-G1160 PolarHBondContact O-N 3.43Å
1159	L	27.7	Very low	27.7	Very low	172 Å²	172	140.3 Å²	140.3	90%	0.901	80%	0.795	S	S	*	*			trans	-71.5	101	160.2	-97.6	136.1	0	0	0	108.5
1160	G	26.3	Very low	27.9	Very low	78 Å²	78	145.4 Å²	145.4	80%	0.804	80%	0.8	S	S	*	*			trans	-98.9	91.4	163.3	0	0	0	0	0	109.6	L1158	L1158-G1160 PolarHBondContact O-N 3.43Å
1161	S	26.8	Very low	28.1	Very low	95 Å²	95	141.1 Å²	141.1	66%	0.664	80%	0.796	S	S	*	*			trans	-57.1	127.6	176.6	-67.9	0	0	0	0	113
1162	F	27.3	Very low	28.5	Very low	194 Å²	194	138.4 Å²	138.4	85%	0.851	80%	0.795	S	S	*	*			trans	-159.5	83.1	141.3	-89.7	-70.7	0	0	0	109.8
1163	V	29.8	Very low	28.5	Very low	140 Å²	140	139.5 Å²	139.5	85%	0.848	80%	0.799	S	S	*	*			trans	-119.5	111.8	157	-177.5	0	0	0	0	106.8
1164	H	26.4	Very low	28.6	Very low	178 Å²	178	145.1 Å²	145.1	82%	0.824	80%	0.802	S	S	*	*			trans	-115.6	118.1	166.4	-85.1	36.4	0	0	0	106.7
1165	G	25.9	Very low	28.7	Very low	75 Å²	75	147.6 Å²	147.6	77%	0.773	81%	0.805	S	S	*	*			trans	153.3	88.5	168.3	0	0	0	0	0	115
1166	G	28.7	Very low	28.6	Very low	78 Å²	78	153.2 Å²	153.2	80%	0.804	83%	0.825	S	S	*	*			trans	80.8	95.5	140.5	0	0	0	0	0	118.4
1167	R	26	Very low	28.5	Very low	247 Å²	247	155.1 Å²	155.1	93%	0.932	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-53.3	133.2	162	-79.9	-179.4	-177.2	-112.3	1.6	111.6
1168	L	27	Very low	28.4	Very low	159 Å²	159	152.5 Å²	152.5	83%	0.832	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-94.9	144.1	153.5	-95.1	144.5	0	0	0	109
1169	P	29.8	Very low	28.2	Very low	115 Å²	115	149.6 Å²	149.6	75%	0.747	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-71.7	136.6	-171.6	-14.3	30	0	0	0	113.2	D1171	P1169-D1171 PolarHBondContact O-N 3.42Å
1170	E	30.8	Very low	28.2	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	83%	0.825	S	S	*	*			trans	-91.5	25.3	-166.3	-116.7	-166.9	179	0	0	115.8
1171	D	32.4	Very low	28.3	Very low	155 Å²	155	155.7 Å²	155.7	83%	0.829	83%	0.831	S	S	*	*			trans	-101.8	12.9	-172.8	-74.2	-31.9	0	0	0	116.3	P1169	P1169-D1171 PolarHBondContact O-N 3.42Å
1172	V	34	Very low	28.4	Very low	137 Å²	137	157 Å²	157	83%	0.83	83%	0.834	S	S	*	*	S	Bend	trans	-121.4	9.5	-177.6	-171.1	0	0	0	0	114.8
1173	V	28	Very low	28.6	Very low	138 Å²	138	157.3 Å²	157.3	84%	0.836	84%	0.835	S	S	*	*	S	Bend	trans	-130.7	50	176.4	-161.9	0	0	0	0	112.1
1174	R	28.2	Very low	28.8	Very low	238 Å²	238	157.2 Å²	157.2	90%	0.898	83%	0.83	S	S	*	*			trans	-124.8	21.3	172.7	-91.6	-167.4	179.7	-166.3	1.9	115.3
1175	Q	28.5	Very low	29	Very low	181 Å²	181	156.4 Å²	156.4	85%	0.846	83%	0.832	S	S	*	*	S	Bend	trans	-122.2	131	167.8	-68.7	-174.5	-6	0	0	109.3
1176	Q	26.8	Very low	29.2	Very low	187 Å²	187	161.7 Å²	161.7	87%	0.874	84%	0.839	S	S	*	*			trans	85.9	66.8	176	-50.3	178.7	-4.8	0	0	116.6
1177	L	27.1	Very low	29.3	Very low	169 Å²	169	164.2 Å²	164.2	89%	0.885	84%	0.839	S	S	*	*			trans	-148.2	130.9	133.5	-107.3	128.7	0	0	0	111.2
1178	P	27.5	Very low	29.5	Very low	121 Å²	121	160.4 Å²	160.4	79%	0.786	84%	0.836	S	S	*	*			trans	-73.3	132.8	-167.6	-14.6	30.9	0	0	0	113	K1180	P1178-K1180 PolarHBondContact O-N 3.24Å
1179	S	26.2	Very low	29.6	Very low	111 Å²	111	158.2 Å²	158.2	78%	0.776	84%	0.835	S	S	*	*			trans	-57.1	118.4	164.7	26.5	0	0	0	0	111.9
1180	K	28.8	Very low	29.4	Very low	200 Å²	200	161.1 Å²	161.1	87%	0.87	84%	0.843	S	S	*	*			trans	169.5	76.3	147.5	-93.8	168.4	-171.6	-173.3	0	110.1	P1178	P1178-K1180 PolarHBondContact O-N 3.24Å
1181	L	28.7	Very low	29.2	Very low	179 Å²	179	159 Å²	159	94%	0.937	85%	0.847	S	S	*	*			trans	-156.3	89.4	148.8	-102.3	166.2	0	0	0	106.5
1182	V	28.9	Very low	28.9	Very low	121 Å²	121	156.1 Å²	156.1	73%	0.733	84%	0.839	S	S	*	*			trans	-67.8	132.1	175.1	170.5	0	0	0	0	109.3
1183	K	30.2	Very low	28.5	Very low	201 Å²	201	158.6 Å²	158.6	87%	0.874	84%	0.839	S	S	*	*				-169.6	83.9	124.3	-99	175.3	-176	-176.4	0	107.5	D1185	K1183-D1185 PolarHBondContact O-N 2.97Å
1184	D	34.7	Very low	28.5	Very low	138 Å²	138	160 Å²	160	74%	0.738	84%	0.84	S	S	*	*			trans	-53.9	114.9	154.6	-69.3	-61.3	0	0	0	108
1185	D	31.2	Very low	28.7	Very low	161 Å²	161	154 Å²	154	86%	0.861	83%	0.832	S	S	*	*			trans	178.3	56.3	150.2	-88.4	-23	0	0	0	110.4	K1183	K1183-D1185 PolarHBondContact O-N 2.97Å
1186	M	29.3	Very low	28.5	Very low	186 Å²	186	156.7 Å²	156.7	92%	0.916	84%	0.836	S	S	*	*	S	Bend	trans	-164.9	36.4	157	-129.2	163.3	64.3	0	0	114.3
1187	V	31.4	Very low	28.7	Very low	132 Å²	132	151.6 Å²	151.6	80%	0.8	83%	0.833	S	S	*	*	S	Bend	trans	-114.6	-2.7	-179.7	179.1	0	0	0	0	114
1188	N	29.7	Very low	28.7	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	83%	0.83	S	S	*	*	S	Bend	trans	-108.7	23.1	-172.5	-79.5	-16.4	0	0	0	117.5
1189	S	29.6	Very low	28.8	Very low	114 Å²	114	155 Å²	155	80%	0.797	83%	0.834	S	S	*	*	S	Bend	trans	-118.9	11.8	178.9	-142.7	0	0	0	0	117.3
1190	L	26.2	Very low	29.1	Very low	176 Å²	176	156.8 Å²	156.8	92%	0.921	84%	0.836	S	S	*	*	S	Bend	trans	-133.8	29.5	178	-71.5	172.4	0	0	0	115
1191	S	25.2	Very low	29	Very low	127 Å²	127	159.4 Å²	159.4	89%	0.888	84%	0.84	S	S	*	*			trans	-123.5	75	167.4	-83	0	0	0	0	111.3
1192	S	25.8	Very low	29	Very low	96 Å²	96	160.7 Å²	160.7	67%	0.671	84%	0.838	S	S	*	*			trans	-163.1	137.6	145.4	67.3	0	0	0	0	111.6
1193	K	26.3	Very low	28.8	Very low	189 Å²	189	164.4 Å²	164.4	82%	0.822	84%	0.844	S	S	*	*			trans	76.9	109.2	166.6	-52.9	169.1	-177.5	178.1	0	112.7
1194	I	28.5	Very low	28.9	Very low	166 Å²	166	161.2 Å²	161.2	85%	0.851	84%	0.844	S	S	*	*				-164.9	149.4	77.9	-80.8	152.4	0	0	0	109.5
1195	P	32.7	Very low	28.8	Very low	114 Å²	114	161.3 Å²	161.3	74%	0.74	85%	0.849	S	S	*	*			trans	-99.5	162.4	-153.8	31.4	-18.9	0	0	0	116.3
1196	Y	24.8	Very low	28.7	Very low	237 Å²	237	163.4 Å²	163.4	93%	0.929	85%	0.851	S	S	*	*			trans	-43.3	149.7	171.9	-74.8	-98.3	0	0	0	116.9
1197	G	30.5	Very low	28.9	Very low	79 Å²	79	158.3 Å²	158.3	81%	0.814	85%	0.846	S	S	*	*			trans	169.4	73.6	161	0	0	0	0	0	115.6
1198	I	26	Very low	28.9	Very low	161 Å²	161	161.7 Å²	161.7	83%	0.826	85%	0.85	S	S	*	*			trans	-71	131.4	165.5	-69	163.9	0	0	0	109
1199	K	31.3	Very low	28.9	Very low	200 Å²	200	163.2 Å²	163.2	87%	0.87	85%	0.852	S	S	*	*			trans	-149.3	136.2	156.3	-106.9	179.2	-174.3	179.9	0	111.8
1200	D	30.8	Very low	29.1	Very low	150 Å²	150	166.7 Å²	166.7	80%	0.802	86%	0.855	S	S	*	*			trans	-59.3	133.2	-165.1	-62	-70	0	0	0	116.3
1201	R	27.3	Very low	29.5	Very low	254 Å²	254	163.9 Å²	163.9	96%	0.958	85%	0.85	S	S	*	*			trans	-88.6	102.7	166.3	-83.7	179.9	166.2	176.9	-4	110.1
1202	K	29.6	Very low	29.9	Very low	206 Å²	206	166.6 Å²	166.6	90%	0.896	85%	0.854	S	S	*	*			trans	-88.4	141.2	158.8	-88.7	-177.5	177.3	176.2	0	110.6
1203	K	23.4	Very low	30.2	Very low	200 Å²	200	165.9 Å²	165.9	87%	0.87	85%	0.854	S	S	*	*			trans	-43.8	134.8	-174.5	-65.4	169	173.8	177	0	115.4
1204	P	33.3	Very low	30.5	Very low	134 Å²	134	162.6 Å²	162.6	87%	0.87	86%	0.855	S	S	*	*			trans	-91	133.8	167.1	33	-27.3	0	0	0	111.9
1205	V	32.9	Very low	30.9	Very low	139 Å²	139	166.8 Å²	166.8	84%	0.842	86%	0.86	S	S	*	*			trans	-81.1	146.3	178.8	168.6	0	0	0	0	110.8	G1207	V1205-G1207 PolarHBondContact O-N 3.37Å
1206	K	28.9	Very low	31.1	Very low	205 Å²	205	171.4 Å²	171.4	89%	0.891	87%	0.868	S	S	*	*			trans	-45.3	123.6	180	-72.2	175	171.1	179.5	0	113.7
1207	G	33.5	Very low	31.4	Very low	79 Å²	79	169.6 Å²	169.6	81%	0.814	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-84.6	142.8	174.4	0	0	0	0	0	113.1	V1205	V1205-G1207 PolarHBondContact O-N 3.37Å
1208	K	31.2	Very low	31.3	Very low	204 Å²	204	171.8 Å²	171.8	89%	0.887	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-64.4	148.1	-174.8	-81.1	171	166.4	176.2	0	114.8
1209	E	29.7	Very low	31.6	Very low	198 Å²	198	177.7 Å²	177.7	93%	0.925	89%	0.886	S	S	*	*	P	Polyproline II helix	trans	-46.9	128.3	163.4	-65.8	165.8	142.7	0	0	112.4
1210	Q	34	Very low	31.7	Very low	187 Å²	187	176.6 Å²	176.6	87%	0.874	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-93.9	117.4	165.7	-81.9	178.6	-13.6	0	0	109.1	L1212	Q1210-L1212 PolarHBondContact O-N 3.4Å
1211	S	34	Very low	31.7	Very low	116 Å²	116	178 Å²	178	81%	0.811	89%	0.892	S	S	*	*			trans	-64.2	108.8	174.2	54.5	0	0	0	0	111.6	A1213	S1211-A1213 PolarHBondContact O-N 3.29Å
1212	L	32.6	Very low	31.9	Very low	184 Å²	184	173.8 Å²	173.8	96%	0.963	89%	0.888	S	S	*	*			trans	-79.5	87.7	164.3	-87.2	151.2	0	0	0	109.2	Q1210	Q1210-L1212 PolarHBondContact O-N 3.4Å
1213	A	32.4	Very low	32.1	Very low	81 Å²	81	171.9 Å²	171.9	67%	0.669	89%	0.888	S	S	*	*			trans	-114.5	113.2	164.9	0	0	0	0	0	107.9	S1211	S1211-A1213 PolarHBondContact O-N 3.29Å
1214	S	34.1	Very low	32.6	Very low	121 Å²	121	170.1 Å²	170.1	85%	0.846	89%	0.889	S	S	*	*			trans	150.6	93.7	148.9	-70.8	0	0	0	0	110.9
1215	R	36.3	Very low	32.6	Very low	254 Å²	254	172.5 Å²	172.5	96%	0.958	89%	0.89	S	S	*	*			trans	-148.9	89	145.2	-112.8	170.8	-171.9	-177.8	1.5	108.9
1216	K	37.5	Very low	32.6	Very low	210 Å²	210	174.9 Å²	174.9	91%	0.913	89%	0.893	S	S	*	*			trans	-62.8	136.7	168.1	-82.6	175.5	172	175.4	0	109.8
1217	K	30.2	Very low	32.8	Very low	199 Å²	199	172.6 Å²	172.6	87%	0.865	89%	0.893	S	S	*	*			trans	-3.8	152.2	150	-75.5	176.9	169.8	179.5	0	119.8
1218	C	27.7	Very low	32.8	Very low	125 Å²	125	180.4 Å²	180.4	85%	0.845	90%	0.9	S	S	*	*			trans	89.3	88.5	154.7	-74.1	0	0	0	0	118.1
1219	K	33.7	Very low	32.9	Very low	286 Å²	286	178.3 Å²	178.3	100%	1.243	90%	0.901	S	S	*	*				-154.5	0	98.5	-111.5	-179.9	-179.6	179.5	0	109.5

Retrieved 1,219 of 1,219 residues in 466.2 ms (Link to these results)

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